| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 61.1 | Low | 81.4 | Confident | 204 Ų | 204 | 102.5 Ų | 102.5 | 100% | 1.005 | 58% | 0.582 | S | S | * | * | 0 | 35.3 | 0 | -152.4 | 131.8 | 72.3 | 0 | 0 | 112.8 | H5 | M1-H5 PolarHBondContact O-CD2 3.09Š| |||
| 2 | N | 72.4 | Confident | 81.5 | Confident | 120 Ų | 120 | 103.5 Ų | 103.5 | 64% | 0.642 | 58% | 0.581 | S | S | * | * | trans | -125.6 | -19.6 | -178.4 | -64.1 | -37 | 0 | 0 | 0 | 112.7 | H5 L6 | N2-H5 PolarHBondContact O-N 3.25Å; N2-L6 WeakPolarHBondContact O-CG 3.36Å; N2-L6 PolarHBondContact O-N 3.46Å | ||
| 3 | I | 80.4 | Confident | 81.6 | Confident | 135 Ų | 135 | 103.2 Ų | 103.2 | 69% | 0.692 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68.6 | -38.1 | -179.2 | -57.5 | 168.7 | 0 | 0 | 0 | 110.4 | H5 L6 V7 | I3-H5 VanDerWaalsContact C-N 3.31Å; I3-H5 PolarHBondContact O-N 3.32Å; I3-L6 PolarHBondContact O-N 3.25Å; I3-V7 HydrophobicContact CG2-CG2 4.34Å; I3-V7 WeakPolarHBondContact O-CB 2.95Å; I3-V7 VanDerWaalsContact O-CG2 3.26Å; I3-V7 WeakPolarHBondContact O-CG2 3.34Å; I3-V7 PolarHBondContact O-N 2.95Å |
| 4 | S | 82.2 | Confident | 81.5 | Confident | 74 Ų | 74 | 101.1 Ų | 101.1 | 52% | 0.517 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -61.9 | -39.5 | 175.3 | 59.2 | 0 | 0 | 0 | 0 | 112.1 | A8 | S4-A8 VanDerWaalsContact O-CB 3.27Å; S4-A8 WeakPolarHBondContact O-CB 3.45Å; S4-A8 PolarHBondContact O-N 3.38Å |
| 5 | H | 82.9 | Confident | 81.2 | Confident | 126 Ų | 126 | 99.8 Ų | 99.8 | 58% | 0.583 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -70 | -39.1 | 177.4 | -69.4 | -76.5 | 0 | 0 | 0 | 112.2 | M1 N2 I3 A8 C9 | M1-H5 PolarHBondContact O-CD2 3.09Å; N2-H5 PolarHBondContact O-N 3.25Å; I3-H5 VanDerWaalsContact C-N 3.31Å; I3-H5 PolarHBondContact O-N 3.32Å; H5-A8 PolarHBondContact O-N 3.18Å; H5-C9 WeakPolarHBondContact O-CB 3.34Å; H5-C9 PolarHBondContact O-N 3.2Å |
| 6 | L | 83.6 | Confident | 80.6 | Confident | 128 Ų | 128 | 100.1 Ų | 100.1 | 67% | 0.67 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.7 | -42.9 | 174.7 | -69.9 | 171.4 | 0 | 0 | 0 | 111.7 | N2 I3 C9 G10 | N2-L6 WeakPolarHBondContact O-CG 3.36Å; N2-L6 PolarHBondContact O-N 3.46Å; I3-L6 PolarHBondContact O-N 3.25Å; L6-C9 PolarHBondContact O-N 3.27Å; L6-G10 PolarHBondContact O-N 2.89Å |
| 7 | V | 87.1 | Confident | 79.9 | Confident | 90 Ų | 90 | 98.3 Ų | 98.3 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.6 | -46.2 | 175.8 | 172.3 | 0 | 0 | 0 | 0 | 110.5 | I3 C9 G10 L11 | I3-V7 HydrophobicContact CG2-CG2 4.34Å; I3-V7 WeakPolarHBondContact O-CB 2.95Å; I3-V7 VanDerWaalsContact O-CG2 3.26Å; I3-V7 WeakPolarHBondContact O-CG2 3.34Å; I3-V7 PolarHBondContact O-N 2.95Å; V7-C9 VanDerWaalsContact C-N 3.34Å; V7-C9 PolarHBondContact O-N 3.32Å; V7-G10 PolarHBondContact O-N 3.49Å; V7-L11 WeakPolarHBondContact O-CB 3.32Å; V7-L11 PolarHBondContact O-N 2.86Å |
| 8 | A | 86.6 | Confident | 78.8 | Confident | 52 Ų | 52 | 100.4 Ų | 100.4 | 43% | 0.43 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.5 | -41 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | S4 H5 L11 M12 | S4-A8 VanDerWaalsContact O-CB 3.27Å; S4-A8 WeakPolarHBondContact O-CB 3.45Å; S4-A8 PolarHBondContact O-N 3.38Å; H5-A8 PolarHBondContact O-N 3.18Å; A8-L11 PolarHBondContact O-N 2.96Å; A8-M12 WeakPolarHBondContact O-CB 3.13Å; A8-M12 VanDerWaalsContact O-CG 3.25Å; A8-M12 WeakPolarHBondContact O-CG 3.33Å; A8-M12 PolarHBondContact O-N 3.45Å |
| 9 | C | 85.2 | Confident | 77.7 | Confident | 73 Ų | 73 | 106.4 Ų | 106.4 | 49% | 0.493 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.3 | -44.1 | 178 | -162.1 | 0 | 0 | 0 | 0 | 111.4 | H5 L6 V7 L11 M12 I13 | H5-C9 WeakPolarHBondContact O-CB 3.34Å; H5-C9 PolarHBondContact O-N 3.2Å; L6-C9 PolarHBondContact O-N 3.27Å; V7-C9 VanDerWaalsContact C-N 3.34Å; V7-C9 PolarHBondContact O-N 3.32Å; C9-L11 VanDerWaalsContact C-N 3.34Å; C9-L11 PolarHBondContact O-N 3.35Å; C9-M12 PolarHBondContact O-N 3.05Å; C9-I13 VanDerWaalsContact O-CG1 3.32Å; C9-I13 WeakPolarHBondContact O-CG1 3.3Å; C9-I13 PolarHBondContact O-N 3.46Å |
| 10 | G | 86.8 | Confident | 76.6 | Confident | 33 Ų | 33 | 106.3 Ų | 106.3 | 34% | 0.34 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -59.8 | -43.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L6 V7 M12 I13 T14 | L6-G10 PolarHBondContact O-N 2.89Å; V7-G10 PolarHBondContact O-N 3.49Å; G10-M12 PolarHBondContact O-N 3.48Å; G10-I13 PolarHBondContact O-N 3.34Å; G10-T14 WeakPolarHBondContact O-CG2 3.26Å; G10-T14 PolarHBondContact O-N 3.22Å; G10-T14 PolarHBondContact O-OG1 3.19Å |
| 11 | L | 86.9 | Confident | 75.3 | Confident | 93 Ų | 93 | 103.7 Ų | 103.7 | 49% | 0.487 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.2 | -41 | 178.3 | -138.8 | 156.5 | 0 | 0 | 0 | 111.2 | V7 A8 C9 T14 L15 | V7-L11 WeakPolarHBondContact O-CB 3.32Å; V7-L11 PolarHBondContact O-N 2.86Å; A8-L11 PolarHBondContact O-N 2.96Å; C9-L11 VanDerWaalsContact C-N 3.34Å; C9-L11 PolarHBondContact O-N 3.35Å; L11-T14 WeakPolarHBondContact CA-OG1 3.17Å; L11-T14 PolarHBondContact O-N 2.7Å; L11-T14 PolarHBondContact O-OG1 3.08Å; L11-L15 HydrophobicContact CD2-CD1 3.59Å; L11-L15 HydrophobicContact CD2-CG 3.94Å; L11-L15 WeakPolarHBondContact O-CB 2.95Å; L11-L15 VanDerWaalsContact O-CG 3.27Å; L11-L15 WeakPolarHBondContact O-CG 3.23Å; L11-L15 PolarHBondContact O-N 3.16Å |
| 12 | M | 83 | Confident | 75.2 | Confident | 114 Ų | 114 | 98.1 Ų | 98.1 | 56% | 0.562 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.4 | -43.8 | 173.9 | -72.6 | -63.1 | -69.4 | 0 | 0 | 112.5 | A8 C9 G10 L15 L16 | A8-M12 WeakPolarHBondContact O-CB 3.13Å; A8-M12 VanDerWaalsContact O-CG 3.25Å; A8-M12 WeakPolarHBondContact O-CG 3.33Å; A8-M12 PolarHBondContact O-N 3.45Å; C9-M12 PolarHBondContact O-N 3.05Å; G10-M12 PolarHBondContact O-N 3.48Å; M12-L15 PolarHBondContact O-N 3.1Å; M12-L16 WeakPolarHBondContact O-CB 3.44Å; M12-L16 WeakPolarHBondContact O-CD1 3.5Å; M12-L16 VanDerWaalsContact O-CG 3.23Å; M12-L16 WeakPolarHBondContact O-CG 3.47Å; M12-L16 PolarHBondContact O-N 3.24Å |
| 13 | I | 82.5 | Confident | 73.8 | Confident | 100 Ų | 100 | 101.1 Ų | 101.1 | 51% | 0.513 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.4 | -47.1 | 176.6 | -66.4 | 164.5 | 0 | 0 | 0 | 110 | C9 G10 L15 L16 S17 | C9-I13 VanDerWaalsContact O-CG1 3.32Å; C9-I13 WeakPolarHBondContact O-CG1 3.3Å; C9-I13 PolarHBondContact O-N 3.46Å; G10-I13 PolarHBondContact O-N 3.34Å; I13-L15 PolarHBondContact O-N 2.97Å; I13-L16 WeakPolarHBondContact O-CB 3.33Å; I13-L16 PolarHBondContact O-N 3.22Å; I13-S17 PolarHBondContact O-N 3.21Å; I13-S17 PolarHBondContact O-OG 3.22Å |
| 14 | T | 80.3 | Confident | 72 | Confident | 73 Ų | 73 | 99.9 Ų | 99.9 | 45% | 0.448 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62.4 | -39.9 | 177.9 | 59.4 | 0 | 0 | 0 | 0 | 112.6 | G10 L11 S17 L18 | G10-T14 WeakPolarHBondContact O-CG2 3.26Å; G10-T14 PolarHBondContact O-N 3.22Å; G10-T14 PolarHBondContact O-OG1 3.19Å; L11-T14 WeakPolarHBondContact CA-OG1 3.17Å; L11-T14 PolarHBondContact O-N 2.7Å; L11-T14 PolarHBondContact O-OG1 3.08Å; T14-S17 WeakPolarHBondContact O-CB 3.41Å; T14-S17 PolarHBondContact O-N 3.38Å; T14-L18 WeakPolarHBondContact O-CD1 3.34Å; T14-L18 PolarHBondContact O-N 3Å |
| 15 | L | 77.2 | Confident | 70.3 | Confident | 82 Ų | 82 | 100.4 Ų | 100.4 | 43% | 0.429 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.2 | -36.7 | 175.5 | -73.7 | 171.9 | 0 | 0 | 0 | 112.3 | L11 M12 I13 L18 R19 | L11-L15 HydrophobicContact CD2-CD1 3.59Å; L11-L15 HydrophobicContact CD2-CG 3.94Å; L11-L15 WeakPolarHBondContact O-CB 2.95Å; L11-L15 VanDerWaalsContact O-CG 3.27Å; L11-L15 WeakPolarHBondContact O-CG 3.23Å; L11-L15 PolarHBondContact O-N 3.16Å; M12-L15 PolarHBondContact O-N 3.1Å; I13-L15 PolarHBondContact O-N 2.97Å; L15-L18 PolarHBondContact O-N 3.07Å; L15-R19 WeakPolarHBondContact O-CB 3.42Å; L15-R19 WeakPolarHBondContact O-CG 3.48Å; L15-R19 PolarHBondContact O-N 3.32Å |
| 16 | L | 71.7 | Confident | 69.1 | Low | 105 Ų | 105 | 98.7 Ų | 98.7 | 55% | 0.55 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.2 | -40.4 | 172 | -71.6 | 164.2 | 0 | 0 | 0 | 111 | M12 I13 R19 T20 | M12-L16 WeakPolarHBondContact O-CB 3.44Å; M12-L16 WeakPolarHBondContact O-CD1 3.5Å; M12-L16 VanDerWaalsContact O-CG 3.23Å; M12-L16 WeakPolarHBondContact O-CG 3.47Å; M12-L16 PolarHBondContact O-N 3.24Å; I13-L16 WeakPolarHBondContact O-CB 3.33Å; I13-L16 PolarHBondContact O-N 3.22Å; L16-R19 PolarHBondContact O-N 2.89Å; L16-T20 WeakPolarHBondContact O-CB 3.36Å; L16-T20 VanDerWaalsContact O-CG2 3.27Å; L16-T20 WeakPolarHBondContact O-CG2 3.42Å; L16-T20 PolarHBondContact O-N 3.48Å; L16-T20 PolarHBondContact O-OG1 3.31Å |
| 17 | S | 68.1 | Low | 67.9 | Low | 69 Ų | 69 | 97.8 Ų | 97.8 | 48% | 0.483 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65.4 | -37 | 174.7 | -58.1 | 0 | 0 | 0 | 0 | 113 | I13 T14 T20 G21 | I13-S17 PolarHBondContact O-N 3.21Å; I13-S17 PolarHBondContact O-OG 3.22Å; T14-S17 WeakPolarHBondContact O-CB 3.41Å; T14-S17 PolarHBondContact O-N 3.38Å; S17-T20 WeakPolarHBondContact CA-OG1 3.41Å; S17-T20 CarbonylContact O-C 3.53Å; S17-T20 PolarHBondContact O-N 3.19Å; S17-T20 PolarHBondContact O-OG1 2.98Å; S17-G21 PolarHBondContact O-N 3.37Å |
| 18 | L | 60.9 | Low | 66.5 | Low | 136 Ų | 136 | 97.1 Ų | 97.1 | 71% | 0.712 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -73 | -35.8 | 175.2 | -93.3 | 72.6 | 0 | 0 | 0 | 112.1 | T14 L15 T20 G21 | T14-L18 WeakPolarHBondContact O-CD1 3.34Å; T14-L18 PolarHBondContact O-N 3Å; L15-L18 PolarHBondContact O-N 3.07Å; L18-T20 VanDerWaalsContact C-N 3.31Å; L18-G21 PolarHBondContact O-N 2.96Å; L18-G21 VanDerWaalsContact O-N 3.14Å |
| 19 | R | 57.6 | Low | 65 | Low | 214 Ų | 214 | 100.2 Ų | 100.2 | 81% | 0.808 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -73.9 | -22.7 | 173.7 | -76.9 | -175.2 | 177.2 | -167.8 | 1.1 | 113.4 | L15 L16 | L15-R19 WeakPolarHBondContact O-CB 3.42Å; L15-R19 WeakPolarHBondContact O-CG 3.48Å; L15-R19 PolarHBondContact O-N 3.32Å; L16-R19 PolarHBondContact O-N 2.89Å |
| 20 | T | 56.3 | Low | 63.7 | Low | 105 Ų | 105 | 99.7 Ų | 99.7 | 64% | 0.644 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | 11.6 | 168.2 | 52.4 | 0 | 0 | 0 | 0 | 112.2 | L16 S17 L18 A22 | L16-T20 WeakPolarHBondContact O-CB 3.36Å; L16-T20 VanDerWaalsContact O-CG2 3.27Å; L16-T20 WeakPolarHBondContact O-CG2 3.42Å; L16-T20 PolarHBondContact O-N 3.48Å; L16-T20 PolarHBondContact O-OG1 3.31Å; S17-T20 WeakPolarHBondContact CA-OG1 3.41Å; S17-T20 CarbonylContact O-C 3.53Å; S17-T20 PolarHBondContact O-N 3.19Å; S17-T20 PolarHBondContact O-OG1 2.98Å; L18-T20 VanDerWaalsContact C-N 3.31Å; T20-A22 PolarHBondContact O-N 3.27Å |
| 21 | G | 49.2 | Very low | 62.4 | Low | 52 Ų | 52 | 106 Ų | 106 | 54% | 0.536 | 59% | 0.585 | S | S | . | * | S | Bend | trans | -47.7 | 108.7 | 152.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | S17 L18 K23 | S17-G21 PolarHBondContact O-N 3.37Å; L18-G21 PolarHBondContact O-N 2.96Å; L18-G21 VanDerWaalsContact O-N 3.14Å; G21-K23 PolarHBondContact O-N 3.37Å |
| 22 | A | 57.7 | Low | 61.2 | Low | 87 Ų | 87 | 105 Ų | 105 | 72% | 0.719 | 59% | 0.585 | S | S | * | * | trans | -41.5 | 105.4 | -161 | 0 | 0 | 0 | 0 | 0 | 111.1 | T20 P24 | T20-A22 PolarHBondContact O-N 3.27Å; A22-P24 WeakPolarHBondContact O-CD 3.47Å | ||
| 23 | K | 44.7 | Very low | 60.1 | Low | 183 Ų | 183 | 103.1 Ų | 103.1 | 80% | 0.796 | 58% | 0.577 | S | S | * | * | trans | -56.2 | 113.8 | 152.6 | -96.3 | 169.6 | 174.1 | 168.1 | 0 | 103.3 | G21 L25 | G21-K23 PolarHBondContact O-N 3.37Å; K23-L25 PolarHBondContact O-N 3.18Å | ||
| 24 | P | 42.2 | Very low | 59 | Low | 109 Ų | 109 | 104 Ų | 104 | 71% | 0.708 | 57% | 0.574 | S | S | * | * | trans | -54.9 | 118.1 | 170.5 | 23.8 | -30.8 | 0 | 0 | 0 | 104.5 | A22 T26 | A22-P24 WeakPolarHBondContact O-CD 3.47Å; P24-T26 PolarHBondContact O-N 2.85Å; P24-T26 VanDerWaalsContact O-N 3.16Å | ||
| 25 | L | 46.3 | Very low | 58.2 | Low | 84 Ų | 84 | 105 Ų | 105 | 44% | 0.44 | 58% | 0.584 | S | S | . | * | trans | -44.7 | 130 | 171.4 | -120.5 | 71 | 0 | 0 | 0 | 105.9 | K23 Q29 L33 | K23-L25 PolarHBondContact O-N 3.18Å; L25-Q29 HydrophobicContact CB-CB 4.44Å; L25-Q29 HydrophobicContact CD2-CB 3.9Å; L25-Q29 HydrophobicContact CG-CB 4.13Å; L25-L33 HydrophobicContact CD2-CD1 3.31Å | ||
| 26 | T | 56.8 | Low | 57.5 | Low | 90 Ų | 90 | 107.7 Ų | 107.7 | 55% | 0.552 | 60% | 0.598 | S | S | * | * | trans | -43.2 | 135.3 | -179.7 | 45.7 | 0 | 0 | 0 | 0 | 108.6 | P24 A28 Q29 Q30 | P24-T26 PolarHBondContact O-N 2.85Å; P24-T26 VanDerWaalsContact O-N 3.16Å; T26-A28 CarbonylContact O-C 3.55Å; T26-A28 PolarHBondContact O-N 2.81Å; T26-Q29 PolarHBondContact O-N 2.96Å; T26-Q29 WeakPolarHBondContact OG1-CG 3.45Å; T26-Q30 PolarHBondContact O-N 2.81Å | ||
| 27 | P | 58.3 | Low | 56.9 | Low | 109 Ų | 109 | 107.2 Ų | 107.2 | 71% | 0.708 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -55 | -22 | -166.6 | 18.4 | -32.1 | 0 | 0 | 0 | 113.5 | K31 | P27-K31 PolarHBondContact O-N 3.35Å |
| 28 | A | 58.3 | Low | 56.5 | Low | 77 Ų | 77 | 105.4 Ų | 105.4 | 64% | 0.636 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -68.6 | -45.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | T26 K31 S32 | T26-A28 CarbonylContact O-C 3.55Å; T26-A28 PolarHBondContact O-N 2.81Å; A28-K31 PolarHBondContact O-N 3.49Å; A28-S32 PolarHBondContact O-N 2.94Å |
| 29 | Q | 54.8 | Low | 56.4 | Low | 117 Ų | 117 | 106.9 Ų | 106.9 | 55% | 0.547 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69.9 | -36.6 | 179.1 | -71.8 | -92.7 | -42.5 | 0 | 0 | 111.6 | L25 T26 K31 S32 L33 | L25-Q29 HydrophobicContact CB-CB 4.44Å; L25-Q29 HydrophobicContact CD2-CB 3.9Å; L25-Q29 HydrophobicContact CG-CB 4.13Å; T26-Q29 PolarHBondContact O-N 2.96Å; T26-Q29 WeakPolarHBondContact OG1-CG 3.45Å; Q29-K31 PolarHBondContact O-N 3.22Å; Q29-S32 PolarHBondContact O-N 3.31Å; Q29-L33 PolarHBondContact O-N 2.99Å; Q29-L33 VanDerWaalsContact O-N 3.09Å |
| 30 | Q | 58.8 | Low | 56.4 | Low | 62 Ų | 62 | 103.5 Ų | 103.5 | 29% | 0.29 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -62.4 | -32.4 | 174.4 | -171.2 | 176.6 | -85.4 | 0 | 0 | 112.2 | T26 R34 | T26-Q30 PolarHBondContact O-N 2.81Å; Q30-R34 VanDerWaalsContact CD-CZ 3.44Å; Q30-R34 VanDerWaalsContact CD-NH2 3.35Å; Q30-R34 HydrophobicContact CG-CG 4.42Å; Q30-R34 WeakPolarHBondContact O-CB 3.42Å; Q30-R34 WeakPolarHBondContact O-CG 3.42Å; Q30-R34 PolarHBondContact O-N 3.4Å |
| 31 | K | 59.9 | Low | 56.4 | Low | 166 Ų | 166 | 102 Ų | 102 | 72% | 0.722 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -70.6 | -39.2 | 179 | -138.5 | 169.4 | -173.8 | 177.4 | 0 | 112 | P27 A28 Q29 S35 | P27-K31 PolarHBondContact O-N 3.35Å; A28-K31 PolarHBondContact O-N 3.49Å; Q29-K31 PolarHBondContact O-N 3.22Å; K31-S35 PolarHBondContact O-N 2.99Å; K31-S35 PolarHBondContact O-OG 3.49Å |
| 32 | S | 61.4 | Low | 57 | Low | 70 Ų | 70 | 103 Ų | 103 | 49% | 0.49 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -68.2 | -42.9 | 175.9 | -172.7 | 0 | 0 | 0 | 0 | 112.3 | A28 Q29 S35 L36 | A28-S32 PolarHBondContact O-N 2.94Å; Q29-S32 PolarHBondContact O-N 3.31Å; S32-S35 WeakPolarHBondContact CA-OG 3.49Å; S32-S35 PolarHBondContact O-N 2.84Å; S32-S35 PolarHBondContact O-OG 2.98Å; S32-L36 WeakPolarHBondContact O-CD1 3.31Å; S32-L36 PolarHBondContact O-N 3.44Å |
| 33 | L | 58.5 | Low | 57.4 | Low | 76 Ų | 76 | 105.5 Ų | 105.5 | 40% | 0.398 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -71.2 | -35.5 | 176.6 | -68.2 | 171.7 | 0 | 0 | 0 | 112.6 | L25 Q29 S35 L36 L37 | L25-L33 HydrophobicContact CD2-CD1 3.31Å; Q29-L33 PolarHBondContact O-N 2.99Å; Q29-L33 VanDerWaalsContact O-N 3.09Å; L33-S35 VanDerWaalsContact C-N 3.3Å; L33-S35 PolarHBondContact O-N 2.85Å; L33-L36 PolarHBondContact O-N 2.87Å; L33-L37 HydrophobicContact CD2-CD1 4.24Å; L33-L37 PolarHBondContact O-N 3.11Å |
| 34 | R | 59.9 | Low | 58.2 | Low | 119 Ų | 119 | 104.5 Ų | 104.5 | 45% | 0.449 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.4 | -30.6 | 171.2 | -79.2 | 176.9 | 179.2 | 163.2 | 0.6 | 112.9 | Q30 G38 L41 | Q30-R34 VanDerWaalsContact CD-CZ 3.44Å; Q30-R34 VanDerWaalsContact CD-NH2 3.35Å; Q30-R34 HydrophobicContact CG-CG 4.42Å; Q30-R34 WeakPolarHBondContact O-CB 3.42Å; Q30-R34 WeakPolarHBondContact O-CG 3.42Å; Q30-R34 PolarHBondContact O-N 3.4Å; R34-G38 WeakPolarHBondContact O-CA 3.36Å; R34-G38 PolarHBondContact O-N 2.92Å; R34-G38 VanDerWaalsContact O-N 3.08Å; R34-L41 HydrophobicContact CG-CD2 4.44Å |
| 35 | S | 63.7 | Low | 59.1 | Low | 92 Ų | 92 | 104.4 Ų | 104.4 | 64% | 0.643 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -73.6 | -27.5 | 173.7 | 52.7 | 0 | 0 | 0 | 0 | 113.3 | K31 S32 L33 | K31-S35 PolarHBondContact O-N 2.99Å; K31-S35 PolarHBondContact O-OG 3.49Å; S32-S35 WeakPolarHBondContact CA-OG 3.49Å; S32-S35 PolarHBondContact O-N 2.84Å; S32-S35 PolarHBondContact O-OG 2.98Å; L33-S35 VanDerWaalsContact C-N 3.3Å; L33-S35 PolarHBondContact O-N 2.85Å |
| 36 | L | 62.7 | Low | 60.1 | Low | 139 Ų | 139 | 102.1 Ų | 102.1 | 73% | 0.728 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -90.3 | -32.9 | 179.5 | -96.5 | 84.7 | 0 | 0 | 0 | 114.1 | S32 L33 | S32-L36 WeakPolarHBondContact O-CD1 3.31Å; S32-L36 PolarHBondContact O-N 3.44Å; L33-L36 PolarHBondContact O-N 2.87Å |
| 37 | L | 59.2 | Low | 60.6 | Low | 96 Ų | 96 | 100.9 Ų | 100.9 | 50% | 0.503 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -125.5 | 21.5 | -173.6 | -62.3 | 111.9 | 0 | 0 | 0 | 112.7 | L33 E39 L41 | L33-L37 HydrophobicContact CD2-CD1 4.24Å; L33-L37 PolarHBondContact O-N 3.11Å; L37-E39 VanDerWaalsContact C-N 3.3Å; L37-E39 PolarHBondContact O-N 2.94Å; L37-L41 VanDerWaalsContact O-CB 3.23Å; L37-L41 WeakPolarHBondContact O-CB 3.35Å; L37-L41 PolarHBondContact O-N 2.92Å |
| 38 | G | 59 | Low | 61.2 | Low | 31 Ų | 31 | 100.1 Ų | 100.1 | 32% | 0.32 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -58.4 | -34.1 | -164.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | R34 S42 | R34-G38 WeakPolarHBondContact O-CA 3.36Å; R34-G38 PolarHBondContact O-N 2.92Å; R34-G38 VanDerWaalsContact O-N 3.08Å; G38-S42 WeakPolarHBondContact O-CB 3.37Å; G38-S42 PolarHBondContact O-N 3.25Å; G38-S42 PolarHBondContact O-OG 3.04Å |
| 39 | E | 60.4 | Low | 61.7 | Low | 167 Ų | 167 | 102 Ų | 102 | 78% | 0.78 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -74.6 | -58.6 | -176.8 | -65 | 157.9 | -151.3 | 0 | 0 | 110.3 | L37 L41 S42 E43 | L37-E39 VanDerWaalsContact C-N 3.3Å; L37-E39 PolarHBondContact O-N 2.94Å; E39-L41 PolarHBondContact O-N 2.88Å; E39-S42 PolarHBondContact O-N 3.47Å; E39-S42 PolarHBondContact O-OG 3.28Å; E39-E43 PolarHBondContact O-N 3.21Å |
| 40 | E | 55.9 | Low | 62.3 | Low | 143 Ų | 143 | 104.9 Ų | 104.9 | 67% | 0.668 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.9 | -39.9 | 179.1 | -65.6 | -71 | 146.3 | 0 | 0 | 113 | E43 F44 | E40-E43 PolarHBondContact O-N 2.7Å; E40-F44 PolarHBondContact O-N 3.3Å |
| 41 | L | 57.2 | Low | 62.9 | Low | 72 Ų | 72 | 107.9 Ų | 107.9 | 38% | 0.377 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -72.6 | -32.4 | -179.9 | -168.1 | 68.3 | 0 | 0 | 0 | 112 | R34 L37 E39 E43 F44 M45 | R34-L41 HydrophobicContact CG-CD2 4.44Å; L37-L41 VanDerWaalsContact O-CB 3.23Å; L37-L41 WeakPolarHBondContact O-CB 3.35Å; L37-L41 PolarHBondContact O-N 2.92Å; E39-L41 PolarHBondContact O-N 2.88Å; L41-E43 VanDerWaalsContact C-N 3.34Å; L41-F44 PolarHBondContact O-N 2.98Å; L41-M45 WeakPolarHBondContact O-CB 3.45Å; L41-M45 WeakPolarHBondContact O-CG 3.48Å; L41-M45 PolarHBondContact O-N 3.4Å |
| 42 | S | 62.2 | Low | 63.7 | Low | 74 Ų | 74 | 106.4 Ų | 106.4 | 52% | 0.517 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.7 | -38.9 | 176.5 | 72.7 | 0 | 0 | 0 | 0 | 111.7 | G38 E39 A46 | G38-S42 WeakPolarHBondContact O-CB 3.37Å; G38-S42 PolarHBondContact O-N 3.25Å; G38-S42 PolarHBondContact O-OG 3.04Å; E39-S42 PolarHBondContact O-N 3.47Å; E39-S42 PolarHBondContact O-OG 3.28Å; S42-A46 VanDerWaalsContact O-CB 3.26Å; S42-A46 WeakPolarHBondContact O-CB 3.3Å; S42-A46 PolarHBondContact O-N 3.42Å |
| 43 | E | 65.4 | Low | 64.4 | Low | 140 Ų | 140 | 111.5 Ų | 111.5 | 65% | 0.654 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -67.8 | -42.9 | 175.3 | -174.3 | 165.2 | -174.3 | 0 | 0 | 111.3 | E39 E40 L41 A46 S47 | E39-E43 PolarHBondContact O-N 3.21Å; E40-E43 PolarHBondContact O-N 2.7Å; L41-E43 VanDerWaalsContact C-N 3.34Å; E43-A46 PolarHBondContact O-N 3.2Å; E43-S47 WeakPolarHBondContact O-CB 3.3Å; E43-S47 PolarHBondContact O-N 3.2Å |
| 44 | F | 61.3 | Low | 65.2 | Low | 161 Ų | 161 | 113.7 Ų | 113.7 | 71% | 0.706 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.2 | -43.3 | 177 | -132.3 | -85.9 | 0 | 0 | 0 | 112.6 | E40 L41 S47 D48 | E40-F44 PolarHBondContact O-N 3.3Å; L41-F44 PolarHBondContact O-N 2.98Å; F44-S47 WeakPolarHBondContact O-CB 3.47Å; F44-S47 PolarHBondContact O-N 3.49Å; F44-D48 WeakPolarHBondContact O-CB 3.44Å; F44-D48 PolarHBondContact O-N 2.99Å |
| 45 | M | 60.9 | Low | 66.2 | Low | 107 Ų | 107 | 111.9 Ų | 111.9 | 53% | 0.527 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.5 | -39.4 | 176.3 | -73.7 | -155.9 | 72.9 | 0 | 0 | 112.5 | L41 S47 D48 E49 | L41-M45 WeakPolarHBondContact O-CB 3.45Å; L41-M45 WeakPolarHBondContact O-CG 3.48Å; L41-M45 PolarHBondContact O-N 3.4Å; M45-S47 VanDerWaalsContact C-N 3.29Å; M45-S47 PolarHBondContact O-N 2.89Å; M45-D48 PolarHBondContact O-N 3.31Å; M45-E49 WeakPolarHBondContact O-CB 3.34Å; M45-E49 PolarHBondContact O-N 3.26Å |
| 46 | A | 67.2 | Low | 67.2 | Low | 37 Ų | 37 | 113.4 Ų | 113.4 | 31% | 0.306 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.5 | -34.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S42 E43 R50 | S42-A46 VanDerWaalsContact O-CB 3.26Å; S42-A46 WeakPolarHBondContact O-CB 3.3Å; S42-A46 PolarHBondContact O-N 3.42Å; E43-A46 PolarHBondContact O-N 3.2Å; A46-R50 WeakPolarHBondContact O-CB 3.43Å; A46-R50 VanDerWaalsContact O-CD 3.32Å; A46-R50 WeakPolarHBondContact O-CD 3.48Å; A46-R50 WeakPolarHBondContact O-CG 3.19Å; A46-R50 PolarHBondContact O-N 2.97Å |
| 47 | S | 66.9 | Low | 68.2 | Low | 64 Ų | 64 | 110.9 Ų | 110.9 | 45% | 0.448 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -67.4 | -47.4 | 173.9 | -168.6 | 0 | 0 | 0 | 0 | 111.7 | E43 F44 M45 E49 R50 E51 | E43-S47 WeakPolarHBondContact O-CB 3.3Å; E43-S47 PolarHBondContact O-N 3.2Å; F44-S47 WeakPolarHBondContact O-CB 3.47Å; F44-S47 PolarHBondContact O-N 3.49Å; M45-S47 VanDerWaalsContact C-N 3.29Å; M45-S47 PolarHBondContact O-N 2.89Å; S47-E49 PolarHBondContact O-N 3.07Å; S47-R50 WeakPolarHBondContact O-CB 3.15Å; S47-R50 PolarHBondContact O-N 2.84Å; S47-E51 PolarHBondContact O-N 3.44Å |
| 48 | D | 72.2 | Confident | 69.4 | Low | 93 Ų | 93 | 112.6 Ų | 112.6 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.7 | -43.6 | 177.5 | -175.6 | 72.4 | 0 | 0 | 0 | 112 | F44 M45 R50 E51 Q52 | F44-D48 WeakPolarHBondContact O-CB 3.44Å; F44-D48 PolarHBondContact O-N 2.99Å; M45-D48 PolarHBondContact O-N 3.31Å; D48-R50 VanDerWaalsContact C-N 3.31Å; D48-R50 PolarHBondContact O-N 2.84Å; D48-E51 PolarHBondContact O-N 2.85Å; D48-Q52 VanDerWaalsContact O-CB 3.3Å; D48-Q52 WeakPolarHBondContact O-CB 3.39Å; D48-Q52 PolarHBondContact O-N 2.97Å |
| 49 | E | 67.9 | Low | 70.6 | Confident | 116 Ų | 116 | 113.9 Ų | 113.9 | 54% | 0.542 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.1 | -36.9 | 176.9 | -166.8 | -175.8 | 165 | 0 | 0 | 112 | M45 S47 R53 | M45-E49 WeakPolarHBondContact O-CB 3.34Å; M45-E49 PolarHBondContact O-N 3.26Å; S47-E49 PolarHBondContact O-N 3.07Å; E49-R53 WeakPolarHBondContact O-CB 3.41Å; E49-R53 PolarHBondContact O-N 2.89Å |
| 50 | R | 68.7 | Low | 71.8 | Confident | 178 Ų | 178 | 113.1 Ų | 113.1 | 67% | 0.672 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.9 | -45.4 | 175 | -73.7 | 168 | -174 | -179.9 | 4 | 111.1 | A46 S47 D48 R53 L54 | A46-R50 WeakPolarHBondContact O-CB 3.43Å; A46-R50 VanDerWaalsContact O-CD 3.32Å; A46-R50 WeakPolarHBondContact O-CD 3.48Å; A46-R50 WeakPolarHBondContact O-CG 3.19Å; A46-R50 PolarHBondContact O-N 2.97Å; S47-R50 WeakPolarHBondContact O-CB 3.15Å; S47-R50 PolarHBondContact O-N 2.84Å; D48-R50 VanDerWaalsContact C-N 3.31Å; D48-R50 PolarHBondContact O-N 2.84Å; R50-R53 WeakPolarHBondContact O-CB 3.42Å; R50-R53 PolarHBondContact O-N 3.46Å; R50-L54 VanDerWaalsContact O-CG 3.3Å; R50-L54 WeakPolarHBondContact O-CG 3.35Å; R50-L54 PolarHBondContact O-N 3.22Å |
| 51 | E | 71.4 | Confident | 73.2 | Confident | 124 Ų | 124 | 109.5 Ų | 109.5 | 58% | 0.579 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63 | -44.2 | 177.8 | -171.6 | 172.7 | 173.8 | 0 | 0 | 111.4 | S47 D48 R53 L54 E55 | S47-E51 PolarHBondContact O-N 3.44Å; D48-E51 PolarHBondContact O-N 2.85Å; E51-R53 VanDerWaalsContact C-N 3.33Å; E51-R53 PolarHBondContact O-N 3.2Å; E51-L54 PolarHBondContact O-N 3.21Å; E51-L54 VanDerWaalsContact O-N 3.11Å; E51-E55 PolarHBondContact O-N 3Å |
| 52 | Q | 76.8 | Confident | 74.5 | Confident | 136 Ų | 136 | 112.7 Ų | 112.7 | 64% | 0.636 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.5 | -38.2 | 176.8 | -161.6 | -179.9 | 46.9 | 0 | 0 | 112.1 | D48 K56 | D48-Q52 VanDerWaalsContact O-CB 3.3Å; D48-Q52 WeakPolarHBondContact O-CB 3.39Å; D48-Q52 PolarHBondContact O-N 2.97Å; Q52-K56 WeakPolarHBondContact O-CB 3.33Å; Q52-K56 PolarHBondContact O-N 3.49Å |
| 53 | R | 74.1 | Confident | 75.6 | Confident | 177 Ų | 177 | 114 Ų | 114 | 67% | 0.668 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.3 | -45 | 170.9 | -93.7 | -171.9 | 177.7 | -162.1 | 1.7 | 111.9 | E49 R50 E51 K56 V57 | E49-R53 WeakPolarHBondContact O-CB 3.41Å; E49-R53 PolarHBondContact O-N 2.89Å; R50-R53 WeakPolarHBondContact O-CB 3.42Å; R50-R53 PolarHBondContact O-N 3.46Å; E51-R53 VanDerWaalsContact C-N 3.33Å; E51-R53 PolarHBondContact O-N 3.2Å; R53-K56 PolarHBondContact O-N 3.46Å; R53-V57 WeakPolarHBondContact O-CG2 3.49Å; R53-V57 PolarHBondContact O-N 2.95Å |
| 54 | L | 76.5 | Confident | 76.4 | Confident | 122 Ų | 122 | 113.1 Ų | 113.1 | 64% | 0.639 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.1 | -42.8 | 179.9 | -70.9 | 173.1 | 0 | 0 | 0 | 111.5 | R50 E51 K56 V57 R58 | R50-L54 VanDerWaalsContact O-CG 3.3Å; R50-L54 WeakPolarHBondContact O-CG 3.35Å; R50-L54 PolarHBondContact O-N 3.22Å; E51-L54 PolarHBondContact O-N 3.21Å; E51-L54 VanDerWaalsContact O-N 3.11Å; L54-K56 PolarHBondContact O-N 3.08Å; L54-V57 PolarHBondContact O-N 2.95Å; L54-R58 VanDerWaalsContact O-CB 3.31Å; L54-R58 WeakPolarHBondContact O-CB 3.45Å; L54-R58 PolarHBondContact O-N 3.09Å |
| 55 | E | 81.6 | Confident | 77.2 | Confident | 80 Ų | 80 | 113.4 Ų | 113.4 | 37% | 0.374 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.3 | -34.6 | 175.6 | -84.6 | -58.4 | 147.6 | 0 | 0 | 112.6 | E51 V57 R58 S59 | E51-E55 PolarHBondContact O-N 3Å; E55-V57 VanDerWaalsContact C-N 3.35Å; E55-V57 PolarHBondContact O-N 3.06Å; E55-R58 PolarHBondContact O-N 3.32Å; E55-R58 VanDerWaalsContact OE1-CD 3.3Å; E55-R58 WeakPolarHBondContact OE1-CD 3.44Å; E55-R58 IonicContact OE1-CZ 3.84Å; E55-R58 IonicContact OE1-NH1 2.85Å; E55-R58 PolarHBondContact OE1-NH1 3.46Å; E55-S59 WeakPolarHBondContact O-CB 3.47Å; E55-S59 PolarHBondContact O-N 3.29Å; E55-S59 PolarHBondContact O-OG 3.13Å |
| 56 | K | 84.3 | Confident | 78 | Confident | 125 Ų | 125 | 113.4 Ų | 113.4 | 54% | 0.543 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.1 | -37.9 | 171.6 | -169.9 | 172.6 | -175.9 | 172.1 | 0 | 112.3 | Q52 R53 L54 S59 R60 | Q52-K56 WeakPolarHBondContact O-CB 3.33Å; Q52-K56 PolarHBondContact O-N 3.49Å; R53-K56 PolarHBondContact O-N 3.46Å; L54-K56 PolarHBondContact O-N 3.08Å; K56-S59 WeakPolarHBondContact CA-OG 3.4Å; K56-S59 PolarHBondContact O-OG 2.9Å; K56-R60 WeakPolarHBondContact O-CB 3.23Å; K56-R60 VanDerWaalsContact O-CG 3.23Å; K56-R60 WeakPolarHBondContact O-CG 3.28Å; K56-R60 PolarHBondContact O-N 3.35Å |
| 57 | V | 83.9 | Confident | 78.6 | Confident | 86 Ų | 86 | 116.3 Ų | 116.3 | 52% | 0.521 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69.4 | -43.8 | 174.4 | 172.1 | 0 | 0 | 0 | 0 | 110.3 | R53 L54 E55 R60 V61 | R53-V57 WeakPolarHBondContact O-CG2 3.49Å; R53-V57 PolarHBondContact O-N 2.95Å; L54-V57 PolarHBondContact O-N 2.95Å; E55-V57 VanDerWaalsContact C-N 3.35Å; E55-V57 PolarHBondContact O-N 3.06Å; V57-R60 WeakPolarHBondContact O-CB 3.45Å; V57-R60 PolarHBondContact O-N 3.32Å; V57-V61 HydrophobicContact CG1-CG2 4.42Å; V57-V61 WeakPolarHBondContact O-CG2 3.28Å; V57-V61 PolarHBondContact O-N 3.4Å |
| 58 | R | 84.3 | Confident | 79 | Confident | 131 Ų | 131 | 120.5 Ų | 120.5 | 49% | 0.494 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.7 | -45.9 | 179.2 | -169.2 | -177 | -167.3 | -178.7 | 3.9 | 112.5 | L54 E55 V61 R62 | L54-R58 VanDerWaalsContact O-CB 3.31Å; L54-R58 WeakPolarHBondContact O-CB 3.45Å; L54-R58 PolarHBondContact O-N 3.09Å; E55-R58 PolarHBondContact O-N 3.32Å; E55-R58 VanDerWaalsContact OE1-CD 3.3Å; E55-R58 WeakPolarHBondContact OE1-CD 3.44Å; E55-R58 IonicContact OE1-CZ 3.84Å; E55-R58 IonicContact OE1-NH1 2.85Å; E55-R58 PolarHBondContact OE1-NH1 3.46Å; R58-V61 PolarHBondContact O-N 3.47Å; R58-R62 VanDerWaalsContact CZ-NH2 3.35Å; R58-R62 VanDerWaalsContact NE-NH2 3.2Å; R58-R62 WeakPolarHBondContact O-CG 3.39Å; R58-R62 PolarHBondContact O-N 3.09Å |
| 59 | S | 84.3 | Confident | 79.2 | Confident | 58 Ų | 58 | 121.2 Ų | 121.2 | 41% | 0.406 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.3 | -42.4 | 175.1 | 52.5 | 0 | 0 | 0 | 0 | 111.8 | E55 K56 V61 R62 L63 | E55-S59 WeakPolarHBondContact O-CB 3.47Å; E55-S59 PolarHBondContact O-N 3.29Å; E55-S59 PolarHBondContact O-OG 3.13Å; K56-S59 WeakPolarHBondContact CA-OG 3.4Å; K56-S59 PolarHBondContact O-OG 2.9Å; S59-V61 PolarHBondContact O-N 2.79Å; S59-R62 PolarHBondContact O-N 3.11Å; S59-L63 WeakPolarHBondContact O-CB 3.45Å; S59-L63 PolarHBondContact O-N 2.93Å |
| 60 | R | 84.4 | Confident | 79.5 | Confident | 151 Ų | 151 | 120.3 Ų | 120.3 | 57% | 0.57 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61.2 | -42.3 | 173.3 | -76.7 | 174.6 | 174.7 | -168.5 | -3.7 | 112.8 | K56 V57 L63 L64 | K56-R60 WeakPolarHBondContact O-CB 3.23Å; K56-R60 VanDerWaalsContact O-CG 3.23Å; K56-R60 WeakPolarHBondContact O-CG 3.28Å; K56-R60 PolarHBondContact O-N 3.35Å; V57-R60 WeakPolarHBondContact O-CB 3.45Å; V57-R60 PolarHBondContact O-N 3.32Å; R60-L63 PolarHBondContact O-N 2.81Å; R60-L64 WeakPolarHBondContact O-CD1 3.48Å; R60-L64 PolarHBondContact O-N 3.46Å |
| 61 | V | 85.3 | Confident | 80 | Confident | 67 Ų | 67 | 116.1 Ų | 116.1 | 41% | 0.406 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 177.1 | 170.5 | 0 | 0 | 0 | 0 | 111.3 | V57 R58 S59 L64 R65 | V57-V61 HydrophobicContact CG1-CG2 4.42Å; V57-V61 WeakPolarHBondContact O-CG2 3.28Å; V57-V61 PolarHBondContact O-N 3.4Å; R58-V61 PolarHBondContact O-N 3.47Å; S59-V61 PolarHBondContact O-N 2.79Å; V61-L64 PolarHBondContact O-N 2.95Å; V61-R65 WeakPolarHBondContact O-CG 3.17Å; V61-R65 PolarHBondContact O-N 2.89Å |
| 62 | R | 85.9 | Confident | 80.1 | Confident | 139 Ų | 139 | 117 Ų | 117 | 53% | 0.525 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 174.5 | -73.7 | 175.6 | 177.1 | 159.4 | -2.7 | 111.2 | R58 S59 L64 R65 D66 | R58-R62 VanDerWaalsContact CZ-NH2 3.35Å; R58-R62 VanDerWaalsContact NE-NH2 3.2Å; R58-R62 WeakPolarHBondContact O-CG 3.39Å; R58-R62 PolarHBondContact O-N 3.09Å; S59-R62 PolarHBondContact O-N 3.11Å; R62-L64 PolarHBondContact O-N 2.87Å; R62-R65 WeakPolarHBondContact O-CB 3.4Å; R62-R65 PolarHBondContact O-N 3.16Å; R62-D66 PolarHBondContact O-N 3.26Å |
| 63 | L | 85 | Confident | 80.2 | Confident | 102 Ų | 102 | 112.4 Ų | 112.4 | 53% | 0.534 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 177.5 | -172.8 | 161.7 | 0 | 0 | 0 | 111.9 | S59 R60 R65 D66 L67 | S59-L63 WeakPolarHBondContact O-CB 3.45Å; S59-L63 PolarHBondContact O-N 2.93Å; R60-L63 PolarHBondContact O-N 2.81Å; L63-R65 VanDerWaalsContact C-N 3.29Å; L63-R65 PolarHBondContact O-N 2.82Å; L63-D66 WeakPolarHBondContact O-CB 3.42Å; L63-D66 PolarHBondContact O-N 2.8Å; L63-D66 VanDerWaalsContact O-N 3.13Å; L63-L67 HydrophobicContact CD2-CD1 3.47Å; L63-L67 VanDerWaalsContact CD2-CD1 3.47Å; L63-L67 HydrophobicContact CD2-CG 3.98Å; L63-L67 PolarHBondContact O-N 3.35Å |
| 64 | L | 81.4 | Confident | 80.5 | Confident | 121 Ų | 121 | 111.8 Ų | 111.8 | 63% | 0.634 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.5 | -36.5 | 176.6 | -105 | 116.9 | 0 | 0 | 0 | 112.7 | R60 V61 R62 D66 R68 | R60-L64 WeakPolarHBondContact O-CD1 3.48Å; R60-L64 PolarHBondContact O-N 3.46Å; V61-L64 PolarHBondContact O-N 2.95Å; R62-L64 PolarHBondContact O-N 2.87Å; L64-D66 VanDerWaalsContact C-N 3.34Å; L64-R68 WeakPolarHBondContact O-CB 3.34Å; L64-R68 PolarHBondContact O-N 3.01Å; L64-R68 VanDerWaalsContact O-N 3.08Å |
| 65 | R | 79.2 | Confident | 80.6 | Confident | 168 Ų | 168 | 108.1 Ų | 108.1 | 63% | 0.634 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.6 | -40.3 | 174.3 | -75.6 | -178.7 | -173.5 | 171 | 2.3 | 111.4 | V61 R62 L63 R68 M69 | V61-R65 WeakPolarHBondContact O-CG 3.17Å; V61-R65 PolarHBondContact O-N 2.89Å; R62-R65 WeakPolarHBondContact O-CB 3.4Å; R62-R65 PolarHBondContact O-N 3.16Å; L63-R65 VanDerWaalsContact C-N 3.29Å; L63-R65 PolarHBondContact O-N 2.82Å; R65-R68 WeakPolarHBondContact O-CB 3.15Å; R65-R68 PolarHBondContact O-N 2.7Å; R65-M69 WeakPolarHBondContact O-CG 3.17Å; R65-M69 PolarHBondContact O-N 3.4Å |
| 66 | D | 77.7 | Confident | 80.6 | Confident | 107 Ų | 107 | 110.7 Ų | 110.7 | 57% | 0.572 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.1 | -49.4 | -180 | -141.3 | 22.1 | 0 | 0 | 0 | 111.1 | R62 L63 L64 R68 M69 D70 | R62-D66 PolarHBondContact O-N 3.26Å; L63-D66 WeakPolarHBondContact O-CB 3.42Å; L63-D66 PolarHBondContact O-N 2.8Å; L63-D66 VanDerWaalsContact O-N 3.13Å; L64-D66 VanDerWaalsContact C-N 3.34Å; D66-R68 PolarHBondContact O-N 2.78Å; D66-M69 WeakPolarHBondContact O-CA 3.5Å; D66-M69 PolarHBondContact O-N 2.77Å; D66-D70 PolarHBondContact O-N 2.84Å |
| 67 | L | 78.6 | Confident | 80.3 | Confident | 98 Ų | 98 | 112.6 Ų | 112.6 | 51% | 0.513 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -57.1 | -36.2 | 172.8 | -69.4 | 176.5 | 0 | 0 | 0 | 112.7 | L63 T71 | L63-L67 HydrophobicContact CD2-CD1 3.47Å; L63-L67 VanDerWaalsContact CD2-CD1 3.47Å; L63-L67 HydrophobicContact CD2-CG 3.98Å; L63-L67 PolarHBondContact O-N 3.35Å; L67-T71 WeakPolarHBondContact O-CB 3.14Å; L67-T71 WeakPolarHBondContact O-CG2 3.48Å; L67-T71 PolarHBondContact O-N 3.14Å; L67-T71 PolarHBondContact O-OG1 3.49Å |
| 68 | R | 75.5 | Confident | 80 | Confident | 151 Ų | 151 | 111.2 Ų | 111.2 | 57% | 0.57 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.5 | -35.9 | 175.4 | -171 | -179.3 | -172.7 | -173.7 | 3.5 | 112.1 | L64 R65 D66 T71 R72 | L64-R68 WeakPolarHBondContact O-CB 3.34Å; L64-R68 PolarHBondContact O-N 3.01Å; L64-R68 VanDerWaalsContact O-N 3.08Å; R65-R68 WeakPolarHBondContact O-CB 3.15Å; R65-R68 PolarHBondContact O-N 2.7Å; D66-R68 PolarHBondContact O-N 2.78Å; R68-T71 WeakPolarHBondContact CA-OG1 3.44Å; R68-T71 PolarHBondContact O-OG1 2.84Å; R68-R72 WeakPolarHBondContact O-CG 3.27Å; R68-R72 PolarHBondContact O-N 2.75Å |
| 69 | M | 77.5 | Confident | 79.7 | Confident | 108 Ų | 108 | 113.7 Ų | 113.7 | 53% | 0.532 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -71.7 | -42.1 | 175.5 | -66 | -53.2 | 165.7 | 0 | 0 | 111.1 | R65 D66 T71 R72 A73 | R65-M69 WeakPolarHBondContact O-CG 3.17Å; R65-M69 PolarHBondContact O-N 3.4Å; D66-M69 WeakPolarHBondContact O-CA 3.5Å; D66-M69 PolarHBondContact O-N 2.77Å; M69-T71 PolarHBondContact O-N 3.23Å; M69-R72 PolarHBondContact O-N 2.97Å; M69-A73 WeakPolarHBondContact O-CB 3.4Å; M69-A73 PolarHBondContact O-N 3.33Å |
| 70 | D | 72.7 | Confident | 79.4 | Confident | 98 Ų | 98 | 116.1 Ų | 116.1 | 52% | 0.524 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61 | -43.1 | 176 | -79.1 | -26.4 | 0 | 0 | 0 | 112.4 | D66 A73 K74 | D66-D70 PolarHBondContact O-N 2.84Å; D70-A73 PolarHBondContact O-N 3.48Å; D70-K74 WeakPolarHBondContact O-CB 3.4Å; D70-K74 PolarHBondContact O-N 2.88Å |
| 71 | T | 79.4 | Confident | 78.9 | Confident | 90 Ų | 90 | 115.1 Ų | 115.1 | 55% | 0.552 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.4 | -38.6 | 176.4 | 46.6 | 0 | 0 | 0 | 0 | 112.5 | L67 R68 M69 A75 | L67-T71 WeakPolarHBondContact O-CB 3.14Å; L67-T71 WeakPolarHBondContact O-CG2 3.48Å; L67-T71 PolarHBondContact O-N 3.14Å; L67-T71 PolarHBondContact O-OG1 3.49Å; R68-T71 WeakPolarHBondContact CA-OG1 3.44Å; R68-T71 PolarHBondContact O-OG1 2.84Å; M69-T71 PolarHBondContact O-N 3.23Å; T71-A75 WeakPolarHBondContact O-CB 3.27Å; T71-A75 PolarHBondContact O-N 2.87Å |
| 72 | R | 75 | Confident | 78.2 | Confident | 142 Ų | 142 | 118.5 Ų | 118.5 | 54% | 0.536 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.5 | -47 | 174.2 | -80.5 | -176.9 | 172 | -161.8 | -2.6 | 112.1 | R68 M69 A75 M76 | R68-R72 WeakPolarHBondContact O-CG 3.27Å; R68-R72 PolarHBondContact O-N 2.75Å; M69-R72 PolarHBondContact O-N 2.97Å; R72-A75 PolarHBondContact O-N 3.01Å; R72-M76 WeakPolarHBondContact O-CG 3.41Å; R72-M76 PolarHBondContact O-N 2.91Å |
| 73 | A | 77.8 | Confident | 77 | Confident | 40 Ų | 40 | 118.2 Ų | 118.2 | 33% | 0.331 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -59 | -49.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | M69 D70 A75 M76 W77 | M69-A73 WeakPolarHBondContact O-CB 3.4Å; M69-A73 PolarHBondContact O-N 3.33Å; D70-A73 PolarHBondContact O-N 3.48Å; A73-A75 VanDerWaalsContact C-N 3.3Å; A73-A75 PolarHBondContact O-N 3.38Å; A73-M76 PolarHBondContact O-N 3.19Å; A73-M76 VanDerWaalsContact O-N 3.07Å; A73-W77 PolarHBondContact O-N 2.85Å |
| 74 | K | 81 | Confident | 75.7 | Confident | 163 Ų | 163 | 119.8 Ų | 119.8 | 71% | 0.709 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -58.4 | -39.1 | 177.3 | -172.5 | 166 | -175.6 | 165.5 | 0 | 112.8 | D70 W77 A78 | D70-K74 WeakPolarHBondContact O-CB 3.4Å; D70-K74 PolarHBondContact O-N 2.88Å; K74-W77 PolarHBondContact O-N 2.8Å; K74-A78 WeakPolarHBondContact O-CB 3.37Å; K74-A78 PolarHBondContact O-N 3.24Å |
| 75 | A | 79.1 | Confident | 74.5 | Confident | 46 Ų | 46 | 118.9 Ų | 118.9 | 38% | 0.38 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -67 | -37.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | T71 R72 A73 R79 | T71-A75 WeakPolarHBondContact O-CB 3.27Å; T71-A75 PolarHBondContact O-N 2.87Å; R72-A75 PolarHBondContact O-N 3.01Å; A73-A75 VanDerWaalsContact C-N 3.3Å; A73-A75 PolarHBondContact O-N 3.38Å; A75-R79 WeakPolarHBondContact O-CG 3.26Å; A75-R79 PolarHBondContact O-N 2.96Å |
| 76 | M | 81.4 | Confident | 73.3 | Confident | 133 Ų | 133 | 116 Ų | 116 | 66% | 0.655 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.2 | -43.3 | 174.4 | -69.9 | 177.8 | 68.5 | 0 | 0 | 111.8 | R72 A73 A78 R79 L80 | R72-M76 WeakPolarHBondContact O-CG 3.41Å; R72-M76 PolarHBondContact O-N 2.91Å; A73-M76 PolarHBondContact O-N 3.19Å; A73-M76 VanDerWaalsContact O-N 3.07Å; M76-A78 VanDerWaalsContact C-N 3.33Å; M76-A78 PolarHBondContact O-N 2.96Å; M76-R79 PolarHBondContact O-N 3.29Å; M76-L80 PolarHBondContact O-N 2.9Å |
| 77 | W | 76.9 | Confident | 72.1 | Confident | 165 Ų | 165 | 115.3 Ų | 115.3 | 63% | 0.625 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -61.5 | -40.5 | 174.7 | -74.3 | 111.8 | 0 | 0 | 0 | 112.3 | A73 K74 R79 L80 L81 | A73-W77 PolarHBondContact O-N 2.85Å; K74-W77 PolarHBondContact O-N 2.8Å; W77-R79 VanDerWaalsContact C-N 3.31Å; W77-R79 PolarHBondContact O-N 2.8Å; W77-L80 HydrophobicContact CE3-CD2 4.06Å; W77-L80 HydrophobicContact CZ3-CD2 3.98Å; W77-L80 PolarHBondContact O-N 3.41Å; W77-L81 WeakPolarHBondContact O-CB 3.34Å; W77-L81 WeakPolarHBondContact O-CD1 3.35Å; W77-L81 WeakPolarHBondContact O-CG 3.32Å; W77-L81 PolarHBondContact O-N 2.94Å |
| 78 | A | 78.8 | Confident | 71 | Confident | 57 Ų | 57 | 122.1 Ų | 122.1 | 47% | 0.471 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -61.6 | -38.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | K74 M76 N82 | K74-A78 WeakPolarHBondContact O-CB 3.37Å; K74-A78 PolarHBondContact O-N 3.24Å; M76-A78 VanDerWaalsContact C-N 3.33Å; M76-A78 PolarHBondContact O-N 2.96Å; A78-N82 VanDerWaalsContact O-CB 3.28Å; A78-N82 WeakPolarHBondContact O-CB 3.47Å; A78-N82 PolarHBondContact O-N 3.39Å; A78-N82 VanDerWaalsContact O-N 3.09Å |
| 79 | R | 77.3 | Confident | 70 | Confident | 183 Ų | 183 | 126.2 Ų | 126.2 | 69% | 0.691 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -67 | -46.1 | 174.5 | -69.7 | 174.7 | -174.3 | -179.7 | 0.4 | 111.5 | A75 M76 W77 L81 N82 D83 | A75-R79 WeakPolarHBondContact O-CG 3.26Å; A75-R79 PolarHBondContact O-N 2.96Å; M76-R79 PolarHBondContact O-N 3.29Å; W77-R79 VanDerWaalsContact C-N 3.31Å; W77-R79 PolarHBondContact O-N 2.8Å; R79-L81 VanDerWaalsContact C-N 3.33Å; R79-L81 PolarHBondContact O-N 3.38Å; R79-N82 CarbonylContact O-C 3.56Å; R79-N82 PolarHBondContact O-N 2.91Å; R79-N82 VanDerWaalsContact O-N 3.11Å; R79-D83 WeakPolarHBondContact O-CB 3.23Å; R79-D83 PolarHBondContact O-N 3.43Å |
| 80 | L | 77.6 | Confident | 68.9 | Low | 109 Ų | 109 | 129.6 Ų | 129.6 | 57% | 0.571 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -61.3 | -39.7 | 178.8 | -176.6 | 64.3 | 0 | 0 | 0 | 112.7 | M76 W77 N82 D83 Q84 | M76-L80 PolarHBondContact O-N 2.9Å; W77-L80 HydrophobicContact CE3-CD2 4.06Å; W77-L80 HydrophobicContact CZ3-CD2 3.98Å; W77-L80 PolarHBondContact O-N 3.41Å; L80-N82 VanDerWaalsContact C-N 3.34Å; L80-D83 PolarHBondContact O-N 2.91Å; L80-Q84 PolarHBondContact O-N 3.47Å |
| 81 | L | 74.9 | Confident | 67.8 | Low | 131 Ų | 131 | 134.2 Ų | 134.2 | 69% | 0.686 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -68.7 | -32.8 | 175.2 | -75 | 160.5 | 0 | 0 | 0 | 112.4 | W77 R79 | W77-L81 WeakPolarHBondContact O-CB 3.34Å; W77-L81 WeakPolarHBondContact O-CD1 3.35Å; W77-L81 WeakPolarHBondContact O-CG 3.32Å; W77-L81 PolarHBondContact O-N 2.94Å; R79-L81 VanDerWaalsContact C-N 3.33Å; R79-L81 PolarHBondContact O-N 3.38Å |
| 82 | N | 68.7 | Low | 66.5 | Low | 138 Ų | 138 | 134.2 Ų | 134.2 | 74% | 0.738 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -81.5 | -23.4 | 177.2 | -166.3 | 65.7 | 0 | 0 | 0 | 113.1 | A78 R79 L80 Q84 | A78-N82 VanDerWaalsContact O-CB 3.28Å; A78-N82 WeakPolarHBondContact O-CB 3.47Å; A78-N82 PolarHBondContact O-N 3.39Å; A78-N82 VanDerWaalsContact O-N 3.09Å; R79-N82 CarbonylContact O-C 3.56Å; R79-N82 PolarHBondContact O-N 2.91Å; R79-N82 VanDerWaalsContact O-N 3.11Å; L80-N82 VanDerWaalsContact C-N 3.34Å; N82-Q84 VanDerWaalsContact C-N 3.29Å |
| 83 | D | 62 | Low | 65.4 | Low | 133 Ų | 133 | 134.6 Ų | 134.6 | 71% | 0.711 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -82.8 | -1.4 | 173.9 | -108.3 | -13.2 | 0 | 0 | 0 | 113.2 | R79 L80 P85 | R79-D83 WeakPolarHBondContact O-CB 3.23Å; R79-D83 PolarHBondContact O-N 3.43Å; L80-D83 PolarHBondContact O-N 2.91Å; D83-P85 VanDerWaalsContact O-CD 3.28Å; D83-P85 WeakPolarHBondContact O-CD 3.44Å; D83-P85 VanDerWaalsContact O-N 3.09Å |
| 84 | Q | 57.7 | Low | 64.1 | Low | 134 Ų | 134 | 138.5 Ų | 138.5 | 63% | 0.626 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -59.9 | 117.4 | 162.6 | -82.7 | -74 | 21 | 0 | 0 | 107.4 | L80 N82 S86 | L80-Q84 PolarHBondContact O-N 3.47Å; N82-Q84 VanDerWaalsContact C-N 3.29Å; Q84-S86 PolarHBondContact O-N 3.3Å |
| 85 | P | 54.8 | Low | 62.8 | Low | 103 Ų | 103 | 139.9 Ų | 139.9 | 67% | 0.669 | 71% | 0.706 | S | S | * | * | trans | -60 | 110.4 | 177.7 | 25.3 | -31.5 | 0 | 0 | 0 | 105.2 | D83 A87 | D83-P85 VanDerWaalsContact O-CD 3.28Å; D83-P85 WeakPolarHBondContact O-CD 3.44Å; D83-P85 VanDerWaalsContact O-N 3.09Å; P85-A87 VanDerWaalsContact C-N 3.35Å; P85-A87 PolarHBondContact O-N 2.9Å | ||
| 86 | S | 54.8 | Low | 61 | Low | 108 Ų | 108 | 147.1 Ų | 147.1 | 76% | 0.755 | 73% | 0.729 | S | S | * | * | trans | -46.8 | 108.9 | 174.8 | -17.8 | 0 | 0 | 0 | 0 | 104.6 | Q84 R88 | Q84-S86 PolarHBondContact O-N 3.3Å; S86-R88 VanDerWaalsContact C-N 3.35Å; S86-R88 WeakPolarHBondContact O-CA 3.49Å; S86-R88 PolarHBondContact O-N 3.45Å | ||
| 87 | A | 53 | Low | 59.4 | Low | 92 Ų | 92 | 144.5 Ų | 144.5 | 76% | 0.76 | 74% | 0.736 | S | S | * | * | trans | -47.3 | 109.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 105.5 | P85 R89 | P85-A87 VanDerWaalsContact C-N 3.35Å; P85-A87 PolarHBondContact O-N 2.9Å; A87-R89 PolarHBondContact O-N 3.36Å | ||
| 88 | R | 55.1 | Low | 57.7 | Low | 240 Ų | 240 | 142.5 Ų | 142.5 | 91% | 0.906 | 75% | 0.748 | S | S | * | * | trans | -46.2 | 107.6 | -169.7 | -106.8 | 173.3 | -96.6 | -166.6 | -7.5 | 105.4 | S86 H90 | S86-R88 VanDerWaalsContact C-N 3.35Å; S86-R88 WeakPolarHBondContact O-CA 3.49Å; S86-R88 PolarHBondContact O-N 3.45Å; R88-H90 PolarHBondContact O-N 2.89Å | ||
| 89 | R | 53.6 | Low | 56.4 | Low | 238 Ų | 238 | 144.3 Ų | 144.3 | 90% | 0.898 | 76% | 0.762 | S | S | * | * | trans | -51.1 | 112.4 | 172.2 | -76.3 | -171.5 | 179.8 | -165.6 | 1.3 | 104.4 | A87 K91 | A87-R89 PolarHBondContact O-N 3.36Å; R89-K91 PolarHBondContact O-N 3.27Å | ||
| 90 | H | 54.6 | Low | 55.2 | Low | 178 Ų | 178 | 139.8 Ų | 139.8 | 82% | 0.824 | 76% | 0.764 | S | S | * | * | trans | -66.9 | 80.5 | 176.9 | -169.1 | -67.5 | 0 | 0 | 0 | 106.4 | R88 S92 | R88-H90 PolarHBondContact O-N 2.89Å; H90-S92 VanDerWaalsContact C-N 3.31Å; H90-S92 PolarHBondContact O-N 3.38Å | ||
| 91 | K | 50.3 | Low | 53.9 | Low | 196 Ų | 196 | 146.1 Ų | 146.1 | 85% | 0.852 | 78% | 0.78 | S | S | * | * | trans | -69.2 | 97.9 | 172.4 | -124.6 | 176.2 | 178.8 | -178.1 | 0 | 104.6 | R89 N93 | R89-K91 PolarHBondContact O-N 3.27Å; K91-N93 PolarHBondContact O-N 2.97Å | ||
| 92 | S | 51.2 | Low | 53.1 | Low | 90 Ų | 90 | 145.7 Ų | 145.7 | 63% | 0.629 | 79% | 0.788 | S | S | * | * | trans | -52.7 | 110.9 | 169.8 | 44.4 | 0 | 0 | 0 | 0 | 107.9 | H90 T94 | H90-S92 VanDerWaalsContact C-N 3.31Å; H90-S92 PolarHBondContact O-N 3.38Å; S92-T94 PolarHBondContact O-N 3.45Å | ||
| 93 | N | 52.5 | Low | 52.4 | Low | 149 Ų | 149 | 142.6 Ų | 142.6 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -76.2 | 79.4 | 177 | -165.9 | 30.1 | 0 | 0 | 0 | 108.2 | K91 K95 | K91-N93 PolarHBondContact O-N 2.97Å; N93-K95 PolarHBondContact O-N 2.93Å | ||
| 94 | T | 50.7 | Low | 52.3 | Low | 123 Ų | 123 | 138.9 Ų | 138.9 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | trans | -88.4 | 91 | 168.1 | -54.8 | 0 | 0 | 0 | 0 | 108.4 | S92 K96 | S92-T94 PolarHBondContact O-N 3.45Å; T94-K96 PolarHBondContact O-N 3.05Å | ||
| 95 | K | 54.2 | Low | 52.3 | Low | 192 Ų | 192 | 141.4 Ų | 141.4 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -56.1 | 115.5 | 159.7 | -98.6 | 178.4 | 171.5 | 177.2 | 0 | 108.9 | N93 | N93-K95 PolarHBondContact O-N 2.93Š| ||
| 96 | K | 39.9 | Very low | 52.3 | Low | 197 Ų | 197 | 140.4 Ų | 140.4 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | trans | -154.2 | 107.9 | 141 | -157 | 165.4 | -178 | 176.5 | 0 | 108.9 | T94 | T94-K96 PolarHBondContact O-N 3.05Š| ||
| 97 | G | 48.2 | Very low | 52.3 | Low | 78 Ų | 78 | 141.8 Ų | 141.8 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -62.1 | 147.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 98 | S | 42.2 | Very low | 52.4 | Low | 124 Ų | 124 | 147.2 Ų | 147.2 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -148.9 | 127.8 | 141.9 | -173.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 99 | A | 50.8 | Low | 52.6 | Low | 94 Ų | 94 | 142.9 Ų | 142.9 | 78% | 0.777 | 78% | 0.783 | S | S | * | * | trans | -61.5 | 174.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 100 | A | 51.4 | Low | 52.8 | Low | 88 Ų | 88 | 137.5 Ų | 137.5 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | trans | 94.2 | 85.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 101 | R | 52.1 | Low | 53.1 | Low | 242 Ų | 242 | 138.7 Ų | 138.7 | 91% | 0.913 | 77% | 0.769 | S | S | * | * | -174.3 | 98 | 122.4 | -98 | 174.5 | -97.5 | -170.3 | -4.3 | 110.9 | |||||
| 102 | S | 57.5 | Low | 53.3 | Low | 122 Ų | 122 | 137.9 Ų | 137.9 | 85% | 0.853 | 77% | 0.773 | S | S | * | * | trans | 15.5 | 118 | 152.9 | 58.6 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 103 | G | 53.5 | Low | 53.3 | Low | 73 Ų | 73 | 136.9 Ų | 136.9 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | 179.7 | 71.8 | 163.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | F105 | G103-F105 PolarHBondContact O-N 2.84Å; G103-F105 VanDerWaalsContact O-N 3.1Å | ||
| 104 | C | 60.6 | Low | 53.5 | Low | 55 Ų | 55 | 136.4 Ų | 136.4 | 37% | 0.372 | 78% | 0.779 | S | S | . | * | S | Bend | trans | -67.2 | 6.1 | 170.6 | 179.2 | 0 | 0 | 0 | 0 | 113.8 | C120 | C104-C120 HydrophobicContact CB-CB 4.04Å; C104-C120 WeakPolarHBondContact SG-CA 3.25Å; C104-C120 PolarHBondContact SG-N 3.42Å |
| 105 | F | 57.1 | Low | 53.8 | Low | 187 Ų | 187 | 138.5 Ų | 138.5 | 82% | 0.82 | 78% | 0.784 | S | S | * | * | trans | -137.6 | 84.9 | -175.4 | -81.3 | -88.1 | 0 | 0 | 0 | 110.7 | G103 | G103-F105 PolarHBondContact O-N 2.84Å; G103-F105 VanDerWaalsContact O-N 3.1Å | ||
| 106 | G | 55.5 | Low | 53.7 | Low | 82 Ų | 82 | 134.6 Ų | 134.6 | 85% | 0.845 | 78% | 0.781 | S | S | * | * | trans | -132.8 | 31.6 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 107 | H | 54.5 | Low | 54.7 | Low | 138 Ų | 138 | 128.9 Ų | 128.9 | 64% | 0.639 | 78% | 0.777 | S | S | * | * | trans | -61.7 | 135.2 | -159.2 | -161.1 | 95.2 | 0 | 0 | 0 | 115.9 | M109 | H107-M109 PolarHBondContact CD2-N 3.42Å; H107-M109 VanDerWaalsContact CD2-N 3.25Å; H107-M109 WeakPolarHBondContact CE1-CB 3.36Å; H107-M109 WeakPolarHBondContact CE1-CG 3.27Å; H107-M109 WeakPolarHBondContact ND1-CG 3.47Å; H107-M109 WeakPolarHBondContact NE2-CB 3.18Å; H107-M109 PolarHBondContact NE2-N 3.32Å | ||
| 108 | K | 54.4 | Low | 54.8 | Low | 206 Ų | 206 | 133.7 Ų | 133.7 | 90% | 0.896 | 78% | 0.781 | S | S | * | * | -137.9 | 95.1 | 121.2 | -131.5 | -173.2 | -170.5 | -173.1 | 0 | 106.8 | D110 | K108-D110 PolarHBondContact O-N 2.88Š| |||
| 109 | M | 60.5 | Low | 55.2 | Low | 148 Ų | 148 | 131 Ų | 131 | 73% | 0.729 | 77% | 0.773 | S | S | * | * | trans | -64.5 | 130.4 | 168.1 | -80.5 | -89.3 | -75 | 0 | 0 | 108 | H107 | H107-M109 PolarHBondContact CD2-N 3.42Å; H107-M109 VanDerWaalsContact CD2-N 3.25Å; H107-M109 WeakPolarHBondContact CE1-CB 3.36Å; H107-M109 WeakPolarHBondContact CE1-CG 3.27Å; H107-M109 WeakPolarHBondContact ND1-CG 3.47Å; H107-M109 WeakPolarHBondContact NE2-CB 3.18Å; H107-M109 PolarHBondContact NE2-N 3.32Å | ||
| 110 | D | 58 | Low | 55.1 | Low | 125 Ų | 125 | 134.6 Ų | 134.6 | 67% | 0.668 | 79% | 0.791 | S | S | * | * | trans | -93.1 | 121.5 | 170.8 | -146.5 | 19.2 | 0 | 0 | 0 | 108.3 | K108 | K108-D110 PolarHBondContact O-N 2.88Š| ||
| 111 | R | 59.6 | Low | 55.2 | Low | 203 Ų | 203 | 137 Ų | 137 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | trans | 73.6 | 108.2 | 153.3 | -60.2 | 170 | -167.1 | -142.1 | -3.3 | 119 | ||||
| 112 | I | 54.8 | Low | 55.4 | Low | 180 Ų | 180 | 131.4 Ų | 131.4 | 92% | 0.923 | 79% | 0.787 | S | S | * | * | trans | 31.5 | 111.1 | 131 | -52.9 | 171.1 | 0 | 0 | 0 | 115.9 | ||||
| 113 | G | 52.2 | Low | 55.3 | Low | 68 Ų | 68 | 131.9 Ų | 131.9 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | trans | 155.8 | 109.5 | 161.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | I115 | G113-I115 PolarHBondContact O-N 3.45Å; G113-I115 VanDerWaalsContact O-N 3.09Å | ||
| 114 | T | 56.3 | Low | 55.4 | Low | 139 Ų | 139 | 135.4 Ų | 135.4 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -50.1 | 105.2 | 173.6 | 47.9 | 0 | 0 | 0 | 0 | 112.6 | ||
| 115 | I | 55.6 | Low | 55.1 | Low | 167 Ų | 167 | 140.4 Ų | 140.4 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | 151.9 | 102.2 | 152.8 | -77.6 | 148.8 | 0 | 0 | 0 | 107.6 | G113 | G113-I115 PolarHBondContact O-N 3.45Å; G113-I115 VanDerWaalsContact O-N 3.09Å | ||
| 116 | S | 53.6 | Low | 54.9 | Low | 111 Ų | 111 | 137.3 Ų | 137.3 | 78% | 0.776 | 81% | 0.811 | S | S | * | * | trans | -177.7 | 78.6 | 135.1 | -169.1 | 0 | 0 | 0 | 0 | 106.8 | M118 | S116-M118 PolarHBondContact O-N 3.33Š| ||
| 117 | G | 59.6 | Low | 54.9 | Low | 76 Ų | 76 | 141.3 Ų | 141.3 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | -69 | 109.5 | 163.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 118 | M | 51.7 | Low | 54.9 | Low | 180 Ų | 180 | 141.5 Ų | 141.5 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | trans | -177.6 | 119 | 148.7 | -103.3 | 165.9 | 54.9 | 0 | 0 | 107 | S116 | S116-M118 PolarHBondContact O-N 3.33Š| ||
| 119 | G | 50.1 | Low | 55 | Low | 67 Ų | 67 | 136.2 Ų | 136.2 | 69% | 0.691 | 82% | 0.815 | S | S | * | * | trans | -68.9 | 161.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 120 | C | 47.4 | Very low | 54.4 | Low | 170 Ų | 170 | 135.1 Ų | 135.1 | 100% | 1.149 | 82% | 0.823 | S | S | * | * | trans | 66.8 | 0 | 170.1 | -49 | 0 | 0 | 0 | 0 | 116.9 | C104 | C104-C120 HydrophobicContact CB-CB 4.04Å; C104-C120 WeakPolarHBondContact SG-CA 3.25Å; C104-C120 PolarHBondContact SG-N 3.42Å |
Retrieved 120 of 120 residues in 160.8 ms
(Link to these results)