| 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 | E | 57 | Low | 72.7 | Confident | 205 Ų | 205 | 143.3 Ų | 143.3 | 96% | 0.958 | 66% | 0.655 | S | S | * | * | 0 | -40.3 | 0 | -69.4 | -171 | 156.9 | 0 | 0 | 115.2 | K4 R5 | E1-K4 PolarHBondContact O-N 3.47Å; E1-R5 PolarHBondContact O-N 2.83Å | |||
| 2 | K | 62.8 | Low | 73.4 | Confident | 181 Ų | 181 | 134.3 Ų | 134.3 | 79% | 0.787 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -62.8 | -41.3 | -179.5 | -71.5 | -178.6 | 176.8 | 178.9 | 0 | 114.5 | K4 R5 L6 | K2-K4 PolarHBondContact O-N 3.21Å; K2-R5 PolarHBondContact O-N 3.38Å; K2-L6 PolarHBondContact O-N 3.46Å |
| 3 | E | 65.8 | Low | 74.2 | Confident | 148 Ų | 148 | 134.7 Ų | 134.7 | 69% | 0.692 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -64.8 | -38.1 | 177.7 | -70.3 | 171.9 | 166 | 0 | 0 | 112.7 | R5 L6 Y7 | E3-R5 VanDerWaalsContact C-N 3.26Å; E3-R5 PolarHBondContact O-N 3.35Å; E3-L6 WeakPolarHBondContact O-CB 3.26Å; E3-L6 PolarHBondContact O-N 3.17Å; E3-Y7 HydrophobicContact CB-CE2 4.32Å; E3-Y7 WeakPolarHBondContact O-CD2 3.43Å; E3-Y7 PolarHBondContact O-N 3.18Å |
| 4 | K | 69.8 | Low | 75 | Confident | 163 Ų | 163 | 131.2 Ų | 131.2 | 71% | 0.709 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -62.4 | -33.3 | 178.2 | -149.1 | 179.2 | -174.2 | -178.2 | 0 | 112.1 | E1 K2 L8 | E1-K4 PolarHBondContact O-N 3.47Å; K2-K4 PolarHBondContact O-N 3.21Å; K4-L8 WeakPolarHBondContact O-CD1 3.43Å; K4-L8 VanDerWaalsContact O-CG 3.29Å; K4-L8 WeakPolarHBondContact O-CG 3.37Å; K4-L8 PolarHBondContact O-N 3.28Å; K4-L8 VanDerWaalsContact O-N 3.16Å |
| 5 | R | 73.3 | Confident | 75.6 | Confident | 183 Ų | 183 | 128.2 Ų | 128.2 | 69% | 0.691 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -73.8 | -38.3 | 174.9 | -68.9 | -173.2 | -177.4 | -156.1 | 1.8 | 112.7 | E1 K2 E3 L8 I9 | E1-R5 PolarHBondContact O-N 2.83Å; K2-R5 PolarHBondContact O-N 3.38Å; E3-R5 VanDerWaalsContact C-N 3.26Å; E3-R5 PolarHBondContact O-N 3.35Å; R5-L8 PolarHBondContact O-N 3.42Å; R5-I9 WeakPolarHBondContact O-CG1 3.38Å; R5-I9 PolarHBondContact O-N 2.93Å |
| 6 | L | 76.4 | Confident | 76.2 | Confident | 116 Ų | 116 | 125.9 Ų | 125.9 | 61% | 0.607 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61 | -46.1 | 173.6 | -90 | 155.3 | 0 | 0 | 0 | 111.5 | K2 E3 L8 I9 Q10 | K2-L6 PolarHBondContact O-N 3.46Å; E3-L6 WeakPolarHBondContact O-CB 3.26Å; E3-L6 PolarHBondContact O-N 3.17Å; L6-L8 PolarHBondContact O-N 3.46Å; L6-I9 PolarHBondContact O-N 3.48Å; L6-Q10 WeakPolarHBondContact O-CB 3.4Å; L6-Q10 PolarHBondContact O-N 3.05Å |
| 7 | Y | 76.2 | Confident | 76.9 | Confident | 146 Ų | 146 | 123.9 Ų | 123.9 | 57% | 0.573 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.8 | -37.7 | 175.6 | -71.6 | -62.3 | 0 | 0 | 0 | 112.8 | E3 Q10 I11 | E3-Y7 HydrophobicContact CB-CE2 4.32Å; E3-Y7 WeakPolarHBondContact O-CD2 3.43Å; E3-Y7 PolarHBondContact O-N 3.18Å; Y7-Q10 PolarHBondContact O-N 3.2Å; Y7-I11 WeakPolarHBondContact O-CB 3.4Å; Y7-I11 WeakPolarHBondContact O-CD1 3.23Å; Y7-I11 WeakPolarHBondContact O-CG1 3.4Å; Y7-I11 PolarHBondContact O-N 2.98Å |
| 8 | L | 78.3 | Confident | 77.5 | Confident | 114 Ų | 114 | 122.4 Ų | 122.4 | 60% | 0.597 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.3 | -40.4 | 175.9 | -77.9 | 166.2 | 0 | 0 | 0 | 112.9 | K4 R5 L6 Q10 I11 G12 | K4-L8 WeakPolarHBondContact O-CD1 3.43Å; K4-L8 VanDerWaalsContact O-CG 3.29Å; K4-L8 WeakPolarHBondContact O-CG 3.37Å; K4-L8 PolarHBondContact O-N 3.28Å; K4-L8 VanDerWaalsContact O-N 3.16Å; R5-L8 PolarHBondContact O-N 3.42Å; L6-L8 PolarHBondContact O-N 3.46Å; L8-Q10 VanDerWaalsContact C-N 3.35Å; L8-I11 PolarHBondContact O-N 3.49Å; L8-G12 PolarHBondContact O-N 2.96Å |
| 9 | I | 78.9 | Confident | 78 | Confident | 123 Ų | 123 | 122.9 Ų | 122.9 | 63% | 0.631 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66 | -40.9 | 174.9 | -67.5 | 167 | 0 | 0 | 0 | 110.3 | R5 L6 G12 Y13 | R5-I9 WeakPolarHBondContact O-CG1 3.38Å; R5-I9 PolarHBondContact O-N 2.93Å; L6-I9 PolarHBondContact O-N 3.48Å; I9-G12 PolarHBondContact O-N 2.97Å; I9-Y13 PolarHBondContact O-N 3.37Å |
| 10 | Q | 81.3 | Confident | 78.5 | Confident | 110 Ų | 110 | 124.6 Ų | 124.6 | 51% | 0.514 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67 | -39.9 | 177.7 | -169.9 | 167.2 | -0.6 | 0 | 0 | 112.1 | L6 Y7 L8 Y13 L14 | L6-Q10 WeakPolarHBondContact O-CB 3.4Å; L6-Q10 PolarHBondContact O-N 3.05Å; Y7-Q10 PolarHBondContact O-N 3.2Å; L8-Q10 VanDerWaalsContact C-N 3.35Å; Q10-Y13 PolarHBondContact O-N 3.2Å; Q10-L14 HydrophobicContact CG-CD1 4.08Å; Q10-L14 VanDerWaalsContact O-CB 3.3Å; Q10-L14 WeakPolarHBondContact O-CB 3.44Å; Q10-L14 WeakPolarHBondContact O-CG 3.49Å; Q10-L14 PolarHBondContact O-N 3.43Å |
| 11 | I | 80.1 | Confident | 79.1 | Confident | 87 Ų | 87 | 124.2 Ų | 124.2 | 45% | 0.446 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -62.6 | -43 | 172.1 | -70.6 | 163.3 | 0 | 0 | 0 | 110.2 | Y7 L8 L14 N15 | Y7-I11 WeakPolarHBondContact O-CB 3.4Å; Y7-I11 WeakPolarHBondContact O-CD1 3.23Å; Y7-I11 WeakPolarHBondContact O-CG1 3.4Å; Y7-I11 PolarHBondContact O-N 2.98Å; L8-I11 PolarHBondContact O-N 3.49Å; I11-L14 PolarHBondContact O-N 2.84Å; I11-N15 VanDerWaalsContact O-CB 3.27Å; I11-N15 WeakPolarHBondContact O-CB 3.47Å; I11-N15 PolarHBondContact O-N 3.31Å; I11-N15 PolarHBondContact O-ND2 3.48Å |
| 12 | G | 81.4 | Confident | 80.7 | Confident | 36 Ų | 36 | 120.2 Ų | 120.2 | 37% | 0.371 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -60.1 | -48.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L8 I9 L14 N15 E16 | L8-G12 PolarHBondContact O-N 2.96Å; I9-G12 PolarHBondContact O-N 2.97Å; G12-L14 PolarHBondContact O-N 3.11Å; G12-N15 PolarHBondContact O-N 2.8Å; G12-E16 WeakPolarHBondContact O-CB 3.45Å; G12-E16 PolarHBondContact O-N 3.43Å |
| 13 | Y | 84.1 | Confident | 81.9 | Confident | 139 Ų | 139 | 116.1 Ų | 116.1 | 55% | 0.545 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.1 | -41 | 176.5 | 177 | -98.9 | 0 | 0 | 0 | 112.5 | I9 Q10 K17 | I9-Y13 PolarHBondContact O-N 3.37Å; Q10-Y13 PolarHBondContact O-N 3.2Å; Y13-K17 HydrophobicContact CE1-CD 4.3Å; Y13-K17 VanDerWaalsContact O-CB 3.29Å; Y13-K17 WeakPolarHBondContact O-CB 3.36Å; Y13-K17 PolarHBondContact O-N 3.08Å |
| 14 | L | 84.7 | Confident | 83.2 | Confident | 86 Ų | 86 | 115 Ų | 115 | 45% | 0.45 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -68.2 | -37.9 | 177.1 | -73.2 | 170.9 | 0 | 0 | 0 | 111.9 | Q10 I11 G12 K17 L18 | Q10-L14 HydrophobicContact CG-CD1 4.08Å; Q10-L14 VanDerWaalsContact O-CB 3.3Å; Q10-L14 WeakPolarHBondContact O-CB 3.44Å; Q10-L14 WeakPolarHBondContact O-CG 3.49Å; Q10-L14 PolarHBondContact O-N 3.43Å; I11-L14 PolarHBondContact O-N 2.84Å; G12-L14 PolarHBondContact O-N 3.11Å; L14-K17 PolarHBondContact O-N 3.15Å; L14-L18 WeakPolarHBondContact O-CB 3.47Å; L14-L18 PolarHBondContact O-N 3.37Å |
| 15 | N | 83.8 | Confident | 84.2 | Confident | 86 Ų | 86 | 111.1 Ų | 111.1 | 46% | 0.46 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.3 | -44.2 | 174.9 | -76.1 | -13.3 | 0 | 0 | 0 | 111.6 | I11 G12 K17 L18 E19 | I11-N15 VanDerWaalsContact O-CB 3.27Å; I11-N15 WeakPolarHBondContact O-CB 3.47Å; I11-N15 PolarHBondContact O-N 3.31Å; I11-N15 PolarHBondContact O-ND2 3.48Å; G12-N15 PolarHBondContact O-N 2.8Å; N15-K17 VanDerWaalsContact C-N 3.29Å; N15-K17 PolarHBondContact O-N 2.79Å; N15-L18 CarbonylContact O-C 3.6Å; N15-L18 WeakPolarHBondContact O-CB 3.19Å; N15-L18 PolarHBondContact O-N 3.06Å; N15-L18 VanDerWaalsContact O-N 3.17Å; N15-E19 PolarHBondContact O-N 2.95Å |
| 16 | E | 85.3 | Confident | 85.1 | Confident | 92 Ų | 92 | 106.4 Ų | 106.4 | 43% | 0.43 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.4 | -38.2 | 175.7 | -165.8 | -173.8 | 166.6 | 0 | 0 | 111.2 | G12 E19 R20 | G12-E16 WeakPolarHBondContact O-CB 3.45Å; G12-E16 PolarHBondContact O-N 3.43Å; E16-E19 PolarHBondContact O-N 3.39Å; E16-R20 VanDerWaalsContact O-CG 3.25Å; E16-R20 WeakPolarHBondContact O-CG 3.39Å; E16-R20 PolarHBondContact O-N 3.31Å; E16-R20 IonicContact OE1-CZ 2.84Å; E16-R20 IonicContact OE1-NE 3.54Å; E16-R20 IonicContact OE1-NH2 3.66Å; E16-R20 PolarHBondContact OE1-NH2 3.22Å |
| 17 | K | 88.1 | Confident | 85.9 | Confident | 92 Ų | 92 | 106 Ų | 106 | 40% | 0.4 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.8 | -37.2 | 174.3 | -164.1 | 174.4 | -175.4 | 176.7 | 0 | 112 | Y13 L14 N15 F21 | Y13-K17 HydrophobicContact CE1-CD 4.3Å; Y13-K17 VanDerWaalsContact O-CB 3.29Å; Y13-K17 WeakPolarHBondContact O-CB 3.36Å; Y13-K17 PolarHBondContact O-N 3.08Å; L14-K17 PolarHBondContact O-N 3.15Å; N15-K17 VanDerWaalsContact C-N 3.29Å; N15-K17 PolarHBondContact O-N 2.79Å; K17-F21 HydrophobicContact CD-CE2 4.16Å; K17-F21 HydrophobicContact CG-CD2 4.11Å; K17-F21 HydrophobicContact CG-CE2 3.66Å; K17-F21 HydrophobicContact CG-CZ 4.34Å; K17-F21 WeakPolarHBondContact O-CD2 3.49Å; K17-F21 WeakPolarHBondContact O-CG 3.36Å; K17-F21 PolarHBondContact O-N 3.18Å |
| 18 | L | 87.3 | Confident | 86.6 | Confident | 97 Ų | 97 | 103.5 Ų | 103.5 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -47.5 | 172.9 | -103.6 | 159.8 | 0 | 0 | 0 | 111.5 | L14 N15 R20 F21 Q22 | L14-L18 WeakPolarHBondContact O-CB 3.47Å; L14-L18 PolarHBondContact O-N 3.37Å; N15-L18 CarbonylContact O-C 3.6Å; N15-L18 WeakPolarHBondContact O-CB 3.19Å; N15-L18 PolarHBondContact O-N 3.06Å; N15-L18 VanDerWaalsContact O-N 3.17Å; L18-R20 VanDerWaalsContact C-N 3.34Å; L18-R20 PolarHBondContact O-N 3.08Å; L18-F21 CarbonylContact O-C 3.58Å; L18-F21 PolarHBondContact O-N 3.46Å; L18-F21 VanDerWaalsContact O-N 3.13Å; L18-Q22 WeakPolarHBondContact O-CB 3.39Å; L18-Q22 PolarHBondContact O-N 3.18Å |
| 19 | E | 87.6 | Confident | 87.3 | Confident | 131 Ų | 131 | 103 Ų | 103 | 61% | 0.612 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.7 | -43.3 | 175.6 | -80.7 | -177.8 | 171.4 | 0 | 0 | 111.7 | N15 E16 F21 Q22 I23 | N15-E19 PolarHBondContact O-N 2.95Å; E16-E19 PolarHBondContact O-N 3.39Å; E19-F21 VanDerWaalsContact C-N 3.32Å; E19-F21 PolarHBondContact O-N 3.48Å; E19-Q22 WeakPolarHBondContact O-CB 3.41Å; E19-Q22 PolarHBondContact O-N 2.96Å; E19-I23 VanDerWaalsContact O-CG1 3.31Å; E19-I23 WeakPolarHBondContact O-CG1 3.44Å; E19-I23 PolarHBondContact O-N 2.82Å |
| 20 | R | 88.6 | Confident | 88 | Confident | 157 Ų | 157 | 103.8 Ų | 103.8 | 59% | 0.592 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.3 | -39.7 | 174.5 | -71.6 | 174 | -170.4 | -156.1 | 6 | 112.3 | E16 L18 K24 | E16-R20 VanDerWaalsContact O-CG 3.25Å; E16-R20 WeakPolarHBondContact O-CG 3.39Å; E16-R20 PolarHBondContact O-N 3.31Å; E16-R20 IonicContact OE1-CZ 2.84Å; E16-R20 IonicContact OE1-NE 3.54Å; E16-R20 IonicContact OE1-NH2 3.66Å; E16-R20 PolarHBondContact OE1-NH2 3.22Å; L18-R20 VanDerWaalsContact C-N 3.34Å; L18-R20 PolarHBondContact O-N 3.08Å; R20-K24 WeakPolarHBondContact O-CB 3.28Å; R20-K24 PolarHBondContact O-N 2.86Å; R20-K24 VanDerWaalsContact O-N 3.11Å |
| 21 | F | 90.2 | Very high | 88.5 | Confident | 117 Ų | 117 | 104 Ų | 104 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -69.2 | -37.6 | 174.3 | -73.7 | -47.7 | 0 | 0 | 0 | 112.2 | K17 L18 E19 K24 C25 | K17-F21 HydrophobicContact CD-CE2 4.16Å; K17-F21 HydrophobicContact CG-CD2 4.11Å; K17-F21 HydrophobicContact CG-CE2 3.66Å; K17-F21 HydrophobicContact CG-CZ 4.34Å; K17-F21 WeakPolarHBondContact O-CD2 3.49Å; K17-F21 WeakPolarHBondContact O-CG 3.36Å; K17-F21 PolarHBondContact O-N 3.18Å; L18-F21 CarbonylContact O-C 3.58Å; L18-F21 PolarHBondContact O-N 3.46Å; L18-F21 VanDerWaalsContact O-N 3.13Å; E19-F21 VanDerWaalsContact C-N 3.32Å; E19-F21 PolarHBondContact O-N 3.48Å; F21-K24 PolarHBondContact O-N 2.83Å; F21-C25 WeakPolarHBondContact O-CB 3.35Å; F21-C25 PolarHBondContact O-N 2.74Å; F21-C25 PolarHBondContact O-SG 3.08Å |
| 22 | Q | 90.4 | Very high | 89 | Confident | 120 Ų | 120 | 103.6 Ų | 103.6 | 56% | 0.561 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.2 | -50.6 | 176.3 | -160.8 | 100.7 | 10.7 | 0 | 0 | 111 | L18 E19 K24 C25 D26 | L18-Q22 WeakPolarHBondContact O-CB 3.39Å; L18-Q22 PolarHBondContact O-N 3.18Å; E19-Q22 WeakPolarHBondContact O-CB 3.41Å; E19-Q22 PolarHBondContact O-N 2.96Å; Q22-K24 VanDerWaalsContact C-N 3.31Å; Q22-K24 PolarHBondContact O-N 3.27Å; Q22-C25 WeakPolarHBondContact O-CB 3.33Å; Q22-C25 PolarHBondContact O-N 3.22Å; Q22-C25 VanDerWaalsContact O-N 3.14Å; Q22-D26 PolarHBondContact O-N 2.87Å |
| 23 | I | 89.6 | Confident | 89.5 | Confident | 95 Ų | 95 | 105.9 Ų | 105.9 | 49% | 0.487 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.8 | -44.8 | 177.4 | -67.2 | 165.5 | 0 | 0 | 0 | 110.4 | E19 C25 D26 E27 | E19-I23 VanDerWaalsContact O-CG1 3.31Å; E19-I23 WeakPolarHBondContact O-CG1 3.44Å; E19-I23 PolarHBondContact O-N 2.82Å; I23-C25 PolarHBondContact O-N 3.11Å; I23-D26 PolarHBondContact O-N 3.24Å; I23-E27 HydrophobicContact CG2-CG 4.49Å; I23-E27 WeakPolarHBondContact O-CB 3.39Å; I23-E27 WeakPolarHBondContact O-CG 3.24Å; I23-E27 PolarHBondContact O-N 3.48Å |
| 24 | K | 92.6 | Very high | 89.9 | Confident | 125 Ų | 125 | 103.6 Ų | 103.6 | 54% | 0.543 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.5 | -39.4 | 177.6 | -171.5 | 172.5 | -176.6 | 176.7 | 0 | 112.3 | R20 F21 Q22 L28 | R20-K24 WeakPolarHBondContact O-CB 3.28Å; R20-K24 PolarHBondContact O-N 2.86Å; R20-K24 VanDerWaalsContact O-N 3.11Å; F21-K24 PolarHBondContact O-N 2.83Å; Q22-K24 VanDerWaalsContact C-N 3.31Å; Q22-K24 PolarHBondContact O-N 3.27Å; K24-L28 HydrophobicContact CG-CD1 4.21Å; K24-L28 WeakPolarHBondContact O-CB 3.36Å; K24-L28 VanDerWaalsContact O-CG 3.23Å; K24-L28 WeakPolarHBondContact O-CG 3.48Å; K24-L28 PolarHBondContact O-N 3.05Å |
| 25 | C | 90.9 | Very high | 90.2 | Very high | 81 Ų | 81 | 104.3 Ų | 104.3 | 55% | 0.547 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -43 | 174.2 | -74.7 | 0 | 0 | 0 | 0 | 111.3 | F21 Q22 I23 L28 Q29 | F21-C25 WeakPolarHBondContact O-CB 3.35Å; F21-C25 PolarHBondContact O-N 2.74Å; F21-C25 PolarHBondContact O-SG 3.08Å; Q22-C25 WeakPolarHBondContact O-CB 3.33Å; Q22-C25 PolarHBondContact O-N 3.22Å; Q22-C25 VanDerWaalsContact O-N 3.14Å; I23-C25 PolarHBondContact O-N 3.11Å; C25-L28 PolarHBondContact O-N 3.25Å; C25-Q29 VanDerWaalsContact O-CB 3.29Å; C25-Q29 WeakPolarHBondContact O-CB 3.38Å; C25-Q29 PolarHBondContact O-N 3.23Å |
| 26 | D | 92 | Very high | 90.5 | Very high | 84 Ų | 84 | 104.4 Ų | 104.4 | 45% | 0.449 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.8 | -39.8 | 177.9 | -69.6 | -20.7 | 0 | 0 | 0 | 112.1 | Q22 I23 Q29 K30 | Q22-D26 PolarHBondContact O-N 2.87Å; I23-D26 PolarHBondContact O-N 3.24Å; D26-Q29 PolarHBondContact O-N 3.5Å; D26-K30 VanDerWaalsContact O-CG 3.32Å; D26-K30 WeakPolarHBondContact O-CG 3.43Å; D26-K30 PolarHBondContact O-N 3.4Å |
| 27 | E | 92.8 | Very high | 90.7 | Very high | 108 Ų | 108 | 102.7 Ų | 102.7 | 51% | 0.505 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | 173.4 | -78.3 | 177.2 | 174.4 | 0 | 0 | 111.7 | I23 Q29 K30 Q31 | I23-E27 HydrophobicContact CG2-CG 4.49Å; I23-E27 WeakPolarHBondContact O-CB 3.39Å; I23-E27 WeakPolarHBondContact O-CG 3.24Å; I23-E27 PolarHBondContact O-N 3.48Å; E27-Q29 VanDerWaalsContact C-N 3.29Å; E27-Q29 PolarHBondContact O-N 3.27Å; E27-K30 PolarHBondContact O-N 2.92Å; E27-Q31 WeakPolarHBondContact O-CG 3.45Å; E27-Q31 PolarHBondContact O-N 3.3Å |
| 28 | L | 92 | Very high | 90.7 | Very high | 93 Ų | 93 | 102.6 Ų | 102.6 | 49% | 0.487 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -37.8 | 175.2 | -73.6 | 172.1 | 0 | 0 | 0 | 111.3 | K24 C25 Q31 N32 | K24-L28 HydrophobicContact CG-CD1 4.21Å; K24-L28 WeakPolarHBondContact O-CB 3.36Å; K24-L28 VanDerWaalsContact O-CG 3.23Å; K24-L28 WeakPolarHBondContact O-CG 3.48Å; K24-L28 PolarHBondContact O-N 3.05Å; C25-L28 PolarHBondContact O-N 3.25Å; L28-Q31 PolarHBondContact O-N 2.86Å; L28-N32 WeakPolarHBondContact O-CB 3.46Å; L28-N32 PolarHBondContact O-N 3.12Å |
| 29 | Q | 92.4 | Very high | 90.7 | Very high | 103 Ų | 103 | 101.3 Ų | 101.3 | 48% | 0.481 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.9 | -42.5 | 176.4 | -171.1 | 64.8 | 18.1 | 0 | 0 | 111.7 | C25 D26 E27 N32 N33 | C25-Q29 VanDerWaalsContact O-CB 3.29Å; C25-Q29 WeakPolarHBondContact O-CB 3.38Å; C25-Q29 PolarHBondContact O-N 3.23Å; D26-Q29 PolarHBondContact O-N 3.5Å; E27-Q29 VanDerWaalsContact C-N 3.29Å; E27-Q29 PolarHBondContact O-N 3.27Å; Q29-N32 PolarHBondContact O-N 2.99Å; Q29-N33 PolarHBondContact NE2-OD1 2.89Å; Q29-N33 WeakPolarHBondContact O-CB 3.48Å; Q29-N33 PolarHBondContact O-N 3.41Å; Q29-N33 PolarHBondContact O-ND2 3.38Å; Q29-N33 PolarHBondContact O-OD1 3.38Å |
| 30 | K | 92.7 | Very high | 90.8 | Very high | 141 Ų | 141 | 98.2 Ų | 98.2 | 61% | 0.613 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.9 | -46.4 | 174.6 | -73.8 | 172.7 | -173.4 | 174.8 | 0 | 111.6 | D26 E27 N32 N33 I34 | D26-K30 VanDerWaalsContact O-CG 3.32Å; D26-K30 WeakPolarHBondContact O-CG 3.43Å; D26-K30 PolarHBondContact O-N 3.4Å; E27-K30 PolarHBondContact O-N 2.92Å; K30-N32 VanDerWaalsContact C-N 3.33Å; K30-N32 PolarHBondContact O-N 3.14Å; K30-N33 PolarHBondContact O-N 3.43Å; K30-I34 WeakPolarHBondContact O-CG1 3.46Å; K30-I34 PolarHBondContact O-N 3.3Å |
| 31 | Q | 91.9 | Very high | 90.9 | Very high | 115 Ų | 115 | 95 Ų | 95 | 54% | 0.537 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 176.5 | -72.6 | 177.9 | 1.3 | 0 | 0 | 111.4 | E27 L28 I34 L35 | E27-Q31 WeakPolarHBondContact O-CG 3.45Å; E27-Q31 PolarHBondContact O-N 3.3Å; L28-Q31 PolarHBondContact O-N 2.86Å; Q31-I34 PolarHBondContact O-N 3.46Å; Q31-L35 WeakPolarHBondContact O-CG 3.44Å; Q31-L35 PolarHBondContact O-N 2.99Å |
| 32 | N | 91.4 | Very high | 91 | Very high | 78 Ų | 78 | 96 Ų | 96 | 42% | 0.417 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62 | -45.5 | 176.4 | -167.1 | 4.2 | 0 | 0 | 0 | 111.4 | L28 Q29 K30 I34 L35 I36 | L28-N32 WeakPolarHBondContact O-CB 3.46Å; L28-N32 PolarHBondContact O-N 3.12Å; Q29-N32 PolarHBondContact O-N 2.99Å; K30-N32 VanDerWaalsContact C-N 3.33Å; K30-N32 PolarHBondContact O-N 3.14Å; N32-I34 VanDerWaalsContact C-N 3.34Å; N32-I34 PolarHBondContact O-N 3.25Å; N32-L35 PolarHBondContact O-N 2.9Å; N32-I36 WeakPolarHBondContact O-CB 3.38Å; N32-I36 VanDerWaalsContact O-CG1 3.25Å; N32-I36 WeakPolarHBondContact O-CG1 3.46Å; N32-I36 PolarHBondContact O-N 3.05Å; N32-I36 WeakPolarHBondContact OD1-CD1 3.45Å |
| 33 | N | 91.8 | Very high | 91.1 | Very high | 83 Ų | 83 | 96.9 Ų | 96.9 | 44% | 0.444 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.5 | -40.9 | 176.7 | -70 | -12.8 | 0 | 0 | 0 | 112.5 | Q29 K30 I36 S37 | Q29-N33 PolarHBondContact NE2-OD1 2.89Å; Q29-N33 WeakPolarHBondContact O-CB 3.48Å; Q29-N33 PolarHBondContact O-N 3.41Å; Q29-N33 PolarHBondContact O-ND2 3.38Å; Q29-N33 PolarHBondContact O-OD1 3.38Å; K30-N33 PolarHBondContact O-N 3.43Å; N33-I36 PolarHBondContact O-N 3.31Å; N33-S37 PolarHBondContact O-N 2.65Å |
| 34 | I | 92.1 | Very high | 91.3 | Very high | 92 Ų | 92 | 97 Ų | 97 | 47% | 0.472 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.6 | -42 | 175.6 | -67.1 | 164.9 | 0 | 0 | 0 | 111.1 | K30 Q31 N32 I36 S37 Q38 | K30-I34 WeakPolarHBondContact O-CG1 3.46Å; K30-I34 PolarHBondContact O-N 3.3Å; Q31-I34 PolarHBondContact O-N 3.46Å; N32-I34 VanDerWaalsContact C-N 3.34Å; N32-I34 PolarHBondContact O-N 3.25Å; I34-I36 VanDerWaalsContact C-N 3.35Å; I34-S37 PolarHBondContact O-N 3.43Å; I34-S37 PolarHBondContact O-OG 3.04Å; I34-Q38 WeakPolarHBondContact O-CB 3.44Å; I34-Q38 VanDerWaalsContact O-CG 3.3Å; I34-Q38 WeakPolarHBondContact O-CG 3.42Å; I34-Q38 PolarHBondContact O-N 3Å |
| 35 | L | 90.6 | Very high | 91.4 | Very high | 100 Ų | 100 | 96 Ų | 96 | 52% | 0.524 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.8 | -40.8 | 176.6 | -72.7 | 171.9 | 0 | 0 | 0 | 111.2 | Q31 N32 Q38 C39 | Q31-L35 WeakPolarHBondContact O-CG 3.44Å; Q31-L35 PolarHBondContact O-N 2.99Å; N32-L35 PolarHBondContact O-N 2.9Å; L35-Q38 PolarHBondContact O-N 3.46Å; L35-C39 VanDerWaalsContact O-CB 3.31Å; L35-C39 WeakPolarHBondContact O-CB 3.38Å; L35-C39 PolarHBondContact O-N 3.43Å; L35-C39 PolarHBondContact O-SG 3.5Å |
| 36 | I | 90.4 | Very high | 91.6 | Very high | 89 Ų | 89 | 95.5 Ų | 95.5 | 46% | 0.456 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.8 | -47.8 | 175.4 | -69.6 | 164.7 | 0 | 0 | 0 | 110.4 | N32 N33 I34 Q38 C39 V40 | N32-I36 WeakPolarHBondContact O-CB 3.38Å; N32-I36 VanDerWaalsContact O-CG1 3.25Å; N32-I36 WeakPolarHBondContact O-CG1 3.46Å; N32-I36 PolarHBondContact O-N 3.05Å; N32-I36 WeakPolarHBondContact OD1-CD1 3.45Å; N33-I36 PolarHBondContact O-N 3.31Å; I34-I36 VanDerWaalsContact C-N 3.35Å; I36-Q38 PolarHBondContact O-N 2.92Å; I36-C39 WeakPolarHBondContact O-CB 3.44Å; I36-C39 PolarHBondContact O-N 3.38Å; I36-C39 VanDerWaalsContact O-N 3.16Å; I36-V40 WeakPolarHBondContact O-CG2 3.44Å; I36-V40 PolarHBondContact O-N 2.9Å |
| 37 | S | 88.4 | Confident | 91.7 | Very high | 55 Ų | 55 | 94.1 Ų | 94.1 | 39% | 0.385 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.6 | -45 | 179.2 | 70.6 | 0 | 0 | 0 | 0 | 111.6 | N33 I34 C39 V40 D41 | N33-S37 PolarHBondContact O-N 2.65Å; I34-S37 PolarHBondContact O-N 3.43Å; I34-S37 PolarHBondContact O-OG 3.04Å; S37-C39 VanDerWaalsContact C-N 3.27Å; S37-C39 PolarHBondContact O-N 3.41Å; S37-V40 PolarHBondContact O-N 3.35Å; S37-V40 VanDerWaalsContact O-N 3.09Å; S37-D41 VanDerWaalsContact O-CG 3.3Å; S37-D41 PolarHBondContact O-N 3.05Å |
| 38 | Q | 89.4 | Confident | 91.8 | Very high | 90 Ų | 90 | 96.6 Ų | 96.6 | 42% | 0.421 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -35.1 | 174.5 | -72 | 178.5 | 5.4 | 0 | 0 | 112.7 | I34 L35 I36 K42 | I34-Q38 WeakPolarHBondContact O-CB 3.44Å; I34-Q38 VanDerWaalsContact O-CG 3.3Å; I34-Q38 WeakPolarHBondContact O-CG 3.42Å; I34-Q38 PolarHBondContact O-N 3Å; L35-Q38 PolarHBondContact O-N 3.46Å; I36-Q38 PolarHBondContact O-N 2.92Å; Q38-K42 WeakPolarHBondContact O-CB 3.47Å; Q38-K42 WeakPolarHBondContact O-CG 3.33Å; Q38-K42 PolarHBondContact O-N 3.41Å |
| 39 | C | 87 | Confident | 92 | Very high | 70 Ų | 70 | 97.1 Ų | 97.1 | 47% | 0.473 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.9 | -35.3 | 174.7 | -79.8 | 0 | 0 | 0 | 0 | 112.3 | L35 I36 S37 K43 | L35-C39 VanDerWaalsContact O-CB 3.31Å; L35-C39 WeakPolarHBondContact O-CB 3.38Å; L35-C39 PolarHBondContact O-N 3.43Å; L35-C39 PolarHBondContact O-SG 3.5Å; I36-C39 WeakPolarHBondContact O-CB 3.44Å; I36-C39 PolarHBondContact O-N 3.38Å; I36-C39 VanDerWaalsContact O-N 3.16Å; S37-C39 VanDerWaalsContact C-N 3.27Å; S37-C39 PolarHBondContact O-N 3.41Å; C39-K43 WeakPolarHBondContact O-CG 3.37Å; C39-K43 PolarHBondContact O-N 2.98Å; C39-K43 VanDerWaalsContact O-N 3.17Å |
| 40 | V | 89 | Confident | 92.2 | Very high | 67 Ų | 67 | 99.4 Ų | 99.4 | 41% | 0.406 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.9 | -50.3 | 174.6 | 174.1 | 0 | 0 | 0 | 0 | 110.2 | I36 S37 K42 K43 D44 | I36-V40 WeakPolarHBondContact O-CG2 3.44Å; I36-V40 PolarHBondContact O-N 2.9Å; S37-V40 PolarHBondContact O-N 3.35Å; S37-V40 VanDerWaalsContact O-N 3.09Å; V40-K42 VanDerWaalsContact C-N 3.31Å; V40-K42 PolarHBondContact O-N 2.91Å; V40-K43 WeakPolarHBondContact O-CA 3.5Å; V40-K43 WeakPolarHBondContact O-CB 3.45Å; V40-K43 PolarHBondContact O-N 3.25Å; V40-D44 PolarHBondContact O-N 3.5Å |
| 41 | D | 90.6 | Very high | 92.4 | Very high | 90 Ų | 90 | 97.6 Ų | 97.6 | 48% | 0.481 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58 | -43.7 | 179.4 | -63 | -24.5 | 0 | 0 | 0 | 111.8 | S37 K43 D44 I45 | S37-D41 VanDerWaalsContact O-CG 3.3Å; S37-D41 PolarHBondContact O-N 3.05Å; D41-K43 VanDerWaalsContact C-N 3.33Å; D41-K43 PolarHBondContact O-N 2.91Å; D41-D44 PolarHBondContact O-N 3.34Å; D41-I45 VanDerWaalsContact O-CG1 3.25Å; D41-I45 WeakPolarHBondContact O-CG1 3.35Å; D41-I45 PolarHBondContact O-N 2.93Å |
| 42 | K | 92.6 | Very high | 92.5 | Very high | 136 Ų | 136 | 93.8 Ų | 93.8 | 59% | 0.591 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.4 | -39.6 | 175.2 | -75 | 175.4 | -174.6 | 178.4 | 0 | 111.9 | Q38 V40 T46 | Q38-K42 WeakPolarHBondContact O-CB 3.47Å; Q38-K42 WeakPolarHBondContact O-CG 3.33Å; Q38-K42 PolarHBondContact O-N 3.41Å; V40-K42 VanDerWaalsContact C-N 3.31Å; V40-K42 PolarHBondContact O-N 2.91Å; K42-T46 WeakPolarHBondContact O-CB 3.36Å; K42-T46 WeakPolarHBondContact O-CG2 3.23Å; K42-T46 PolarHBondContact O-N 3.32Å; K42-T46 PolarHBondContact O-OG1 3.45Å; K42-T46 VanDerWaalsContact O-OG1 3.14Å |
| 43 | K | 93.6 | Very high | 92.8 | Very high | 139 Ų | 139 | 95 Ų | 95 | 60% | 0.604 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63 | -46 | 176.7 | -78 | 171.2 | -178 | -178.5 | 0 | 110.7 | C39 V40 D41 T46 A47 | C39-K43 WeakPolarHBondContact O-CG 3.37Å; C39-K43 PolarHBondContact O-N 2.98Å; C39-K43 VanDerWaalsContact O-N 3.17Å; V40-K43 WeakPolarHBondContact O-CA 3.5Å; V40-K43 WeakPolarHBondContact O-CB 3.45Å; V40-K43 PolarHBondContact O-N 3.25Å; D41-K43 VanDerWaalsContact C-N 3.33Å; D41-K43 PolarHBondContact O-N 2.91Å; K43-T46 WeakPolarHBondContact CA-OG1 3.35Å; K43-T46 PolarHBondContact O-N 2.98Å; K43-T46 PolarHBondContact O-OG1 3.34Å; K43-A47 WeakPolarHBondContact O-CB 3.35Å; K43-A47 PolarHBondContact O-N 2.95Å |
| 44 | D | 93.6 | Very high | 93 | Very high | 99 Ų | 99 | 94.4 Ų | 94.4 | 53% | 0.529 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.8 | -43.7 | -179.2 | -66.9 | -13.5 | 0 | 0 | 0 | 111.6 | V40 D41 T46 A47 Y48 | V40-D44 PolarHBondContact O-N 3.5Å; D41-D44 PolarHBondContact O-N 3.34Å; D44-T46 PolarHBondContact O-N 2.96Å; D44-A47 PolarHBondContact O-N 3.46Å; D44-Y48 PolarHBondContact O-N 3.27Å |
| 45 | I | 93.8 | Very high | 93.2 | Very high | 103 Ų | 103 | 94.9 Ų | 94.9 | 53% | 0.528 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.4 | -45.5 | 173.6 | -66.4 | 165.3 | 0 | 0 | 0 | 110.5 | D41 A47 Y48 L49 | D41-I45 VanDerWaalsContact O-CG1 3.25Å; D41-I45 WeakPolarHBondContact O-CG1 3.35Å; D41-I45 PolarHBondContact O-N 2.93Å; I45-A47 VanDerWaalsContact C-N 3.31Å; I45-A47 PolarHBondContact O-N 3.18Å; I45-Y48 PolarHBondContact O-N 3.25Å; I45-L49 HydrophobicContact CG2-CD1 3.94Å; I45-L49 HydrophobicContact CG2-CG 4.36Å; I45-L49 WeakPolarHBondContact O-CB 3.3Å; I45-L49 VanDerWaalsContact O-CG 3.31Å; I45-L49 WeakPolarHBondContact O-CG 3.35Å; I45-L49 PolarHBondContact O-N 3.43Å |
| 46 | T | 95.3 | Very high | 93.5 | Very high | 70 Ų | 70 | 95 Ų | 95 | 43% | 0.429 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.6 | -33.7 | 178 | 59.6 | 0 | 0 | 0 | 0 | 112.8 | K42 K43 D44 K50 | K42-T46 WeakPolarHBondContact O-CB 3.36Å; K42-T46 WeakPolarHBondContact O-CG2 3.23Å; K42-T46 PolarHBondContact O-N 3.32Å; K42-T46 PolarHBondContact O-OG1 3.45Å; K42-T46 VanDerWaalsContact O-OG1 3.14Å; K43-T46 WeakPolarHBondContact CA-OG1 3.35Å; K43-T46 PolarHBondContact O-N 2.98Å; K43-T46 PolarHBondContact O-OG1 3.34Å; D44-T46 PolarHBondContact O-N 2.96Å; T46-K50 WeakPolarHBondContact O-CB 3.46Å; T46-K50 WeakPolarHBondContact O-CG 3.34Å; T46-K50 PolarHBondContact O-N 2.93Å |
| 47 | A | 94.6 | Very high | 93.8 | Very high | 56 Ų | 56 | 96.1 Ų | 96.1 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68 | -45.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111 | K43 D44 I45 K50 L51 | K43-A47 WeakPolarHBondContact O-CB 3.35Å; K43-A47 PolarHBondContact O-N 2.95Å; D44-A47 PolarHBondContact O-N 3.46Å; I45-A47 VanDerWaalsContact C-N 3.31Å; I45-A47 PolarHBondContact O-N 3.18Å; A47-K50 PolarHBondContact O-N 3.34Å; A47-L51 PolarHBondContact O-N 3.02Å |
| 48 | Y | 95.5 | Very high | 94.2 | Very high | 160 Ų | 160 | 95.2 Ų | 95.2 | 63% | 0.627 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.3 | -47.3 | 174.7 | 176.5 | -95.9 | 0 | 0 | 0 | 112 | D44 I45 K50 L51 S52 | D44-Y48 PolarHBondContact O-N 3.27Å; I45-Y48 PolarHBondContact O-N 3.25Å; Y48-K50 VanDerWaalsContact C-N 3.31Å; Y48-K50 PolarHBondContact O-N 2.96Å; Y48-L51 PolarHBondContact O-N 2.98Å; Y48-S52 WeakPolarHBondContact O-CB 3.32Å; Y48-S52 PolarHBondContact O-N 3.5Å |
| 49 | L | 96.1 | Very high | 94.5 | Very high | 104 Ų | 104 | 95.1 Ų | 95.1 | 55% | 0.545 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.7 | -38 | 178.2 | -70.9 | 175.1 | 0 | 0 | 0 | 112 | I45 L53 | I45-L49 HydrophobicContact CG2-CD1 3.94Å; I45-L49 HydrophobicContact CG2-CG 4.36Å; I45-L49 WeakPolarHBondContact O-CB 3.3Å; I45-L49 VanDerWaalsContact O-CG 3.31Å; I45-L49 WeakPolarHBondContact O-CG 3.35Å; I45-L49 PolarHBondContact O-N 3.43Å; L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 PolarHBondContact O-N 2.89Å |
| 50 | K | 96.2 | Very high | 95 | Very high | 150 Ų | 150 | 96.3 Ų | 96.3 | 65% | 0.652 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.4 | -44.3 | 174.4 | -78.4 | 174.9 | -179.8 | -176.9 | 0 | 112.2 | T46 A47 Y48 L53 S54 | T46-K50 WeakPolarHBondContact O-CB 3.46Å; T46-K50 WeakPolarHBondContact O-CG 3.34Å; T46-K50 PolarHBondContact O-N 2.93Å; A47-K50 PolarHBondContact O-N 3.34Å; Y48-K50 VanDerWaalsContact C-N 3.31Å; Y48-K50 PolarHBondContact O-N 2.96Å; K50-L53 PolarHBondContact O-N 3.26Å; K50-S54 WeakPolarHBondContact O-CB 3.32Å; K50-S54 PolarHBondContact O-N 2.94Å |
| 51 | L | 96.5 | Very high | 95.4 | Very high | 103 Ų | 103 | 95.9 Ų | 95.9 | 54% | 0.539 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.8 | -50 | 177.6 | -177.4 | 69.6 | 0 | 0 | 0 | 110.5 | A47 Y48 L53 S54 E55 | A47-L51 PolarHBondContact O-N 3.02Å; Y48-L51 PolarHBondContact O-N 2.98Å; L51-L53 VanDerWaalsContact C-N 3.32Å; L51-L53 PolarHBondContact O-N 2.97Å; L51-S54 WeakPolarHBondContact O-CB 3.47Å; L51-S54 PolarHBondContact O-N 2.9Å; L51-S54 VanDerWaalsContact O-N 3.13Å; L51-E55 WeakPolarHBondContact O-CG 3.5Å; L51-E55 PolarHBondContact O-N 2.85Å |
| 52 | S | 95.1 | Very high | 95.7 | Very high | 35 Ų | 35 | 96.4 Ų | 96.4 | 25% | 0.245 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -61.7 | -39.5 | 178.6 | -174.6 | 0 | 0 | 0 | 0 | 112.3 | Y48 E55 K56 | Y48-S52 WeakPolarHBondContact O-CB 3.32Å; Y48-S52 PolarHBondContact O-N 3.5Å; S52-E55 PolarHBondContact O-N 3.36Å; S52-K56 WeakPolarHBondContact O-CG 3.5Å; S52-K56 PolarHBondContact O-N 2.87Å |
| 53 | L | 96.6 | Very high | 95.9 | Very high | 103 Ų | 103 | 94.9 Ų | 94.9 | 54% | 0.539 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.3 | -46 | 173.8 | -177.5 | 65.7 | 0 | 0 | 0 | 111.2 | L49 K50 L51 E55 K56 E57 | L49-L53 WeakPolarHBondContact O-CB 3.36Å; L49-L53 PolarHBondContact O-N 2.89Å; K50-L53 PolarHBondContact O-N 3.26Å; L51-L53 VanDerWaalsContact C-N 3.32Å; L51-L53 PolarHBondContact O-N 2.97Å; L53-E55 VanDerWaalsContact C-N 3.34Å; L53-E55 PolarHBondContact O-N 3.06Å; L53-K56 PolarHBondContact O-N 3.48Å; L53-E57 WeakPolarHBondContact O-CG 3.4Å; L53-E57 PolarHBondContact O-N 2.9Å |
| 54 | S | 95.8 | Very high | 96.1 | Very high | 71 Ų | 71 | 96 Ų | 96 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.9 | -38.8 | 177.9 | -175 | 0 | 0 | 0 | 0 | 112.5 | K50 L51 E57 G58 | K50-S54 WeakPolarHBondContact O-CB 3.32Å; K50-S54 PolarHBondContact O-N 2.94Å; L51-S54 WeakPolarHBondContact O-CB 3.47Å; L51-S54 PolarHBondContact O-N 2.9Å; L51-S54 VanDerWaalsContact O-N 3.13Å; S54-E57 PolarHBondContact O-N 3.26Å; S54-G58 PolarHBondContact O-N 3.42Å |
| 55 | E | 96.2 | Very high | 96.3 | Very high | 103 Ų | 103 | 98.2 Ų | 98.2 | 48% | 0.481 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 174.2 | -73.1 | 171.1 | 172.7 | 0 | 0 | 110.9 | L51 S52 L53 G58 E59 | L51-E55 WeakPolarHBondContact O-CG 3.5Å; L51-E55 PolarHBondContact O-N 2.85Å; S52-E55 PolarHBondContact O-N 3.36Å; L53-E55 VanDerWaalsContact C-N 3.34Å; L53-E55 PolarHBondContact O-N 3.06Å; E55-G58 PolarHBondContact O-N 2.85Å; E55-E59 WeakPolarHBondContact O-CG 3.49Å; E55-E59 PolarHBondContact O-N 3.33Å |
| 56 | K | 96.4 | Very high | 96.4 | Very high | 102 Ų | 102 | 100.4 Ų | 100.4 | 44% | 0.443 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.9 | -34.7 | 177 | -66 | -61.1 | 169.2 | -150.1 | 0 | 113.1 | S52 L53 G58 E59 L60 | S52-K56 WeakPolarHBondContact O-CG 3.5Å; S52-K56 PolarHBondContact O-N 2.87Å; L53-K56 PolarHBondContact O-N 3.48Å; K56-G58 VanDerWaalsContact C-N 3.33Å; K56-E59 WeakPolarHBondContact CD-OE2 3.46Å; K56-E59 IonicContact NZ-OE1 3.63Å; K56-E59 PolarHBondContact NZ-OE1 3.22Å; K56-E59 IonicContact NZ-OE2 3.95Å; K56-E59 PolarHBondContact NZ-OE2 3.48Å; K56-L60 VanDerWaalsContact O-CB 3.3Å; K56-L60 WeakPolarHBondContact O-CB 3.33Å; K56-L60 WeakPolarHBondContact O-CG 3.48Å; K56-L60 PolarHBondContact O-N 3.17Å |
| 57 | E | 96.8 | Very high | 96.5 | Very high | 113 Ų | 113 | 100.8 Ų | 100.8 | 53% | 0.528 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.6 | -40.1 | 171.1 | -74.5 | 173.6 | 170.6 | 0 | 0 | 111.4 | L53 S54 L60 A61 | L53-E57 WeakPolarHBondContact O-CG 3.4Å; L53-E57 PolarHBondContact O-N 2.9Å; S54-E57 PolarHBondContact O-N 3.26Å; E57-L60 PolarHBondContact O-N 3.43Å; E57-A61 WeakPolarHBondContact O-CB 3.42Å; E57-A61 PolarHBondContact O-N 2.79Å |
| 58 | G | 97.1 | Very high | 96.7 | Very high | 35 Ų | 35 | 104.3 Ų | 104.3 | 36% | 0.361 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.8 | -50.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | S54 E55 K56 L60 A61 E62 | S54-G58 PolarHBondContact O-N 3.42Å; E55-G58 PolarHBondContact O-N 2.85Å; K56-G58 VanDerWaalsContact C-N 3.33Å; G58-L60 VanDerWaalsContact C-N 3.29Å; G58-L60 PolarHBondContact O-N 3.17Å; G58-A61 WeakPolarHBondContact O-CB 3.37Å; G58-A61 PolarHBondContact O-N 2.92Å; G58-A61 VanDerWaalsContact O-N 3.08Å; G58-E62 PolarHBondContact O-N 3.47Å |
| 59 | E | 97.1 | Very high | 96.8 | Very high | 89 Ų | 89 | 98.4 Ų | 98.4 | 42% | 0.416 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -56.7 | -42.9 | 175.1 | -72 | 174.5 | -158.8 | 0 | 0 | 111.6 | E55 K56 A61 E62 L63 | E55-E59 WeakPolarHBondContact O-CG 3.49Å; E55-E59 PolarHBondContact O-N 3.33Å; K56-E59 WeakPolarHBondContact CD-OE2 3.46Å; K56-E59 IonicContact NZ-OE1 3.63Å; K56-E59 PolarHBondContact NZ-OE1 3.22Å; K56-E59 IonicContact NZ-OE2 3.95Å; K56-E59 PolarHBondContact NZ-OE2 3.48Å; E59-A61 VanDerWaalsContact C-N 3.34Å; E59-A61 PolarHBondContact O-N 3.48Å; E59-E62 PolarHBondContact O-N 3Å; E59-L63 WeakPolarHBondContact O-CB 3.44Å; E59-L63 VanDerWaalsContact O-CG 3.3Å; E59-L63 WeakPolarHBondContact O-CG 3.27Å; E59-L63 PolarHBondContact O-N 3.35Å |
| 60 | L | 96.8 | Very high | 96.8 | Very high | 95 Ų | 95 | 99.7 Ų | 99.7 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.6 | -36.8 | 176.7 | -77.5 | 171.7 | 0 | 0 | 0 | 112.3 | K56 E57 G58 R64 | K56-L60 VanDerWaalsContact O-CB 3.3Å; K56-L60 WeakPolarHBondContact O-CB 3.33Å; K56-L60 WeakPolarHBondContact O-CG 3.48Å; K56-L60 PolarHBondContact O-N 3.17Å; E57-L60 PolarHBondContact O-N 3.43Å; G58-L60 VanDerWaalsContact C-N 3.29Å; G58-L60 PolarHBondContact O-N 3.17Å; L60-R64 WeakPolarHBondContact O-CB 3.37Å; L60-R64 WeakPolarHBondContact O-CD 3.21Å; L60-R64 WeakPolarHBondContact O-CG 3.46Å; L60-R64 PolarHBondContact O-N 3Å; L60-R64 VanDerWaalsContact O-N 3.08Å |
| 61 | A | 96.9 | Very high | 96.8 | Very high | 57 Ų | 57 | 100 Ų | 100 | 47% | 0.471 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.1 | -46.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | E57 G58 E59 L63 R64 E65 | E57-A61 WeakPolarHBondContact O-CB 3.42Å; E57-A61 PolarHBondContact O-N 2.79Å; G58-A61 WeakPolarHBondContact O-CB 3.37Å; G58-A61 PolarHBondContact O-N 2.92Å; G58-A61 VanDerWaalsContact O-N 3.08Å; E59-A61 VanDerWaalsContact C-N 3.34Å; E59-A61 PolarHBondContact O-N 3.48Å; A61-L63 PolarHBondContact O-N 3.16Å; A61-R64 WeakPolarHBondContact O-CB 3.35Å; A61-R64 PolarHBondContact O-N 3.48Å; A61-E65 PolarHBondContact O-N 3.5Å |
| 62 | E | 97.4 | Very high | 96.9 | Very high | 102 Ų | 102 | 101.2 Ų | 101.2 | 48% | 0.477 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.2 | -43.5 | 176.6 | -70.6 | -174.2 | -162.4 | 0 | 0 | 112.4 | G58 E59 R64 E65 R66 | G58-E62 PolarHBondContact O-N 3.47Å; E59-E62 PolarHBondContact O-N 3Å; E62-R64 VanDerWaalsContact C-N 3.29Å; E62-R64 PolarHBondContact O-N 3.4Å; E62-E65 PolarHBondContact O-N 2.92Å; E62-R66 WeakPolarHBondContact O-CG 3.49Å; E62-R66 PolarHBondContact O-N 3.3Å; E62-R66 IonicContact OE2-CZ 3.54Å; E62-R66 IonicContact OE2-NH2 2.69Å; E62-R66 PolarHBondContact OE2-NH2 3.01Å |
| 63 | L | 97.4 | Very high | 97 | Very high | 103 Ų | 103 | 102.9 Ų | 102.9 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.6 | -35.7 | 177.8 | -73.2 | 174.5 | 0 | 0 | 0 | 111.9 | E59 A61 L67 | E59-L63 WeakPolarHBondContact O-CB 3.44Å; E59-L63 VanDerWaalsContact O-CG 3.3Å; E59-L63 WeakPolarHBondContact O-CG 3.27Å; E59-L63 PolarHBondContact O-N 3.35Å; A61-L63 PolarHBondContact O-N 3.16Å; L63-L67 VanDerWaalsContact O-CB 3.28Å; L63-L67 WeakPolarHBondContact O-CB 3.35Å; L63-L67 PolarHBondContact O-N 3.43Å |
| 64 | R | 96.4 | Very high | 97 | Very high | 164 Ų | 164 | 100 Ų | 100 | 62% | 0.619 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.4 | -46.2 | 173.9 | -75.5 | 168.7 | -172.2 | -120 | 5.2 | 111.4 | L60 A61 E62 R66 L67 E68 | L60-R64 WeakPolarHBondContact O-CB 3.37Å; L60-R64 WeakPolarHBondContact O-CD 3.21Å; L60-R64 WeakPolarHBondContact O-CG 3.46Å; L60-R64 PolarHBondContact O-N 3Å; L60-R64 VanDerWaalsContact O-N 3.08Å; A61-R64 WeakPolarHBondContact O-CB 3.35Å; A61-R64 PolarHBondContact O-N 3.48Å; E62-R64 VanDerWaalsContact C-N 3.29Å; E62-R64 PolarHBondContact O-N 3.4Å; R64-R66 PolarHBondContact O-N 3.4Å; R64-L67 PolarHBondContact O-N 2.97Å; R64-E68 WeakPolarHBondContact O-CB 3.5Å; R64-E68 WeakPolarHBondContact O-CG 3.39Å; R64-E68 PolarHBondContact O-N 3.09Å |
| 65 | E | 97.3 | Very high | 97.1 | Very high | 144 Ų | 144 | 99.8 Ų | 99.8 | 67% | 0.673 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.1 | -44.4 | 178.2 | -173 | 179.4 | -177.9 | 0 | 0 | 111.5 | A61 E62 L67 E68 G69 | A61-E65 PolarHBondContact O-N 3.5Å; E62-E65 PolarHBondContact O-N 2.92Å; E65-L67 PolarHBondContact O-N 2.98Å; E65-E68 PolarHBondContact O-N 3.14Å; E65-G69 PolarHBondContact O-N 2.94Å |
| 66 | R | 97.9 | Very high | 97.1 | Very high | 150 Ų | 150 | 100.6 Ų | 100.6 | 57% | 0.566 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.8 | -45.1 | 174.9 | -68.5 | 177.8 | -153.3 | -178.7 | 9.1 | 111.8 | E62 R64 E68 G69 E70 | E62-R66 WeakPolarHBondContact O-CG 3.49Å; E62-R66 PolarHBondContact O-N 3.3Å; E62-R66 IonicContact OE2-CZ 3.54Å; E62-R66 IonicContact OE2-NH2 2.69Å; E62-R66 PolarHBondContact OE2-NH2 3.01Å; R64-R66 PolarHBondContact O-N 3.4Å; R66-E68 VanDerWaalsContact C-N 3.33Å; R66-E68 PolarHBondContact O-N 3Å; R66-G69 PolarHBondContact O-N 3.03Å; R66-E70 WeakPolarHBondContact O-CG 3.44Å; R66-E70 PolarHBondContact O-N 3.44Å |
| 67 | L | 97.1 | Very high | 97.2 | Very high | 77 Ų | 77 | 101.3 Ų | 101.3 | 40% | 0.403 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.8 | -38.7 | 178.2 | -177.5 | 67 | 0 | 0 | 0 | 112 | L63 R64 E65 R71 | L63-L67 VanDerWaalsContact O-CB 3.28Å; L63-L67 WeakPolarHBondContact O-CB 3.35Å; L63-L67 PolarHBondContact O-N 3.43Å; R64-L67 PolarHBondContact O-N 2.97Å; E65-L67 PolarHBondContact O-N 2.98Å; L67-R71 WeakPolarHBondContact O-CB 3.36Å; L67-R71 WeakPolarHBondContact O-CD 3.31Å; L67-R71 WeakPolarHBondContact O-CG 3.32Å; L67-R71 PolarHBondContact O-N 3.43Å |
| 68 | E | 97.5 | Very high | 97.2 | Very high | 130 Ų | 130 | 101.8 Ų | 101.8 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.1 | -40.7 | 175 | -75.1 | 176.6 | -174.8 | 0 | 0 | 111.6 | R64 E65 R66 R71 H72 | R64-E68 WeakPolarHBondContact O-CB 3.5Å; R64-E68 WeakPolarHBondContact O-CG 3.39Å; R64-E68 PolarHBondContact O-N 3.09Å; E65-E68 PolarHBondContact O-N 3.14Å; R66-E68 VanDerWaalsContact C-N 3.33Å; R66-E68 PolarHBondContact O-N 3Å; E68-R71 PolarHBondContact O-N 3.42Å; E68-H72 WeakPolarHBondContact O-CB 3.33Å; E68-H72 PolarHBondContact O-N 3.18Å |
| 69 | G | 97.3 | Very high | 97.3 | Very high | 36 Ų | 36 | 108.3 Ų | 108.3 | 37% | 0.371 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.2 | -51.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E65 R66 R71 H72 T73 | E65-G69 PolarHBondContact O-N 2.94Å; R66-G69 PolarHBondContact O-N 3.03Å; G69-R71 VanDerWaalsContact C-N 3.32Å; G69-R71 PolarHBondContact O-N 3.47Å; G69-H72 WeakPolarHBondContact O-CB 3.45Å; G69-H72 PolarHBondContact O-N 2.86Å; G69-H72 VanDerWaalsContact O-N 3.12Å; G69-T73 WeakPolarHBondContact O-CG2 3.38Å; G69-T73 PolarHBondContact O-N 3.45Å; G69-T73 PolarHBondContact O-OG1 2.82Å |
| 70 | E | 97.1 | Very high | 97.3 | Very high | 131 Ų | 131 | 106.5 Ų | 106.5 | 61% | 0.612 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.8 | -39 | 176.5 | -74.3 | 179.9 | 178.5 | 0 | 0 | 112.5 | R66 H72 T73 S74 | R66-E70 WeakPolarHBondContact O-CG 3.44Å; R66-E70 PolarHBondContact O-N 3.44Å; E70-H72 VanDerWaalsContact C-N 3.35Å; E70-T73 WeakPolarHBondContact CA-OG1 3.48Å; E70-T73 PolarHBondContact O-OG1 2.96Å; E70-S74 VanDerWaalsContact O-CB 3.24Å; E70-S74 WeakPolarHBondContact O-CB 3.41Å; E70-S74 PolarHBondContact O-N 3Å |
| 71 | R | 96.6 | Very high | 97.3 | Very high | 157 Ų | 157 | 107 Ų | 107 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.3 | -42.1 | 174.3 | -77.3 | 171.3 | 175.9 | -172.9 | -0.1 | 111.2 | L67 E68 G69 V75 | L67-R71 WeakPolarHBondContact O-CB 3.36Å; L67-R71 WeakPolarHBondContact O-CD 3.31Å; L67-R71 WeakPolarHBondContact O-CG 3.32Å; L67-R71 PolarHBondContact O-N 3.43Å; E68-R71 PolarHBondContact O-N 3.42Å; G69-R71 VanDerWaalsContact C-N 3.32Å; G69-R71 PolarHBondContact O-N 3.47Å; R71-V75 WeakPolarHBondContact O-CB 3.43Å; R71-V75 VanDerWaalsContact O-CG2 3.26Å; R71-V75 WeakPolarHBondContact O-CG2 3.41Å; R71-V75 PolarHBondContact O-N 3.2Å |
| 72 | H | 97.5 | Very high | 97.4 | Very high | 128 Ų | 128 | 110.8 Ų | 110.8 | 59% | 0.593 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.5 | -48.4 | 179.3 | -171.6 | 72.8 | 0 | 0 | 0 | 111.7 | E68 G69 E70 S74 V75 Q76 | E68-H72 WeakPolarHBondContact O-CB 3.33Å; E68-H72 PolarHBondContact O-N 3.18Å; G69-H72 WeakPolarHBondContact O-CB 3.45Å; G69-H72 PolarHBondContact O-N 2.86Å; G69-H72 VanDerWaalsContact O-N 3.12Å; E70-H72 VanDerWaalsContact C-N 3.35Å; H72-S74 PolarHBondContact O-N 3.42Å; H72-V75 PolarHBondContact O-N 3.09Å; H72-Q76 WeakPolarHBondContact O-CB 3.43Å; H72-Q76 PolarHBondContact O-N 3.43Å |
| 73 | T | 97.1 | Very high | 97.4 | Very high | 71 Ų | 71 | 110.9 Ų | 110.9 | 44% | 0.436 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 177.3 | 56.5 | 0 | 0 | 0 | 0 | 111.2 | G69 E70 V75 Q76 E77 | G69-T73 WeakPolarHBondContact O-CG2 3.38Å; G69-T73 PolarHBondContact O-N 3.45Å; G69-T73 PolarHBondContact O-OG1 2.82Å; E70-T73 WeakPolarHBondContact CA-OG1 3.48Å; E70-T73 PolarHBondContact O-OG1 2.96Å; T73-V75 VanDerWaalsContact C-N 3.33Å; T73-V75 PolarHBondContact O-N 3.44Å; T73-Q76 PolarHBondContact O-N 2.96Å; T73-Q76 VanDerWaalsContact O-N 3.13Å; T73-E77 WeakPolarHBondContact O-CG 3.48Å; T73-E77 PolarHBondContact O-N 2.93Å |
| 74 | S | 96.9 | Very high | 97.4 | Very high | 43 Ų | 43 | 111.3 Ų | 111.3 | 30% | 0.301 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.6 | -40.2 | 177.2 | -173.6 | 0 | 0 | 0 | 0 | 112.7 | E70 H72 K78 | E70-S74 VanDerWaalsContact O-CB 3.24Å; E70-S74 WeakPolarHBondContact O-CB 3.41Å; E70-S74 PolarHBondContact O-N 3Å; H72-S74 PolarHBondContact O-N 3.42Å; S74-K78 WeakPolarHBondContact O-CB 3.49Å; S74-K78 WeakPolarHBondContact O-CG 3.48Å; S74-K78 PolarHBondContact O-N 2.86Å |
| 75 | V | 97.9 | Very high | 97.5 | Very high | 65 Ų | 65 | 108.2 Ų | 108.2 | 39% | 0.394 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67 | -40.6 | 175.7 | 169 | 0 | 0 | 0 | 0 | 111 | R71 H72 T73 K78 R79 | R71-V75 WeakPolarHBondContact O-CB 3.43Å; R71-V75 VanDerWaalsContact O-CG2 3.26Å; R71-V75 WeakPolarHBondContact O-CG2 3.41Å; R71-V75 PolarHBondContact O-N 3.2Å; H72-V75 PolarHBondContact O-N 3.09Å; T73-V75 VanDerWaalsContact C-N 3.33Å; T73-V75 PolarHBondContact O-N 3.44Å; V75-K78 PolarHBondContact O-N 3.26Å; V75-R79 VanDerWaalsContact O-CG 3.28Å; V75-R79 WeakPolarHBondContact O-CG 3.32Å; V75-R79 PolarHBondContact O-N 3.29Å |
| 76 | Q | 97.6 | Very high | 97.5 | Very high | 120 Ų | 120 | 102.5 Ų | 102.5 | 56% | 0.561 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.4 | -45.6 | 178.6 | -174.2 | 174.9 | -6.7 | 0 | 0 | 111.8 | H72 T73 K78 R79 S80 | H72-Q76 WeakPolarHBondContact O-CB 3.43Å; H72-Q76 PolarHBondContact O-N 3.43Å; T73-Q76 PolarHBondContact O-N 2.96Å; T73-Q76 VanDerWaalsContact O-N 3.13Å; Q76-K78 PolarHBondContact O-N 2.85Å; Q76-R79 WeakPolarHBondContact O-CB 3.49Å; Q76-R79 PolarHBondContact O-N 2.88Å; Q76-R79 VanDerWaalsContact O-N 3.17Å; Q76-S80 PolarHBondContact O-N 3.19Å |
| 77 | E | 97.2 | Very high | 97.5 | Very high | 117 Ų | 117 | 99.2 Ų | 99.2 | 55% | 0.547 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.4 | -42.8 | 175.1 | -72.1 | 172.5 | -178.8 | 0 | 0 | 111.8 | T73 R79 S80 L81 | T73-E77 WeakPolarHBondContact O-CG 3.48Å; T73-E77 PolarHBondContact O-N 2.93Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 3.35Å; E77-S80 WeakPolarHBondContact CA-OG 3.4Å; E77-S80 PolarHBondContact O-N 3.3Å; E77-S80 PolarHBondContact O-OG 3.01Å; E77-L81 WeakPolarHBondContact O-CB 3.35Å; E77-L81 VanDerWaalsContact O-CG 3.29Å; E77-L81 WeakPolarHBondContact O-CG 3.28Å; E77-L81 PolarHBondContact O-N 3.37Å |
| 78 | K | 97.7 | Very high | 97.6 | Very high | 123 Ų | 123 | 100.1 Ų | 100.1 | 54% | 0.535 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.3 | -40.7 | 174.5 | -76.3 | 173.8 | -173.3 | 177.4 | 0 | 111.5 | S74 V75 Q76 Q82 | S74-K78 WeakPolarHBondContact O-CB 3.49Å; S74-K78 WeakPolarHBondContact O-CG 3.48Å; S74-K78 PolarHBondContact O-N 2.86Å; V75-K78 PolarHBondContact O-N 3.26Å; Q76-K78 PolarHBondContact O-N 2.85Å; K78-Q82 VanDerWaalsContact O-CB 3.31Å; K78-Q82 WeakPolarHBondContact O-CB 3.48Å; K78-Q82 WeakPolarHBondContact O-CG 3.3Å; K78-Q82 PolarHBondContact O-N 3.09Å |
| 79 | R | 97.9 | Very high | 97.6 | Very high | 172 Ų | 172 | 101.4 Ų | 101.4 | 65% | 0.649 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.7 | -41.8 | 177.9 | -74.2 | 173.4 | -179.1 | -176.5 | 1.7 | 112.2 | V75 Q76 E77 Q82 L83 | V75-R79 VanDerWaalsContact O-CG 3.28Å; V75-R79 WeakPolarHBondContact O-CG 3.32Å; V75-R79 PolarHBondContact O-N 3.29Å; Q76-R79 WeakPolarHBondContact O-CB 3.49Å; Q76-R79 PolarHBondContact O-N 2.88Å; Q76-R79 VanDerWaalsContact O-N 3.17Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 3.35Å; R79-Q82 PolarHBondContact O-N 3.47Å; R79-L83 WeakPolarHBondContact O-CB 3.48Å; R79-L83 PolarHBondContact O-N 2.94Å |
| 80 | S | 97.3 | Very high | 97.7 | Very high | 51 Ų | 51 | 106.7 Ų | 106.7 | 36% | 0.357 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.7 | -46.6 | 177.5 | 61.5 | 0 | 0 | 0 | 0 | 111.3 | Q76 E77 Q82 L83 E84 | Q76-S80 PolarHBondContact O-N 3.19Å; E77-S80 WeakPolarHBondContact CA-OG 3.4Å; E77-S80 PolarHBondContact O-N 3.3Å; E77-S80 PolarHBondContact O-OG 3.01Å; S80-Q82 VanDerWaalsContact C-N 3.33Å; S80-Q82 PolarHBondContact O-N 3.16Å; S80-L83 WeakPolarHBondContact O-CB 3.46Å; S80-L83 PolarHBondContact O-N 2.93Å; S80-L83 VanDerWaalsContact O-N 3.12Å; S80-E84 WeakPolarHBondContact O-CG 3.45Å; S80-E84 PolarHBondContact O-N 3.49Å |
| 81 | L | 97.6 | Very high | 97.7 | Very high | 106 Ų | 106 | 106.5 Ų | 106.5 | 56% | 0.555 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.8 | -38.8 | 177.2 | -68.6 | 169.5 | 0 | 0 | 0 | 112.2 | E77 L83 E84 H85 | E77-L81 WeakPolarHBondContact O-CB 3.35Å; E77-L81 VanDerWaalsContact O-CG 3.29Å; E77-L81 WeakPolarHBondContact O-CG 3.28Å; E77-L81 PolarHBondContact O-N 3.37Å; L81-L83 VanDerWaalsContact C-N 3.33Å; L81-E84 PolarHBondContact O-N 3.15Å; L81-H85 VanDerWaalsContact O-CB 3.22Å; L81-H85 WeakPolarHBondContact O-CB 3.44Å; L81-H85 PolarHBondContact O-N 3.26Å |
| 82 | Q | 97.9 | Very high | 97.8 | Very high | 136 Ų | 136 | 103.5 Ų | 103.5 | 64% | 0.636 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -40.2 | 174.1 | -79.3 | 173.9 | -0.7 | 0 | 0 | 112.1 | K78 R79 S80 G86 | K78-Q82 VanDerWaalsContact O-CB 3.31Å; K78-Q82 WeakPolarHBondContact O-CB 3.48Å; K78-Q82 WeakPolarHBondContact O-CG 3.3Å; K78-Q82 PolarHBondContact O-N 3.09Å; R79-Q82 PolarHBondContact O-N 3.47Å; S80-Q82 VanDerWaalsContact C-N 3.33Å; S80-Q82 PolarHBondContact O-N 3.16Å; Q82-G86 PolarHBondContact O-N 2.94Å |
| 83 | L | 98.1 | Very high | 97.8 | Very high | 104 Ų | 104 | 102.1 Ų | 102.1 | 55% | 0.545 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.8 | -47.8 | 177.5 | -177.1 | 65.7 | 0 | 0 | 0 | 111.3 | R79 S80 L81 G86 Q87 | R79-L83 WeakPolarHBondContact O-CB 3.48Å; R79-L83 PolarHBondContact O-N 2.94Å; S80-L83 WeakPolarHBondContact O-CB 3.46Å; S80-L83 PolarHBondContact O-N 2.93Å; S80-L83 VanDerWaalsContact O-N 3.12Å; L81-L83 VanDerWaalsContact C-N 3.33Å; L83-G86 PolarHBondContact O-N 3.4Å; L83-Q87 WeakPolarHBondContact O-CG 3.5Å; L83-Q87 PolarHBondContact O-N 3.49Å |
| 84 | E | 97.8 | Very high | 97.9 | Very high | 112 Ų | 112 | 101.4 Ų | 101.4 | 52% | 0.523 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.5 | -47.2 | 177.7 | -73 | 175.9 | -171.8 | 0 | 0 | 111.5 | S80 L81 G86 Q87 L88 | S80-E84 WeakPolarHBondContact O-CG 3.45Å; S80-E84 PolarHBondContact O-N 3.49Å; L81-E84 PolarHBondContact O-N 3.15Å; E84-G86 VanDerWaalsContact C-N 3.28Å; E84-G86 PolarHBondContact O-N 3.42Å; E84-Q87 WeakPolarHBondContact O-CB 3.28Å; E84-Q87 PolarHBondContact O-N 3.49Å; E84-Q87 VanDerWaalsContact O-N 3.1Å; E84-L88 PolarHBondContact O-N 2.93Å |
| 85 | H | 97.8 | Very high | 98 | Very high | 99 Ų | 99 | 107.8 Ų | 107.8 | 46% | 0.458 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.5 | -37 | 176.5 | 176.8 | -109 | 0 | 0 | 0 | 111.8 | L81 R89 | L81-H85 VanDerWaalsContact O-CB 3.22Å; L81-H85 WeakPolarHBondContact O-CB 3.44Å; L81-H85 PolarHBondContact O-N 3.26Å; H85-R89 PolarHBondContact CE1-NE 2.96Å; H85-R89 PolarHBondContact CE1-NH2 2.93Å; H85-R89 PolarHBondContact NE2-NE 2.88Å; H85-R89 PolarHBondContact NE2-NH2 3.24Å; H85-R89 VanDerWaalsContact NE2-NH2 3.14Å; H85-R89 WeakPolarHBondContact O-CB 3.42Å; H85-R89 WeakPolarHBondContact O-CG 3.41Å; H85-R89 PolarHBondContact O-N 3.18Å |
| 86 | G | 98.2 | Very high | 98 | Very high | 25 Ų | 25 | 108.3 Ų | 108.3 | 26% | 0.258 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.1 | -35.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q82 L83 E84 R90 | Q82-G86 PolarHBondContact O-N 2.94Å; L83-G86 PolarHBondContact O-N 3.4Å; E84-G86 VanDerWaalsContact C-N 3.28Å; E84-G86 PolarHBondContact O-N 3.42Å; G86-R90 WeakPolarHBondContact O-CG 3.48Å; G86-R90 PolarHBondContact O-N 2.9Å; G86-R90 PolarHBondContact O-NE 3.46Å; G86-R90 VanDerWaalsContact O-NE 3.16Å |
| 87 | Q | 98.3 | Very high | 98 | Very high | 81 Ų | 81 | 105.7 Ų | 105.7 | 38% | 0.379 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.2 | -51 | 173.9 | -72.8 | 171.6 | -1.8 | 0 | 0 | 111 | L83 E84 R89 R90 E91 | L83-Q87 WeakPolarHBondContact O-CG 3.5Å; L83-Q87 PolarHBondContact O-N 3.49Å; E84-Q87 WeakPolarHBondContact O-CB 3.28Å; E84-Q87 PolarHBondContact O-N 3.49Å; E84-Q87 VanDerWaalsContact O-N 3.1Å; Q87-R89 VanDerWaalsContact C-N 3.29Å; Q87-R89 PolarHBondContact O-N 3.16Å; Q87-R90 WeakPolarHBondContact O-CB 3.45Å; Q87-R90 PolarHBondContact O-N 3.25Å; Q87-E91 PolarHBondContact O-N 2.93Å |
| 88 | L | 98.2 | Very high | 98.1 | Very high | 95 Ų | 95 | 106 Ų | 106 | 50% | 0.497 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.1 | -39.3 | -179.7 | -173.2 | 64.7 | 0 | 0 | 0 | 112 | E84 R90 E91 L92 | E84-L88 PolarHBondContact O-N 2.93Å; L88-R90 PolarHBondContact O-N 3.29Å; L88-E91 PolarHBondContact O-N 3.43Å; L88-L92 HydrophobicContact CG-CD1 4.23Å; L88-L92 WeakPolarHBondContact O-CB 3.47Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.31Å; L88-L92 PolarHBondContact O-N 2.86Å |
| 89 | R | 98.4 | Very high | 98.1 | Very high | 157 Ų | 157 | 104.2 Ų | 104.2 | 59% | 0.592 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.8 | -43 | 173.5 | -79.5 | -175.5 | -177.8 | -123 | 0.6 | 112.7 | H85 Q87 L92 Q93 | H85-R89 PolarHBondContact CE1-NE 2.96Å; H85-R89 PolarHBondContact CE1-NH2 2.93Å; H85-R89 PolarHBondContact NE2-NE 2.88Å; H85-R89 PolarHBondContact NE2-NH2 3.24Å; H85-R89 VanDerWaalsContact NE2-NH2 3.14Å; H85-R89 WeakPolarHBondContact O-CB 3.42Å; H85-R89 WeakPolarHBondContact O-CG 3.41Å; H85-R89 PolarHBondContact O-N 3.18Å; Q87-R89 VanDerWaalsContact C-N 3.29Å; Q87-R89 PolarHBondContact O-N 3.16Å; R89-L92 PolarHBondContact O-N 3.33Å; R89-Q93 WeakPolarHBondContact O-CB 3.33Å; R89-Q93 PolarHBondContact O-N 2.88Å |
| 90 | R | 98.3 | Very high | 98.1 | Very high | 147 Ų | 147 | 101.6 Ų | 101.6 | 56% | 0.555 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.4 | -41.1 | 177.7 | -77.7 | -179.2 | -81.5 | 113.7 | -9.1 | 111.7 | G86 Q87 L88 Q93 A94 | G86-R90 WeakPolarHBondContact O-CG 3.48Å; G86-R90 PolarHBondContact O-N 2.9Å; G86-R90 PolarHBondContact O-NE 3.46Å; G86-R90 VanDerWaalsContact O-NE 3.16Å; Q87-R90 WeakPolarHBondContact O-CB 3.45Å; Q87-R90 PolarHBondContact O-N 3.25Å; L88-R90 PolarHBondContact O-N 3.29Å; R90-Q93 PolarHBondContact O-N 2.96Å; R90-A94 WeakPolarHBondContact O-CB 3.3Å; R90-A94 PolarHBondContact O-N 3.46Å |
| 91 | E | 98.3 | Very high | 98.2 | Very high | 128 Ų | 128 | 105.8 Ų | 105.8 | 60% | 0.598 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.2 | -43.2 | 176.6 | -70.9 | 176.2 | -172 | 0 | 0 | 112.4 | Q87 L88 A94 R95 | Q87-E91 PolarHBondContact O-N 2.93Å; L88-E91 PolarHBondContact O-N 3.43Å; E91-A94 PolarHBondContact O-N 3.39Å; E91-R95 WeakPolarHBondContact O-CB 3.44Å; E91-R95 PolarHBondContact O-N 3.48Å |
| 92 | L | 98.1 | Very high | 98.2 | Very high | 94 Ų | 94 | 106.1 Ų | 106.1 | 49% | 0.492 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.2 | -43.7 | 175.1 | -73 | 173.9 | 0 | 0 | 0 | 111.3 | L88 R89 R95 I96 | L88-L92 HydrophobicContact CG-CD1 4.23Å; L88-L92 WeakPolarHBondContact O-CB 3.47Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.31Å; L88-L92 PolarHBondContact O-N 2.86Å; R89-L92 PolarHBondContact O-N 3.33Å; L92-R95 PolarHBondContact O-N 3.49Å; L92-I96 VanDerWaalsContact O-CG1 3.31Å; L92-I96 WeakPolarHBondContact O-CG1 3.48Å; L92-I96 PolarHBondContact O-N 2.97Å |
| 93 | Q | 98.4 | Very high | 98.2 | Very high | 98 Ų | 98 | 104.6 Ų | 104.6 | 46% | 0.458 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.4 | -48.6 | 176.6 | -169.4 | 61.2 | 50.4 | 0 | 0 | 111.3 | R89 R90 R95 I96 D97 | R89-Q93 WeakPolarHBondContact O-CB 3.33Å; R89-Q93 PolarHBondContact O-N 2.88Å; R90-Q93 PolarHBondContact O-N 2.96Å; Q93-R95 PolarHBondContact O-N 2.64Å; Q93-I96 WeakPolarHBondContact O-CA 3.45Å; Q93-I96 WeakPolarHBondContact O-CB 3.42Å; Q93-I96 PolarHBondContact O-N 3.31Å; Q93-D97 PolarHBondContact NE2-OD1 3Å; Q93-D97 PolarHBondContact O-N 2.99Å |
| 94 | A | 98.3 | Very high | 98.2 | Very high | 57 Ų | 57 | 102.6 Ų | 102.6 | 47% | 0.471 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.2 | -32.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R90 E91 K98 | R90-A94 WeakPolarHBondContact O-CB 3.3Å; R90-A94 PolarHBondContact O-N 3.46Å; E91-A94 PolarHBondContact O-N 3.39Å; A94-K98 VanDerWaalsContact O-CB 3.3Å; A94-K98 WeakPolarHBondContact O-CB 3.46Å; A94-K98 PolarHBondContact O-N 3.34Å |
| 95 | R | 98.3 | Very high | 98.2 | Very high | 177 Ų | 177 | 99.4 Ų | 99.4 | 67% | 0.668 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -71.7 | -37.8 | 174.5 | -172.8 | 174 | 179.6 | 179.6 | -0.6 | 112.1 | E91 L92 Q93 L99 | E91-R95 WeakPolarHBondContact O-CB 3.44Å; E91-R95 PolarHBondContact O-N 3.48Å; L92-R95 PolarHBondContact O-N 3.49Å; Q93-R95 PolarHBondContact O-N 2.64Å; R95-L99 HydrophobicContact CG-CD1 4.39Å; R95-L99 VanDerWaalsContact O-CG 3.29Å; R95-L99 WeakPolarHBondContact O-CG 3.28Å; R95-L99 PolarHBondContact O-N 3.15Å; R95-L99 VanDerWaalsContact O-N 3.07Å |
| 96 | I | 98.4 | Very high | 98.2 | Very high | 76 Ų | 76 | 99.3 Ų | 99.3 | 39% | 0.39 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.9 | -53.5 | 173.5 | -70.3 | 164.6 | 0 | 0 | 0 | 109 | L92 Q93 K98 L99 E100 | L92-I96 VanDerWaalsContact O-CG1 3.31Å; L92-I96 WeakPolarHBondContact O-CG1 3.48Å; L92-I96 PolarHBondContact O-N 2.97Å; Q93-I96 WeakPolarHBondContact O-CA 3.45Å; Q93-I96 WeakPolarHBondContact O-CB 3.42Å; Q93-I96 PolarHBondContact O-N 3.31Å; I96-K98 VanDerWaalsContact C-N 3.29Å; I96-K98 PolarHBondContact O-N 3.28Å; I96-L99 CarbonylContact O-C 3.6Å; I96-L99 WeakPolarHBondContact O-CA 3.46Å; I96-L99 WeakPolarHBondContact O-CB 3.45Å; I96-L99 PolarHBondContact O-N 2.84Å; I96-E100 HydrophobicContact CG2-CG 4.3Å; I96-E100 WeakPolarHBondContact CG2-OE1 3.35Å; I96-E100 WeakPolarHBondContact O-CG 3.34Å; I96-E100 PolarHBondContact O-N 2.94Å |
| 97 | D | 98.3 | Very high | 98.2 | Very high | 65 Ų | 65 | 100.5 Ų | 100.5 | 35% | 0.348 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -56.5 | -44.4 | -179.2 | -55.2 | -17.3 | 0 | 0 | 0 | 110.9 | Q93 L99 E100 E101 | Q93-D97 PolarHBondContact NE2-OD1 3Å; Q93-D97 PolarHBondContact O-N 2.99Å; D97-L99 VanDerWaalsContact C-N 3.31Å; D97-L99 PolarHBondContact O-N 3.13Å; D97-E100 PolarHBondContact O-N 2.93Å; D97-E101 WeakPolarHBondContact O-CG 3.31Å; D97-E101 PolarHBondContact O-N 3.36Å |
| 98 | K | 98.4 | Very high | 98.2 | Very high | 124 Ų | 124 | 102.9 Ų | 102.9 | 54% | 0.539 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.8 | -32.9 | 176.1 | -174.7 | 173.6 | -174.2 | 172.6 | 0 | 113.5 | A94 I96 K102 | A94-K98 VanDerWaalsContact O-CB 3.3Å; A94-K98 WeakPolarHBondContact O-CB 3.46Å; A94-K98 PolarHBondContact O-N 3.34Å; I96-K98 VanDerWaalsContact C-N 3.29Å; I96-K98 PolarHBondContact O-N 3.28Å; K98-K102 VanDerWaalsContact O-CG 3.3Å; K98-K102 WeakPolarHBondContact O-CG 3.49Å; K98-K102 PolarHBondContact O-N 3.49Å |
| 99 | L | 98.1 | Very high | 98.2 | Very high | 85 Ų | 85 | 104.6 Ų | 104.6 | 45% | 0.445 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -75 | -37.4 | 175.3 | -75 | 171.4 | 0 | 0 | 0 | 111 | R95 I96 D97 K102 N103 | R95-L99 HydrophobicContact CG-CD1 4.39Å; R95-L99 VanDerWaalsContact O-CG 3.29Å; R95-L99 WeakPolarHBondContact O-CG 3.28Å; R95-L99 PolarHBondContact O-N 3.15Å; R95-L99 VanDerWaalsContact O-N 3.07Å; I96-L99 CarbonylContact O-C 3.6Å; I96-L99 WeakPolarHBondContact O-CA 3.46Å; I96-L99 WeakPolarHBondContact O-CB 3.45Å; I96-L99 PolarHBondContact O-N 2.84Å; D97-L99 VanDerWaalsContact C-N 3.31Å; D97-L99 PolarHBondContact O-N 3.13Å; L99-K102 PolarHBondContact O-N 3.47Å; L99-N103 WeakPolarHBondContact O-CB 3.47Å; L99-N103 VanDerWaalsContact O-CG 3.27Å; L99-N103 PolarHBondContact O-N 2.93Å |
| 100 | E | 98 | Very high | 98.2 | Very high | 117 Ų | 117 | 101.9 Ų | 101.9 | 55% | 0.547 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 174.5 | -70.2 | 178.5 | 171.6 | 0 | 0 | 111.4 | I96 D97 K102 N103 A104 | I96-E100 HydrophobicContact CG2-CG 4.3Å; I96-E100 WeakPolarHBondContact CG2-OE1 3.35Å; I96-E100 WeakPolarHBondContact O-CG 3.34Å; I96-E100 PolarHBondContact O-N 2.94Å; D97-E100 PolarHBondContact O-N 2.93Å; E100-K102 VanDerWaalsContact C-N 3.33Å; E100-K102 PolarHBondContact O-N 3.43Å; E100-N103 PolarHBondContact O-N 2.88Å; E100-A104 WeakPolarHBondContact O-CB 3.46Å; E100-A104 PolarHBondContact O-N 2.94Å |
| 101 | E | 98.4 | Very high | 98.1 | Very high | 138 Ų | 138 | 97.9 Ų | 97.9 | 65% | 0.645 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -57 | -45 | 173.3 | -74.5 | 174.9 | 179.1 | 0 | 0 | 112 | D97 A104 A105 | D97-E101 WeakPolarHBondContact O-CG 3.31Å; D97-E101 PolarHBondContact O-N 3.36Å; E101-A104 PolarHBondContact O-N 3.35Å; E101-A105 WeakPolarHBondContact O-CB 3.47Å; E101-A105 PolarHBondContact O-N 3.39Å |
| 102 | K | 98.2 | Very high | 98.1 | Very high | 113 Ų | 113 | 96.2 Ų | 96.2 | 49% | 0.491 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65 | -41.7 | 176.9 | -75.1 | 179.7 | -176.2 | -169.9 | 0 | 112.1 | K98 L99 E100 A104 A105 L106 | K98-K102 VanDerWaalsContact O-CG 3.3Å; K98-K102 WeakPolarHBondContact O-CG 3.49Å; K98-K102 PolarHBondContact O-N 3.49Å; L99-K102 PolarHBondContact O-N 3.47Å; E100-K102 VanDerWaalsContact C-N 3.33Å; E100-K102 PolarHBondContact O-N 3.43Å; K102-A104 VanDerWaalsContact C-N 3.34Å; K102-A105 PolarHBondContact O-N 3.49Å; K102-L106 WeakPolarHBondContact O-CB 3.43Å; K102-L106 VanDerWaalsContact O-CG 3.28Å; K102-L106 WeakPolarHBondContact O-CG 3.44Å; K102-L106 PolarHBondContact O-N 2.93Å |
| 103 | N | 97.8 | Very high | 98.1 | Very high | 104 Ų | 104 | 96.4 Ų | 96.4 | 56% | 0.556 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.6 | -41.3 | 177.9 | -76 | -14.4 | 0 | 0 | 0 | 111 | L99 E100 L106 A107 | L99-N103 WeakPolarHBondContact O-CB 3.47Å; L99-N103 VanDerWaalsContact O-CG 3.27Å; L99-N103 PolarHBondContact O-N 2.93Å; E100-N103 PolarHBondContact O-N 2.88Å; N103-L106 PolarHBondContact O-N 3.39Å; N103-A107 WeakPolarHBondContact O-CB 3.36Å; N103-A107 PolarHBondContact O-N 2.86Å |
| 104 | A | 98 | Very high | 98.1 | Very high | 63 Ų | 63 | 97.6 Ų | 97.6 | 52% | 0.521 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E100 E101 K102 L106 A107 E108 | E100-A104 WeakPolarHBondContact O-CB 3.46Å; E100-A104 PolarHBondContact O-N 2.94Å; E101-A104 PolarHBondContact O-N 3.35Å; K102-A104 VanDerWaalsContact C-N 3.34Å; A104-L106 VanDerWaalsContact C-N 3.3Å; A104-L106 PolarHBondContact O-N 3.45Å; A104-A107 WeakPolarHBondContact O-CB 3.33Å; A104-A107 PolarHBondContact O-N 3.14Å; A104-E108 PolarHBondContact O-N 3.47Å |
| 105 | A | 98.1 | Very high | 98.1 | Very high | 44 Ų | 44 | 100 Ų | 100 | 36% | 0.364 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -32.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | E101 K102 K109 | E101-A105 WeakPolarHBondContact O-CB 3.47Å; E101-A105 PolarHBondContact O-N 3.39Å; K102-A105 PolarHBondContact O-N 3.49Å; A105-K109 WeakPolarHBondContact O-CG 3.28Å; A105-K109 PolarHBondContact O-N 3.32Å |
| 106 | L | 98.1 | Very high | 98 | Very high | 98 Ų | 98 | 97.9 Ų | 97.9 | 51% | 0.513 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -72.4 | -37.7 | 173.3 | -73.7 | 174.1 | 0 | 0 | 0 | 111.8 | K102 N103 A104 K109 L110 | K102-L106 WeakPolarHBondContact O-CB 3.43Å; K102-L106 VanDerWaalsContact O-CG 3.28Å; K102-L106 WeakPolarHBondContact O-CG 3.44Å; K102-L106 PolarHBondContact O-N 2.93Å; N103-L106 PolarHBondContact O-N 3.39Å; A104-L106 VanDerWaalsContact C-N 3.3Å; A104-L106 PolarHBondContact O-N 3.45Å; L106-K109 PolarHBondContact O-N 3.46Å; L106-L110 WeakPolarHBondContact O-CG 3.5Å; L106-L110 PolarHBondContact O-N 3Å |
| 107 | A | 98.1 | Very high | 98 | Very high | 50 Ų | 50 | 99.9 Ų | 99.9 | 41% | 0.413 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.9 | -43.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | N103 A104 K109 L110 C111 | N103-A107 WeakPolarHBondContact O-CB 3.36Å; N103-A107 PolarHBondContact O-N 2.86Å; A104-A107 WeakPolarHBondContact O-CB 3.33Å; A104-A107 PolarHBondContact O-N 3.14Å; A107-K109 PolarHBondContact O-N 3.45Å; A107-L110 WeakPolarHBondContact O-CB 3.43Å; A107-L110 PolarHBondContact O-N 2.94Å; A107-L110 VanDerWaalsContact O-N 3.16Å; A107-C111 PolarHBondContact O-N 3.12Å; A107-C111 PolarHBondContact O-SG 3.04Å; A107-C111 VanDerWaalsContact O-SG 3.39Å |
| 108 | E | 98.2 | Very high | 98 | Very high | 131 Ų | 131 | 103 Ų | 103 | 61% | 0.612 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.6 | -48.1 | 174.5 | -172.9 | 178.8 | -170.7 | 0 | 0 | 111.6 | A104 L110 C111 D112 | A104-E108 PolarHBondContact O-N 3.47Å; E108-L110 VanDerWaalsContact C-N 3.26Å; E108-L110 PolarHBondContact O-N 2.94Å; E108-C111 WeakPolarHBondContact O-CB 3.3Å; E108-C111 PolarHBondContact O-N 3.46Å; E108-C111 VanDerWaalsContact O-N 3.12Å; E108-D112 PolarHBondContact O-N 3.01Å |
| 109 | K | 98.3 | Very high | 98 | Very high | 131 Ų | 131 | 101.9 Ų | 101.9 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.1 | -32.9 | 175.7 | -73.6 | 176.4 | -178.8 | -177.5 | 0 | 113.7 | A105 L106 A107 L113 | A105-K109 WeakPolarHBondContact O-CG 3.28Å; A105-K109 PolarHBondContact O-N 3.32Å; L106-K109 PolarHBondContact O-N 3.46Å; A107-K109 PolarHBondContact O-N 3.45Å; K109-L113 WeakPolarHBondContact O-CB 3.4Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.42Å; K109-L113 PolarHBondContact O-N 3.02Å; K109-L113 VanDerWaalsContact O-N 3.1Å |
| 110 | L | 98.1 | Very high | 98 | Very high | 99 Ų | 99 | 101.6 Ų | 101.6 | 52% | 0.518 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -69.1 | -43 | 175.3 | -76.7 | 168 | 0 | 0 | 0 | 110.7 | L106 A107 E108 D112 L113 E114 | L106-L110 WeakPolarHBondContact O-CG 3.5Å; L106-L110 PolarHBondContact O-N 3Å; A107-L110 WeakPolarHBondContact O-CB 3.43Å; A107-L110 PolarHBondContact O-N 2.94Å; A107-L110 VanDerWaalsContact O-N 3.16Å; E108-L110 VanDerWaalsContact C-N 3.26Å; E108-L110 PolarHBondContact O-N 2.94Å; L110-D112 VanDerWaalsContact C-N 3.35Å; L110-D112 PolarHBondContact O-N 3.32Å; L110-L113 PolarHBondContact O-N 2.91Å; L110-E114 WeakPolarHBondContact O-CG 3.42Å; L110-E114 PolarHBondContact O-N 3.29Å |
| 111 | C | 97.3 | Very high | 98 | Very high | 64 Ų | 64 | 101.2 Ų | 101.2 | 43% | 0.432 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.4 | -45.9 | 173.4 | -65.8 | 0 | 0 | 0 | 0 | 111.6 | A107 E108 L113 E114 E115 | A107-C111 PolarHBondContact O-N 3.12Å; A107-C111 PolarHBondContact O-SG 3.04Å; A107-C111 VanDerWaalsContact O-SG 3.39Å; E108-C111 WeakPolarHBondContact O-CB 3.3Å; E108-C111 PolarHBondContact O-N 3.46Å; E108-C111 VanDerWaalsContact O-N 3.12Å; C111-L113 VanDerWaalsContact C-N 3.29Å; C111-L113 PolarHBondContact O-N 3.13Å; C111-E114 PolarHBondContact O-N 3.47Å; C111-E115 WeakPolarHBondContact O-CG 3.36Å; C111-E115 PolarHBondContact O-N 2.96Å |
| 112 | D | 97.6 | Very high | 98 | Very high | 93 Ų | 93 | 99.2 Ų | 99.2 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 176.3 | -67.7 | -20.6 | 0 | 0 | 0 | 112.2 | E108 L110 F116 | E108-D112 PolarHBondContact O-N 3.01Å; L110-D112 VanDerWaalsContact C-N 3.35Å; L110-D112 PolarHBondContact O-N 3.32Å; D112-F116 WeakPolarHBondContact O-CB 3.3Å; D112-F116 PolarHBondContact O-N 2.97Å |
| 113 | L | 97.9 | Very high | 98 | Very high | 98 Ų | 98 | 99.8 Ų | 99.8 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.1 | -39.8 | 178.1 | -77.5 | 171.1 | 0 | 0 | 0 | 112.4 | K109 L110 C111 F116 Q117 | K109-L113 WeakPolarHBondContact O-CB 3.4Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.42Å; K109-L113 PolarHBondContact O-N 3.02Å; K109-L113 VanDerWaalsContact O-N 3.1Å; L110-L113 PolarHBondContact O-N 2.91Å; C111-L113 VanDerWaalsContact C-N 3.29Å; C111-L113 PolarHBondContact O-N 3.13Å; L113-F116 PolarHBondContact O-N 3.46Å; L113-Q117 WeakPolarHBondContact O-CB 3.46Å; L113-Q117 VanDerWaalsContact O-CG 3.3Å; L113-Q117 WeakPolarHBondContact O-CG 3.3Å; L113-Q117 PolarHBondContact O-N 3.12Å |
| 114 | E | 97.8 | Very high | 98 | Very high | 123 Ų | 123 | 98.8 Ų | 98.8 | 58% | 0.575 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.3 | -41.3 | 174.9 | -73.1 | 173.8 | 176.4 | 0 | 0 | 111.1 | L110 C111 Q117 R118 | L110-E114 WeakPolarHBondContact O-CG 3.42Å; L110-E114 PolarHBondContact O-N 3.29Å; C111-E114 PolarHBondContact O-N 3.47Å; E114-Q117 PolarHBondContact O-N 2.99Å; E114-R118 PolarHBondContact O-N 3.28Å |
| 115 | E | 97.9 | Very high | 98 | Very high | 108 Ų | 108 | 98.5 Ų | 98.5 | 51% | 0.505 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 173.9 | -73.7 | -171.8 | -179.4 | 0 | 0 | 112 | C111 Q117 R118 Q119 | C111-E115 WeakPolarHBondContact O-CG 3.36Å; C111-E115 PolarHBondContact O-N 2.96Å; E115-Q117 VanDerWaalsContact C-N 3.35Å; E115-Q117 PolarHBondContact O-N 3.41Å; E115-R118 PolarHBondContact O-N 3Å; E115-Q119 WeakPolarHBondContact O-CG 3.44Å; E115-Q119 PolarHBondContact O-N 2.95Å |
| 116 | F | 97.9 | Very high | 98 | Very high | 131 Ų | 131 | 101 Ų | 101 | 58% | 0.575 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -41.7 | 175.5 | 179.4 | -98.7 | 0 | 0 | 0 | 112 | D112 L113 Q119 N120 | D112-F116 WeakPolarHBondContact O-CB 3.3Å; D112-F116 PolarHBondContact O-N 2.97Å; L113-F116 PolarHBondContact O-N 3.46Å; F116-Q119 PolarHBondContact O-N 3.38Å; F116-N120 WeakPolarHBondContact O-CB 3.41Å; F116-N120 PolarHBondContact O-N 2.89Å |
| 117 | Q | 98 | Very high | 97.9 | Very high | 118 Ų | 118 | 100.5 Ų | 100.5 | 55% | 0.551 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.7 | -47.4 | 174.8 | -77 | 175.7 | 2.8 | 0 | 0 | 111.4 | L113 E114 E115 Q119 N120 D121 | L113-Q117 WeakPolarHBondContact O-CB 3.46Å; L113-Q117 VanDerWaalsContact O-CG 3.3Å; L113-Q117 WeakPolarHBondContact O-CG 3.3Å; L113-Q117 PolarHBondContact O-N 3.12Å; E114-Q117 PolarHBondContact O-N 2.99Å; E115-Q117 VanDerWaalsContact C-N 3.35Å; E115-Q117 PolarHBondContact O-N 3.41Å; Q117-Q119 VanDerWaalsContact C-N 3.32Å; Q117-Q119 PolarHBondContact O-N 2.92Å; Q117-N120 WeakPolarHBondContact O-CB 3.41Å; Q117-N120 PolarHBondContact O-N 3.34Å; Q117-N120 VanDerWaalsContact O-N 3.14Å; Q117-D121 PolarHBondContact O-N 3.36Å |
| 118 | R | 98.1 | Very high | 97.9 | Very high | 131 Ų | 131 | 102.5 Ų | 102.5 | 49% | 0.494 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.5 | -44.3 | 176.4 | -173.9 | -176.8 | 65.4 | 85.9 | -0.1 | 111.9 | E114 E115 N120 D121 E122 | E114-R118 PolarHBondContact O-N 3.28Å; E115-R118 PolarHBondContact O-N 3Å; R118-N120 VanDerWaalsContact C-N 3.32Å; R118-N120 PolarHBondContact O-N 3.19Å; R118-D121 PolarHBondContact O-N 3.39Å; R118-E122 IonicContact CZ-OE1 2.79Å; R118-E122 IonicContact NH1-OE1 2.72Å; R118-E122 PolarHBondContact NH1-OE1 3.23Å; R118-E122 IonicContact NH1-OE2 2.88Å; R118-E122 WeakPolarHBondContact O-CG 3.47Å; R118-E122 PolarHBondContact O-N 2.96Å |
| 119 | Q | 97.9 | Very high | 97.9 | Very high | 100 Ų | 100 | 99.6 Ų | 99.6 | 47% | 0.467 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.8 | -40.8 | 176.8 | -73.3 | 176.5 | 7.3 | 0 | 0 | 111.9 | E115 F116 Q117 E122 L123 | E115-Q119 WeakPolarHBondContact O-CG 3.44Å; E115-Q119 PolarHBondContact O-N 2.95Å; F116-Q119 PolarHBondContact O-N 3.38Å; Q117-Q119 VanDerWaalsContact C-N 3.32Å; Q117-Q119 PolarHBondContact O-N 2.92Å; Q119-E122 PolarHBondContact O-N 3.24Å; Q119-L123 WeakPolarHBondContact O-CB 3.44Å; Q119-L123 PolarHBondContact O-N 2.95Å |
| 120 | N | 98.4 | Very high | 97.9 | Very high | 79 Ų | 79 | 98.6 Ų | 98.6 | 42% | 0.422 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.4 | -44.3 | 178.1 | -166.1 | 22.9 | 0 | 0 | 0 | 111.5 | F116 Q117 R118 E122 L123 M124 | F116-N120 WeakPolarHBondContact O-CB 3.41Å; F116-N120 PolarHBondContact O-N 2.89Å; Q117-N120 WeakPolarHBondContact O-CB 3.41Å; Q117-N120 PolarHBondContact O-N 3.34Å; Q117-N120 VanDerWaalsContact O-N 3.14Å; R118-N120 VanDerWaalsContact C-N 3.32Å; R118-N120 PolarHBondContact O-N 3.19Å; N120-E122 VanDerWaalsContact C-N 3.34Å; N120-E122 PolarHBondContact O-N 3.1Å; N120-L123 PolarHBondContact O-N 3.5Å; N120-L123 VanDerWaalsContact O-N 3.16Å; N120-M124 WeakPolarHBondContact O-CB 3.4Å; N120-M124 VanDerWaalsContact O-CG 3.3Å; N120-M124 WeakPolarHBondContact O-CG 3.48Å; N120-M124 PolarHBondContact O-N 2.9Å |
| 121 | D | 97.9 | Very high | 97.9 | Very high | 110 Ų | 110 | 99.3 Ų | 99.3 | 59% | 0.588 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.6 | -41.8 | 176.9 | -69.5 | -17.4 | 0 | 0 | 0 | 111.8 | Q117 R118 M124 S125 | Q117-D121 PolarHBondContact O-N 3.36Å; R118-D121 PolarHBondContact O-N 3.39Å; D121-M124 PolarHBondContact O-N 2.98Å; D121-S125 WeakPolarHBondContact O-CB 3.38Å; D121-S125 PolarHBondContact O-N 3.22Å |
| 122 | E | 98.3 | Very high | 97.9 | Very high | 95 Ų | 95 | 101.3 Ų | 101.3 | 44% | 0.444 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 173.2 | -76.7 | 174.5 | -169.5 | 0 | 0 | 111.8 | R118 Q119 N120 S125 N126 | R118-E122 IonicContact CZ-OE1 2.79Å; R118-E122 IonicContact NH1-OE1 2.72Å; R118-E122 PolarHBondContact NH1-OE1 3.23Å; R118-E122 IonicContact NH1-OE2 2.88Å; R118-E122 WeakPolarHBondContact O-CG 3.47Å; R118-E122 PolarHBondContact O-N 2.96Å; Q119-E122 PolarHBondContact O-N 3.24Å; N120-E122 VanDerWaalsContact C-N 3.34Å; N120-E122 PolarHBondContact O-N 3.1Å; E122-S125 PolarHBondContact O-N 3.38Å; E122-N126 WeakPolarHBondContact O-CB 3.44Å; E122-N126 VanDerWaalsContact O-CG 3.23Å; E122-N126 PolarHBondContact O-N 3Å; E122-N126 PolarHBondContact O-ND2 2.88Å |
| 123 | L | 98.3 | Very high | 97.9 | Very high | 126 Ų | 126 | 102 Ų | 102 | 66% | 0.66 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.6 | -44.6 | 178.5 | -134.5 | 101.7 | 0 | 0 | 0 | 111.7 | Q119 N120 N126 M127 | Q119-L123 WeakPolarHBondContact O-CB 3.44Å; Q119-L123 PolarHBondContact O-N 2.95Å; N120-L123 PolarHBondContact O-N 3.5Å; N120-L123 VanDerWaalsContact O-N 3.16Å; L123-N126 PolarHBondContact O-N 2.98Å; L123-M127 WeakPolarHBondContact O-CB 3.44Å; L123-M127 PolarHBondContact O-N 3.38Å |
| 124 | M | 97.3 | Very high | 98 | Very high | 83 Ų | 83 | 101.5 Ų | 101.5 | 41% | 0.409 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 177.6 | -72 | -59.2 | -61 | 0 | 0 | 111.2 | N120 D121 N126 M127 E128 | N120-M124 WeakPolarHBondContact O-CB 3.4Å; N120-M124 VanDerWaalsContact O-CG 3.3Å; N120-M124 WeakPolarHBondContact O-CG 3.48Å; N120-M124 PolarHBondContact O-N 2.9Å; D121-M124 PolarHBondContact O-N 2.98Å; M124-N126 VanDerWaalsContact C-N 3.35Å; M124-N126 PolarHBondContact O-N 2.98Å; M124-M127 HydrophobicContact CE-CE 3.63Å; M124-M127 PolarHBondContact O-N 3.32Å; M124-M127 HydrophobicContact SD-CE 3.89Å; M124-E128 WeakPolarHBondContact O-CG 3.29Å; M124-E128 PolarHBondContact O-N 3.41Å |
| 125 | S | 97.9 | Very high | 98 | Very high | 57 Ų | 57 | 99.5 Ų | 99.5 | 40% | 0.399 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 175.3 | -172.3 | 0 | 0 | 0 | 0 | 112.1 | D121 E122 E128 N129 | D121-S125 WeakPolarHBondContact O-CB 3.38Å; D121-S125 PolarHBondContact O-N 3.22Å; E122-S125 PolarHBondContact O-N 3.38Å; S125-E128 PolarHBondContact O-N 2.97Å; S125-N129 WeakPolarHBondContact O-CB 3.35Å; S125-N129 PolarHBondContact O-N 2.69Å; S125-N129 PolarHBondContact O-ND2 3.16Å; S125-N129 VanDerWaalsContact O-ND2 3.15Å |
| 126 | N | 98.3 | Very high | 98 | Very high | 97 Ų | 97 | 101.5 Ų | 101.5 | 52% | 0.519 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.8 | -41.9 | 175.6 | -74.4 | -28.4 | 0 | 0 | 0 | 111.9 | E122 L123 M124 N129 L130 | E122-N126 WeakPolarHBondContact O-CB 3.44Å; E122-N126 VanDerWaalsContact O-CG 3.23Å; E122-N126 PolarHBondContact O-N 3Å; E122-N126 PolarHBondContact O-ND2 2.88Å; L123-N126 PolarHBondContact O-N 2.98Å; M124-N126 VanDerWaalsContact C-N 3.35Å; M124-N126 PolarHBondContact O-N 2.98Å; N126-N129 PolarHBondContact O-N 3.18Å; N126-L130 WeakPolarHBondContact O-CG 3.42Å; N126-L130 PolarHBondContact O-N 3.39Å |
| 127 | M | 97.6 | Very high | 98 | Very high | 86 Ų | 86 | 100.1 Ų | 100.1 | 42% | 0.424 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.9 | -48.2 | 176.5 | -170.8 | 178.3 | 72.6 | 0 | 0 | 111.2 | L123 M124 N129 L130 E131 | L123-M127 WeakPolarHBondContact O-CB 3.44Å; L123-M127 PolarHBondContact O-N 3.38Å; M124-M127 HydrophobicContact CE-CE 3.63Å; M124-M127 PolarHBondContact O-N 3.32Å; M124-M127 HydrophobicContact SD-CE 3.89Å; M127-N129 VanDerWaalsContact C-N 3.28Å; M127-N129 PolarHBondContact O-N 2.91Å; M127-L130 PolarHBondContact O-N 3.49Å; M127-E131 WeakPolarHBondContact O-CG 3.48Å; M127-E131 PolarHBondContact O-N 3.23Å |
| 128 | E | 98 | Very high | 98 | Very high | 92 Ų | 92 | 99 Ų | 99 | 43% | 0.43 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.3 | -38.8 | 175.7 | -73.5 | -177.7 | -168.6 | 0 | 0 | 112.5 | M124 S125 E131 K132 | M124-E128 WeakPolarHBondContact O-CG 3.29Å; M124-E128 PolarHBondContact O-N 3.41Å; S125-E128 PolarHBondContact O-N 2.97Å; E128-E131 PolarHBondContact O-N 3.44Å; E128-K132 WeakPolarHBondContact O-CB 3.44Å; E128-K132 VanDerWaalsContact O-CG 3.28Å; E128-K132 WeakPolarHBondContact O-CG 3.46Å; E128-K132 PolarHBondContact O-N 3.34Å; E128-K132 IonicContact OE2-NZ 3.8Å |
| 129 | N | 97.9 | Very high | 97.9 | Very high | 71 Ų | 71 | 97.9 Ų | 97.9 | 38% | 0.38 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 177.2 | -73.7 | -30.1 | 0 | 0 | 0 | 111.6 | S125 N126 M127 K132 Q133 | S125-N129 WeakPolarHBondContact O-CB 3.35Å; S125-N129 PolarHBondContact O-N 2.69Å; S125-N129 PolarHBondContact O-ND2 3.16Å; S125-N129 VanDerWaalsContact O-ND2 3.15Å; N126-N129 PolarHBondContact O-N 3.18Å; M127-N129 VanDerWaalsContact C-N 3.28Å; M127-N129 PolarHBondContact O-N 2.91Å; N129-K132 PolarHBondContact O-N 2.92Å; N129-Q133 VanDerWaalsContact O-CG 3.32Å; N129-Q133 WeakPolarHBondContact O-CG 3.3Å; N129-Q133 PolarHBondContact O-N 2.97Å |
| 130 | L | 98.1 | Very high | 97.9 | Very high | 110 Ų | 110 | 98.5 Ų | 98.5 | 58% | 0.576 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -64.3 | -41.2 | 175.3 | -74.3 | 171.7 | 0 | 0 | 0 | 111.6 | N126 M127 Q133 L134 | N126-L130 WeakPolarHBondContact O-CG 3.42Å; N126-L130 PolarHBondContact O-N 3.39Å; M127-L130 PolarHBondContact O-N 3.49Å; L130-Q133 PolarHBondContact O-N 3.26Å; L130-L134 WeakPolarHBondContact O-CB 3.44Å; L130-L134 PolarHBondContact O-N 3.45Å |
| 131 | E | 97.8 | Very high | 97.9 | Very high | 113 Ų | 113 | 99.5 Ų | 99.5 | 53% | 0.528 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.1 | -45.4 | 174.7 | -73.9 | 177.6 | 171.2 | 0 | 0 | 111.7 | M127 E128 Q133 L134 E135 | M127-E131 WeakPolarHBondContact O-CG 3.48Å; M127-E131 PolarHBondContact O-N 3.23Å; E128-E131 PolarHBondContact O-N 3.44Å; E131-Q133 PolarHBondContact O-N 3.05Å; E131-L134 PolarHBondContact O-N 3.45Å; E131-E135 PolarHBondContact O-N 2.9Å |
| 132 | K | 97.9 | Very high | 97.9 | Very high | 107 Ų | 107 | 99.2 Ų | 99.2 | 47% | 0.465 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.1 | -41.3 | 175.2 | -73.4 | 168.2 | -171.2 | 160.6 | 0 | 112.1 | E128 N129 E135 R136 | E128-K132 WeakPolarHBondContact O-CB 3.44Å; E128-K132 VanDerWaalsContact O-CG 3.28Å; E128-K132 WeakPolarHBondContact O-CG 3.46Å; E128-K132 PolarHBondContact O-N 3.34Å; E128-K132 IonicContact OE2-NZ 3.8Å; N129-K132 PolarHBondContact O-N 2.92Å; K132-E135 PolarHBondContact O-N 3.24Å; K132-R136 VanDerWaalsContact O-CG 3.31Å; K132-R136 WeakPolarHBondContact O-CG 3.31Å; K132-R136 PolarHBondContact O-N 3.34Å; K132-R136 VanDerWaalsContact O-N 3.09Å |
| 133 | Q | 97.9 | Very high | 97.8 | Very high | 106 Ų | 106 | 98.3 Ų | 98.3 | 50% | 0.495 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.1 | -43.4 | 175.9 | -75.4 | 177.1 | 8.2 | 0 | 0 | 111.5 | N129 L130 E131 E135 R136 Q137 | N129-Q133 VanDerWaalsContact O-CG 3.32Å; N129-Q133 WeakPolarHBondContact O-CG 3.3Å; N129-Q133 PolarHBondContact O-N 2.97Å; L130-Q133 PolarHBondContact O-N 3.26Å; E131-Q133 PolarHBondContact O-N 3.05Å; Q133-E135 VanDerWaalsContact C-N 3.34Å; Q133-E135 PolarHBondContact O-N 3.47Å; Q133-R136 PolarHBondContact O-N 3.43Å; Q133-Q137 WeakPolarHBondContact O-CG 3.37Å; Q133-Q137 PolarHBondContact O-N 3.35Å |
| 134 | L | 98.1 | Very high | 97.8 | Very high | 88 Ų | 88 | 97.3 Ų | 97.3 | 46% | 0.461 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.3 | -40.4 | 178.2 | -176 | 67.3 | 0 | 0 | 0 | 111.6 | L130 E131 Q137 K138 | L130-L134 WeakPolarHBondContact O-CB 3.44Å; L130-L134 PolarHBondContact O-N 3.45Å; E131-L134 PolarHBondContact O-N 3.45Å; L134-Q137 PolarHBondContact O-N 2.88Å; L134-K138 WeakPolarHBondContact O-CG 3.38Å; L134-K138 PolarHBondContact O-N 3.19Å |
| 135 | E | 98 | Very high | 97.8 | Very high | 81 Ų | 81 | 97.9 Ų | 97.9 | 38% | 0.379 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.7 | -41.4 | 177.9 | -162.1 | 58.1 | -147.8 | 0 | 0 | 111.7 | E131 K132 Q133 Q137 K138 E139 | E131-E135 PolarHBondContact O-N 2.9Å; K132-E135 PolarHBondContact O-N 3.24Å; Q133-E135 VanDerWaalsContact C-N 3.34Å; Q133-E135 PolarHBondContact O-N 3.47Å; E135-Q137 PolarHBondContact O-N 3.2Å; E135-K138 WeakPolarHBondContact O-CB 3.34Å; E135-K138 PolarHBondContact O-N 2.88Å; E135-K138 VanDerWaalsContact O-N 3.16Å; E135-K138 IonicContact OE2-NZ 3.08Å; E135-E139 WeakPolarHBondContact O-CG 3.45Å; E135-E139 PolarHBondContact O-N 2.78Å |
| 136 | R | 97.8 | Very high | 97.7 | Very high | 151 Ų | 151 | 102.3 Ų | 102.3 | 57% | 0.57 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -57.6 | -47.2 | 172.7 | -71.9 | 172.9 | -171.4 | 165.2 | 3.1 | 111.8 | K132 Q133 K138 E139 E140 | K132-R136 VanDerWaalsContact O-CG 3.31Å; K132-R136 WeakPolarHBondContact O-CG 3.31Å; K132-R136 PolarHBondContact O-N 3.34Å; K132-R136 VanDerWaalsContact O-N 3.09Å; Q133-R136 PolarHBondContact O-N 3.43Å; R136-K138 VanDerWaalsContact C-N 3.3Å; R136-K138 PolarHBondContact O-N 3.4Å; R136-E139 PolarHBondContact O-N 3.34Å; R136-E139 VanDerWaalsContact O-N 3.15Å; R136-E140 WeakPolarHBondContact O-CB 3.26Å; R136-E140 WeakPolarHBondContact O-CG 3.5Å; R136-E140 PolarHBondContact O-N 2.94Å |
| 137 | Q | 97.9 | Very high | 97.7 | Very high | 101 Ų | 101 | 102.4 Ų | 102.4 | 47% | 0.472 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.8 | -39.1 | 177.1 | -75.4 | -177.1 | -19.8 | 0 | 0 | 112.2 | Q133 L134 E135 E140 H141 | Q133-Q137 WeakPolarHBondContact O-CG 3.37Å; Q133-Q137 PolarHBondContact O-N 3.35Å; L134-Q137 PolarHBondContact O-N 2.88Å; E135-Q137 PolarHBondContact O-N 3.2Å; Q137-E140 PolarHBondContact O-N 3.42Å; Q137-H141 WeakPolarHBondContact O-CB 3.47Å; Q137-H141 PolarHBondContact O-CD2 3.09Å; Q137-H141 VanDerWaalsContact O-CG 3.29Å; Q137-H141 PolarHBondContact O-N 2.86Å |
| 138 | K | 97.9 | Very high | 97.7 | Very high | 94 Ų | 94 | 103.7 Ų | 103.7 | 41% | 0.409 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.6 | -40 | 175 | -73.8 | 172 | -176 | 167.7 | 0 | 112.2 | L134 E135 R136 K142 | L134-K138 WeakPolarHBondContact O-CG 3.38Å; L134-K138 PolarHBondContact O-N 3.19Å; E135-K138 WeakPolarHBondContact O-CB 3.34Å; E135-K138 PolarHBondContact O-N 2.88Å; E135-K138 VanDerWaalsContact O-N 3.16Å; E135-K138 IonicContact OE2-NZ 3.08Å; R136-K138 VanDerWaalsContact C-N 3.3Å; R136-K138 PolarHBondContact O-N 3.4Å; K138-K142 WeakPolarHBondContact O-CB 3.47Å; K138-K142 WeakPolarHBondContact O-CG 3.36Å; K138-K142 PolarHBondContact O-N 3.02Å |
| 139 | E | 97.5 | Very high | 97.6 | Very high | 108 Ų | 108 | 104.6 Ų | 104.6 | 51% | 0.505 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.7 | -47.7 | 175.7 | -71.8 | -177.1 | 162 | 0 | 0 | 111.3 | E135 R136 H141 K142 D143 | E135-E139 WeakPolarHBondContact O-CG 3.45Å; E135-E139 PolarHBondContact O-N 2.78Å; R136-E139 PolarHBondContact O-N 3.34Å; R136-E139 VanDerWaalsContact O-N 3.15Å; E139-H141 PolarHBondContact O-N 2.82Å; E139-K142 WeakPolarHBondContact O-CB 3.28Å; E139-K142 PolarHBondContact O-N 3.35Å; E139-K142 VanDerWaalsContact O-N 3.14Å; E139-D143 PolarHBondContact O-N 3.27Å |
| 140 | E | 97.7 | Very high | 97.5 | Very high | 113 Ų | 113 | 106.1 Ų | 106.1 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -55.3 | -49.7 | 175.5 | -73.3 | 170.1 | -175.9 | 0 | 0 | 111.1 | R136 Q137 K142 D143 E144 | R136-E140 WeakPolarHBondContact O-CB 3.26Å; R136-E140 WeakPolarHBondContact O-CG 3.5Å; R136-E140 PolarHBondContact O-N 2.94Å; Q137-E140 PolarHBondContact O-N 3.42Å; E140-K142 PolarHBondContact O-N 2.95Å; E140-D143 PolarHBondContact O-N 2.86Å; E140-E144 WeakPolarHBondContact O-CG 3.16Å; E140-E144 PolarHBondContact O-N 2.92Å |
| 141 | H | 97.4 | Very high | 97.4 | Very high | 100 Ų | 100 | 107.1 Ų | 107.1 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -37 | 177.1 | -71.6 | -40.6 | 0 | 0 | 0 | 113.3 | Q137 E139 D143 E144 I145 | Q137-H141 WeakPolarHBondContact O-CB 3.47Å; Q137-H141 PolarHBondContact O-CD2 3.09Å; Q137-H141 VanDerWaalsContact O-CG 3.29Å; Q137-H141 PolarHBondContact O-N 2.86Å; E139-H141 PolarHBondContact O-N 2.82Å; H141-D143 VanDerWaalsContact C-N 3.3Å; H141-D143 PolarHBondContact O-N 2.92Å; H141-E144 IonicContact CE1-OE2 3.84Å; H141-E144 IonicContact ND1-OE2 3.95Å; H141-E144 PolarHBondContact ND1-OE2 3.29Å; H141-E144 PolarHBondContact O-N 3.28Å; H141-I145 WeakPolarHBondContact O-CB 3.31Å; H141-I145 WeakPolarHBondContact O-CD1 3.44Å; H141-I145 VanDerWaalsContact O-CG1 3.23Å; H141-I145 WeakPolarHBondContact O-CG1 3.22Å; H141-I145 PolarHBondContact O-N 2.86Å |
| 142 | K | 97.9 | Very high | 97.3 | Very high | 104 Ų | 104 | 104.5 Ų | 104.5 | 45% | 0.452 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.7 | -41.4 | 173.9 | -78.6 | 168 | -175.5 | 168.4 | 0 | 111 | K138 E139 E140 I145 R146 | K138-K142 WeakPolarHBondContact O-CB 3.47Å; K138-K142 WeakPolarHBondContact O-CG 3.36Å; K138-K142 PolarHBondContact O-N 3.02Å; E139-K142 WeakPolarHBondContact O-CB 3.28Å; E139-K142 PolarHBondContact O-N 3.35Å; E139-K142 VanDerWaalsContact O-N 3.14Å; E140-K142 PolarHBondContact O-N 2.95Å; K142-I145 PolarHBondContact O-N 3.42Å; K142-R146 VanDerWaalsContact O-CG 3.27Å; K142-R146 WeakPolarHBondContact O-CG 3.44Å; K142-R146 PolarHBondContact O-N 2.92Å |
| 143 | D | 96.8 | Very high | 97.3 | Very high | 77 Ų | 77 | 104.8 Ų | 104.8 | 41% | 0.412 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -72 | -37.6 | 178.8 | -73 | -18.4 | 0 | 0 | 0 | 112.1 | E139 E140 H141 R146 N147 | E139-D143 PolarHBondContact O-N 3.27Å; E140-D143 PolarHBondContact O-N 2.86Å; H141-D143 VanDerWaalsContact C-N 3.3Å; H141-D143 PolarHBondContact O-N 2.92Å; D143-R146 PolarHBondContact O-N 3.35Å; D143-R146 IonicContact OD1-CZ 3.8Å; D143-R146 IonicContact OD1-NH1 3.98Å; D143-R146 PolarHBondContact OD1-NH1 2.91Å; D143-N147 WeakPolarHBondContact O-CB 3.44Å; D143-N147 PolarHBondContact O-N 3.2Å; D143-N147 PolarHBondContact O-ND2 3.29Å |
| 144 | E | 97.6 | Very high | 97.1 | Very high | 105 Ų | 105 | 104.1 Ų | 104.1 | 49% | 0.491 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.1 | -47.3 | 170.3 | -74.4 | 175.7 | 163.7 | 0 | 0 | 111.8 | E140 H141 N147 L148 | E140-E144 WeakPolarHBondContact O-CG 3.16Å; E140-E144 PolarHBondContact O-N 2.92Å; H141-E144 IonicContact CE1-OE2 3.84Å; H141-E144 IonicContact ND1-OE2 3.95Å; H141-E144 PolarHBondContact ND1-OE2 3.29Å; H141-E144 PolarHBondContact O-N 3.28Å; E144-N147 PolarHBondContact O-N 3.49Å; E144-L148 WeakPolarHBondContact O-CG 3.34Å; E144-L148 PolarHBondContact O-N 3.46Å |
| 145 | I | 97.6 | Very high | 97 | Very high | 94 Ų | 94 | 105.2 Ų | 105.2 | 48% | 0.482 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.1 | -50.3 | 176.6 | -70.1 | 165.1 | 0 | 0 | 0 | 110.2 | H141 K142 N147 L148 E149 | H141-I145 WeakPolarHBondContact O-CB 3.31Å; H141-I145 WeakPolarHBondContact O-CD1 3.44Å; H141-I145 VanDerWaalsContact O-CG1 3.23Å; H141-I145 WeakPolarHBondContact O-CG1 3.22Å; H141-I145 PolarHBondContact O-N 2.86Å; K142-I145 PolarHBondContact O-N 3.42Å; I145-N147 VanDerWaalsContact C-N 3.28Å; I145-N147 PolarHBondContact O-N 3.2Å; I145-L148 PolarHBondContact O-N 3.22Å; I145-L148 VanDerWaalsContact O-N 3.17Å; I145-E149 HydrophobicContact CG2-CG 4.32Å; I145-E149 WeakPolarHBondContact O-CG 3.48Å; I145-E149 PolarHBondContact O-N 3.01Å |
| 146 | R | 96.9 | Very high | 97 | Very high | 150 Ų | 150 | 108.4 Ų | 108.4 | 57% | 0.566 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -57.7 | -41.6 | 177.5 | -72.3 | 167.3 | -178.2 | 167.1 | -3.9 | 112.1 | K142 D143 E149 M150 | K142-R146 VanDerWaalsContact O-CG 3.27Å; K142-R146 WeakPolarHBondContact O-CG 3.44Å; K142-R146 PolarHBondContact O-N 2.92Å; D143-R146 PolarHBondContact O-N 3.35Å; D143-R146 IonicContact OD1-CZ 3.8Å; D143-R146 IonicContact OD1-NH1 3.98Å; D143-R146 PolarHBondContact OD1-NH1 2.91Å; R146-E149 PolarHBondContact O-N 3.26Å; R146-M150 WeakPolarHBondContact O-CB 3.41Å; R146-M150 PolarHBondContact O-N 3.06Å |
| 147 | N | 97.1 | Very high | 96.9 | Very high | 99 Ų | 99 | 109 Ų | 109 | 53% | 0.529 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.4 | -42.1 | 178.3 | -76.3 | -34.7 | 0 | 0 | 0 | 111.8 | D143 E144 I145 M150 K151 | D143-N147 WeakPolarHBondContact O-CB 3.44Å; D143-N147 PolarHBondContact O-N 3.2Å; D143-N147 PolarHBondContact O-ND2 3.29Å; E144-N147 PolarHBondContact O-N 3.49Å; I145-N147 VanDerWaalsContact C-N 3.28Å; I145-N147 PolarHBondContact O-N 3.2Å; N147-M150 PolarHBondContact O-N 2.92Å; N147-K151 WeakPolarHBondContact O-CB 3.22Å; N147-K151 VanDerWaalsContact O-CG 3.3Å; N147-K151 WeakPolarHBondContact O-CG 3.44Å; N147-K151 PolarHBondContact O-N 2.91Å |
| 148 | L | 97.3 | Very high | 96.7 | Very high | 114 Ų | 114 | 111.8 Ų | 111.8 | 60% | 0.597 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.4 | -43.3 | 175.4 | -71.6 | 172.5 | 0 | 0 | 0 | 111.5 | E144 I145 M150 K151 A152 | E144-L148 WeakPolarHBondContact O-CG 3.34Å; E144-L148 PolarHBondContact O-N 3.46Å; I145-L148 PolarHBondContact O-N 3.22Å; I145-L148 VanDerWaalsContact O-N 3.17Å; L148-M150 PolarHBondContact O-N 2.98Å; L148-K151 PolarHBondContact O-N 3.45Å; L148-A152 WeakPolarHBondContact O-CB 3.48Å; L148-A152 PolarHBondContact O-N 2.87Å |
| 149 | E | 96 | Very high | 96.6 | Very high | 110 Ų | 110 | 115 Ų | 115 | 51% | 0.514 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.4 | -46.5 | 174.7 | -73.7 | 176.3 | 168.6 | 0 | 0 | 111.5 | I145 R146 A152 Q153 | I145-E149 HydrophobicContact CG2-CG 4.32Å; I145-E149 WeakPolarHBondContact O-CG 3.48Å; I145-E149 PolarHBondContact O-N 3.01Å; R146-E149 PolarHBondContact O-N 3.26Å; E149-A152 PolarHBondContact O-N 3.07Å; E149-Q153 WeakPolarHBondContact O-CB 3.47Å; E149-Q153 WeakPolarHBondContact O-CG 3.45Å; E149-Q153 PolarHBondContact O-N 3.01Å |
| 150 | M | 96.2 | Very high | 96.5 | Very high | 104 Ų | 104 | 114 Ų | 114 | 51% | 0.512 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 177.5 | -178 | 56.6 | 173.6 | 0 | 0 | 111.7 | R146 N147 L148 A152 Q153 L154 | R146-M150 WeakPolarHBondContact O-CB 3.41Å; R146-M150 PolarHBondContact O-N 3.06Å; N147-M150 PolarHBondContact O-N 2.92Å; L148-M150 PolarHBondContact O-N 2.98Å; M150-A152 PolarHBondContact O-N 3.3Å; M150-Q153 PolarHBondContact O-N 3Å; M150-L154 HydrophobicContact CE-CD1 4.04Å; M150-L154 HydrophobicContact CE-CD2 4.15Å; M150-L154 HydrophobicContact CE-CG 4.1Å; M150-L154 HydrophobicContact CG-CD1 4.26Å; M150-L154 WeakPolarHBondContact O-CB 3.29Å; M150-L154 WeakPolarHBondContact O-CG 3.33Å; M150-L154 PolarHBondContact O-N 2.96Å; M150-L154 HydrophobicContact SD-CD1 4.5Å; M150-L154 HydrophobicContact SD-CG 4.32Å |
| 151 | K | 96.2 | Very high | 96.3 | Very high | 131 Ų | 131 | 114.2 Ų | 114.2 | 57% | 0.57 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.1 | -47.5 | 175 | -76 | 176.1 | -177.3 | 179 | 0 | 111.5 | N147 L148 Q153 L154 E155 | N147-K151 WeakPolarHBondContact O-CB 3.22Å; N147-K151 VanDerWaalsContact O-CG 3.3Å; N147-K151 WeakPolarHBondContact O-CG 3.44Å; N147-K151 PolarHBondContact O-N 2.91Å; L148-K151 PolarHBondContact O-N 3.45Å; K151-Q153 VanDerWaalsContact C-N 3.33Å; K151-Q153 PolarHBondContact O-N 3.48Å; K151-L154 PolarHBondContact O-N 3.41Å; K151-E155 WeakPolarHBondContact O-CG 3.26Å; K151-E155 PolarHBondContact O-N 3.46Å |
| 152 | A | 96.6 | Very high | 96.1 | Very high | 57 Ų | 57 | 112.4 Ų | 112.4 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.9 | -39.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L148 E149 M150 K156 | L148-A152 WeakPolarHBondContact O-CB 3.48Å; L148-A152 PolarHBondContact O-N 2.87Å; E149-A152 PolarHBondContact O-N 3.07Å; M150-A152 PolarHBondContact O-N 3.3Å; A152-K156 WeakPolarHBondContact O-CB 3.47Å; A152-K156 PolarHBondContact O-N 3.25Å |
| 153 | Q | 96.2 | Very high | 95.9 | Very high | 113 Ų | 113 | 112.4 Ų | 112.4 | 53% | 0.528 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.4 | -41.6 | 175.3 | -74.1 | -175 | 12 | 0 | 0 | 112.6 | E149 M150 K151 K156 R157 | E149-Q153 WeakPolarHBondContact O-CB 3.47Å; E149-Q153 WeakPolarHBondContact O-CG 3.45Å; E149-Q153 PolarHBondContact O-N 3.01Å; M150-Q153 PolarHBondContact O-N 3Å; K151-Q153 VanDerWaalsContact C-N 3.33Å; K151-Q153 PolarHBondContact O-N 3.48Å; Q153-K156 PolarHBondContact O-N 3.13Å; Q153-R157 WeakPolarHBondContact O-CG 3.39Å; Q153-R157 PolarHBondContact O-N 3.36Å |
| 154 | L | 95.4 | Very high | 95.8 | Very high | 92 Ų | 92 | 113.8 Ų | 113.8 | 48% | 0.482 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 175.7 | -73.6 | 172.5 | 0 | 0 | 0 | 111.5 | M150 K151 K156 R157 R158 | M150-L154 HydrophobicContact CE-CD1 4.04Å; M150-L154 HydrophobicContact CE-CD2 4.15Å; M150-L154 HydrophobicContact CE-CG 4.1Å; M150-L154 HydrophobicContact CG-CD1 4.26Å; M150-L154 WeakPolarHBondContact O-CB 3.29Å; M150-L154 WeakPolarHBondContact O-CG 3.33Å; M150-L154 PolarHBondContact O-N 2.96Å; M150-L154 HydrophobicContact SD-CD1 4.5Å; M150-L154 HydrophobicContact SD-CG 4.32Å; K151-L154 PolarHBondContact O-N 3.41Å; L154-K156 VanDerWaalsContact C-N 3.32Å; L154-K156 PolarHBondContact O-N 2.89Å; L154-R157 PolarHBondContact O-N 2.86Å; L154-R158 WeakPolarHBondContact O-CB 3.43Å; L154-R158 PolarHBondContact O-N 3.16Å |
| 155 | E | 95.9 | Very high | 95.5 | Very high | 112 Ų | 112 | 115.2 Ų | 115.2 | 52% | 0.523 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.3 | -42.7 | 174.6 | -75.9 | -178.4 | -170.5 | 0 | 0 | 111.7 | K151 R158 R159 | K151-E155 WeakPolarHBondContact O-CG 3.26Å; K151-E155 PolarHBondContact O-N 3.46Å; E155-R158 PolarHBondContact O-N 3.1Å; E155-R159 WeakPolarHBondContact O-CG 3.29Å; E155-R159 PolarHBondContact O-N 2.88Å |
| 156 | K | 96.4 | Very high | 95.2 | Very high | 148 Ų | 148 | 117.7 Ų | 117.7 | 64% | 0.643 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.5 | -44.5 | 175.7 | -173.8 | 179.4 | 179.2 | -179.4 | 0 | 111.9 | A152 Q153 L154 R159 L160 | A152-K156 WeakPolarHBondContact O-CB 3.47Å; A152-K156 PolarHBondContact O-N 3.25Å; Q153-K156 PolarHBondContact O-N 3.13Å; L154-K156 VanDerWaalsContact C-N 3.32Å; L154-K156 PolarHBondContact O-N 2.89Å; K156-R159 PolarHBondContact O-N 3.28Å; K156-L160 WeakPolarHBondContact O-CG 3.39Å; K156-L160 PolarHBondContact O-N 2.95Å; K156-L160 VanDerWaalsContact O-N 3.14Å |
| 157 | R | 95.4 | Very high | 95 | Very high | 163 Ų | 163 | 116.8 Ų | 116.8 | 62% | 0.615 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.6 | -46.7 | 176 | -76.1 | -176.9 | -175.7 | -148 | 2.3 | 111.7 | Q153 L154 R159 L160 E161 | Q153-R157 WeakPolarHBondContact O-CG 3.39Å; Q153-R157 PolarHBondContact O-N 3.36Å; L154-R157 PolarHBondContact O-N 2.86Å; R157-R159 VanDerWaalsContact C-N 3.31Å; R157-R159 PolarHBondContact O-N 3.37Å; R157-L160 WeakPolarHBondContact O-CB 3.41Å; R157-L160 PolarHBondContact O-N 3.48Å; R157-L160 VanDerWaalsContact O-N 3.12Å; R157-E161 WeakPolarHBondContact O-CG 3.22Å; R157-E161 PolarHBondContact O-N 3.3Å |
| 158 | R | 95.5 | Very high | 94.8 | Very high | 160 Ų | 160 | 115.6 Ų | 115.6 | 60% | 0.604 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -57.8 | -43.9 | 177.7 | -176.8 | -175.6 | 170.1 | 168.1 | 7.3 | 111.7 | L154 E155 L160 E161 E162 | L154-R158 WeakPolarHBondContact O-CB 3.43Å; L154-R158 PolarHBondContact O-N 3.16Å; E155-R158 PolarHBondContact O-N 3.1Å; R158-L160 VanDerWaalsContact C-N 3.34Å; R158-L160 PolarHBondContact O-N 3.02Å; R158-E161 PolarHBondContact O-N 3.02Å; R158-E162 IonicContact CZ-OE1 3.09Å; R158-E162 IonicContact NE-OE1 3.2Å; R158-E162 PolarHBondContact NE-OE1 3.48Å; R158-E162 VanDerWaalsContact NE-OE1 3.08Å; R158-E162 IonicContact NH2-OE1 3.02Å; R158-E162 WeakPolarHBondContact O-CG 3.42Å; R158-E162 PolarHBondContact O-N 2.91Å |
| 159 | R | 95.6 | Very high | 94.4 | Very high | 160 Ų | 160 | 113 Ų | 113 | 60% | 0.604 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60.4 | -43.3 | 176 | -71.9 | 179.4 | -170.5 | 179.6 | 6.3 | 112.1 | E155 K156 R157 E162 E163 | E155-R159 WeakPolarHBondContact O-CG 3.29Å; E155-R159 PolarHBondContact O-N 2.88Å; K156-R159 PolarHBondContact O-N 3.28Å; R157-R159 VanDerWaalsContact C-N 3.31Å; R157-R159 PolarHBondContact O-N 3.37Å; R159-E162 PolarHBondContact O-N 2.92Å; R159-E163 WeakPolarHBondContact O-CG 3.27Å; R159-E163 PolarHBondContact O-N 3.06Å |
| 160 | L | 95.1 | Very high | 94.1 | Very high | 88 Ų | 88 | 110.3 Ų | 110.3 | 46% | 0.461 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 176.2 | -71 | 168.6 | 0 | 0 | 0 | 112.3 | K156 R157 R158 E163 L164 | K156-L160 WeakPolarHBondContact O-CG 3.39Å; K156-L160 PolarHBondContact O-N 2.95Å; K156-L160 VanDerWaalsContact O-N 3.14Å; R157-L160 WeakPolarHBondContact O-CB 3.41Å; R157-L160 PolarHBondContact O-N 3.48Å; R157-L160 VanDerWaalsContact O-N 3.12Å; R158-L160 VanDerWaalsContact C-N 3.34Å; R158-L160 PolarHBondContact O-N 3.02Å; L160-E163 PolarHBondContact O-N 2.87Å; L160-L164 WeakPolarHBondContact O-CB 3.47Å; L160-L164 PolarHBondContact O-N 3.37Å |
| 161 | E | 92.5 | Very high | 93.7 | Very high | 117 Ų | 117 | 110.9 Ų | 110.9 | 55% | 0.547 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.1 | -46.9 | 174.4 | -74.1 | 170.1 | 175.1 | 0 | 0 | 110.9 | R157 R158 E163 L164 E165 | R157-E161 WeakPolarHBondContact O-CG 3.22Å; R157-E161 PolarHBondContact O-N 3.3Å; R158-E161 PolarHBondContact O-N 3.02Å; E161-E163 VanDerWaalsContact C-N 3.31Å; E161-E163 PolarHBondContact O-N 3.18Å; E161-L164 PolarHBondContact O-N 2.92Å; E161-E165 WeakPolarHBondContact O-CB 3.45Å; E161-E165 WeakPolarHBondContact O-CG 3.35Å; E161-E165 PolarHBondContact O-N 3.48Å |
| 162 | E | 94.4 | Very high | 93.2 | Very high | 62 Ų | 62 | 107.4 Ų | 107.4 | 29% | 0.29 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.5 | -35.4 | 175.8 | -70.9 | 177.5 | -165.2 | 0 | 0 | 112.4 | R158 R159 R166 | R158-E162 IonicContact CZ-OE1 3.09Å; R158-E162 IonicContact NE-OE1 3.2Å; R158-E162 PolarHBondContact NE-OE1 3.48Å; R158-E162 VanDerWaalsContact NE-OE1 3.08Å; R158-E162 IonicContact NH2-OE1 3.02Å; R158-E162 WeakPolarHBondContact O-CG 3.42Å; R158-E162 PolarHBondContact O-N 2.91Å; R159-E162 PolarHBondContact O-N 2.92Å; E162-R166 VanDerWaalsContact C-NH1 3.3Å; E162-R166 VanDerWaalsContact O-CG 3.23Å; E162-R166 WeakPolarHBondContact O-CG 3.38Å; E162-R166 PolarHBondContact O-N 3.32Å; E162-R166 PolarHBondContact O-NH1 3.02Å; E162-R166 IonicContact OE2-NH2 3.2Å; E162-R166 PolarHBondContact OE2-NH2 3.12Å |
| 163 | E | 94.2 | Very high | 92.6 | Very high | 104 Ų | 104 | 107.3 Ų | 107.3 | 49% | 0.486 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.1 | -47.4 | 172.7 | -76.2 | 170.8 | -172.3 | 0 | 0 | 111.7 | R159 L160 E161 E165 R166 E167 | R159-E163 WeakPolarHBondContact O-CG 3.27Å; R159-E163 PolarHBondContact O-N 3.06Å; L160-E163 PolarHBondContact O-N 2.87Å; E161-E163 VanDerWaalsContact C-N 3.31Å; E161-E163 PolarHBondContact O-N 3.18Å; E163-E165 PolarHBondContact O-N 2.9Å; E163-R166 WeakPolarHBondContact O-CB 3.36Å; E163-R166 PolarHBondContact O-N 2.99Å; E163-E167 PolarHBondContact O-N 3.27Å |
| 164 | L | 93.1 | Very high | 91.9 | Very high | 106 Ų | 106 | 108.1 Ų | 108.1 | 56% | 0.555 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.4 | -43.7 | 176.2 | -109.4 | 152 | 0 | 0 | 0 | 112.3 | L160 E161 R166 E167 V168 | L160-L164 WeakPolarHBondContact O-CB 3.47Å; L160-L164 PolarHBondContact O-N 3.37Å; E161-L164 PolarHBondContact O-N 2.92Å; L164-R166 VanDerWaalsContact C-N 3.32Å; L164-R166 PolarHBondContact O-N 2.92Å; L164-E167 PolarHBondContact O-N 3.45Å; L164-V168 HydrophobicContact CD2-CG2 4.46Å; L164-V168 WeakPolarHBondContact O-CB 3.24Å; L164-V168 VanDerWaalsContact O-CG2 3.28Å; L164-V168 WeakPolarHBondContact O-CG2 3.47Å; L164-V168 PolarHBondContact O-N 3.2Å |
| 165 | E | 91.3 | Very high | 91 | Very high | 136 Ų | 136 | 107.6 Ų | 107.6 | 64% | 0.636 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.7 | -42 | 176 | -77.5 | 179.7 | 175.2 | 0 | 0 | 111.5 | E161 E163 A169 | E161-E165 WeakPolarHBondContact O-CB 3.45Å; E161-E165 WeakPolarHBondContact O-CG 3.35Å; E161-E165 PolarHBondContact O-N 3.48Å; E163-E165 PolarHBondContact O-N 2.9Å; E165-A169 VanDerWaalsContact O-CB 3.24Å; E165-A169 WeakPolarHBondContact O-CB 3.4Å; E165-A169 PolarHBondContact O-N 2.92Å |
| 166 | R | 92.4 | Very high | 89.9 | Confident | 146 Ų | 146 | 108.3 Ų | 108.3 | 55% | 0.551 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.6 | -43.6 | 175.1 | -72 | 175.3 | -159.8 | 108.2 | 2.1 | 111.7 | E162 E163 L164 A169 A170 | E162-R166 VanDerWaalsContact C-NH1 3.3Å; E162-R166 VanDerWaalsContact O-CG 3.23Å; E162-R166 WeakPolarHBondContact O-CG 3.38Å; E162-R166 PolarHBondContact O-N 3.32Å; E162-R166 PolarHBondContact O-NH1 3.02Å; E162-R166 IonicContact OE2-NH2 3.2Å; E162-R166 PolarHBondContact OE2-NH2 3.12Å; E163-R166 WeakPolarHBondContact O-CB 3.36Å; E163-R166 PolarHBondContact O-N 2.99Å; L164-R166 VanDerWaalsContact C-N 3.32Å; L164-R166 PolarHBondContact O-N 2.92Å; R166-A169 PolarHBondContact O-N 3.06Å; R166-A170 WeakPolarHBondContact O-CB 3.27Å; R166-A170 PolarHBondContact O-N 2.93Å |
| 167 | E | 92.8 | Very high | 88.8 | Confident | 131 Ų | 131 | 106 Ų | 106 | 61% | 0.612 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.7 | -44.4 | 177.5 | -74 | -172.1 | 171.5 | 0 | 0 | 112.4 | E163 L164 A170 M171 | E163-E167 PolarHBondContact O-N 3.27Å; L164-E167 PolarHBondContact O-N 3.45Å; E167-A170 PolarHBondContact O-N 3.14Å; E167-M171 WeakPolarHBondContact O-CB 3.35Å; E167-M171 PolarHBondContact O-N 3.36Å |
| 168 | V | 91.6 | Very high | 87.6 | Confident | 74 Ų | 74 | 103.6 Ų | 103.6 | 45% | 0.448 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 175.9 | 170.5 | 0 | 0 | 0 | 0 | 110.3 | L164 A170 M171 S172 | L164-V168 HydrophobicContact CD2-CG2 4.46Å; L164-V168 WeakPolarHBondContact O-CB 3.24Å; L164-V168 VanDerWaalsContact O-CG2 3.28Å; L164-V168 WeakPolarHBondContact O-CG2 3.47Å; L164-V168 PolarHBondContact O-N 3.2Å; V168-A170 VanDerWaalsContact C-N 3.32Å; V168-A170 PolarHBondContact O-N 3.14Å; V168-M171 PolarHBondContact O-N 3.24Å; V168-S172 WeakPolarHBondContact O-CB 3.41Å; V168-S172 PolarHBondContact O-N 2.89Å; V168-S172 PolarHBondContact O-OG 2.96Å; V168-S172 VanDerWaalsContact O-OG 3.11Å |
| 169 | A | 89.1 | Confident | 86 | Confident | 60 Ų | 60 | 97.8 Ų | 97.8 | 50% | 0.496 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.2 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | E165 R166 S172 A173 | E165-A169 VanDerWaalsContact O-CB 3.24Å; E165-A169 WeakPolarHBondContact O-CB 3.4Å; E165-A169 PolarHBondContact O-N 2.92Å; R166-A169 PolarHBondContact O-N 3.06Å; A169-S172 PolarHBondContact O-N 2.87Å; A169-A173 WeakPolarHBondContact O-CB 3.46Å; A169-A173 PolarHBondContact O-N 3.5Å |
| 170 | A | 89.7 | Confident | 84.4 | Confident | 52 Ų | 52 | 97.8 Ų | 97.8 | 43% | 0.43 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | R166 E167 V168 A173 Q174 | R166-A170 WeakPolarHBondContact O-CB 3.27Å; R166-A170 PolarHBondContact O-N 2.93Å; E167-A170 PolarHBondContact O-N 3.14Å; V168-A170 VanDerWaalsContact C-N 3.32Å; V168-A170 PolarHBondContact O-N 3.14Å; A170-A173 PolarHBondContact O-N 2.88Å; A170-Q174 WeakPolarHBondContact O-CG 3.45Å; A170-Q174 PolarHBondContact O-N 3Å |
| 171 | M | 88.9 | Confident | 82.5 | Confident | 116 Ų | 116 | 99.4 Ų | 99.4 | 57% | 0.571 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -67.1 | -42.1 | 177.2 | -167.2 | -172.8 | -53.6 | 0 | 0 | 111.9 | E167 V168 A173 Q174 V175 | E167-M171 WeakPolarHBondContact O-CB 3.35Å; E167-M171 PolarHBondContact O-N 3.36Å; V168-M171 PolarHBondContact O-N 3.24Å; M171-A173 VanDerWaalsContact C-N 3.34Å; M171-A173 PolarHBondContact O-N 3.42Å; M171-Q174 WeakPolarHBondContact O-CB 3.47Å; M171-Q174 PolarHBondContact O-N 2.91Å; M171-V175 WeakPolarHBondContact O-CG2 3.49Å; M171-V175 PolarHBondContact O-N 2.9Å |
| 172 | S | 84.4 | Confident | 80.8 | Confident | 58 Ų | 58 | 101.7 Ų | 101.7 | 41% | 0.406 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 174.8 | -69.7 | 0 | 0 | 0 | 0 | 111.7 | V168 A169 Q174 V175 Q176 | V168-S172 WeakPolarHBondContact O-CB 3.41Å; V168-S172 PolarHBondContact O-N 2.89Å; V168-S172 PolarHBondContact O-OG 2.96Å; V168-S172 VanDerWaalsContact O-OG 3.11Å; A169-S172 PolarHBondContact O-N 2.87Å; S172-Q174 VanDerWaalsContact C-N 3.34Å; S172-V175 PolarHBondContact O-N 3.34Å; S172-Q176 WeakPolarHBondContact O-CB 3.3Å; S172-Q176 WeakPolarHBondContact O-CG 3.49Å; S172-Q176 PolarHBondContact O-N 3.46Å |
| 173 | A | 84.3 | Confident | 78.6 | Confident | 56 Ų | 56 | 102.7 Ų | 102.7 | 46% | 0.463 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | A169 A170 M171 H177 | A169-A173 WeakPolarHBondContact O-CB 3.46Å; A169-A173 PolarHBondContact O-N 3.5Å; A170-A173 PolarHBondContact O-N 2.88Å; M171-A173 VanDerWaalsContact C-N 3.34Å; M171-A173 PolarHBondContact O-N 3.42Å; A173-H177 VanDerWaalsContact O-CB 3.26Å; A173-H177 WeakPolarHBondContact O-CB 3.43Å; A173-H177 PolarHBondContact O-N 3.17Å |
| 174 | Q | 81.5 | Confident | 77.4 | Confident | 130 Ų | 130 | 102 Ų | 102 | 61% | 0.607 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.1 | -43.3 | 173.8 | -72.4 | 175.8 | 15.2 | 0 | 0 | 112.2 | A170 M171 S172 H177 L178 | A170-Q174 WeakPolarHBondContact O-CG 3.45Å; A170-Q174 PolarHBondContact O-N 3Å; M171-Q174 WeakPolarHBondContact O-CB 3.47Å; M171-Q174 PolarHBondContact O-N 2.91Å; S172-Q174 VanDerWaalsContact C-N 3.34Å; Q174-H177 PolarHBondContact O-N 3.4Å; Q174-L178 WeakPolarHBondContact O-CB 3.48Å; Q174-L178 PolarHBondContact O-N 2.65Å |
| 175 | V | 77.7 | Confident | 75.8 | Confident | 80 Ų | 80 | 104.6 Ų | 104.6 | 49% | 0.485 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.7 | -44.9 | 177.9 | 171.1 | 0 | 0 | 0 | 0 | 111 | M171 S172 H177 L178 V179 | M171-V175 WeakPolarHBondContact O-CG2 3.49Å; M171-V175 PolarHBondContact O-N 2.9Å; S172-V175 PolarHBondContact O-N 3.34Å; V175-H177 VanDerWaalsContact C-N 3.34Å; V175-H177 PolarHBondContact O-N 2.91Å; V175-L178 CarbonylContact O-C 3.59Å; V175-L178 WeakPolarHBondContact O-CB 3.17Å; V175-L178 PolarHBondContact O-N 2.9Å; V175-L178 VanDerWaalsContact O-N 3.15Å; V175-V179 HydrophobicContact CG1-CG2 4.06Å; V175-V179 WeakPolarHBondContact O-CB 3.49Å; V175-V179 WeakPolarHBondContact O-CG2 3.18Å; V175-V179 PolarHBondContact O-N 3.47Å |
| 176 | Q | 72.4 | Confident | 74.4 | Confident | 127 Ų | 127 | 101.7 Ų | 101.7 | 59% | 0.593 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -58.5 | -46.4 | 174.9 | -82.8 | 179.1 | -18.3 | 0 | 0 | 111.2 | S172 L178 V179 E180 | S172-Q176 WeakPolarHBondContact O-CB 3.3Å; S172-Q176 WeakPolarHBondContact O-CG 3.49Å; S172-Q176 PolarHBondContact O-N 3.46Å; Q176-L178 VanDerWaalsContact C-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.4Å; Q176-V179 PolarHBondContact O-N 3.17Å; Q176-E180 WeakPolarHBondContact O-CB 3.46Å; Q176-E180 WeakPolarHBondContact O-CG 3.49Å; Q176-E180 PolarHBondContact O-N 3.5Å |
| 177 | H | 73.4 | Confident | 73.1 | Confident | 101 Ų | 101 | 97.4 Ų | 97.4 | 47% | 0.468 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.2 | -40 | 174.9 | 178.8 | -84.4 | 0 | 0 | 0 | 112.2 | A173 Q174 V175 Q181 | A173-H177 VanDerWaalsContact O-CB 3.26Å; A173-H177 WeakPolarHBondContact O-CB 3.43Å; A173-H177 PolarHBondContact O-N 3.17Å; Q174-H177 PolarHBondContact O-N 3.4Å; V175-H177 VanDerWaalsContact C-N 3.34Å; V175-H177 PolarHBondContact O-N 2.91Å; H177-Q181 VanDerWaalsContact CE1-CD 3.44Å; H177-Q181 PolarHBondContact CE1-NE2 2.94Å; H177-Q181 PolarHBondContact NE2-NE2 2.96Å; H177-Q181 WeakPolarHBondContact O-CB 3.48Å; H177-Q181 WeakPolarHBondContact O-CG 3.42Å; H177-Q181 PolarHBondContact O-N 3.13Å |
| 178 | L | 70.1 | Confident | 71.9 | Confident | 111 Ų | 111 | 99 Ų | 99 | 58% | 0.581 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.2 | -39.8 | 176 | -122 | 118.7 | 0 | 0 | 0 | 112.7 | Q174 V175 Q176 Q181 K182 | Q174-L178 WeakPolarHBondContact O-CB 3.48Å; Q174-L178 PolarHBondContact O-N 2.65Å; V175-L178 CarbonylContact O-C 3.59Å; V175-L178 WeakPolarHBondContact O-CB 3.17Å; V175-L178 PolarHBondContact O-N 2.9Å; V175-L178 VanDerWaalsContact O-N 3.15Å; Q176-L178 VanDerWaalsContact C-N 3.3Å; Q176-L178 PolarHBondContact O-N 3.4Å; L178-Q181 PolarHBondContact O-N 3.33Å; L178-K182 WeakPolarHBondContact O-CB 3.31Å; L178-K182 PolarHBondContact O-N 3.01Å; L178-K182 VanDerWaalsContact O-N 3.11Å |
| 179 | V | 62.2 | Low | 70.8 | Confident | 38 Ų | 38 | 99 Ų | 99 | 23% | 0.23 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -67 | -44.5 | 178.2 | 168.8 | 0 | 0 | 0 | 0 | 110.8 | V175 Q176 Q181 K182 L183 | V175-V179 HydrophobicContact CG1-CG2 4.06Å; V175-V179 WeakPolarHBondContact O-CB 3.49Å; V175-V179 WeakPolarHBondContact O-CG2 3.18Å; V175-V179 PolarHBondContact O-N 3.47Å; Q176-V179 PolarHBondContact O-N 3.17Å; V179-Q181 VanDerWaalsContact C-N 3.25Å; V179-Q181 PolarHBondContact O-N 3.47Å; V179-K182 PolarHBondContact O-N 2.98Å; V179-L183 HydrophobicContact CB-CD1 4.42Å; V179-L183 HydrophobicContact CG2-CD1 3.78Å; V179-L183 PolarHBondContact O-N 3.38Å |
| 180 | E | 60.5 | Low | 70.2 | Confident | 160 Ų | 160 | 99.9 Ų | 99.9 | 75% | 0.748 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.3 | -31.7 | 174.8 | -76.1 | 179 | 170.8 | 0 | 0 | 112.4 | Q176 | Q176-E180 WeakPolarHBondContact O-CB 3.46Å; Q176-E180 WeakPolarHBondContact O-CG 3.49Å; Q176-E180 PolarHBondContact O-N 3.5Å |
| 181 | Q | 57.1 | Low | 69.6 | Low | 122 Ų | 122 | 102 Ų | 102 | 57% | 0.57 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -85.8 | -21.9 | -179.8 | -78 | -169.9 | -7.2 | 0 | 0 | 115.4 | H177 L178 V179 | H177-Q181 VanDerWaalsContact CE1-CD 3.44Å; H177-Q181 PolarHBondContact CE1-NE2 2.94Å; H177-Q181 PolarHBondContact NE2-NE2 2.96Å; H177-Q181 WeakPolarHBondContact O-CB 3.48Å; H177-Q181 WeakPolarHBondContact O-CG 3.42Å; H177-Q181 PolarHBondContact O-N 3.13Å; L178-Q181 PolarHBondContact O-N 3.33Å; V179-Q181 VanDerWaalsContact C-N 3.25Å; V179-Q181 PolarHBondContact O-N 3.47Å |
| 182 | K | 54.8 | Low | 69.1 | Low | 165 Ų | 165 | 102.3 Ų | 102.3 | 72% | 0.717 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -145.4 | -7.8 | -159.7 | -69.3 | -74.1 | 173 | 169 | 0 | 119.8 | L178 V179 | L178-K182 WeakPolarHBondContact O-CB 3.31Å; L178-K182 PolarHBondContact O-N 3.01Å; L178-K182 VanDerWaalsContact O-N 3.11Å; V179-K182 PolarHBondContact O-N 2.98Å |
| 183 | L | 50.2 | Low | 69 | Low | 83 Ų | 83 | 105.4 Ų | 105.4 | 44% | 0.435 | 55% | 0.546 | S | S | . | . | trans | -109.4 | 128.5 | -164.8 | -85.8 | 159.1 | 0 | 0 | 0 | 116.7 | V179 T187 | V179-L183 HydrophobicContact CB-CD1 4.42Å; V179-L183 HydrophobicContact CG2-CD1 3.78Å; V179-L183 PolarHBondContact O-N 3.38Å; L183-T187 HydrophobicContact CD1-CG2 4.48Å; L183-T187 HydrophobicContact CD2-CG2 3.94Å; L183-T187 WeakPolarHBondContact CD2-OG1 3.46Å | ||
| 184 | P | 67.8 | Low | 69 | Low | 90 Ų | 90 | 106.8 Ų | 106.8 | 58% | 0.584 | 55% | 0.546 | S | S | * | . | trans | -71.8 | 160.7 | 173.3 | -12.1 | 26.9 | 0 | 0 | 0 | 113.9 | A186 T187 | P184-A186 VanDerWaalsContact C-N 3.25Å; P184-A186 PolarHBondContact O-N 3.01Å; P184-T187 PolarHBondContact O-N 3.44Å; P184-T187 VanDerWaalsContact O-N 3.08Å | ||
| 185 | E | 59.5 | Low | 69 | Low | 160 Ų | 160 | 103.6 Ų | 103.6 | 75% | 0.748 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -53.9 | -29.6 | -172.9 | -71.3 | 174.7 | 155.2 | 0 | 0 | 115.6 | T187 R188 S189 | E185-T187 PolarHBondContact O-N 3.44Å; E185-R188 WeakPolarHBondContact O-CB 3.45Å; E185-R188 PolarHBondContact O-N 2.9Å; E185-R188 VanDerWaalsContact O-N 3.08Å; E185-S189 PolarHBondContact O-N 3.33Å |
| 186 | A | 61.3 | Low | 69.3 | Low | 76 Ų | 76 | 105.7 Ų | 105.7 | 63% | 0.628 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.6 | -32.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | P184 V190 | P184-A186 VanDerWaalsContact C-N 3.25Å; P184-A186 PolarHBondContact O-N 3.01Å; A186-V190 PolarHBondContact O-N 3.18Å |
| 187 | T | 66.2 | Low | 70 | Confident | 56 Ų | 56 | 104.8 Ų | 104.8 | 34% | 0.344 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -80.1 | -24.4 | 178.8 | -41.2 | 0 | 0 | 0 | 0 | 112 | L183 P184 E185 L191 | L183-T187 HydrophobicContact CD1-CG2 4.48Å; L183-T187 HydrophobicContact CD2-CG2 3.94Å; L183-T187 WeakPolarHBondContact CD2-OG1 3.46Å; P184-T187 PolarHBondContact O-N 3.44Å; P184-T187 VanDerWaalsContact O-N 3.08Å; E185-T187 PolarHBondContact O-N 3.44Å; T187-L191 WeakPolarHBondContact O-CG 3.48Å; T187-L191 PolarHBondContact O-N 2.89Å |
| 188 | R | 66.3 | Low | 70.7 | Confident | 164 Ų | 164 | 106.5 Ų | 106.5 | 62% | 0.619 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -67.2 | -41.7 | 171.8 | -88.7 | -179.6 | 168.8 | 158.2 | -1.5 | 111.8 | E185 V190 L191 Q192 | E185-R188 WeakPolarHBondContact O-CB 3.45Å; E185-R188 PolarHBondContact O-N 2.9Å; E185-R188 VanDerWaalsContact O-N 3.08Å; R188-V190 PolarHBondContact O-N 3.03Å; R188-L191 PolarHBondContact O-N 2.97Å; R188-Q192 PolarHBondContact O-N 3.47Å |
| 189 | S | 68.9 | Low | 71.4 | Confident | 74 Ų | 74 | 104.5 Ų | 104.5 | 52% | 0.517 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 176 | -74.1 | 0 | 0 | 0 | 0 | 112.8 | E185 L191 Q192 E193 | E185-S189 PolarHBondContact O-N 3.33Å; S189-L191 VanDerWaalsContact C-N 3.32Å; S189-L191 PolarHBondContact O-N 3.01Å; S189-Q192 WeakPolarHBondContact O-CB 3.36Å; S189-Q192 PolarHBondContact O-N 2.93Å; S189-E193 PolarHBondContact O-N 3.49Å |
| 190 | V | 76.9 | Confident | 72.8 | Confident | 78 Ų | 78 | 107.5 Ų | 107.5 | 47% | 0.473 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.4 | -33.4 | 177.3 | 175.1 | 0 | 0 | 0 | 0 | 112.3 | A186 R188 N194 | A186-V190 PolarHBondContact O-N 3.18Å; R188-V190 PolarHBondContact O-N 3.03Å; V190-N194 WeakPolarHBondContact O-CB 3.44Å; V190-N194 PolarHBondContact O-N 3.05Å |
| 191 | L | 78.1 | Confident | 74.3 | Confident | 97 Ų | 97 | 105.2 Ų | 105.2 | 51% | 0.508 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -71.2 | -36.6 | 174.8 | -71.2 | 171.4 | 0 | 0 | 0 | 112.1 | T187 R188 S189 N194 S195 | T187-L191 WeakPolarHBondContact O-CG 3.48Å; T187-L191 PolarHBondContact O-N 2.89Å; R188-L191 PolarHBondContact O-N 2.97Å; S189-L191 VanDerWaalsContact C-N 3.32Å; S189-L191 PolarHBondContact O-N 3.01Å; L191-N194 PolarHBondContact O-N 2.94Å; L191-S195 PolarHBondContact O-N 3.36Å |
| 192 | Q | 78.2 | Confident | 75.9 | Confident | 123 Ų | 123 | 101.2 Ų | 101.2 | 58% | 0.575 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62.4 | -46.9 | 172 | -110.1 | 177.1 | -27 | 0 | 0 | 111.3 | R188 S189 N194 S195 E196 | R188-Q192 PolarHBondContact O-N 3.47Å; S189-Q192 WeakPolarHBondContact O-CB 3.36Å; S189-Q192 PolarHBondContact O-N 2.93Å; Q192-N194 VanDerWaalsContact C-N 3.3Å; Q192-N194 PolarHBondContact O-N 3.28Å; Q192-S195 WeakPolarHBondContact O-CB 3.47Å; Q192-S195 PolarHBondContact O-N 2.88Å; Q192-S195 PolarHBondContact O-OG 3.36Å; Q192-E196 PolarHBondContact O-N 3.42Å |
| 193 | E | 81.1 | Confident | 77.7 | Confident | 123 Ų | 123 | 99.5 Ų | 99.5 | 58% | 0.575 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.9 | -38.3 | 177.1 | -147.4 | 176.6 | -166.2 | 0 | 0 | 111.6 | S189 S195 E196 L197 | S189-E193 PolarHBondContact O-N 3.49Å; E193-S195 VanDerWaalsContact C-N 3.34Å; E193-S195 PolarHBondContact O-N 2.99Å; E193-E196 PolarHBondContact O-N 2.9Å; E193-L197 WeakPolarHBondContact O-CG 3.33Å; E193-L197 PolarHBondContact O-N 3.48Å |
| 194 | N | 84.6 | Confident | 79.7 | Confident | 85 Ų | 85 | 100.5 Ų | 100.5 | 46% | 0.455 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.3 | -37.3 | 172.2 | -112 | -54.6 | 0 | 0 | 0 | 113 | V190 L191 Q192 E196 L197 Q198 | V190-N194 WeakPolarHBondContact O-CB 3.44Å; V190-N194 PolarHBondContact O-N 3.05Å; L191-N194 PolarHBondContact O-N 2.94Å; Q192-N194 VanDerWaalsContact C-N 3.3Å; Q192-N194 PolarHBondContact O-N 3.28Å; N194-E196 VanDerWaalsContact C-N 3.35Å; N194-L197 PolarHBondContact O-N 2.86Å; N194-Q198 PolarHBondContact O-N 3.35Å |
| 195 | S | 82.2 | Confident | 80.9 | Confident | 62 Ų | 62 | 98.9 Ų | 98.9 | 43% | 0.434 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.3 | -36.7 | 176.8 | 79.7 | 0 | 0 | 0 | 0 | 112.1 | L191 Q192 E193 Q198 S199 | L191-S195 PolarHBondContact O-N 3.36Å; Q192-S195 WeakPolarHBondContact O-CB 3.47Å; Q192-S195 PolarHBondContact O-N 2.88Å; Q192-S195 PolarHBondContact O-OG 3.36Å; E193-S195 VanDerWaalsContact C-N 3.34Å; E193-S195 PolarHBondContact O-N 2.99Å; S195-Q198 PolarHBondContact O-N 2.97Å; S195-S199 PolarHBondContact O-N 2.95Å |
| 196 | E | 84.1 | Confident | 82.4 | Confident | 125 Ų | 125 | 93.4 Ų | 93.4 | 58% | 0.584 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.3 | -41.8 | 175 | -69 | 178.6 | -176.7 | 0 | 0 | 111.2 | Q192 E193 N194 S199 L200 | Q192-E196 PolarHBondContact O-N 3.42Å; E193-E196 PolarHBondContact O-N 2.9Å; N194-E196 VanDerWaalsContact C-N 3.35Å; E196-S199 WeakPolarHBondContact O-CB 3.28Å; E196-S199 PolarHBondContact O-N 3.4Å; E196-L200 PolarHBondContact O-N 2.88Å |
| 197 | L | 86.9 | Confident | 84.1 | Confident | 107 Ų | 107 | 94.5 Ų | 94.5 | 56% | 0.56 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.8 | -40.2 | 173.4 | -72.6 | 173.7 | 0 | 0 | 0 | 112.5 | E193 N194 S199 L200 L201 | E193-L197 WeakPolarHBondContact O-CG 3.33Å; E193-L197 PolarHBondContact O-N 3.48Å; N194-L197 PolarHBondContact O-N 2.86Å; L197-S199 VanDerWaalsContact C-N 3.34Å; L197-S199 PolarHBondContact O-N 3.15Å; L197-L200 PolarHBondContact O-N 3.07Å; L197-L201 WeakPolarHBondContact O-CB 3.47Å; L197-L201 PolarHBondContact O-N 3.38Å |
| 198 | Q | 86.8 | Confident | 85.4 | Confident | 138 Ų | 138 | 94.9 Ų | 94.9 | 65% | 0.645 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -40 | 173.9 | -85.4 | 179.5 | -26.6 | 0 | 0 | 112.2 | N194 S195 L201 G202 | N194-Q198 PolarHBondContact O-N 3.35Å; S195-Q198 PolarHBondContact O-N 2.97Å; Q198-L201 PolarHBondContact O-N 3Å; Q198-G202 PolarHBondContact O-N 3.12Å |
| 199 | S | 86.5 | Confident | 86.7 | Confident | 68 Ų | 68 | 93.3 Ų | 93.3 | 48% | 0.476 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.6 | -46.7 | 174.2 | 178.8 | 0 | 0 | 0 | 0 | 111.7 | S195 E196 L197 L201 G202 Q203 | S195-S199 PolarHBondContact O-N 2.95Å; E196-S199 WeakPolarHBondContact O-CB 3.28Å; E196-S199 PolarHBondContact O-N 3.4Å; L197-S199 VanDerWaalsContact C-N 3.34Å; L197-S199 PolarHBondContact O-N 3.15Å; S199-L201 PolarHBondContact O-N 3.48Å; S199-G202 PolarHBondContact O-N 3.32Å; S199-Q203 WeakPolarHBondContact O-CG 3.33Å; S199-Q203 PolarHBondContact O-N 2.97Å |
| 200 | L | 90.3 | Very high | 87.9 | Confident | 102 Ų | 102 | 92.2 Ų | 92.2 | 53% | 0.534 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 177.4 | -119 | 125.3 | 0 | 0 | 0 | 112.2 | E196 L197 G202 Q203 L204 | E196-L200 PolarHBondContact O-N 2.88Å; L197-L200 PolarHBondContact O-N 3.07Å; L200-G202 VanDerWaalsContact C-N 3.31Å; L200-G202 PolarHBondContact O-N 3.32Å; L200-Q203 PolarHBondContact O-N 3.48Å; L200-L204 PolarHBondContact O-N 2.85Å |
| 201 | L | 92.1 | Very high | 88.8 | Confident | 111 Ų | 111 | 92.6 Ų | 92.6 | 58% | 0.581 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.2 | -37.1 | 175.7 | -169.5 | 70.3 | 0 | 0 | 0 | 111.7 | L197 Q198 S199 L204 S205 | L197-L201 WeakPolarHBondContact O-CB 3.47Å; L197-L201 PolarHBondContact O-N 3.38Å; Q198-L201 PolarHBondContact O-N 3Å; S199-L201 PolarHBondContact O-N 3.48Å; L201-L204 PolarHBondContact O-N 2.9Å; L201-S205 WeakPolarHBondContact O-CB 3.2Å; L201-S205 PolarHBondContact O-N 3.4Å; L201-S205 PolarHBondContact O-OG 3.46Å |
| 202 | G | 91.4 | Very high | 89.6 | Confident | 39 Ų | 39 | 94 Ų | 94 | 40% | 0.402 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q198 S199 L200 S205 A206 | Q198-G202 PolarHBondContact O-N 3.12Å; S199-G202 PolarHBondContact O-N 3.32Å; L200-G202 VanDerWaalsContact C-N 3.31Å; L200-G202 PolarHBondContact O-N 3.32Å; G202-S205 PolarHBondContact O-N 3.24Å; G202-A206 PolarHBondContact O-N 3.3Å |
| 203 | Q | 92.1 | Very high | 90.5 | Very high | 129 Ų | 129 | 96.3 Ų | 96.3 | 60% | 0.603 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.1 | -45.9 | 176.5 | -67.2 | 177.7 | 18.7 | 0 | 0 | 112 | S199 L200 S205 A206 L207 | S199-Q203 WeakPolarHBondContact O-CG 3.33Å; S199-Q203 PolarHBondContact O-N 2.97Å; L200-Q203 PolarHBondContact O-N 3.48Å; Q203-S205 VanDerWaalsContact C-N 3.31Å; Q203-S205 PolarHBondContact O-N 3.26Å; Q203-A206 WeakPolarHBondContact O-CB 3.35Å; Q203-A206 PolarHBondContact O-N 2.97Å; Q203-A206 VanDerWaalsContact O-N 3.16Å; Q203-L207 PolarHBondContact O-N 3.01Å |
| 204 | L | 92.6 | Very high | 91.2 | Very high | 103 Ų | 103 | 96 Ų | 96 | 54% | 0.539 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60 | -40.5 | 175.1 | -86.8 | 161 | 0 | 0 | 0 | 112.1 | L200 L201 A206 L207 S208 | L200-L204 PolarHBondContact O-N 2.85Å; L201-L204 PolarHBondContact O-N 2.9Å; L204-A206 VanDerWaalsContact C-N 3.33Å; L204-A206 PolarHBondContact O-N 3.48Å; L204-L207 PolarHBondContact O-N 3.35Å; L204-S208 WeakPolarHBondContact O-CB 3.32Å; L204-S208 PolarHBondContact O-N 3.06Å |
| 205 | S | 92.5 | Very high | 91.8 | Very high | 56 Ų | 56 | 95.6 Ų | 95.6 | 39% | 0.392 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.8 | -32.7 | 176.8 | -60.6 | 0 | 0 | 0 | 0 | 112.5 | L201 G202 Q203 R209 | L201-S205 WeakPolarHBondContact O-CB 3.2Å; L201-S205 PolarHBondContact O-N 3.4Å; L201-S205 PolarHBondContact O-OG 3.46Å; G202-S205 PolarHBondContact O-N 3.24Å; Q203-S205 VanDerWaalsContact C-N 3.31Å; Q203-S205 PolarHBondContact O-N 3.26Å; S205-R209 WeakPolarHBondContact O-CG 3.3Å; S205-R209 PolarHBondContact O-N 2.87Å; S205-R209 PolarHBondContact O-NE 2.97Å |
| 206 | A | 92.2 | Very high | 92.4 | Very high | 45 Ų | 45 | 95.2 Ų | 95.2 | 37% | 0.372 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.1 | -44.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | G202 Q203 L204 R209 S210 | G202-A206 PolarHBondContact O-N 3.3Å; Q203-A206 WeakPolarHBondContact O-CB 3.35Å; Q203-A206 PolarHBondContact O-N 2.97Å; Q203-A206 VanDerWaalsContact O-N 3.16Å; L204-A206 VanDerWaalsContact C-N 3.33Å; L204-A206 PolarHBondContact O-N 3.48Å; A206-R209 PolarHBondContact O-N 2.98Å; A206-S210 PolarHBondContact O-N 2.89Å |
| 207 | L | 95.3 | Very high | 93 | Very high | 100 Ų | 100 | 92.2 Ų | 92.2 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.4 | -41.1 | 176.5 | -172.3 | 69.9 | 0 | 0 | 0 | 112.1 | Q203 L204 R209 S210 L211 | Q203-L207 PolarHBondContact O-N 3.01Å; L204-L207 PolarHBondContact O-N 3.35Å; L207-R209 VanDerWaalsContact C-N 3.32Å; L207-R209 PolarHBondContact O-N 2.9Å; L207-S210 PolarHBondContact O-N 3.36Å; L207-S210 PolarHBondContact O-OG 2.94Å; L207-L211 HydrophobicContact CG-CD1 4.37Å; L207-L211 WeakPolarHBondContact O-CG 3.33Å; L207-L211 PolarHBondContact O-N 2.94Å |
| 208 | S | 93.8 | Very high | 93.5 | Very high | 63 Ų | 63 | 92 Ų | 92 | 44% | 0.441 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.2 | -42.9 | 175.3 | -173.1 | 0 | 0 | 0 | 0 | 111.4 | L204 L211 Q212 | L204-S208 WeakPolarHBondContact O-CB 3.32Å; L204-S208 PolarHBondContact O-N 3.06Å; S208-L211 PolarHBondContact O-N 2.95Å; S208-Q212 WeakPolarHBondContact O-CG 3.4Å; S208-Q212 PolarHBondContact O-N 3.37Å |
| 209 | R | 94.6 | Very high | 94 | Very high | 131 Ų | 131 | 93 Ų | 93 | 49% | 0.494 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.5 | -38.8 | 175.7 | -76 | -178.2 | -69.6 | 159 | -3.2 | 112.9 | S205 A206 L207 Q212 R213 | S205-R209 WeakPolarHBondContact O-CG 3.3Å; S205-R209 PolarHBondContact O-N 2.87Å; S205-R209 PolarHBondContact O-NE 2.97Å; A206-R209 PolarHBondContact O-N 2.98Å; L207-R209 VanDerWaalsContact C-N 3.32Å; L207-R209 PolarHBondContact O-N 2.9Å; R209-Q212 PolarHBondContact O-N 3.16Å; R209-R213 WeakPolarHBondContact O-CG 3.3Å; R209-R213 PolarHBondContact O-N 3.34Å; R209-R213 VanDerWaalsContact O-N 3.09Å |
| 210 | S | 94.4 | Very high | 94.5 | Very high | 51 Ų | 51 | 94.7 Ų | 94.7 | 36% | 0.357 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 176.6 | 64.5 | 0 | 0 | 0 | 0 | 111.5 | A206 L207 Q212 R213 E214 | A206-S210 PolarHBondContact O-N 2.89Å; L207-S210 PolarHBondContact O-N 3.36Å; L207-S210 PolarHBondContact O-OG 2.94Å; S210-Q212 VanDerWaalsContact C-N 3.32Å; S210-Q212 PolarHBondContact O-N 3.29Å; S210-R213 PolarHBondContact O-N 2.91Å; S210-E214 PolarHBondContact O-N 2.93Å |
| 211 | L | 95.9 | Very high | 94.8 | Very high | 87 Ų | 87 | 98.7 Ų | 98.7 | 46% | 0.455 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -36.9 | 175.9 | -75.3 | 170.2 | 0 | 0 | 0 | 112.7 | L207 S208 E214 N215 | L207-L211 HydrophobicContact CG-CD1 4.37Å; L207-L211 WeakPolarHBondContact O-CG 3.33Å; L207-L211 PolarHBondContact O-N 2.94Å; S208-L211 PolarHBondContact O-N 2.95Å; L211-E214 PolarHBondContact O-N 3.48Å; L211-N215 WeakPolarHBondContact O-CB 3.26Å; L211-N215 PolarHBondContact O-N 3.44Å; L211-N215 PolarHBondContact O-ND2 3.08Å |
| 212 | Q | 95 | Very high | 95 | Very high | 127 Ų | 127 | 101.1 Ų | 101.1 | 59% | 0.593 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.1 | -42.6 | 173.9 | -80.1 | -179.8 | -19.5 | 0 | 0 | 112.2 | S208 R209 S210 N215 A216 | S208-Q212 WeakPolarHBondContact O-CG 3.4Å; S208-Q212 PolarHBondContact O-N 3.37Å; R209-Q212 PolarHBondContact O-N 3.16Å; S210-Q212 VanDerWaalsContact C-N 3.32Å; S210-Q212 PolarHBondContact O-N 3.29Å; Q212-N215 PolarHBondContact O-N 3.22Å; Q212-A216 WeakPolarHBondContact O-CB 3.42Å; Q212-A216 PolarHBondContact O-N 3.46Å |
| 213 | R | 95.4 | Very high | 95.3 | Very high | 171 Ų | 171 | 105 Ų | 105 | 65% | 0.645 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.5 | -44.4 | 176.1 | -71.4 | 174.3 | -173.2 | 141.4 | -2 | 111.4 | R209 S210 A216 A217 | R209-R213 WeakPolarHBondContact O-CG 3.3Å; R209-R213 PolarHBondContact O-N 3.34Å; R209-R213 VanDerWaalsContact O-N 3.09Å; S210-R213 PolarHBondContact O-N 2.91Å; R213-A216 PolarHBondContact O-N 2.99Å; R213-A217 PolarHBondContact O-N 2.99Å |
| 214 | E | 96.6 | Very high | 95.5 | Very high | 117 Ų | 117 | 103.8 Ų | 103.8 | 55% | 0.547 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 177.2 | -167.7 | 176.4 | -174.8 | 0 | 0 | 111.5 | S210 L211 A216 A217 L218 | S210-E214 PolarHBondContact O-N 2.93Å; L211-E214 PolarHBondContact O-N 3.48Å; E214-A216 VanDerWaalsContact C-N 3.33Å; E214-A216 PolarHBondContact O-N 2.95Å; E214-A217 PolarHBondContact O-N 3.18Å; E214-L218 HydrophobicContact CG-CD1 4.33Å; E214-L218 WeakPolarHBondContact O-CB 3.48Å; E214-L218 WeakPolarHBondContact O-CG 3.47Å; E214-L218 PolarHBondContact O-N 3.44Å |
| 215 | N | 96.4 | Very high | 95.7 | Very high | 76 Ų | 76 | 103.6 Ų | 103.6 | 41% | 0.406 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.6 | -41.6 | 173 | -107.7 | -79.7 | 0 | 0 | 0 | 112.7 | L211 Q212 L218 R219 | L211-N215 WeakPolarHBondContact O-CB 3.26Å; L211-N215 PolarHBondContact O-N 3.44Å; L211-N215 PolarHBondContact O-ND2 3.08Å; Q212-N215 PolarHBondContact O-N 3.22Å; N215-L218 PolarHBondContact O-N 3.08Å; N215-R219 WeakPolarHBondContact O-CB 3.4Å; N215-R219 WeakPolarHBondContact O-CG 3.3Å; N215-R219 PolarHBondContact O-N 3.3Å |
| 216 | A | 95.8 | Very high | 95.9 | Very high | 54 Ų | 54 | 104 Ų | 104 | 45% | 0.446 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q212 R213 E214 L218 R219 E220 | Q212-A216 WeakPolarHBondContact O-CB 3.42Å; Q212-A216 PolarHBondContact O-N 3.46Å; R213-A216 PolarHBondContact O-N 2.99Å; E214-A216 VanDerWaalsContact C-N 3.33Å; E214-A216 PolarHBondContact O-N 2.95Å; A216-L218 PolarHBondContact O-N 3.46Å; A216-R219 PolarHBondContact O-N 3.41Å; A216-E220 PolarHBondContact O-N 3.47Å |
| 217 | A | 95.9 | Very high | 96.1 | Very high | 62 Ų | 62 | 105.2 Ų | 105.2 | 51% | 0.512 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R213 E214 E220 R221 | R213-A217 PolarHBondContact O-N 2.99Å; E214-A217 PolarHBondContact O-N 3.18Å; A217-E220 PolarHBondContact O-N 2.85Å; A217-R221 WeakPolarHBondContact O-CB 3.17Å; A217-R221 PolarHBondContact O-N 2.9Å |
| 218 | L | 97.3 | Very high | 96.1 | Very high | 103 Ų | 103 | 103.5 Ų | 103.5 | 54% | 0.539 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -39.5 | 175.8 | -73.1 | 172.9 | 0 | 0 | 0 | 112.3 | E214 N215 A216 E220 R221 K222 | E214-L218 HydrophobicContact CG-CD1 4.33Å; E214-L218 WeakPolarHBondContact O-CB 3.48Å; E214-L218 WeakPolarHBondContact O-CG 3.47Å; E214-L218 PolarHBondContact O-N 3.44Å; N215-L218 PolarHBondContact O-N 3.08Å; A216-L218 PolarHBondContact O-N 3.46Å; L218-E220 VanDerWaalsContact C-N 3.35Å; L218-R221 PolarHBondContact O-N 3.44Å; L218-K222 WeakPolarHBondContact O-CB 3.46Å; L218-K222 PolarHBondContact O-N 2.97Å |
| 219 | R | 97.2 | Very high | 96.3 | Very high | 157 Ų | 157 | 103.9 Ų | 103.9 | 59% | 0.592 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.2 | -42 | 174.6 | -76.9 | -179.9 | -172.9 | 126.9 | 2.7 | 111.8 | N215 A216 K222 K223 | N215-R219 WeakPolarHBondContact O-CB 3.4Å; N215-R219 WeakPolarHBondContact O-CG 3.3Å; N215-R219 PolarHBondContact O-N 3.3Å; A216-R219 PolarHBondContact O-N 3.41Å; R219-K222 WeakPolarHBondContact O-CB 3.49Å; R219-K222 PolarHBondContact O-N 3Å; R219-K223 WeakPolarHBondContact O-CG 3.33Å; R219-K223 PolarHBondContact O-N 2.92Å |
| 220 | E | 96.9 | Very high | 96.4 | Very high | 105 Ų | 105 | 102 Ų | 102 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.9 | -42.6 | 178.1 | -160.3 | 57.9 | -154.8 | 0 | 0 | 111.3 | A216 A217 L218 K222 K223 Q224 | A216-E220 PolarHBondContact O-N 3.47Å; A217-E220 PolarHBondContact O-N 2.85Å; L218-E220 VanDerWaalsContact C-N 3.35Å; E220-K222 VanDerWaalsContact C-N 3.3Å; E220-K222 PolarHBondContact O-N 3.35Å; E220-K223 WeakPolarHBondContact O-CB 3.44Å; E220-K223 PolarHBondContact O-N 3.48Å; E220-K223 VanDerWaalsContact O-N 3.13Å; E220-K223 IonicContact OE2-NZ 2.97Å; E220-K223 PolarHBondContact OE2-NZ 2.98Å; E220-Q224 PolarHBondContact O-N 3.35Å |
| 221 | R | 97.3 | Very high | 96.5 | Very high | 185 Ų | 185 | 104.1 Ų | 104.1 | 70% | 0.698 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.4 | -38.1 | 173.9 | -168.1 | 141 | -177.3 | 162 | -0.5 | 112.5 | A217 L218 Q224 L225 | A217-R221 WeakPolarHBondContact O-CB 3.17Å; A217-R221 PolarHBondContact O-N 2.9Å; L218-R221 PolarHBondContact O-N 3.44Å; R221-Q224 PolarHBondContact O-N 2.9Å; R221-L225 HydrophobicContact CG-CD1 4.33Å; R221-L225 WeakPolarHBondContact O-CB 3.41Å; R221-L225 VanDerWaalsContact O-CG 3.31Å; R221-L225 WeakPolarHBondContact O-CG 3.39Å; R221-L225 PolarHBondContact O-N 2.84Å |
| 222 | K | 96.6 | Very high | 96.5 | Very high | 162 Ų | 162 | 105.5 Ų | 105.5 | 70% | 0.704 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.7 | -43.3 | 173.6 | -179.1 | -179.6 | 176.5 | -179.8 | 0 | 111.9 | L218 R219 E220 L225 S226 | L218-K222 WeakPolarHBondContact O-CB 3.46Å; L218-K222 PolarHBondContact O-N 2.97Å; R219-K222 WeakPolarHBondContact O-CB 3.49Å; R219-K222 PolarHBondContact O-N 3Å; E220-K222 VanDerWaalsContact C-N 3.3Å; E220-K222 PolarHBondContact O-N 3.35Å; K222-L225 PolarHBondContact O-N 3.13Å; K222-S226 PolarHBondContact O-N 3.31Å |
| 223 | K | 96.8 | Very high | 96.6 | Very high | 122 Ų | 122 | 103.7 Ų | 103.7 | 53% | 0.53 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -45.6 | 175.7 | -68.4 | 175 | -166.1 | 161.9 | 0 | 111.1 | R219 E220 L225 S226 V227 | R219-K223 WeakPolarHBondContact O-CG 3.33Å; R219-K223 PolarHBondContact O-N 2.92Å; E220-K223 WeakPolarHBondContact O-CB 3.44Å; E220-K223 PolarHBondContact O-N 3.48Å; E220-K223 VanDerWaalsContact O-N 3.13Å; E220-K223 IonicContact OE2-NZ 2.97Å; E220-K223 PolarHBondContact OE2-NZ 2.98Å; K223-L225 PolarHBondContact O-N 3.48Å; K223-S226 VanDerWaalsContact O-CB 3.28Å; K223-S226 WeakPolarHBondContact O-CB 3.39Å; K223-S226 PolarHBondContact O-N 2.93Å; K223-S226 VanDerWaalsContact O-N 3.12Å; K223-V227 PolarHBondContact O-N 3.44Å |
| 224 | Q | 96.8 | Very high | 96.7 | Very high | 103 Ų | 103 | 98.2 Ų | 98.2 | 48% | 0.481 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.8 | -48.5 | 178 | -173 | 60.9 | 40.4 | 0 | 0 | 111.3 | E220 R221 S226 V227 D228 | E220-Q224 PolarHBondContact O-N 3.35Å; R221-Q224 PolarHBondContact O-N 2.9Å; Q224-S226 PolarHBondContact O-N 3.34Å; Q224-V227 PolarHBondContact O-N 3.2Å; Q224-V227 VanDerWaalsContact O-N 3.13Å; Q224-D228 PolarHBondContact NE2-OD1 2.9Å; Q224-D228 VanDerWaalsContact O-CG 3.25Å; Q224-D228 PolarHBondContact O-N 2.88Å |
| 225 | L | 96.8 | Very high | 96.6 | Very high | 99 Ų | 99 | 95.7 Ų | 95.7 | 52% | 0.518 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.6 | -34.5 | 176.7 | -72.5 | 170.8 | 0 | 0 | 0 | 112.5 | R221 K222 K223 T229 | R221-L225 HydrophobicContact CG-CD1 4.33Å; R221-L225 WeakPolarHBondContact O-CB 3.41Å; R221-L225 VanDerWaalsContact O-CG 3.31Å; R221-L225 WeakPolarHBondContact O-CG 3.39Å; R221-L225 PolarHBondContact O-N 2.84Å; K222-L225 PolarHBondContact O-N 3.13Å; K223-L225 PolarHBondContact O-N 3.48Å; L225-T229 WeakPolarHBondContact O-CB 3.42Å; L225-T229 PolarHBondContact O-N 3.2Å; L225-T229 PolarHBondContact O-OG1 3.4Å |
| 226 | S | 96.9 | Very high | 96.6 | Very high | 63 Ų | 63 | 98.2 Ų | 98.2 | 44% | 0.441 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.4 | -48 | 174.2 | -166.9 | 0 | 0 | 0 | 0 | 111.2 | K222 K223 Q224 D228 T229 D230 | K222-S226 PolarHBondContact O-N 3.31Å; K223-S226 VanDerWaalsContact O-CB 3.28Å; K223-S226 WeakPolarHBondContact O-CB 3.39Å; K223-S226 PolarHBondContact O-N 2.93Å; K223-S226 VanDerWaalsContact O-N 3.12Å; Q224-S226 PolarHBondContact O-N 3.34Å; S226-D228 PolarHBondContact O-N 3.02Å; S226-T229 WeakPolarHBondContact O-CB 3.21Å; S226-T229 PolarHBondContact O-N 3.46Å; S226-D230 VanDerWaalsContact O-CG 3.3Å; S226-D230 PolarHBondContact O-N 2.94Å |
| 227 | V | 97.2 | Very high | 96.6 | Very high | 72 Ų | 72 | 102 Ų | 102 | 44% | 0.436 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.2 | -44.3 | 177.7 | 174.7 | 0 | 0 | 0 | 0 | 111 | K223 Q224 T229 D230 I231 | K223-V227 PolarHBondContact O-N 3.44Å; Q224-V227 PolarHBondContact O-N 3.2Å; Q224-V227 VanDerWaalsContact O-N 3.13Å; V227-T229 VanDerWaalsContact C-N 3.27Å; V227-T229 PolarHBondContact O-N 2.87Å; V227-D230 PolarHBondContact O-N 3.22Å; V227-I231 HydrophobicContact CG1-CD1 3.92Å; V227-I231 WeakPolarHBondContact O-CG1 3.37Å; V227-I231 PolarHBondContact O-N 2.92Å |
| 228 | D | 95.6 | Very high | 96.6 | Very high | 63 Ų | 63 | 106 Ų | 106 | 34% | 0.337 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.3 | -38.9 | 177.6 | -62.8 | -17.7 | 0 | 0 | 0 | 111.2 | Q224 S226 I231 L232 | Q224-D228 PolarHBondContact NE2-OD1 2.9Å; Q224-D228 VanDerWaalsContact O-CG 3.25Å; Q224-D228 PolarHBondContact O-N 2.88Å; S226-D228 PolarHBondContact O-N 3.02Å; D228-I231 PolarHBondContact O-N 3.49Å; D228-L232 WeakPolarHBondContact O-CB 3.37Å; D228-L232 VanDerWaalsContact O-CG 3.28Å; D228-L232 WeakPolarHBondContact O-CG 3.47Å; D228-L232 PolarHBondContact O-N 3.44Å |
| 229 | T | 96.7 | Very high | 96.5 | Very high | 71 Ų | 71 | 103.9 Ų | 103.9 | 44% | 0.436 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -45.2 | 175.8 | -53.9 | 0 | 0 | 0 | 0 | 111.1 | L225 S226 V227 I231 L232 E233 | L225-T229 WeakPolarHBondContact O-CB 3.42Å; L225-T229 PolarHBondContact O-N 3.2Å; L225-T229 PolarHBondContact O-OG1 3.4Å; S226-T229 WeakPolarHBondContact O-CB 3.21Å; S226-T229 PolarHBondContact O-N 3.46Å; V227-T229 VanDerWaalsContact C-N 3.27Å; V227-T229 PolarHBondContact O-N 2.87Å; T229-I231 VanDerWaalsContact C-N 3.34Å; T229-I231 PolarHBondContact O-N 2.92Å; T229-L232 PolarHBondContact O-N 3.19Å; T229-E233 WeakPolarHBondContact O-CG 3.38Å; T229-E233 PolarHBondContact O-N 3.36Å |
| 230 | D | 96.5 | Very high | 96.4 | Very high | 93 Ų | 93 | 99.3 Ų | 99.3 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 178.2 | -65.4 | -27.2 | 0 | 0 | 0 | 111.9 | S226 V227 E233 E234 | S226-D230 VanDerWaalsContact O-CG 3.3Å; S226-D230 PolarHBondContact O-N 2.94Å; V227-D230 PolarHBondContact O-N 3.22Å; D230-E233 PolarHBondContact O-N 2.96Å; D230-E234 PolarHBondContact O-N 3.14Å |
| 231 | I | 96.8 | Very high | 96.4 | Very high | 95 Ų | 95 | 100.5 Ų | 100.5 | 49% | 0.487 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 175.8 | -67.8 | 167 | 0 | 0 | 0 | 110.2 | V227 D228 T229 E233 E234 T235 | V227-I231 HydrophobicContact CG1-CD1 3.92Å; V227-I231 WeakPolarHBondContact O-CG1 3.37Å; V227-I231 PolarHBondContact O-N 2.92Å; D228-I231 PolarHBondContact O-N 3.49Å; T229-I231 VanDerWaalsContact C-N 3.34Å; T229-I231 PolarHBondContact O-N 2.92Å; I231-E233 PolarHBondContact O-N 3.02Å; I231-E234 PolarHBondContact O-N 2.74Å; I231-T235 HydrophobicContact CG2-CG2 4.36Å; I231-T235 WeakPolarHBondContact O-CG2 3.32Å; I231-T235 PolarHBondContact O-N 3.33Å; I231-T235 PolarHBondContact O-OG1 3.38Å |
| 232 | L | 96.8 | Very high | 96.3 | Very high | 116 Ų | 116 | 93.8 Ų | 93.8 | 61% | 0.607 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.5 | -43.4 | 179.3 | -74.4 | 171.5 | 0 | 0 | 0 | 111.5 | D228 T229 E234 T235 L236 | D228-L232 WeakPolarHBondContact O-CB 3.37Å; D228-L232 VanDerWaalsContact O-CG 3.28Å; D228-L232 WeakPolarHBondContact O-CG 3.47Å; D228-L232 PolarHBondContact O-N 3.44Å; T229-L232 PolarHBondContact O-N 3.19Å; L232-E234 PolarHBondContact O-N 3Å; L232-T235 WeakPolarHBondContact CA-OG1 3.46Å; L232-T235 PolarHBondContact O-N 3.46Å; L232-T235 PolarHBondContact O-OG1 3.4Å; L232-L236 WeakPolarHBondContact O-CB 3.21Å; L232-L236 PolarHBondContact O-N 3.43Å |
| 233 | E | 96.5 | Very high | 96.2 | Very high | 89 Ų | 89 | 89.7 Ų | 89.7 | 42% | 0.416 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.2 | -44.8 | 174.9 | -75.3 | -169.6 | -173.5 | 0 | 0 | 112.4 | T229 D230 I231 L236 R237 | T229-E233 WeakPolarHBondContact O-CG 3.38Å; T229-E233 PolarHBondContact O-N 3.36Å; D230-E233 PolarHBondContact O-N 2.96Å; I231-E233 PolarHBondContact O-N 3.02Å; E233-L236 PolarHBondContact O-N 2.88Å; E233-R237 VanDerWaalsContact O-CG 3.3Å; E233-R237 WeakPolarHBondContact O-CG 3.49Å; E233-R237 PolarHBondContact O-N 3.45Å; E233-R237 IonicContact OE2-NH2 3.73Å; E233-R237 PolarHBondContact OE2-NH2 2.89Å |
| 234 | E | 96.5 | Very high | 96.1 | Very high | 56 Ų | 56 | 86.5 Ų | 86.5 | 26% | 0.262 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.6 | -38 | 180 | -178.3 | 53.9 | -153.6 | 0 | 0 | 112.1 | D230 I231 L232 R237 R238 R241 | D230-E234 PolarHBondContact O-N 3.14Å; I231-E234 PolarHBondContact O-N 2.74Å; L232-E234 PolarHBondContact O-N 3Å; E234-R237 PolarHBondContact O-N 3.25Å; E234-R238 WeakPolarHBondContact O-CG 3.42Å; E234-R238 PolarHBondContact O-N 2.92Å; E234-R238 IonicContact OE1-CZ 2.82Å; E234-R238 IonicContact OE1-NE 3.56Å; E234-R238 PolarHBondContact OE1-NE 3.29Å; E234-R238 IonicContact OE1-NH2 3.82Å; E234-R241 IonicContact OE1-NH2 3.66Å; E234-R241 PolarHBondContact OE1-NH2 2.88Å; E234-R241 VanDerWaalsContact OE1-NH2 3.09Å |
| 235 | T | 95.4 | Very high | 96 | Very high | 64 Ų | 64 | 86.5 Ų | 86.5 | 39% | 0.393 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.4 | -41.7 | 173.4 | 60.7 | 0 | 0 | 0 | 0 | 111.9 | I231 L232 R238 A239 | I231-T235 HydrophobicContact CG2-CG2 4.36Å; I231-T235 WeakPolarHBondContact O-CG2 3.32Å; I231-T235 PolarHBondContact O-N 3.33Å; I231-T235 PolarHBondContact O-OG1 3.38Å; L232-T235 WeakPolarHBondContact CA-OG1 3.46Å; L232-T235 PolarHBondContact O-N 3.46Å; L232-T235 PolarHBondContact O-OG1 3.4Å; T235-R238 PolarHBondContact O-N 2.94Å; T235-A239 WeakPolarHBondContact O-CB 3.31Å; T235-A239 PolarHBondContact O-N 2.9Å |
| 236 | L | 96.4 | Very high | 95.9 | Very high | 129 Ų | 129 | 87.3 Ų | 87.3 | 68% | 0.675 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -62.4 | -44 | 175.4 | -167.5 | 100.3 | 0 | 0 | 0 | 111.2 | L232 E233 R238 A239 A240 | L232-L236 WeakPolarHBondContact O-CB 3.21Å; L232-L236 PolarHBondContact O-N 3.43Å; E233-L236 PolarHBondContact O-N 2.88Å; L236-R238 PolarHBondContact O-N 2.86Å; L236-A239 PolarHBondContact O-N 3.4Å; L236-A240 WeakPolarHBondContact O-CB 3.36Å; L236-A240 PolarHBondContact O-N 3.31Å |
| 237 | R | 96.8 | Very high | 95.8 | Very high | 132 Ų | 132 | 90 Ų | 90 | 50% | 0.498 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 176 | -73.5 | 175.7 | -171.4 | 158 | 10.4 | 111.8 | E233 E234 A240 R241 | E233-R237 VanDerWaalsContact O-CG 3.3Å; E233-R237 WeakPolarHBondContact O-CG 3.49Å; E233-R237 PolarHBondContact O-N 3.45Å; E233-R237 IonicContact OE2-NH2 3.73Å; E233-R237 PolarHBondContact OE2-NH2 2.89Å; E234-R237 PolarHBondContact O-N 3.25Å; R237-A240 PolarHBondContact O-N 2.9Å; R237-R241 WeakPolarHBondContact O-CG 3.48Å; R237-R241 PolarHBondContact O-N 2.91Å |
| 238 | R | 95.9 | Very high | 95.7 | Very high | 147 Ų | 147 | 91.8 Ų | 91.8 | 56% | 0.555 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.5 | -45.7 | 174.9 | -73 | 172.9 | -165.8 | 165.3 | 0.4 | 111.8 | E234 T235 L236 A240 R241 A242 | E234-R238 WeakPolarHBondContact O-CG 3.42Å; E234-R238 PolarHBondContact O-N 2.92Å; E234-R238 IonicContact OE1-CZ 2.82Å; E234-R238 IonicContact OE1-NE 3.56Å; E234-R238 PolarHBondContact OE1-NE 3.29Å; E234-R238 IonicContact OE1-NH2 3.82Å; T235-R238 PolarHBondContact O-N 2.94Å; L236-R238 PolarHBondContact O-N 2.86Å; R238-A240 PolarHBondContact O-N 3.39Å; R238-R241 PolarHBondContact O-N 2.79Å; R238-A242 PolarHBondContact O-N 2.72Å |
| 239 | A | 94.8 | Very high | 95.6 | Very high | 58 Ų | 58 | 92 Ų | 92 | 48% | 0.479 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.6 | -43.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | T235 L236 R241 A242 S243 | T235-A239 WeakPolarHBondContact O-CB 3.31Å; T235-A239 PolarHBondContact O-N 2.9Å; L236-A239 PolarHBondContact O-N 3.4Å; A239-R241 PolarHBondContact O-N 3.28Å; A239-A242 PolarHBondContact O-N 2.95Å; A239-S243 WeakPolarHBondContact O-CB 3.4Å; A239-S243 PolarHBondContact O-N 2.84Å |
| 240 | A | 95.1 | Very high | 95.6 | Very high | 61 Ų | 61 | 92.8 Ų | 92.8 | 50% | 0.504 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.4 | -42 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L236 R237 R238 S243 C244 | L236-A240 WeakPolarHBondContact O-CB 3.36Å; L236-A240 PolarHBondContact O-N 3.31Å; R237-A240 PolarHBondContact O-N 2.9Å; R238-A240 PolarHBondContact O-N 3.39Å; A240-S243 PolarHBondContact O-N 2.95Å; A240-C244 WeakPolarHBondContact O-CB 3.47Å; A240-C244 PolarHBondContact O-N 3.14Å |
| 241 | R | 96.1 | Very high | 95.5 | Very high | 131 Ų | 131 | 94 Ų | 94 | 49% | 0.494 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.3 | -46.9 | 174 | -73.4 | -172.4 | -64.1 | -99.9 | 10.1 | 111.6 | E234 R237 R238 A239 C244 M245 | E234-R241 IonicContact OE1-NH2 3.66Å; E234-R241 PolarHBondContact OE1-NH2 2.88Å; E234-R241 VanDerWaalsContact OE1-NH2 3.09Å; R237-R241 WeakPolarHBondContact O-CG 3.48Å; R237-R241 PolarHBondContact O-N 2.91Å; R238-R241 PolarHBondContact O-N 2.79Å; A239-R241 PolarHBondContact O-N 3.28Å; R241-C244 PolarHBondContact O-N 2.93Å; R241-M245 WeakPolarHBondContact O-CG 3.26Å; R241-M245 PolarHBondContact O-N 3.26Å |
| 242 | A | 95.1 | Very high | 95.4 | Very high | 43 Ų | 43 | 95.6 Ų | 95.6 | 36% | 0.355 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | R238 A239 C244 M245 H246 | R238-A242 PolarHBondContact O-N 2.72Å; A239-A242 PolarHBondContact O-N 2.95Å; A242-C244 VanDerWaalsContact C-N 3.31Å; A242-C244 PolarHBondContact O-N 3.34Å; A242-M245 PolarHBondContact O-N 3.45Å; A242-H246 PolarHBondContact O-CD2 3.45Å; A242-H246 PolarHBondContact O-N 3.21Å |
| 243 | S | 94.6 | Very high | 95.3 | Very high | 76 Ų | 76 | 95.3 Ų | 95.3 | 53% | 0.531 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.1 | -39.2 | 176 | -170.7 | 0 | 0 | 0 | 0 | 112.5 | A239 A240 Q247 | A239-S243 WeakPolarHBondContact O-CB 3.4Å; A239-S243 PolarHBondContact O-N 2.84Å; A240-S243 PolarHBondContact O-N 2.95Å; S243-Q247 WeakPolarHBondContact O-CB 3.44Å; S243-Q247 PolarHBondContact O-N 2.94Å |
| 244 | C | 95 | Very high | 95.2 | Very high | 56 Ų | 56 | 94.2 Ų | 94.2 | 38% | 0.378 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.5 | -42.1 | 175.8 | -178.4 | 0 | 0 | 0 | 0 | 111.8 | A240 R241 A242 Q247 K248 | A240-C244 WeakPolarHBondContact O-CB 3.47Å; A240-C244 PolarHBondContact O-N 3.14Å; R241-C244 PolarHBondContact O-N 2.93Å; A242-C244 VanDerWaalsContact C-N 3.31Å; A242-C244 PolarHBondContact O-N 3.34Å; C244-Q247 PolarHBondContact O-N 3.07Å; C244-K248 WeakPolarHBondContact O-CG 3.22Å; C244-K248 PolarHBondContact O-N 3.42Å |
| 245 | M | 94.7 | Very high | 95.1 | Very high | 103 Ų | 103 | 92.9 Ų | 92.9 | 51% | 0.507 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.2 | -49.9 | 175.2 | -69.2 | -58.7 | -65.4 | 0 | 0 | 111.1 | R241 A242 Q247 K248 D249 | R241-M245 WeakPolarHBondContact O-CG 3.26Å; R241-M245 PolarHBondContact O-N 3.26Å; A242-M245 PolarHBondContact O-N 3.45Å; M245-Q247 VanDerWaalsContact C-N 3.27Å; M245-Q247 PolarHBondContact O-N 2.96Å; M245-K248 WeakPolarHBondContact O-CA 3.46Å; M245-K248 WeakPolarHBondContact O-CB 3.21Å; M245-K248 PolarHBondContact O-N 2.93Å; M245-D249 VanDerWaalsContact O-CG 3.28Å; M245-D249 PolarHBondContact O-N 3.21Å |
| 246 | H | 93.6 | Very high | 95.1 | Very high | 116 Ų | 116 | 95.3 Ų | 95.3 | 54% | 0.537 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.8 | -38 | 176.3 | -66.3 | -40.6 | 0 | 0 | 0 | 112.7 | A242 K248 D249 V250 | A242-H246 PolarHBondContact O-CD2 3.45Å; A242-H246 PolarHBondContact O-N 3.21Å; H246-K248 VanDerWaalsContact C-N 3.33Å; H246-K248 PolarHBondContact O-N 3.39Å; H246-D249 IonicContact ND1-OD2 2.64Å; H246-D249 PolarHBondContact O-N 3.29Å; H246-V250 WeakPolarHBondContact O-CB 3.35Å; H246-V250 VanDerWaalsContact O-CG2 3.26Å; H246-V250 WeakPolarHBondContact O-CG2 3.45Å; H246-V250 PolarHBondContact O-N 3.17Å |
| 247 | Q | 95.6 | Very high | 94.9 | Very high | 120 Ų | 120 | 93.8 Ų | 93.8 | 56% | 0.561 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.3 | -39.4 | 174.7 | -171.9 | 179.1 | 13 | 0 | 0 | 111.9 | S243 C244 M245 Q251 | S243-Q247 WeakPolarHBondContact O-CB 3.44Å; S243-Q247 PolarHBondContact O-N 2.94Å; C244-Q247 PolarHBondContact O-N 3.07Å; M245-Q247 VanDerWaalsContact C-N 3.27Å; M245-Q247 PolarHBondContact O-N 2.96Å; Q247-Q251 VanDerWaalsContact O-CG 3.29Å; Q247-Q251 WeakPolarHBondContact O-CG 3.43Å; Q247-Q251 PolarHBondContact O-N 2.89Å |
| 248 | K | 94.8 | Very high | 94.8 | Very high | 109 Ų | 109 | 93.2 Ų | 93.2 | 47% | 0.474 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 174.1 | -70.3 | 175.9 | -178.4 | 179.5 | 0 | 111.5 | C244 M245 H246 V250 Q251 Q252 | C244-K248 WeakPolarHBondContact O-CG 3.22Å; C244-K248 PolarHBondContact O-N 3.42Å; M245-K248 WeakPolarHBondContact O-CA 3.46Å; M245-K248 WeakPolarHBondContact O-CB 3.21Å; M245-K248 PolarHBondContact O-N 2.93Å; H246-K248 VanDerWaalsContact C-N 3.33Å; H246-K248 PolarHBondContact O-N 3.39Å; K248-V250 VanDerWaalsContact C-N 3.33Å; K248-V250 PolarHBondContact O-N 3.15Å; K248-Q251 WeakPolarHBondContact O-CB 3.31Å; K248-Q251 PolarHBondContact O-N 3.35Å; K248-Q252 WeakPolarHBondContact O-CG 3.43Å; K248-Q252 PolarHBondContact O-N 2.97Å |
| 249 | D | 94.8 | Very high | 94.8 | Very high | 66 Ų | 66 | 95 Ų | 95 | 35% | 0.353 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.8 | -44.9 | 177.7 | -59.2 | -21.3 | 0 | 0 | 0 | 110.6 | M245 H246 Q251 Q252 L253 | M245-D249 VanDerWaalsContact O-CG 3.28Å; M245-D249 PolarHBondContact O-N 3.21Å; H246-D249 IonicContact ND1-OD2 2.64Å; H246-D249 PolarHBondContact O-N 3.29Å; D249-Q251 VanDerWaalsContact C-N 3.33Å; D249-Q251 PolarHBondContact O-N 3.48Å; D249-Q252 PolarHBondContact O-N 3.31Å; D249-L253 WeakPolarHBondContact O-CB 3.36Å; D249-L253 WeakPolarHBondContact O-CG 3.25Å; D249-L253 PolarHBondContact O-N 3.41Å |
| 250 | V | 94.9 | Very high | 94.7 | Very high | 88 Ų | 88 | 97.9 Ų | 97.9 | 53% | 0.533 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.3 | -42.6 | 175.1 | 169.1 | 0 | 0 | 0 | 0 | 111.2 | H246 K248 T254 | H246-V250 WeakPolarHBondContact O-CB 3.35Å; H246-V250 VanDerWaalsContact O-CG2 3.26Å; H246-V250 WeakPolarHBondContact O-CG2 3.45Å; H246-V250 PolarHBondContact O-N 3.17Å; K248-V250 VanDerWaalsContact C-N 3.33Å; K248-V250 PolarHBondContact O-N 3.15Å; V250-T254 WeakPolarHBondContact O-CB 3.34Å; V250-T254 PolarHBondContact O-N 3.48Å; V250-T254 PolarHBondContact O-OG1 2.68Å |
| 251 | Q | 94.9 | Very high | 94.6 | Very high | 119 Ų | 119 | 99.6 Ų | 99.6 | 56% | 0.556 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.8 | -42 | 176.6 | -75.2 | 173 | -4.1 | 0 | 0 | 112 | Q247 K248 D249 T254 G255 | Q247-Q251 VanDerWaalsContact O-CG 3.29Å; Q247-Q251 WeakPolarHBondContact O-CG 3.43Å; Q247-Q251 PolarHBondContact O-N 2.89Å; K248-Q251 WeakPolarHBondContact O-CB 3.31Å; K248-Q251 PolarHBondContact O-N 3.35Å; D249-Q251 VanDerWaalsContact C-N 3.33Å; D249-Q251 PolarHBondContact O-N 3.48Å; Q251-T254 PolarHBondContact O-N 2.89Å; Q251-G255 PolarHBondContact O-N 2.63Å |
| 252 | Q | 94.8 | Very high | 94.5 | Very high | 128 Ų | 128 | 98.7 Ų | 98.7 | 60% | 0.598 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.2 | -51.7 | 176.8 | -73.3 | 179.1 | -2.8 | 0 | 0 | 111.5 | K248 D249 T254 G255 E256 | K248-Q252 WeakPolarHBondContact O-CG 3.43Å; K248-Q252 PolarHBondContact O-N 2.97Å; D249-Q252 PolarHBondContact O-N 3.31Å; Q252-T254 VanDerWaalsContact C-N 3.27Å; Q252-T254 PolarHBondContact O-N 3.11Å; Q252-G255 WeakPolarHBondContact O-CA 3.46Å; Q252-G255 PolarHBondContact O-N 2.98Å; Q252-E256 PolarHBondContact O-N 2.84Å |
| 253 | L | 94.3 | Very high | 94.4 | Very high | 110 Ų | 110 | 100.1 Ų | 100.1 | 58% | 0.576 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.8 | -37.9 | 178.1 | -71 | 172.8 | 0 | 0 | 0 | 112 | D249 G255 E256 L257 | D249-L253 WeakPolarHBondContact O-CB 3.36Å; D249-L253 WeakPolarHBondContact O-CG 3.25Å; D249-L253 PolarHBondContact O-N 3.41Å; L253-G255 VanDerWaalsContact C-N 3.34Å; L253-E256 PolarHBondContact O-N 2.86Å; L253-L257 WeakPolarHBondContact O-CB 3.32Å; L253-L257 PolarHBondContact O-N 3.47Å |
| 254 | T | 94.1 | Very high | 94.3 | Very high | 67 Ų | 67 | 100.7 Ų | 100.7 | 41% | 0.411 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.2 | -41.1 | 174.8 | -59.5 | 0 | 0 | 0 | 0 | 111 | V250 Q251 Q252 L257 Q258 | V250-T254 WeakPolarHBondContact O-CB 3.34Å; V250-T254 PolarHBondContact O-N 3.48Å; V250-T254 PolarHBondContact O-OG1 2.68Å; Q251-T254 PolarHBondContact O-N 2.89Å; Q252-T254 VanDerWaalsContact C-N 3.27Å; Q252-T254 PolarHBondContact O-N 3.11Å; T254-L257 PolarHBondContact O-N 3.09Å; T254-Q258 WeakPolarHBondContact O-CG 3.41Å; T254-Q258 PolarHBondContact O-N 3.36Å |
| 255 | G | 95 | Very high | 94.3 | Very high | 28 Ų | 28 | 105.7 Ų | 105.7 | 29% | 0.289 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.2 | -44.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q251 Q252 L253 Q258 R259 | Q251-G255 PolarHBondContact O-N 2.63Å; Q252-G255 WeakPolarHBondContact O-CA 3.46Å; Q252-G255 PolarHBondContact O-N 2.98Å; L253-G255 VanDerWaalsContact C-N 3.34Å; G255-Q258 PolarHBondContact O-N 2.97Å; G255-R259 WeakPolarHBondContact O-CG 3.46Å; G255-R259 PolarHBondContact O-N 3.29Å |
| 256 | E | 94.9 | Very high | 94.2 | Very high | 115 Ų | 115 | 104.9 Ų | 104.9 | 54% | 0.537 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 175.5 | -70.7 | -178.2 | 174.2 | 0 | 0 | 112 | Q252 L253 Q258 R259 L260 | Q252-E256 PolarHBondContact O-N 2.84Å; L253-E256 PolarHBondContact O-N 2.86Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 3.41Å; E256-R259 PolarHBondContact O-N 3.39Å; E256-L260 WeakPolarHBondContact O-CG 3.23Å; E256-L260 PolarHBondContact O-N 3.19Å |
| 257 | L | 93.8 | Very high | 94.1 | Very high | 96 Ų | 96 | 105.8 Ų | 105.8 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.5 | -40.1 | 177.2 | -173.9 | 136.9 | 0 | 0 | 0 | 111.9 | L253 T254 L260 Q261 | L253-L257 WeakPolarHBondContact O-CB 3.32Å; L253-L257 PolarHBondContact O-N 3.47Å; T254-L257 PolarHBondContact O-N 3.09Å; L257-L260 PolarHBondContact O-N 2.93Å; L257-Q261 HydrophobicContact CD2-CG 4.41Å; L257-Q261 WeakPolarHBondContact O-CB 3.38Å; L257-Q261 VanDerWaalsContact O-CG 3.27Å; L257-Q261 WeakPolarHBondContact O-CG 3.19Å; L257-Q261 PolarHBondContact O-N 3.32Å |
| 258 | Q | 94.9 | Very high | 94 | Very high | 120 Ų | 120 | 104.6 Ų | 104.6 | 56% | 0.561 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.6 | -41 | 173.8 | -74.4 | 175.3 | -3.2 | 0 | 0 | 112.3 | T254 G255 E256 Q261 Q262 | T254-Q258 WeakPolarHBondContact O-CG 3.41Å; T254-Q258 PolarHBondContact O-N 3.36Å; G255-Q258 PolarHBondContact O-N 2.97Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 3.41Å; Q258-Q261 PolarHBondContact O-N 3.44Å; Q258-Q262 PolarHBondContact O-N 2.99Å |
| 259 | R | 94.3 | Very high | 93.9 | Very high | 186 Ų | 186 | 104.2 Ų | 104.2 | 70% | 0.702 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.9 | -47.2 | 176 | -68.9 | 179 | 83 | 165.3 | 6.8 | 111.5 | G255 E256 Q261 Q262 D263 | G255-R259 WeakPolarHBondContact O-CG 3.46Å; G255-R259 PolarHBondContact O-N 3.29Å; E256-R259 PolarHBondContact O-N 3.39Å; R259-Q261 VanDerWaalsContact C-N 3.3Å; R259-Q261 PolarHBondContact O-N 3.16Å; R259-Q262 WeakPolarHBondContact O-CB 3.25Å; R259-Q262 PolarHBondContact O-N 2.86Å; R259-D263 PolarHBondContact O-N 2.98Å |
| 260 | L | 93.4 | Very high | 93.8 | Very high | 118 Ų | 118 | 106.3 Ų | 106.3 | 62% | 0.618 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.5 | -39.8 | 176.5 | -72.2 | 172.8 | 0 | 0 | 0 | 112.1 | E256 L257 Q262 D263 D264 | E256-L260 WeakPolarHBondContact O-CG 3.23Å; E256-L260 PolarHBondContact O-N 3.19Å; L257-L260 PolarHBondContact O-N 2.93Å; L260-Q262 VanDerWaalsContact C-N 3.31Å; L260-Q262 PolarHBondContact O-N 3.5Å; L260-D263 PolarHBondContact O-N 2.83Å; L260-D264 WeakPolarHBondContact O-CB 3.49Å; L260-D264 PolarHBondContact O-N 2.94Å |
| 261 | Q | 93.6 | Very high | 93.8 | Very high | 97 Ų | 97 | 106.9 Ų | 106.9 | 45% | 0.453 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -36.6 | 174.1 | -77.8 | 179.3 | -9.4 | 0 | 0 | 112.5 | L257 Q258 R259 R265 | L257-Q261 HydrophobicContact CD2-CG 4.41Å; L257-Q261 WeakPolarHBondContact O-CB 3.38Å; L257-Q261 VanDerWaalsContact O-CG 3.27Å; L257-Q261 WeakPolarHBondContact O-CG 3.19Å; L257-Q261 PolarHBondContact O-N 3.32Å; Q258-Q261 PolarHBondContact O-N 3.44Å; R259-Q261 VanDerWaalsContact C-N 3.3Å; R259-Q261 PolarHBondContact O-N 3.16Å; Q261-R265 VanDerWaalsContact O-CG 3.3Å; Q261-R265 WeakPolarHBondContact O-CG 3.34Å; Q261-R265 PolarHBondContact O-N 2.83Å; Q261-R265 VanDerWaalsContact O-N 3.15Å |
| 262 | Q | 93.4 | Very high | 93.7 | Very high | 111 Ų | 111 | 107.1 Ų | 107.1 | 52% | 0.519 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.7 | -46.5 | 175.5 | -174.4 | 175.9 | -17.9 | 0 | 0 | 111.2 | Q258 R259 L260 D264 R265 E266 | Q258-Q262 PolarHBondContact O-N 2.99Å; R259-Q262 WeakPolarHBondContact O-CB 3.25Å; R259-Q262 PolarHBondContact O-N 2.86Å; L260-Q262 VanDerWaalsContact C-N 3.31Å; L260-Q262 PolarHBondContact O-N 3.5Å; Q262-D264 VanDerWaalsContact C-N 3.29Å; Q262-D264 PolarHBondContact O-N 3.33Å; Q262-R265 WeakPolarHBondContact O-CB 3.3Å; Q262-R265 PolarHBondContact O-N 2.9Å; Q262-R265 VanDerWaalsContact O-N 3.16Å; Q262-E266 PolarHBondContact NE2-OE1 3.31Å; Q262-E266 WeakPolarHBondContact O-CG 3.29Å; Q262-E266 PolarHBondContact O-N 3.41Å |
| 263 | D | 92.8 | Very high | 93.6 | Very high | 74 Ų | 74 | 108.5 Ų | 108.5 | 40% | 0.396 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.2 | -40.4 | 177.1 | -70 | -4.6 | 0 | 0 | 0 | 111.7 | R259 L260 E266 K267 | R259-D263 PolarHBondContact O-N 2.98Å; L260-D263 PolarHBondContact O-N 2.83Å; D263-E266 PolarHBondContact O-N 3.48Å; D263-K267 WeakPolarHBondContact O-CB 3.3Å; D263-K267 VanDerWaalsContact O-CG 3.31Å; D263-K267 WeakPolarHBondContact O-CG 3.44Å; D263-K267 PolarHBondContact O-N 2.99Å |
| 264 | D | 93.3 | Very high | 93.5 | Very high | 88 Ų | 88 | 107 Ų | 107 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.3 | -43.3 | 176.6 | -169.1 | 57.5 | 0 | 0 | 0 | 111.6 | L260 Q262 E266 K267 Q268 | L260-D264 WeakPolarHBondContact O-CB 3.49Å; L260-D264 PolarHBondContact O-N 2.94Å; Q262-D264 VanDerWaalsContact C-N 3.29Å; Q262-D264 PolarHBondContact O-N 3.33Å; D264-E266 PolarHBondContact O-N 2.91Å; D264-K267 PolarHBondContact O-N 3.46Å; D264-Q268 WeakPolarHBondContact O-CB 3.47Å; D264-Q268 VanDerWaalsContact O-CG 3.27Å; D264-Q268 WeakPolarHBondContact O-CG 3.42Å; D264-Q268 PolarHBondContact O-N 2.97Å; D264-Q268 PolarHBondContact OD2-NE2 3.48Å |
| 265 | R | 93.9 | Very high | 93.4 | Very high | 161 Ų | 161 | 108.9 Ų | 108.9 | 61% | 0.608 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -42 | 173.8 | -73.2 | 173.8 | -177 | 177.9 | 3.4 | 112.3 | Q261 Q262 Q268 Q269 | Q261-R265 VanDerWaalsContact O-CG 3.3Å; Q261-R265 WeakPolarHBondContact O-CG 3.34Å; Q261-R265 PolarHBondContact O-N 2.83Å; Q261-R265 VanDerWaalsContact O-N 3.15Å; Q262-R265 WeakPolarHBondContact O-CB 3.3Å; Q262-R265 PolarHBondContact O-N 2.9Å; Q262-R265 VanDerWaalsContact O-N 3.16Å; R265-Q268 PolarHBondContact O-N 3.32Å; R265-Q269 WeakPolarHBondContact O-CG 3.25Å; R265-Q269 PolarHBondContact O-N 2.83Å |
| 266 | E | 93.4 | Very high | 93.3 | Very high | 85 Ų | 85 | 110.6 Ų | 110.6 | 40% | 0.397 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.9 | -43.2 | 177.8 | -73.1 | 177.6 | -166.8 | 0 | 0 | 111.2 | Q262 D263 D264 Q269 Q270 | Q262-E266 PolarHBondContact NE2-OE1 3.31Å; Q262-E266 WeakPolarHBondContact O-CG 3.29Å; Q262-E266 PolarHBondContact O-N 3.41Å; D263-E266 PolarHBondContact O-N 3.48Å; D264-E266 PolarHBondContact O-N 2.91Å; E266-Q269 PolarHBondContact O-N 3.24Å; E266-Q270 WeakPolarHBondContact O-CG 3.45Å; E266-Q270 PolarHBondContact O-N 2.93Å |
| 267 | K | 92.2 | Very high | 93.2 | Very high | 136 Ų | 136 | 111.3 Ų | 111.3 | 59% | 0.591 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.4 | -41.2 | 174.5 | -73.9 | 174.7 | -175.1 | 172.4 | 0 | 112.4 | D263 D264 Q270 L271 | D263-K267 WeakPolarHBondContact O-CB 3.3Å; D263-K267 VanDerWaalsContact O-CG 3.31Å; D263-K267 WeakPolarHBondContact O-CG 3.44Å; D263-K267 PolarHBondContact O-N 2.99Å; D264-K267 PolarHBondContact O-N 3.46Å; K267-Q270 PolarHBondContact O-N 3.09Å; K267-L271 WeakPolarHBondContact O-CB 3.44Å; K267-L271 PolarHBondContact O-N 3.04Å |
| 268 | Q | 92.8 | Very high | 93 | Very high | 94 Ų | 94 | 112.2 Ų | 112.2 | 44% | 0.439 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.1 | -46.6 | 174.6 | -74.4 | 170.3 | 8.1 | 0 | 0 | 111.1 | D264 R265 Q270 L271 E272 | D264-Q268 WeakPolarHBondContact O-CB 3.47Å; D264-Q268 VanDerWaalsContact O-CG 3.27Å; D264-Q268 WeakPolarHBondContact O-CG 3.42Å; D264-Q268 PolarHBondContact O-N 2.97Å; D264-Q268 PolarHBondContact OD2-NE2 3.48Å; R265-Q268 PolarHBondContact O-N 3.32Å; Q268-Q270 VanDerWaalsContact C-N 3.33Å; Q268-Q270 PolarHBondContact O-N 3.45Å; Q268-L271 WeakPolarHBondContact O-CB 3.34Å; Q268-L271 PolarHBondContact O-N 3.32Å; Q268-E272 WeakPolarHBondContact O-CG 3.5Å; Q268-E272 PolarHBondContact O-N 3.37Å |
| 269 | Q | 93.4 | Very high | 92.9 | Very high | 101 Ų | 101 | 109.3 Ų | 109.3 | 47% | 0.472 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.1 | -38.9 | 175.9 | -71.8 | 177.4 | 10.2 | 0 | 0 | 112.7 | R265 E266 E272 R273 | R265-Q269 WeakPolarHBondContact O-CG 3.25Å; R265-Q269 PolarHBondContact O-N 2.83Å; E266-Q269 PolarHBondContact O-N 3.24Å; Q269-E272 PolarHBondContact O-N 3.49Å; Q269-R273 VanDerWaalsContact O-CG 3.32Å; Q269-R273 WeakPolarHBondContact O-CG 3.47Å; Q269-R273 PolarHBondContact O-N 3.4Å |
| 270 | Q | 92.7 | Very high | 92.8 | Very high | 111 Ų | 111 | 102 Ų | 102 | 52% | 0.519 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 174.6 | -74 | 175.9 | 2.1 | 0 | 0 | 111.5 | E266 K267 Q268 R273 I274 | E266-Q270 WeakPolarHBondContact O-CG 3.45Å; E266-Q270 PolarHBondContact O-N 2.93Å; K267-Q270 PolarHBondContact O-N 3.09Å; Q268-Q270 VanDerWaalsContact C-N 3.33Å; Q268-Q270 PolarHBondContact O-N 3.45Å; Q270-R273 PolarHBondContact O-N 3.43Å; Q270-I274 WeakPolarHBondContact O-CG1 3.39Å; Q270-I274 PolarHBondContact O-N 2.89Å |
| 271 | L | 93.3 | Very high | 92.8 | Very high | 99 Ų | 99 | 100.1 Ų | 100.1 | 52% | 0.518 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -45 | 177 | -171.6 | 71.4 | 0 | 0 | 0 | 111.2 | K267 Q268 R273 I274 Q275 | K267-L271 WeakPolarHBondContact O-CB 3.44Å; K267-L271 PolarHBondContact O-N 3.04Å; Q268-L271 WeakPolarHBondContact O-CB 3.34Å; Q268-L271 PolarHBondContact O-N 3.32Å; L271-R273 PolarHBondContact O-N 2.95Å; L271-I274 PolarHBondContact O-N 3.14Å; L271-Q275 WeakPolarHBondContact O-CB 3.43Å; L271-Q275 VanDerWaalsContact O-CG 3.3Å; L271-Q275 WeakPolarHBondContact O-CG 3.11Å; L271-Q275 PolarHBondContact O-N 2.94Å |
| 272 | E | 93.3 | Very high | 92.7 | Very high | 124 Ų | 124 | 100.4 Ų | 100.4 | 58% | 0.579 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.8 | -42 | 175.9 | -73 | 175.1 | 175.3 | 0 | 0 | 112.1 | Q268 Q269 Q275 A276 | Q268-E272 WeakPolarHBondContact O-CG 3.5Å; Q268-E272 PolarHBondContact O-N 3.37Å; Q269-E272 PolarHBondContact O-N 3.49Å; E272-Q275 PolarHBondContact O-N 2.87Å; E272-A276 WeakPolarHBondContact O-CB 3.46Å; E272-A276 PolarHBondContact O-N 2.84Å |
| 273 | R | 93.1 | Very high | 92.7 | Very high | 158 Ų | 158 | 97.7 Ų | 97.7 | 60% | 0.596 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.4 | -47.2 | 175.2 | -73.8 | 175.2 | -171.4 | 178.4 | 5.5 | 111.8 | Q269 Q270 L271 Q275 A276 E277 | Q269-R273 VanDerWaalsContact O-CG 3.32Å; Q269-R273 WeakPolarHBondContact O-CG 3.47Å; Q269-R273 PolarHBondContact O-N 3.4Å; Q270-R273 PolarHBondContact O-N 3.43Å; L271-R273 PolarHBondContact O-N 2.95Å; R273-Q275 VanDerWaalsContact C-N 3.31Å; R273-Q275 PolarHBondContact O-N 2.82Å; R273-A276 PolarHBondContact O-N 2.92Å; R273-E277 WeakPolarHBondContact O-CG 3.36Å; R273-E277 PolarHBondContact O-N 3.29Å |
| 274 | I | 92.8 | Very high | 92.6 | Very high | 79 Ų | 79 | 99.2 Ų | 99.2 | 41% | 0.405 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 178 | -68.5 | 168.3 | 0 | 0 | 0 | 110.5 | Q270 L271 A276 E277 Q278 | Q270-I274 WeakPolarHBondContact O-CG1 3.39Å; Q270-I274 PolarHBondContact O-N 2.89Å; L271-I274 PolarHBondContact O-N 3.14Å; I274-A276 VanDerWaalsContact C-N 3.34Å; I274-A276 PolarHBondContact O-N 3.49Å; I274-E277 PolarHBondContact O-N 3.37Å; I274-Q278 HydrophobicContact CG2-CG 4.35Å; I274-Q278 WeakPolarHBondContact O-CB 3.35Å; I274-Q278 VanDerWaalsContact O-CG 3.26Å; I274-Q278 WeakPolarHBondContact O-CG 3.36Å; I274-Q278 PolarHBondContact O-N 3.41Å |
| 275 | Q | 92.1 | Very high | 92.4 | Very high | 105 Ų | 105 | 99.7 Ų | 99.7 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 175.8 | -74.4 | 175.1 | -1 | 0 | 0 | 111.9 | L271 E272 R273 Q278 A279 | L271-Q275 WeakPolarHBondContact O-CB 3.43Å; L271-Q275 VanDerWaalsContact O-CG 3.3Å; L271-Q275 WeakPolarHBondContact O-CG 3.11Å; L271-Q275 PolarHBondContact O-N 2.94Å; E272-Q275 PolarHBondContact O-N 2.87Å; R273-Q275 VanDerWaalsContact C-N 3.31Å; R273-Q275 PolarHBondContact O-N 2.82Å; Q275-Q278 PolarHBondContact O-N 3.02Å; Q275-A279 WeakPolarHBondContact O-CB 3.29Å; Q275-A279 PolarHBondContact O-N 3.45Å |
| 276 | A | 92.2 | Very high | 92.3 | Very high | 65 Ų | 65 | 98.2 Ų | 98.2 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | E272 R273 I274 A279 G280 | E272-A276 WeakPolarHBondContact O-CB 3.46Å; E272-A276 PolarHBondContact O-N 2.84Å; R273-A276 PolarHBondContact O-N 2.92Å; I274-A276 VanDerWaalsContact C-N 3.34Å; I274-A276 PolarHBondContact O-N 3.49Å; A276-A279 PolarHBondContact O-N 3.17Å; A276-G280 PolarHBondContact O-N 3.48Å |
| 277 | E | 92.6 | Very high | 92.1 | Very high | 129 Ų | 129 | 96.6 Ų | 96.6 | 60% | 0.603 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.5 | -45.2 | 174 | -73.4 | 172.5 | -173.8 | 0 | 0 | 111.5 | R273 I274 A279 G280 V281 | R273-E277 WeakPolarHBondContact O-CG 3.36Å; R273-E277 PolarHBondContact O-N 3.29Å; I274-E277 PolarHBondContact O-N 3.37Å; E277-A279 VanDerWaalsContact C-N 3.35Å; E277-A279 PolarHBondContact O-N 2.91Å; E277-G280 PolarHBondContact O-N 3.43Å; E277-V281 WeakPolarHBondContact O-CG2 3.43Å; E277-V281 PolarHBondContact O-N 3.37Å |
| 278 | Q | 89.6 | Confident | 92.1 | Very high | 116 Ų | 116 | 95.3 Ų | 95.3 | 54% | 0.542 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.8 | -44.1 | 175.2 | -75.5 | 176 | 4.3 | 0 | 0 | 111.7 | I274 Q275 G280 V281 L282 | I274-Q278 HydrophobicContact CG2-CG 4.35Å; I274-Q278 WeakPolarHBondContact O-CB 3.35Å; I274-Q278 VanDerWaalsContact O-CG 3.26Å; I274-Q278 WeakPolarHBondContact O-CG 3.36Å; I274-Q278 PolarHBondContact O-N 3.41Å; Q275-Q278 PolarHBondContact O-N 3.02Å; Q278-G280 VanDerWaalsContact C-N 3.33Å; Q278-G280 PolarHBondContact O-N 2.87Å; Q278-V281 PolarHBondContact O-N 3.41Å; Q278-L282 WeakPolarHBondContact O-CG 3.43Å; Q278-L282 PolarHBondContact O-N 3.24Å |
| 279 | A | 91.9 | Very high | 92 | Very high | 59 Ų | 59 | 99.2 Ų | 99.2 | 49% | 0.488 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.5 | -40.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q275 A276 E277 L282 A283 | Q275-A279 WeakPolarHBondContact O-CB 3.29Å; Q275-A279 PolarHBondContact O-N 3.45Å; A276-A279 PolarHBondContact O-N 3.17Å; E277-A279 VanDerWaalsContact C-N 3.35Å; E277-A279 PolarHBondContact O-N 2.91Å; A279-L282 PolarHBondContact O-N 2.87Å; A279-A283 PolarHBondContact O-N 2.98Å |
| 280 | G | 93.3 | Very high | 91.8 | Very high | 33 Ų | 33 | 97.6 Ų | 97.6 | 34% | 0.34 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61 | -49 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | A276 E277 Q278 L282 A283 D284 | A276-G280 PolarHBondContact O-N 3.48Å; E277-G280 PolarHBondContact O-N 3.43Å; Q278-G280 VanDerWaalsContact C-N 3.33Å; Q278-G280 PolarHBondContact O-N 2.87Å; G280-L282 VanDerWaalsContact C-N 3.3Å; G280-L282 PolarHBondContact O-N 2.96Å; G280-A283 WeakPolarHBondContact O-CB 3.32Å; G280-A283 PolarHBondContact O-N 3.4Å; G280-A283 VanDerWaalsContact O-N 3.14Å; G280-D284 PolarHBondContact O-N 3.13Å |
| 281 | V | 92.6 | Very high | 91.7 | Very high | 78 Ų | 78 | 97.4 Ų | 97.4 | 47% | 0.473 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.9 | -39.3 | 177.4 | 171.7 | 0 | 0 | 0 | 0 | 111.7 | E277 Q278 D284 M285 | E277-V281 WeakPolarHBondContact O-CG2 3.43Å; E277-V281 PolarHBondContact O-N 3.37Å; Q278-V281 PolarHBondContact O-N 3.41Å; V281-D284 PolarHBondContact O-N 3.01Å; V281-M285 HydrophobicContact CG1-CE 3.96Å; V281-M285 WeakPolarHBondContact O-CB 3.47Å; V281-M285 WeakPolarHBondContact O-CG 3.39Å; V281-M285 PolarHBondContact O-N 3.44Å |
| 282 | L | 92.9 | Very high | 91.3 | Very high | 103 Ų | 103 | 96 Ų | 96 | 54% | 0.539 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.2 | -74.2 | 171.3 | 0 | 0 | 0 | 111.6 | Q278 A279 G280 M285 E286 | Q278-L282 WeakPolarHBondContact O-CG 3.43Å; Q278-L282 PolarHBondContact O-N 3.24Å; A279-L282 PolarHBondContact O-N 2.87Å; G280-L282 VanDerWaalsContact C-N 3.3Å; G280-L282 PolarHBondContact O-N 2.96Å; L282-M285 PolarHBondContact O-N 2.79Å; L282-E286 WeakPolarHBondContact O-CG 3.29Å; L282-E286 PolarHBondContact O-N 3.07Å |
| 283 | A | 92.3 | Very high | 91 | Very high | 53 Ų | 53 | 94.1 Ų | 94.1 | 44% | 0.438 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A279 G280 E286 A287 | A279-A283 PolarHBondContact O-N 2.98Å; G280-A283 WeakPolarHBondContact O-CB 3.32Å; G280-A283 PolarHBondContact O-N 3.4Å; G280-A283 VanDerWaalsContact O-N 3.14Å; A283-E286 PolarHBondContact O-N 3.38Å; A283-A287 WeakPolarHBondContact O-CB 3.45Å; A283-A287 PolarHBondContact O-N 2.83Å |
| 284 | D | 91.4 | Very high | 90.9 | Very high | 106 Ų | 106 | 89.9 Ų | 89.9 | 57% | 0.567 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -41.5 | 175.5 | -71.5 | -17.8 | 0 | 0 | 0 | 111.7 | G280 V281 E286 A287 L288 | G280-D284 PolarHBondContact O-N 3.13Å; V281-D284 PolarHBondContact O-N 3.01Å; D284-E286 VanDerWaalsContact C-N 3.34Å; D284-E286 PolarHBondContact O-N 3.42Å; D284-A287 PolarHBondContact O-N 2.82Å; D284-L288 WeakPolarHBondContact O-CB 3.19Å; D284-L288 WeakPolarHBondContact O-CG 3.3Å; D284-L288 PolarHBondContact O-N 3.49Å |
| 285 | M | 88.4 | Confident | 90.7 | Very high | 98 Ų | 98 | 91 Ų | 91 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.5 | -40.7 | 174.6 | -77.2 | -166.1 | -172.4 | 0 | 0 | 112.1 | V281 L282 R289 | V281-M285 HydrophobicContact CG1-CE 3.96Å; V281-M285 WeakPolarHBondContact O-CB 3.47Å; V281-M285 WeakPolarHBondContact O-CG 3.39Å; V281-M285 PolarHBondContact O-N 3.44Å; L282-M285 PolarHBondContact O-N 2.79Å; M285-R289 WeakPolarHBondContact O-CB 3.35Å; M285-R289 VanDerWaalsContact O-CG 3.26Å; M285-R289 WeakPolarHBondContact O-CG 3.41Å; M285-R289 PolarHBondContact O-N 3.17Å |
| 286 | E | 91.2 | Very high | 90.6 | Very high | 130 Ų | 130 | 89.7 Ų | 89.7 | 61% | 0.607 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66.3 | -42.1 | 175.9 | -73.7 | 178.5 | 177.9 | 0 | 0 | 111.8 | L282 A283 D284 R289 S290 | L282-E286 WeakPolarHBondContact O-CG 3.29Å; L282-E286 PolarHBondContact O-N 3.07Å; A283-E286 PolarHBondContact O-N 3.38Å; D284-E286 VanDerWaalsContact C-N 3.34Å; D284-E286 PolarHBondContact O-N 3.42Å; E286-R289 WeakPolarHBondContact O-CB 3.44Å; E286-R289 PolarHBondContact O-N 3.11Å; E286-S290 PolarHBondContact O-N 2.9Å |
| 287 | A | 91.2 | Very high | 90.5 | Very high | 51 Ų | 51 | 92.2 Ų | 92.2 | 42% | 0.421 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.4 | -50.8 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | A283 D284 R289 S290 E291 | A283-A287 WeakPolarHBondContact O-CB 3.45Å; A283-A287 PolarHBondContact O-N 2.83Å; D284-A287 PolarHBondContact O-N 2.82Å; A287-R289 VanDerWaalsContact C-N 3.3Å; A287-R289 PolarHBondContact O-N 3.19Å; A287-S290 PolarHBondContact O-N 3.28Å; A287-S290 VanDerWaalsContact O-N 3.11Å; A287-S290 PolarHBondContact O-OG 2.87Å; A287-E291 PolarHBondContact O-N 3.49Å |
| 288 | L | 90.9 | Very high | 90.3 | Very high | 110 Ų | 110 | 90.5 Ų | 90.5 | 58% | 0.576 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.7 | -37.5 | 176.2 | -73.9 | 171.4 | 0 | 0 | 0 | 112.5 | D284 E291 S292 | D284-L288 WeakPolarHBondContact O-CB 3.19Å; D284-L288 WeakPolarHBondContact O-CG 3.3Å; D284-L288 PolarHBondContact O-N 3.49Å; L288-E291 PolarHBondContact O-N 3Å; L288-S292 VanDerWaalsContact O-CB 3.32Å; L288-S292 WeakPolarHBondContact O-CB 3.4Å; L288-S292 PolarHBondContact O-N 2.83Å |
| 289 | R | 90.5 | Very high | 90.2 | Very high | 175 Ų | 175 | 94 Ų | 94 | 66% | 0.66 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.5 | -46.4 | 173.3 | -80.1 | 174.7 | 180 | 177.6 | 3.3 | 111 | M285 E286 A287 S292 T293 | M285-R289 WeakPolarHBondContact O-CB 3.35Å; M285-R289 VanDerWaalsContact O-CG 3.26Å; M285-R289 WeakPolarHBondContact O-CG 3.41Å; M285-R289 PolarHBondContact O-N 3.17Å; E286-R289 WeakPolarHBondContact O-CB 3.44Å; E286-R289 PolarHBondContact O-N 3.11Å; A287-R289 VanDerWaalsContact C-N 3.3Å; A287-R289 PolarHBondContact O-N 3.19Å; R289-S292 PolarHBondContact O-N 3.35Å; R289-T293 WeakPolarHBondContact O-CG2 3.38Å; R289-T293 PolarHBondContact O-N 2.77Å |
| 290 | S | 89.2 | Confident | 90 | Very high | 67 Ų | 67 | 94 Ų | 94 | 47% | 0.469 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 177.5 | 73.4 | 0 | 0 | 0 | 0 | 112.1 | E286 A287 S292 T293 T294 | E286-S290 PolarHBondContact O-N 2.9Å; A287-S290 PolarHBondContact O-N 3.28Å; A287-S290 VanDerWaalsContact O-N 3.11Å; A287-S290 PolarHBondContact O-OG 2.87Å; S290-S292 PolarHBondContact O-N 3.47Å; S290-T293 WeakPolarHBondContact CA-OG1 3.29Å; S290-T293 PolarHBondContact O-N 2.94Å; S290-T293 VanDerWaalsContact O-N 3.15Å; S290-T293 PolarHBondContact O-OG1 2.94Å; S290-T294 PolarHBondContact O-N 2.96Å |
| 291 | E | 90.7 | Very high | 89.7 | Confident | 108 Ų | 108 | 94.6 Ų | 94.6 | 51% | 0.505 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.1 | -39.3 | 176 | -171.2 | 178.9 | -170.1 | 0 | 0 | 111.7 | A287 L288 T293 T294 L295 | A287-E291 PolarHBondContact O-N 3.49Å; L288-E291 PolarHBondContact O-N 3Å; E291-T293 VanDerWaalsContact C-N 3.3Å; E291-T293 PolarHBondContact O-N 3.49Å; E291-T294 WeakPolarHBondContact CA-OG1 3.31Å; E291-T294 PolarHBondContact O-N 2.69Å; E291-T294 PolarHBondContact O-OG1 3.4Å; E291-L295 HydrophobicContact CG-CD1 4.31Å; E291-L295 WeakPolarHBondContact O-CB 3.33Å; E291-L295 VanDerWaalsContact O-CG 3.29Å; E291-L295 WeakPolarHBondContact O-CG 3.33Å; E291-L295 PolarHBondContact O-N 3.39Å |
| 292 | S | 84.6 | Confident | 89.5 | Confident | 69 Ų | 69 | 96.2 Ų | 96.2 | 48% | 0.483 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.4 | -40.7 | 173 | -170.8 | 0 | 0 | 0 | 0 | 111.5 | L288 R289 S290 L295 V296 | L288-S292 VanDerWaalsContact O-CB 3.32Å; L288-S292 WeakPolarHBondContact O-CB 3.4Å; L288-S292 PolarHBondContact O-N 2.83Å; R289-S292 PolarHBondContact O-N 3.35Å; S290-S292 PolarHBondContact O-N 3.47Å; S292-L295 PolarHBondContact O-N 3.08Å; S292-V296 WeakPolarHBondContact O-CB 3.45Å; S292-V296 VanDerWaalsContact O-CG2 3.25Å; S292-V296 WeakPolarHBondContact O-CG2 3.38Å; S292-V296 PolarHBondContact O-N 2.96Å |
| 293 | T | 88.6 | Confident | 89.1 | Confident | 85 Ų | 85 | 94.6 Ų | 94.6 | 52% | 0.521 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 176.4 | 60 | 0 | 0 | 0 | 0 | 112.7 | R289 S290 E291 V296 L297 | R289-T293 WeakPolarHBondContact O-CG2 3.38Å; R289-T293 PolarHBondContact O-N 2.77Å; S290-T293 WeakPolarHBondContact CA-OG1 3.29Å; S290-T293 PolarHBondContact O-N 2.94Å; S290-T293 VanDerWaalsContact O-N 3.15Å; S290-T293 PolarHBondContact O-OG1 2.94Å; E291-T293 VanDerWaalsContact C-N 3.3Å; E291-T293 PolarHBondContact O-N 3.49Å; T293-V296 PolarHBondContact O-N 3.3Å; T293-L297 WeakPolarHBondContact O-CG 3.32Å; T293-L297 PolarHBondContact O-N 2.82Å |
| 294 | T | 89 | Confident | 88.8 | Confident | 68 Ų | 68 | 94 Ų | 94 | 42% | 0.417 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.9 | -44.7 | 176.5 | 55.5 | 0 | 0 | 0 | 0 | 111 | S290 E291 V296 L297 D298 | S290-T294 PolarHBondContact O-N 2.96Å; E291-T294 WeakPolarHBondContact CA-OG1 3.31Å; E291-T294 PolarHBondContact O-N 2.69Å; E291-T294 PolarHBondContact O-OG1 3.4Å; T294-V296 VanDerWaalsContact C-N 3.29Å; T294-V296 PolarHBondContact O-N 3.18Å; T294-L297 WeakPolarHBondContact O-CB 3.25Å; T294-L297 PolarHBondContact O-N 3.44Å; T294-L297 VanDerWaalsContact O-N 3.09Å; T294-D298 PolarHBondContact O-N 3.36Å |
| 295 | L | 89.2 | Confident | 88.7 | Confident | 102 Ų | 102 | 93.9 Ų | 93.9 | 53% | 0.534 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.6 | -37 | 175.9 | -71.6 | 173.7 | 0 | 0 | 0 | 112.8 | E291 S292 R299 | E291-L295 HydrophobicContact CG-CD1 4.31Å; E291-L295 WeakPolarHBondContact O-CB 3.33Å; E291-L295 VanDerWaalsContact O-CG 3.29Å; E291-L295 WeakPolarHBondContact O-CG 3.33Å; E291-L295 PolarHBondContact O-N 3.39Å; S292-L295 PolarHBondContact O-N 3.08Å; L295-R299 VanDerWaalsContact O-CB 3.3Å; L295-R299 WeakPolarHBondContact O-CB 3.41Å; L295-R299 PolarHBondContact O-N 2.87Å |
| 296 | V | 89.6 | Confident | 88.4 | Confident | 79 Ų | 79 | 96.6 Ų | 96.6 | 48% | 0.479 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.5 | -42.6 | 174.4 | 168.1 | 0 | 0 | 0 | 0 | 111.2 | S292 T293 T294 R299 A300 | S292-V296 WeakPolarHBondContact O-CB 3.45Å; S292-V296 VanDerWaalsContact O-CG2 3.25Å; S292-V296 WeakPolarHBondContact O-CG2 3.38Å; S292-V296 PolarHBondContact O-N 2.96Å; T293-V296 PolarHBondContact O-N 3.3Å; T294-V296 VanDerWaalsContact C-N 3.29Å; T294-V296 PolarHBondContact O-N 3.18Å; V296-R299 PolarHBondContact O-N 3.02Å; V296-A300 WeakPolarHBondContact O-CB 3.49Å; V296-A300 PolarHBondContact O-N 3.34Å |
| 297 | L | 90.7 | Very high | 87.9 | Confident | 118 Ų | 118 | 93.4 Ų | 93.4 | 62% | 0.618 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.8 | -44.5 | 175.8 | -70.2 | 171.9 | 0 | 0 | 0 | 111.5 | T293 T294 R299 A300 A301 | T293-L297 WeakPolarHBondContact O-CG 3.32Å; T293-L297 PolarHBondContact O-N 2.82Å; T294-L297 WeakPolarHBondContact O-CB 3.25Å; T294-L297 PolarHBondContact O-N 3.44Å; T294-L297 VanDerWaalsContact O-N 3.09Å; L297-R299 PolarHBondContact O-N 3.46Å; L297-A300 WeakPolarHBondContact O-CB 3.41Å; L297-A300 PolarHBondContact O-N 3.33Å; L297-A301 PolarHBondContact O-N 3.38Å |
| 298 | D | 88.6 | Confident | 87.6 | Confident | 93 Ų | 93 | 98.2 Ų | 98.2 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.8 | -42.9 | 177.2 | -71.2 | -16.2 | 0 | 0 | 0 | 111.3 | T294 A300 A301 L302 | T294-D298 PolarHBondContact O-N 3.36Å; D298-A300 VanDerWaalsContact C-N 3.3Å; D298-A300 PolarHBondContact O-N 3.42Å; D298-A301 PolarHBondContact O-N 2.82Å; D298-L302 WeakPolarHBondContact O-CB 3.49Å; D298-L302 WeakPolarHBondContact O-CG 3.07Å; D298-L302 PolarHBondContact O-N 3.47Å |
| 299 | R | 87.4 | Confident | 87.2 | Confident | 189 Ų | 189 | 95.4 Ų | 95.4 | 71% | 0.713 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.1 | -40.3 | 174.6 | -167.7 | 179.4 | 78.9 | 169 | 3.3 | 111.6 | L295 V296 L297 S303 | L295-R299 VanDerWaalsContact O-CB 3.3Å; L295-R299 WeakPolarHBondContact O-CB 3.41Å; L295-R299 PolarHBondContact O-N 2.87Å; V296-R299 PolarHBondContact O-N 3.02Å; L297-R299 PolarHBondContact O-N 3.46Å; R299-S303 VanDerWaalsContact O-CB 3.29Å; R299-S303 WeakPolarHBondContact O-CB 3.41Å; R299-S303 PolarHBondContact O-N 2.89Å |
| 300 | A | 86.8 | Confident | 87 | Confident | 58 Ų | 58 | 93.8 Ų | 93.8 | 48% | 0.479 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.2 | -42.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V296 L297 D298 S303 A304 | V296-A300 WeakPolarHBondContact O-CB 3.49Å; V296-A300 PolarHBondContact O-N 3.34Å; L297-A300 WeakPolarHBondContact O-CB 3.41Å; L297-A300 PolarHBondContact O-N 3.33Å; D298-A300 VanDerWaalsContact C-N 3.3Å; D298-A300 PolarHBondContact O-N 3.42Å; A300-S303 PolarHBondContact O-N 3.04Å; A300-A304 WeakPolarHBondContact O-CB 3.37Å; A300-A304 PolarHBondContact O-N 3.29Å |
| 301 | A | 87.5 | Confident | 86.4 | Confident | 47 Ų | 47 | 93.3 Ų | 93.3 | 39% | 0.388 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62 | -50.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L297 D298 S303 A304 E305 | L297-A301 PolarHBondContact O-N 3.38Å; D298-A301 PolarHBondContact O-N 2.82Å; A301-S303 VanDerWaalsContact C-N 3.32Å; A301-S303 PolarHBondContact O-N 2.9Å; A301-A304 WeakPolarHBondContact O-CA 3.15Å; A301-A304 WeakPolarHBondContact O-CB 3.27Å; A301-A304 PolarHBondContact O-N 2.92Å; A301-E305 PolarHBondContact O-N 2.91Å |
| 302 | L | 88.2 | Confident | 86.1 | Confident | 111 Ų | 111 | 93.5 Ų | 93.5 | 58% | 0.581 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.2 | -40.3 | 176.3 | -75.3 | 170.3 | 0 | 0 | 0 | 112.2 | D298 A304 E305 W306 | D298-L302 WeakPolarHBondContact O-CB 3.49Å; D298-L302 WeakPolarHBondContact O-CG 3.07Å; D298-L302 PolarHBondContact O-N 3.47Å; L302-A304 VanDerWaalsContact C-N 3.32Å; L302-A304 PolarHBondContact O-N 3.27Å; L302-E305 PolarHBondContact O-N 2.96Å; L302-W306 WeakPolarHBondContact O-CB 3.43Å; L302-W306 PolarHBondContact O-N 3.35Å |
| 303 | S | 86.1 | Confident | 85.8 | Confident | 70 Ų | 70 | 98.9 Ų | 98.9 | 49% | 0.49 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.7 | -39.5 | 174.1 | -179.6 | 0 | 0 | 0 | 0 | 111.9 | R299 A300 A301 S307 | R299-S303 VanDerWaalsContact O-CB 3.29Å; R299-S303 WeakPolarHBondContact O-CB 3.41Å; R299-S303 PolarHBondContact O-N 2.89Å; A300-S303 PolarHBondContact O-N 3.04Å; A301-S303 VanDerWaalsContact C-N 3.32Å; A301-S303 PolarHBondContact O-N 2.9Å; S303-S307 WeakPolarHBondContact O-CB 3.22Å; S303-S307 PolarHBondContact O-N 3.42Å; S303-S307 PolarHBondContact O-OG 2.89Å |
| 304 | A | 85.7 | Confident | 85.3 | Confident | 40 Ų | 40 | 98.8 Ų | 98.8 | 33% | 0.331 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68 | -40 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A300 A301 L302 S307 R308 | A300-A304 WeakPolarHBondContact O-CB 3.37Å; A300-A304 PolarHBondContact O-N 3.29Å; A301-A304 WeakPolarHBondContact O-CA 3.15Å; A301-A304 WeakPolarHBondContact O-CB 3.27Å; A301-A304 PolarHBondContact O-N 2.92Å; L302-A304 VanDerWaalsContact C-N 3.32Å; L302-A304 PolarHBondContact O-N 3.27Å; A304-S307 PolarHBondContact O-N 2.92Å; A304-R308 WeakPolarHBondContact O-CG 3.46Å; A304-R308 PolarHBondContact O-N 3.5Å |
| 305 | E | 88.3 | Confident | 84.9 | Confident | 103 Ų | 103 | 100.7 Ų | 100.7 | 48% | 0.481 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.4 | -46.3 | 173.2 | -72.9 | -178.3 | 176.5 | 0 | 0 | 111.9 | A301 L302 S307 R308 S309 | A301-E305 PolarHBondContact O-N 2.91Å; L302-E305 PolarHBondContact O-N 2.96Å; E305-S307 VanDerWaalsContact C-N 3.29Å; E305-S307 PolarHBondContact O-N 2.86Å; E305-R308 CarbonylContact O-C 3.6Å; E305-R308 WeakPolarHBondContact O-CA 3.42Å; E305-R308 WeakPolarHBondContact O-CB 3.5Å; E305-R308 PolarHBondContact O-N 3.48Å; E305-R308 VanDerWaalsContact O-N 3.08Å; E305-S309 PolarHBondContact O-N 3.39Å; E305-S309 PolarHBondContact O-OG 2.85Å |
| 306 | W | 81.7 | Confident | 84.4 | Confident | 155 Ų | 155 | 100.6 Ų | 100.6 | 59% | 0.587 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.2 | -41.2 | 176.6 | -171.1 | 89.9 | 0 | 0 | 0 | 111.6 | L302 S309 R310 | L302-W306 WeakPolarHBondContact O-CB 3.43Å; L302-W306 PolarHBondContact O-N 3.35Å; W306-S309 PolarHBondContact O-N 3.09Å; W306-R310 VanDerWaalsContact CH2-NH1 3.33Å; W306-R310 WeakPolarHBondContact O-CB 3.34Å; W306-R310 PolarHBondContact O-N 3.47Å |
| 307 | S | 81.3 | Confident | 83.8 | Confident | 63 Ų | 63 | 101.9 Ų | 101.9 | 44% | 0.441 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 174.2 | -60.1 | 0 | 0 | 0 | 0 | 111.9 | S303 A304 E305 S311 | S303-S307 WeakPolarHBondContact O-CB 3.22Å; S303-S307 PolarHBondContact O-N 3.42Å; S303-S307 PolarHBondContact O-OG 2.89Å; A304-S307 PolarHBondContact O-N 2.92Å; E305-S307 VanDerWaalsContact C-N 3.29Å; E305-S307 PolarHBondContact O-N 2.86Å; S307-S311 WeakPolarHBondContact O-CB 3.33Å; S307-S311 PolarHBondContact O-N 3.3Å |
| 308 | R | 84.9 | Confident | 83.2 | Confident | 152 Ų | 152 | 100.8 Ų | 100.8 | 57% | 0.574 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.4 | -53.8 | 173.5 | -79.5 | -177.1 | -101.4 | 178.9 | -4.4 | 111.7 | A304 E305 R310 S311 E312 | A304-R308 WeakPolarHBondContact O-CG 3.46Å; A304-R308 PolarHBondContact O-N 3.5Å; E305-R308 CarbonylContact O-C 3.6Å; E305-R308 WeakPolarHBondContact O-CA 3.42Å; E305-R308 WeakPolarHBondContact O-CB 3.5Å; E305-R308 PolarHBondContact O-N 3.48Å; E305-R308 VanDerWaalsContact O-N 3.08Å; R308-R310 VanDerWaalsContact C-N 3.27Å; R308-R310 PolarHBondContact O-N 3.42Å; R308-S311 WeakPolarHBondContact O-CB 3.44Å; R308-S311 PolarHBondContact O-N 3.46Å; R308-S311 VanDerWaalsContact O-N 3.09Å; R308-E312 WeakPolarHBondContact O-CG 3.29Å; R308-E312 PolarHBondContact O-N 3.49Å |
| 309 | S | 83.2 | Confident | 82.7 | Confident | 52 Ų | 52 | 102.7 Ų | 102.7 | 36% | 0.364 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.6 | -34.7 | 178.3 | -62.8 | 0 | 0 | 0 | 0 | 112.7 | E305 W306 E312 R313 | E305-S309 PolarHBondContact O-N 3.39Å; E305-S309 PolarHBondContact O-OG 2.85Å; W306-S309 PolarHBondContact O-N 3.09Å; S309-E312 PolarHBondContact O-N 2.82Å; S309-R313 WeakPolarHBondContact O-CB 3.48Å; S309-R313 WeakPolarHBondContact O-CG 3.38Å; S309-R313 PolarHBondContact O-N 2.85Å |
| 310 | R | 85.1 | Confident | 82.3 | Confident | 140 Ų | 140 | 99.1 Ų | 99.1 | 53% | 0.528 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.1 | -44.3 | 173.3 | -174.4 | 175.6 | -175.5 | -177.3 | 0.7 | 111.5 | W306 R308 R313 N314 | W306-R310 VanDerWaalsContact CH2-NH1 3.33Å; W306-R310 WeakPolarHBondContact O-CB 3.34Å; W306-R310 PolarHBondContact O-N 3.47Å; R308-R310 VanDerWaalsContact C-N 3.27Å; R308-R310 PolarHBondContact O-N 3.42Å; R310-R313 PolarHBondContact O-N 3.16Å; R310-N314 WeakPolarHBondContact O-CB 3.37Å; R310-N314 VanDerWaalsContact O-CG 3.22Å; R310-N314 PolarHBondContact O-N 3.33Å |
| 311 | S | 77.5 | Confident | 81.8 | Confident | 58 Ų | 58 | 104.4 Ų | 104.4 | 41% | 0.406 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.3 | -46.6 | 173.6 | -177.5 | 0 | 0 | 0 | 0 | 111.3 | S307 R308 R313 N314 Q315 | S307-S311 WeakPolarHBondContact O-CB 3.33Å; S307-S311 PolarHBondContact O-N 3.3Å; R308-S311 WeakPolarHBondContact O-CB 3.44Å; R308-S311 PolarHBondContact O-N 3.46Å; R308-S311 VanDerWaalsContact O-N 3.09Å; S311-R313 PolarHBondContact O-N 3.25Å; S311-N314 WeakPolarHBondContact O-CB 3.38Å; S311-N314 PolarHBondContact O-N 3.49Å; S311-Q315 WeakPolarHBondContact O-CG 3.36Å; S311-Q315 PolarHBondContact O-N 3.31Å |
| 312 | E | 83.5 | Confident | 81.2 | Confident | 112 Ų | 112 | 107.4 Ų | 107.4 | 52% | 0.523 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.4 | -44.7 | 176.8 | -72.7 | 173 | 179.3 | 0 | 0 | 112.6 | R308 S309 N314 Q315 L316 | R308-E312 WeakPolarHBondContact O-CG 3.29Å; R308-E312 PolarHBondContact O-N 3.49Å; S309-E312 PolarHBondContact O-N 2.82Å; E312-N314 PolarHBondContact O-N 3.5Å; E312-Q315 PolarHBondContact O-N 2.91Å; E312-L316 WeakPolarHBondContact O-CB 3.36Å; E312-L316 WeakPolarHBondContact O-CG 3.48Å; E312-L316 PolarHBondContact O-N 2.88Å |
| 313 | R | 79.4 | Confident | 80.8 | Confident | 182 Ų | 182 | 108.5 Ų | 108.5 | 69% | 0.687 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.1 | -43.9 | 174.1 | -77.1 | -179.5 | -170.3 | 165.6 | 4.3 | 111.8 | S309 R310 S311 Q315 L316 Q317 | S309-R313 WeakPolarHBondContact O-CB 3.48Å; S309-R313 WeakPolarHBondContact O-CG 3.38Å; S309-R313 PolarHBondContact O-N 2.85Å; R310-R313 PolarHBondContact O-N 3.16Å; S311-R313 PolarHBondContact O-N 3.25Å; R313-Q315 VanDerWaalsContact C-N 3.34Å; R313-Q315 PolarHBondContact O-N 3.5Å; R313-L316 PolarHBondContact O-N 2.83Å; R313-Q317 WeakPolarHBondContact O-CB 3.46Å; R313-Q317 PolarHBondContact O-N 3.3Å |
| 314 | N | 78.8 | Confident | 80.2 | Confident | 82 Ų | 82 | 107.6 Ų | 107.6 | 44% | 0.439 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.3 | -43.7 | 175.7 | -72.7 | -12.4 | 0 | 0 | 0 | 111 | R310 S311 E312 Q317 V318 | R310-N314 WeakPolarHBondContact O-CB 3.37Å; R310-N314 VanDerWaalsContact O-CG 3.22Å; R310-N314 PolarHBondContact O-N 3.33Å; S311-N314 WeakPolarHBondContact O-CB 3.38Å; S311-N314 PolarHBondContact O-N 3.49Å; E312-N314 PolarHBondContact O-N 3.5Å; N314-Q317 PolarHBondContact O-N 3.33Å; N314-V318 WeakPolarHBondContact O-CG2 3.38Å; N314-V318 PolarHBondContact O-N 3.28Å |
| 315 | Q | 79 | Confident | 79.7 | Confident | 108 Ų | 108 | 110.4 Ų | 110.4 | 51% | 0.505 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.2 | -43.5 | 175.2 | -72.6 | -179.1 | 13.3 | 0 | 0 | 112.2 | S311 E312 R313 Q317 V318 K319 | S311-Q315 WeakPolarHBondContact O-CG 3.36Å; S311-Q315 PolarHBondContact O-N 3.31Å; E312-Q315 PolarHBondContact O-N 2.91Å; R313-Q315 VanDerWaalsContact C-N 3.34Å; R313-Q315 PolarHBondContact O-N 3.5Å; Q315-Q317 VanDerWaalsContact C-N 3.34Å; Q315-V318 PolarHBondContact O-N 3.4Å; Q315-K319 WeakPolarHBondContact O-CG 3.35Å; Q315-K319 PolarHBondContact O-N 2.83Å |
| 316 | L | 79.1 | Confident | 79 | Confident | 100 Ų | 100 | 111.6 Ų | 111.6 | 52% | 0.524 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.6 | -39.4 | 175.3 | -75.6 | 169.2 | 0 | 0 | 0 | 111.6 | E312 R313 K319 L320 | E312-L316 WeakPolarHBondContact O-CB 3.36Å; E312-L316 WeakPolarHBondContact O-CG 3.48Å; E312-L316 PolarHBondContact O-N 2.88Å; R313-L316 PolarHBondContact O-N 2.83Å; L316-K319 CarbonylContact O-C 3.57Å; L316-K319 PolarHBondContact O-N 2.83Å; L316-L320 WeakPolarHBondContact O-CB 3.39Å; L316-L320 WeakPolarHBondContact O-CG 3.37Å; L316-L320 PolarHBondContact O-N 2.85Å |
| 317 | Q | 77.9 | Confident | 78.7 | Confident | 107 Ų | 107 | 110.3 Ų | 110.3 | 50% | 0.5 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.1 | -40.7 | 175.7 | -164.9 | -179.4 | 20.2 | 0 | 0 | 111.5 | R313 N314 Q315 L320 R321 | R313-Q317 WeakPolarHBondContact O-CB 3.46Å; R313-Q317 PolarHBondContact O-N 3.3Å; N314-Q317 PolarHBondContact O-N 3.33Å; Q315-Q317 VanDerWaalsContact C-N 3.34Å; Q317-L320 PolarHBondContact O-N 3.27Å; Q317-R321 WeakPolarHBondContact O-CB 3.4Å; Q317-R321 WeakPolarHBondContact O-CG 3.27Å; Q317-R321 PolarHBondContact O-N 2.82Å |
| 318 | V | 78.1 | Confident | 78.1 | Confident | 95 Ų | 95 | 113 Ų | 113 | 58% | 0.576 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.1 | -44.1 | 171.6 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | N314 Q315 R321 M322 | N314-V318 WeakPolarHBondContact O-CG2 3.38Å; N314-V318 PolarHBondContact O-N 3.28Å; Q315-V318 PolarHBondContact O-N 3.4Å; V318-R321 PolarHBondContact O-N 3.25Å; V318-M322 WeakPolarHBondContact O-CB 3.36Å; V318-M322 PolarHBondContact O-N 3.12Å |
| 319 | K | 78 | Confident | 77.3 | Confident | 132 Ų | 132 | 108.1 Ų | 108.1 | 57% | 0.574 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.2 | -39.5 | 176.4 | -73.5 | 178.3 | -176.5 | 177.9 | 0 | 112.8 | Q315 L316 M322 K323 | Q315-K319 WeakPolarHBondContact O-CG 3.35Å; Q315-K319 PolarHBondContact O-N 2.83Å; L316-K319 CarbonylContact O-C 3.57Å; L316-K319 PolarHBondContact O-N 2.83Å; K319-M322 PolarHBondContact O-N 2.88Å; K319-K323 WeakPolarHBondContact O-CB 3.47Å; K319-K323 PolarHBondContact O-N 3.39Å |
| 320 | L | 78.6 | Confident | 76.5 | Confident | 114 Ų | 114 | 107.6 Ų | 107.6 | 60% | 0.597 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -69.6 | -40.8 | 176.3 | -76.5 | 170.7 | 0 | 0 | 0 | 111.4 | L316 Q317 M322 K323 S324 | L316-L320 WeakPolarHBondContact O-CB 3.39Å; L316-L320 WeakPolarHBondContact O-CG 3.37Å; L316-L320 PolarHBondContact O-N 2.85Å; Q317-L320 PolarHBondContact O-N 3.27Å; L320-M322 VanDerWaalsContact C-N 3.34Å; L320-K323 CarbonylContact O-C 3.54Å; L320-K323 PolarHBondContact O-N 3.36Å; L320-S324 PolarHBondContact O-N 2.8Å |
| 321 | R | 76 | Confident | 75.6 | Confident | 169 Ų | 169 | 107.5 Ų | 107.5 | 64% | 0.638 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -58.8 | -46 | 169.6 | -78.7 | -178.6 | 175.4 | -167.3 | -0.6 | 111 | Q317 V318 K323 S324 I325 | Q317-R321 WeakPolarHBondContact O-CB 3.4Å; Q317-R321 WeakPolarHBondContact O-CG 3.27Å; Q317-R321 PolarHBondContact O-N 2.82Å; V318-R321 PolarHBondContact O-N 3.25Å; R321-K323 PolarHBondContact O-N 3.41Å; R321-S324 WeakPolarHBondContact O-CB 3.36Å; R321-S324 PolarHBondContact O-N 2.78Å; R321-I325 VanDerWaalsContact O-CG1 3.27Å; R321-I325 WeakPolarHBondContact O-CG1 3.27Å; R321-I325 PolarHBondContact O-N 2.8Å |
| 322 | M | 76 | Confident | 75 | Confident | 110 Ų | 110 | 107.4 Ų | 107.4 | 54% | 0.542 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.3 | -43.3 | 174.9 | -164.7 | 75.7 | 93.1 | 0 | 0 | 111.5 | V318 K319 L320 I325 M326 | V318-M322 WeakPolarHBondContact O-CB 3.36Å; V318-M322 PolarHBondContact O-N 3.12Å; K319-M322 PolarHBondContact O-N 2.88Å; L320-M322 VanDerWaalsContact C-N 3.34Å; M322-I325 PolarHBondContact O-N 2.8Å; M322-M326 WeakPolarHBondContact O-CB 3.4Å; M322-M326 VanDerWaalsContact O-CG 3.27Å; M322-M326 WeakPolarHBondContact O-CG 3.22Å; M322-M326 PolarHBondContact O-N 3.28Å |
| 323 | K | 77.9 | Confident | 73.8 | Confident | 135 Ų | 135 | 107.4 Ų | 107.4 | 59% | 0.587 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.8 | -39.2 | 174.3 | -87.9 | -174.9 | 174.7 | -178.5 | 0 | 112.8 | K319 L320 R321 M326 Q327 | K319-K323 WeakPolarHBondContact O-CB 3.47Å; K319-K323 PolarHBondContact O-N 3.39Å; L320-K323 CarbonylContact O-C 3.54Å; L320-K323 PolarHBondContact O-N 3.36Å; R321-K323 PolarHBondContact O-N 3.41Å; K323-M326 PolarHBondContact O-N 3.21Å; K323-Q327 VanDerWaalsContact O-CB 3.28Å; K323-Q327 WeakPolarHBondContact O-CB 3.48Å; K323-Q327 WeakPolarHBondContact O-CG 3.28Å; K323-Q327 PolarHBondContact O-N 3.46Å |
| 324 | S | 75.3 | Confident | 72.8 | Confident | 50 Ų | 50 | 107.9 Ų | 107.9 | 35% | 0.35 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.5 | -48.3 | 174.1 | -163.8 | 0 | 0 | 0 | 0 | 110.1 | L320 R321 M326 Q327 E328 | L320-S324 PolarHBondContact O-N 2.8Å; R321-S324 WeakPolarHBondContact O-CB 3.36Å; R321-S324 PolarHBondContact O-N 2.78Å; S324-M326 VanDerWaalsContact C-N 3.32Å; S324-M326 PolarHBondContact O-N 2.76Å; S324-Q327 CarbonylContact O-C 3.56Å; S324-Q327 PolarHBondContact O-N 3.37Å; S324-Q327 VanDerWaalsContact O-N 3.15Å; S324-E328 WeakPolarHBondContact O-CB 3.31Å; S324-E328 WeakPolarHBondContact O-CG 3.32Å; S324-E328 PolarHBondContact O-N 2.73Å; S324-E328 PolarHBondContact OG-OE1 3.25Å; S324-E328 VanDerWaalsContact OG-OE1 3.12Å |
| 325 | I | 74.9 | Confident | 71.9 | Confident | 100 Ų | 100 | 111.5 Ų | 111.5 | 51% | 0.513 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -59.7 | -42.4 | 175.4 | -66.1 | 164.4 | 0 | 0 | 0 | 110.7 | R321 M322 A329 | R321-I325 VanDerWaalsContact O-CG1 3.27Å; R321-I325 WeakPolarHBondContact O-CG1 3.27Å; R321-I325 PolarHBondContact O-N 2.8Å; M322-I325 PolarHBondContact O-N 2.8Å; I325-A329 WeakPolarHBondContact O-CB 3.33Å; I325-A329 PolarHBondContact O-N 2.76Å |
| 326 | M | 74 | Confident | 70.9 | Confident | 127 Ų | 127 | 110.1 Ų | 110.1 | 63% | 0.626 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -69 | -35.1 | 176 | -72.7 | -177.2 | 83.5 | 0 | 0 | 112.8 | M322 K323 S324 A330 | M322-M326 WeakPolarHBondContact O-CB 3.4Å; M322-M326 VanDerWaalsContact O-CG 3.27Å; M322-M326 WeakPolarHBondContact O-CG 3.22Å; M322-M326 PolarHBondContact O-N 3.28Å; K323-M326 PolarHBondContact O-N 3.21Å; S324-M326 VanDerWaalsContact C-N 3.32Å; S324-M326 PolarHBondContact O-N 2.76Å; M326-A330 WeakPolarHBondContact O-CB 3.18Å; M326-A330 PolarHBondContact O-N 2.78Å |
| 327 | Q | 73.7 | Confident | 69.6 | Low | 129 Ų | 129 | 112 Ų | 112 | 60% | 0.603 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -74.6 | -34.8 | 175.6 | -80.7 | -177.6 | -11 | 0 | 0 | 112.1 | K323 S324 A330 K331 | K323-Q327 VanDerWaalsContact O-CB 3.28Å; K323-Q327 WeakPolarHBondContact O-CB 3.48Å; K323-Q327 WeakPolarHBondContact O-CG 3.28Å; K323-Q327 PolarHBondContact O-N 3.46Å; S324-Q327 CarbonylContact O-C 3.56Å; S324-Q327 PolarHBondContact O-N 3.37Å; S324-Q327 VanDerWaalsContact O-N 3.15Å; Q327-A330 PolarHBondContact O-N 2.74Å; Q327-K331 VanDerWaalsContact O-CB 3.26Å; Q327-K331 WeakPolarHBondContact O-CB 3.44Å; Q327-K331 WeakPolarHBondContact O-CG 3.26Å; Q327-K331 PolarHBondContact O-N 3.49Å |
| 328 | E | 69.3 | Low | 68.3 | Low | 119 Ų | 119 | 115.4 Ų | 115.4 | 56% | 0.556 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.2 | -44.1 | 169.5 | -77.7 | 166.1 | -152 | 0 | 0 | 110.2 | S324 A330 K331 A332 | S324-E328 WeakPolarHBondContact O-CB 3.31Å; S324-E328 WeakPolarHBondContact O-CG 3.32Å; S324-E328 PolarHBondContact O-N 2.73Å; S324-E328 PolarHBondContact OG-OE1 3.25Å; S324-E328 VanDerWaalsContact OG-OE1 3.12Å; E328-A330 PolarHBondContact O-N 3.15Å; E328-K331 PolarHBondContact O-N 3.39Å; E328-A332 VanDerWaalsContact O-CB 3.31Å; E328-A332 WeakPolarHBondContact O-CB 3.36Å; E328-A332 PolarHBondContact O-N 2.83Å |
| 329 | A | 68.4 | Low | 67.1 | Low | 49 Ų | 49 | 116.9 Ų | 116.9 | 41% | 0.405 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -62.6 | -40.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | I325 A332 L333 | I325-A329 WeakPolarHBondContact O-CB 3.33Å; I325-A329 PolarHBondContact O-N 2.76Å; A329-A332 PolarHBondContact O-N 3.39Å; A329-L333 WeakPolarHBondContact O-CB 3.37Å; A329-L333 VanDerWaalsContact O-CG 3.26Å; A329-L333 WeakPolarHBondContact O-CG 3.26Å; A329-L333 PolarHBondContact O-N 3.45Å |
| 330 | A | 66.1 | Low | 65.6 | Low | 41 Ų | 41 | 116 Ų | 116 | 34% | 0.339 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -71.2 | -32.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | M326 Q327 E328 R334 | M326-A330 WeakPolarHBondContact O-CB 3.18Å; M326-A330 PolarHBondContact O-N 2.78Å; Q327-A330 PolarHBondContact O-N 2.74Å; E328-A330 PolarHBondContact O-N 3.15Å; A330-R334 VanDerWaalsContact O-CB 3.32Å; A330-R334 WeakPolarHBondContact O-CB 3.35Å; A330-R334 VanDerWaalsContact O-CG 3.26Å; A330-R334 WeakPolarHBondContact O-CG 3.26Å; A330-R334 PolarHBondContact O-N 2.73Å |
| 331 | K | 66.6 | Low | 63.8 | Low | 139 Ų | 139 | 123.2 Ų | 123.2 | 60% | 0.604 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -69.4 | -40.9 | 170.3 | -85.7 | 179.4 | 178.2 | 177.3 | 0 | 110.9 | Q327 E328 L333 R334 Q335 | Q327-K331 VanDerWaalsContact O-CB 3.26Å; Q327-K331 WeakPolarHBondContact O-CB 3.44Å; Q327-K331 WeakPolarHBondContact O-CG 3.26Å; Q327-K331 PolarHBondContact O-N 3.49Å; E328-K331 PolarHBondContact O-N 3.39Å; K331-L333 VanDerWaalsContact C-N 3.33Å; K331-R334 CarbonylContact O-C 3.57Å; K331-R334 PolarHBondContact O-N 3.04Å; K331-Q335 WeakPolarHBondContact O-CB 3.34Å; K331-Q335 WeakPolarHBondContact O-CG 3.35Å; K331-Q335 PolarHBondContact O-N 3.21Å |
| 332 | A | 63.6 | Low | 63.2 | Low | 55 Ų | 55 | 121 Ų | 121 | 46% | 0.455 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -61.6 | -42 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | E328 A329 Q335 A336 | E328-A332 VanDerWaalsContact O-CB 3.31Å; E328-A332 WeakPolarHBondContact O-CB 3.36Å; E328-A332 PolarHBondContact O-N 2.83Å; A329-A332 PolarHBondContact O-N 3.39Å; A332-Q335 PolarHBondContact O-N 2.8Å; A332-A336 WeakPolarHBondContact O-CB 3.32Å; A332-A336 PolarHBondContact O-N 2.92Å |
| 333 | L | 59 | Low | 62.5 | Low | 113 Ų | 113 | 121.5 Ų | 121.5 | 59% | 0.592 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -67.4 | -35.6 | 172.7 | -73.8 | 166.1 | 0 | 0 | 0 | 112.8 | A329 K331 A336 L337 | A329-L333 WeakPolarHBondContact O-CB 3.37Å; A329-L333 VanDerWaalsContact O-CG 3.26Å; A329-L333 WeakPolarHBondContact O-CG 3.26Å; A329-L333 PolarHBondContact O-N 3.45Å; K331-L333 VanDerWaalsContact C-N 3.33Å; L333-A336 PolarHBondContact O-N 3.37Å; L333-L337 WeakPolarHBondContact O-CB 3.41Å; L333-L337 PolarHBondContact O-N 3.41Å |
| 334 | R | 59.3 | Low | 61.6 | Low | 192 Ų | 192 | 120.8 Ų | 120.8 | 73% | 0.725 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -74.4 | -30.1 | 174.1 | -78 | 178.7 | -172.8 | -159.1 | 2.3 | 113.2 | A330 K331 A336 L337 K338 | A330-R334 VanDerWaalsContact O-CB 3.32Å; A330-R334 WeakPolarHBondContact O-CB 3.35Å; A330-R334 VanDerWaalsContact O-CG 3.26Å; A330-R334 WeakPolarHBondContact O-CG 3.26Å; A330-R334 PolarHBondContact O-N 2.73Å; K331-R334 CarbonylContact O-C 3.57Å; K331-R334 PolarHBondContact O-N 3.04Å; R334-A336 VanDerWaalsContact C-N 3.32Å; R334-L337 CarbonylContact O-C 3.6Å; R334-L337 PolarHBondContact O-N 2.98Å; R334-K338 PolarHBondContact O-N 3.33Å |
| 335 | Q | 59.9 | Low | 60.8 | Low | 157 Ų | 157 | 124.9 Ų | 124.9 | 73% | 0.734 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -70.8 | -31.4 | 169.3 | -78.1 | 174.7 | -20.5 | 0 | 0 | 110.8 | K331 A332 L337 | K331-Q335 WeakPolarHBondContact O-CB 3.34Å; K331-Q335 WeakPolarHBondContact O-CG 3.35Å; K331-Q335 PolarHBondContact O-N 3.21Å; A332-Q335 PolarHBondContact O-N 2.8Å; Q335-L337 VanDerWaalsContact C-N 3.35Å |
| 336 | A | 57.6 | Low | 59.9 | Low | 80 Ų | 80 | 126.5 Ų | 126.5 | 66% | 0.661 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.4 | -21.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | A332 L333 R334 | A332-A336 WeakPolarHBondContact O-CB 3.32Å; A332-A336 PolarHBondContact O-N 2.92Å; L333-A336 PolarHBondContact O-N 3.37Å; R334-A336 VanDerWaalsContact C-N 3.32Å |
| 337 | L | 50.3 | Low | 59 | Low | 140 Ų | 140 | 126.5 Ų | 126.5 | 73% | 0.733 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -109.7 | 5 | -177.4 | -82.9 | 157.3 | 0 | 0 | 0 | 115.1 | L333 R334 Q335 | L333-L337 WeakPolarHBondContact O-CB 3.41Å; L333-L337 PolarHBondContact O-N 3.41Å; R334-L337 CarbonylContact O-C 3.6Å; R334-L337 PolarHBondContact O-N 2.98Å; Q335-L337 VanDerWaalsContact C-N 3.35Å |
| 338 | K | 50.9 | Low | 58 | Low | 178 Ų | 178 | 126.3 Ų | 126.3 | 77% | 0.774 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -120 | 74.5 | 163.9 | -86 | -172.9 | 172.6 | -172.8 | 0 | 109.7 | R334 | R334-K338 PolarHBondContact O-N 3.33Š|
| 339 | V | 53.5 | Low | 57.1 | Low | 125 Ų | 125 | 126.8 Ų | 126.8 | 76% | 0.758 | 67% | 0.674 | S | S | * | * | trans | -8.1 | 130.4 | 143.6 | -169.8 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 340 | P | 45.8 | Very low | 56.1 | Low | 115 Ų | 115 | 133.3 Ų | 133.3 | 75% | 0.747 | 70% | 0.697 | S | S | * | * | trans | -133.4 | 119.5 | 145.9 | 33.2 | -17.4 | 0 | 0 | 0 | 110.7 | ||||
| 341 | E | 40.9 | Very low | 55.2 | Low | 265 Ų | 265 | 141.7 Ų | 141.7 | 100% | 1.238 | 73% | 0.729 | S | S | * | * | trans | 60.5 | 0 | 166.4 | -63 | -174.8 | 157.4 | 0 | 0 | 118.5 |
Retrieved 341 of 341 residues in 617.4 ms
(Link to these results)