| 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 | 56.6 | Low | 54.5 | Low | 197 Ų | 197 | 142.4 Ų | 142.4 | 97% | 0.97 | 67% | 0.671 | S | S | * | * | 0 | -49.2 | 0 | -85.2 | -166.3 | -84.9 | 0 | 0 | 112 | E3 M4 | M1-E3 PolarHBondContact O-N 2.84Å; M1-M4 PolarHBondContact O-N 3.24Å | |||
| 2 | L | 56.2 | Low | 54.3 | Low | 148 Ų | 148 | 138.5 Ų | 138.5 | 78% | 0.775 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -60 | -39.6 | 174.3 | -80.2 | 158.7 | 0 | 0 | 0 | 113.7 | M4 L5 E6 | L2-M4 PolarHBondContact O-N 3.2Å; L2-L5 PolarHBondContact O-N 3.18Å; L2-E6 PolarHBondContact O-N 3.22Å |
| 3 | E | 58.2 | Low | 54 | Low | 166 Ų | 166 | 141.2 Ų | 141.2 | 78% | 0.776 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -58.3 | -29.3 | 174.5 | -101 | 174.9 | 151.7 | 0 | 0 | 114.2 | M1 Y7 | M1-E3 PolarHBondContact O-N 2.84Å; E3-Y7 PolarHBondContact O-N 3.46Å; E3-Y7 VanDerWaalsContact O-N 3.1Å |
| 4 | M | 55.2 | Low | 54.2 | Low | 126 Ų | 126 | 138.1 Ų | 138.1 | 62% | 0.621 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -79.9 | -29.4 | -177.3 | -145.4 | -177.9 | -56.8 | 0 | 0 | 111.8 | M1 L2 N8 | M1-M4 PolarHBondContact O-N 3.24Å; L2-M4 PolarHBondContact O-N 3.2Å; M4-N8 PolarHBondContact O-N 3.21Å; M4-N8 PolarHBondContact O-ND2 3.47Å |
| 5 | L | 55.9 | Low | 54.4 | Low | 126 Ų | 126 | 137.8 Ų | 137.8 | 66% | 0.66 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -75.3 | -33.1 | 173.5 | -73.2 | 165.4 | 0 | 0 | 0 | 111.2 | L2 N8 H9 | L2-L5 PolarHBondContact O-N 3.18Å; L5-N8 PolarHBondContact O-N 3.27Å; L5-H9 PolarHBondContact O-N 3.45Å |
| 6 | E | 55.2 | Low | 54.7 | Low | 114 Ų | 114 | 138.1 Ų | 138.1 | 53% | 0.533 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -66.5 | -43.8 | 172.2 | -153 | -164.8 | 110.3 | 0 | 0 | 110.8 | L2 N8 H9 Y10 | L2-E6 PolarHBondContact O-N 3.22Å; E6-N8 VanDerWaalsContact C-N 3.28Å; E6-N8 PolarHBondContact O-N 3.04Å; E6-H9 WeakPolarHBondContact O-CB 3.38Å; E6-H9 PolarHBondContact O-N 3.28Å; E6-Y10 HydrophobicContact CG-CE2 3.8Å; E6-Y10 WeakPolarHBondContact O-CD2 3.05Å; E6-Y10 PolarHBondContact O-N 3.38Å; E6-Y10 WeakPolarHBondContact OE1-CE2 3.4Å |
| 7 | Y | 51.2 | Low | 54.9 | Low | 154 Ų | 154 | 136.6 Ų | 136.6 | 60% | 0.604 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -60.7 | -32.4 | 175.8 | -169.8 | -101.4 | 0 | 0 | 0 | 113.8 | E3 Y10 Q11 | E3-Y7 PolarHBondContact O-N 3.46Å; E3-Y7 VanDerWaalsContact O-N 3.1Å; Y7-Y10 PolarHBondContact O-N 3.1Å; Y7-Q11 PolarHBondContact O-N 3.34Å |
| 8 | N | 53.2 | Low | 54.7 | Low | 99 Ų | 99 | 133.6 Ų | 133.6 | 53% | 0.529 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -77.1 | -21.5 | 175.3 | -85.7 | -89 | 0 | 0 | 0 | 113.5 | M4 L5 E6 Y10 | M4-N8 PolarHBondContact O-N 3.21Å; M4-N8 PolarHBondContact O-ND2 3.47Å; L5-N8 PolarHBondContact O-N 3.27Å; E6-N8 VanDerWaalsContact C-N 3.28Å; E6-N8 PolarHBondContact O-N 3.04Å; N8-Y10 VanDerWaalsContact C-N 3.34Å |
| 9 | H | 55.3 | Low | 55 | Low | 149 Ų | 149 | 131.2 Ų | 131.2 | 69% | 0.69 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -74 | -28.6 | 172 | -168.9 | 86.1 | 0 | 0 | 0 | 111.8 | L5 E6 | L5-H9 PolarHBondContact O-N 3.45Å; E6-H9 WeakPolarHBondContact O-CB 3.38Å; E6-H9 PolarHBondContact O-N 3.28Å |
| 10 | Y | 55.2 | Low | 55.7 | Low | 158 Ų | 158 | 128.6 Ų | 128.6 | 62% | 0.62 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -82.7 | -14 | 175 | -66.6 | -71.1 | 0 | 0 | 0 | 114.6 | E6 Y7 N8 V12 | E6-Y10 HydrophobicContact CG-CE2 3.8Å; E6-Y10 WeakPolarHBondContact O-CD2 3.05Å; E6-Y10 PolarHBondContact O-N 3.38Å; E6-Y10 WeakPolarHBondContact OE1-CE2 3.4Å; Y7-Y10 PolarHBondContact O-N 3.1Å; N8-Y10 VanDerWaalsContact C-N 3.34Å; Y10-V12 PolarHBondContact O-N 2.62Å |
| 11 | Q | 47.4 | Very low | 56.5 | Low | 129 Ų | 129 | 127.9 Ų | 127.9 | 60% | 0.603 | 63% | 0.631 | S | S | * | * | trans | -78.7 | 49.5 | 161.7 | -67.1 | -150.5 | 82.2 | 0 | 0 | 110.5 | Y7 Q13 | Y7-Q11 PolarHBondContact O-N 3.34Å; Q11-Q13 PolarHBondContact O-N 3.03Å | ||
| 12 | V | 51.5 | Low | 57.4 | Low | 96 Ų | 96 | 125.6 Ų | 125.6 | 58% | 0.582 | 61% | 0.613 | S | S | * | * | trans | -35.7 | 118.3 | 154 | 172.9 | 0 | 0 | 0 | 0 | 106 | Y10 T14 | Y10-V12 PolarHBondContact O-N 2.62Å; V12-T14 HydrophobicContact CB-CG2 4.43Å; V12-T14 HydrophobicContact CG1-CG2 3.96Å; V12-T14 PolarHBondContact O-N 2.93Å | ||
| 13 | Q | 51.3 | Low | 58.6 | Low | 174 Ų | 174 | 124.2 Ų | 124.2 | 81% | 0.813 | 60% | 0.602 | S | S | * | * | trans | -56.3 | 79.9 | 169.9 | -173.3 | 83.3 | 27.7 | 0 | 0 | 108 | Q11 H15 | Q11-Q13 PolarHBondContact O-N 3.03Å; Q13-H15 PolarHBondContact O-N 3.2Å | ||
| 14 | T | 56 | Low | 59.9 | Low | 98 Ų | 98 | 120.3 Ų | 120.3 | 60% | 0.601 | 59% | 0.586 | S | S | * | * | trans | -79.6 | 79.7 | 166 | 56.7 | 0 | 0 | 0 | 0 | 103.8 | V12 L16 | V12-T14 HydrophobicContact CB-CG2 4.43Å; V12-T14 HydrophobicContact CG1-CG2 3.96Å; V12-T14 PolarHBondContact O-N 2.93Å; T14-L16 PolarHBondContact O-N 2.99Å | ||
| 15 | H | 58.1 | Low | 61.4 | Low | 133 Ų | 133 | 118.4 Ų | 118.4 | 62% | 0.616 | 58% | 0.575 | S | S | * | * | trans | -65.7 | 83.6 | 154.9 | -167.6 | -110.6 | 0 | 0 | 0 | 105.2 | Q13 E17 | Q13-H15 PolarHBondContact O-N 3.2Å; H15-E17 WeakPolarHBondContact CE1-CB 3.48Å; H15-E17 IonicContact CE1-OE2 3.2Å; H15-E17 PolarHBondContact CE1-OE2 2.69Å; H15-E17 WeakPolarHBondContact ND1-CB 3.37Å; H15-E17 IonicContact NE2-OE2 3.92Å; H15-E17 PolarHBondContact O-N 2.76Å | ||
| 16 | L | 58.2 | Low | 62.9 | Low | 143 Ų | 143 | 116 Ų | 116 | 75% | 0.749 | 56% | 0.561 | S | S | * | * | trans | -72.4 | 33.1 | -179.3 | -144.5 | 88.9 | 0 | 0 | 0 | 109.5 | T14 N18 | T14-L16 PolarHBondContact O-N 2.99Å; L16-N18 PolarHBondContact O-N 2.84Å | ||
| 17 | E | 59.3 | Low | 64.2 | Low | 112 Ų | 112 | 113.1 Ų | 113.1 | 52% | 0.523 | 56% | 0.556 | S | S | . | * | S | Bend | trans | -74.9 | 65.6 | 156.9 | -146.6 | -178.2 | 145.2 | 0 | 0 | 106.7 | H15 K21 | H15-E17 WeakPolarHBondContact CE1-CB 3.48Å; H15-E17 IonicContact CE1-OE2 3.2Å; H15-E17 PolarHBondContact CE1-OE2 2.69Å; H15-E17 WeakPolarHBondContact ND1-CB 3.37Å; H15-E17 IonicContact NE2-OE2 3.92Å; H15-E17 PolarHBondContact O-N 2.76Å; E17-K21 IonicContact OE1-NZ 3.61Å |
| 18 | N | 50.7 | Low | 66.1 | Low | 82 Ų | 82 | 110.9 Ų | 110.9 | 44% | 0.439 | 55% | 0.552 | S | S | . | * | trans | 13.6 | 99.7 | 172.5 | -167.9 | -62.8 | 0 | 0 | 0 | 111.3 | L16 T20 K21 | L16-N18 PolarHBondContact O-N 2.84Å; N18-T20 CarbonylContact O-C 3.58Å; N18-T20 PolarHBondContact O-N 3.49Å; N18-T20 WeakPolarHBondContact OD1-CA 3.36Å; N18-T20 WeakPolarHBondContact OD1-CB 3.27Å; N18-T20 PolarHBondContact OD1-N 3.32Å; N18-T20 PolarHBondContact OD1-OG1 3.47Å; N18-K21 HydrophobicContact CB-CB 3.91Å; N18-K21 WeakPolarHBondContact O-CB 3.28Å; N18-K21 PolarHBondContact O-N 2.83Å; N18-K21 PolarHBondContact OD1-N 2.91Å; N18-K21 VanDerWaalsContact OD1-N 3.14Å | ||
| 19 | P | 60.4 | Low | 68 | Low | 89 Ų | 89 | 114.1 Ų | 114.1 | 58% | 0.578 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -49.3 | -34.8 | -176.9 | 17.8 | -30.8 | 0 | 0 | 0 | 110.7 | K21 Y22 H23 | P19-K21 PolarHBondContact O-N 2.67Å; P19-Y22 PolarHBondContact O-N 3.28Å; P19-H23 PolarHBondContact O-N 3.43Å; P19-H23 PolarHBondContact O-ND1 2.93Å |
| 20 | T | 69.6 | Low | 69.6 | Low | 78 Ų | 78 | 112.6 Ų | 112.6 | 48% | 0.479 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64 | -36.2 | 175.7 | -30.6 | 0 | 0 | 0 | 0 | 114.2 | N18 Y22 H23 I24 | N18-T20 CarbonylContact O-C 3.58Å; N18-T20 PolarHBondContact O-N 3.49Å; N18-T20 WeakPolarHBondContact OD1-CA 3.36Å; N18-T20 WeakPolarHBondContact OD1-CB 3.27Å; N18-T20 PolarHBondContact OD1-N 3.32Å; N18-T20 PolarHBondContact OD1-OG1 3.47Å; T20-Y22 PolarHBondContact O-N 3.5Å; T20-H23 PolarHBondContact O-N 3.5Å; T20-I24 HydrophobicContact CG2-CD1 3.53Å; T20-I24 HydrophobicContact CG2-CG1 4Å; T20-I24 VanDerWaalsContact O-CB 3.25Å; T20-I24 WeakPolarHBondContact O-CB 3.47Å; T20-I24 WeakPolarHBondContact O-CD1 3.22Å; T20-I24 WeakPolarHBondContact O-CG1 3.43Å; T20-I24 PolarHBondContact O-N 2.75Å |
| 21 | K | 71.6 | Confident | 71.2 | Confident | 115 Ų | 115 | 111.3 Ų | 111.3 | 50% | 0.5 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 178.5 | -176.1 | -171.1 | 174.6 | -159.8 | 0 | 111.7 | E17 N18 P19 Q25 | E17-K21 IonicContact OE1-NZ 3.61Å; N18-K21 HydrophobicContact CB-CB 3.91Å; N18-K21 WeakPolarHBondContact O-CB 3.28Å; N18-K21 PolarHBondContact O-N 2.83Å; N18-K21 PolarHBondContact OD1-N 2.91Å; N18-K21 VanDerWaalsContact OD1-N 3.14Å; P19-K21 PolarHBondContact O-N 2.67Å; K21-Q25 VanDerWaalsContact O-CB 3.22Å; K21-Q25 WeakPolarHBondContact O-CB 3.16Å; K21-Q25 PolarHBondContact O-N 2.79Å |
| 22 | Y | 76.1 | Confident | 73.2 | Confident | 148 Ų | 148 | 109 Ų | 109 | 58% | 0.58 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.8 | -47.1 | 177.2 | -179 | -96 | 0 | 0 | 0 | 111.3 | P19 T20 I24 Q25 Q26 | P19-Y22 PolarHBondContact O-N 3.28Å; T20-Y22 PolarHBondContact O-N 3.5Å; Y22-I24 PolarHBondContact O-N 3.26Å; Y22-Q25 PolarHBondContact O-N 2.91Å; Y22-Q26 VanDerWaalsContact CE1-OE1 3.26Å; Y22-Q26 VanDerWaalsContact O-CB 3.28Å; Y22-Q26 WeakPolarHBondContact O-CB 3.25Å; Y22-Q26 PolarHBondContact O-N 3.44Å |
| 23 | H | 80.5 | Confident | 75 | Confident | 119 Ų | 119 | 111.9 Ų | 111.9 | 55% | 0.551 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.6 | -42.4 | 178.9 | -68.1 | 95.2 | 0 | 0 | 0 | 112.5 | P19 T20 Q26 A27 | P19-H23 PolarHBondContact O-N 3.43Å; P19-H23 PolarHBondContact O-ND1 2.93Å; T20-H23 PolarHBondContact O-N 3.5Å; H23-Q26 PolarHBondContact O-N 3.37Å; H23-A27 VanDerWaalsContact O-CB 3.29Å; H23-A27 WeakPolarHBondContact O-CB 3.09Å; H23-A27 PolarHBondContact O-N 3.46Å |
| 24 | I | 85.2 | Confident | 76.5 | Confident | 85 Ų | 85 | 110.1 Ų | 110.1 | 44% | 0.436 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63 | -47 | 175.1 | -70.9 | 165.7 | 0 | 0 | 0 | 110.1 | T20 Y22 Q26 A27 Q28 | T20-I24 HydrophobicContact CG2-CD1 3.53Å; T20-I24 HydrophobicContact CG2-CG1 4Å; T20-I24 VanDerWaalsContact O-CB 3.25Å; T20-I24 WeakPolarHBondContact O-CB 3.47Å; T20-I24 WeakPolarHBondContact O-CD1 3.22Å; T20-I24 WeakPolarHBondContact O-CG1 3.43Å; T20-I24 PolarHBondContact O-N 2.75Å; Y22-I24 PolarHBondContact O-N 3.26Å; I24-Q26 VanDerWaalsContact C-N 3.32Å; I24-Q26 PolarHBondContact O-N 3.14Å; I24-A27 PolarHBondContact O-N 3.25Å; I24-Q28 HydrophobicContact CG2-CG 4.32Å; I24-Q28 WeakPolarHBondContact O-CB 3.1Å; I24-Q28 VanDerWaalsContact O-CG 3.28Å; I24-Q28 WeakPolarHBondContact O-CG 3.25Å; I24-Q28 PolarHBondContact O-N 2.83Å |
| 25 | Q | 88.6 | Confident | 77.9 | Confident | 85 Ų | 85 | 111.6 Ų | 111.6 | 40% | 0.397 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.1 | -38.7 | -179.7 | -168 | -179.9 | 34.5 | 0 | 0 | 111.4 | K21 Y22 R29 | K21-Q25 VanDerWaalsContact O-CB 3.22Å; K21-Q25 WeakPolarHBondContact O-CB 3.16Å; K21-Q25 PolarHBondContact O-N 2.79Å; Y22-Q25 PolarHBondContact O-N 2.91Å; Q25-R29 WeakPolarHBondContact O-CB 3.34Å; Q25-R29 VanDerWaalsContact O-CG 3.27Å; Q25-R29 WeakPolarHBondContact O-CG 3.43Å; Q25-R29 PolarHBondContact O-N 3.3Å |
| 26 | Q | 86.1 | Confident | 79.2 | Confident | 76 Ų | 76 | 109.8 Ų | 109.8 | 36% | 0.355 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.7 | -44.7 | 175.1 | -172.3 | 178.9 | 4.9 | 0 | 0 | 111.3 | Y22 H23 I24 R29 Q30 | Y22-Q26 VanDerWaalsContact CE1-OE1 3.26Å; Y22-Q26 VanDerWaalsContact O-CB 3.28Å; Y22-Q26 WeakPolarHBondContact O-CB 3.25Å; Y22-Q26 PolarHBondContact O-N 3.44Å; H23-Q26 PolarHBondContact O-N 3.37Å; I24-Q26 VanDerWaalsContact C-N 3.32Å; I24-Q26 PolarHBondContact O-N 3.14Å; Q26-R29 PolarHBondContact O-N 3.45Å; Q26-Q30 WeakPolarHBondContact O-CG 3.29Å; Q26-Q30 PolarHBondContact O-N 2.86Å |
| 27 | A | 83.8 | Confident | 80.2 | Confident | 53 Ų | 53 | 106.4 Ų | 106.4 | 44% | 0.438 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | H23 I24 R29 Q30 Q31 | H23-A27 VanDerWaalsContact O-CB 3.29Å; H23-A27 WeakPolarHBondContact O-CB 3.09Å; H23-A27 PolarHBondContact O-N 3.46Å; I24-A27 PolarHBondContact O-N 3.25Å; A27-R29 PolarHBondContact O-N 3.24Å; A27-Q30 PolarHBondContact O-N 2.84Å; A27-Q31 WeakPolarHBondContact O-CB 3.44Å; A27-Q31 PolarHBondContact O-N 3.22Å |
| 28 | Q | 91.1 | Very high | 80.6 | Confident | 108 Ų | 108 | 103.7 Ų | 103.7 | 51% | 0.505 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -45 | 173.7 | -75 | 177.2 | -8.7 | 0 | 0 | 111.5 | I24 Q30 Q31 V32 | I24-Q28 HydrophobicContact CG2-CG 4.32Å; I24-Q28 WeakPolarHBondContact O-CB 3.1Å; I24-Q28 VanDerWaalsContact O-CG 3.28Å; I24-Q28 WeakPolarHBondContact O-CG 3.25Å; I24-Q28 PolarHBondContact O-N 2.83Å; Q28-Q30 VanDerWaalsContact C-N 3.33Å; Q28-Q30 PolarHBondContact O-N 2.87Å; Q28-Q31 PolarHBondContact O-N 2.92Å; Q28-V32 WeakPolarHBondContact O-CG2 3.35Å; Q28-V32 PolarHBondContact O-N 2.73Å |
| 29 | R | 91.1 | Very high | 81.3 | Confident | 167 Ų | 167 | 102.2 Ų | 102.2 | 63% | 0.63 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61 | -41.6 | 175 | -76.1 | 176.1 | -171.2 | -90.3 | 2.3 | 111.9 | Q25 Q26 A27 V32 K33 | Q25-R29 WeakPolarHBondContact O-CB 3.34Å; Q25-R29 VanDerWaalsContact O-CG 3.27Å; Q25-R29 WeakPolarHBondContact O-CG 3.43Å; Q25-R29 PolarHBondContact O-N 3.3Å; Q26-R29 PolarHBondContact O-N 3.45Å; A27-R29 PolarHBondContact O-N 3.24Å; R29-V32 PolarHBondContact O-N 2.86Å; R29-K33 VanDerWaalsContact O-CB 3.25Å; R29-K33 WeakPolarHBondContact O-CB 3.37Å; R29-K33 PolarHBondContact O-N 3.49Å |
| 30 | Q | 89.7 | Confident | 81.4 | Confident | 117 Ų | 117 | 103 Ų | 103 | 55% | 0.547 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64 | -42.9 | 176.4 | -74.7 | 177.8 | 1 | 0 | 0 | 111.5 | Q26 A27 Q28 K33 Q34 | Q26-Q30 WeakPolarHBondContact O-CG 3.29Å; Q26-Q30 PolarHBondContact O-N 2.86Å; A27-Q30 PolarHBondContact O-N 2.84Å; Q28-Q30 VanDerWaalsContact C-N 3.33Å; Q28-Q30 PolarHBondContact O-N 2.87Å; Q30-K33 PolarHBondContact O-N 3.31Å; Q30-Q34 WeakPolarHBondContact O-CB 3.47Å; Q30-Q34 PolarHBondContact O-N 2.86Å |
| 31 | Q | 90 | Very high | 80.6 | Confident | 131 Ų | 131 | 101.6 Ų | 101.6 | 61% | 0.612 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.5 | -47.4 | 176.3 | -172.2 | -178.2 | 28.7 | 0 | 0 | 111.7 | A27 Q28 K33 Q34 Y35 | A27-Q31 WeakPolarHBondContact O-CB 3.44Å; A27-Q31 PolarHBondContact O-N 3.22Å; Q28-Q31 PolarHBondContact O-N 2.92Å; Q31-K33 VanDerWaalsContact C-N 3.33Å; Q31-K33 PolarHBondContact O-N 3.48Å; Q31-Q34 PolarHBondContact O-N 3.35Å; Q31-Y35 WeakPolarHBondContact O-CB 3.42Å; Q31-Y35 PolarHBondContact O-N 3.4Å |
| 32 | V | 89.2 | Confident | 79.6 | Confident | 79 Ų | 79 | 99.6 Ų | 99.6 | 48% | 0.479 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.4 | -41.5 | 176.6 | 174 | 0 | 0 | 0 | 0 | 110.7 | Q28 R29 Q34 Y35 L36 | Q28-V32 WeakPolarHBondContact O-CG2 3.35Å; Q28-V32 PolarHBondContact O-N 2.73Å; R29-V32 PolarHBondContact O-N 2.86Å; V32-Q34 PolarHBondContact O-N 2.8Å; V32-Y35 PolarHBondContact O-N 2.75Å; V32-L36 HydrophobicContact CG1-CD1 3.9Å; V32-L36 HydrophobicContact CG1-CG 4.25Å; V32-L36 WeakPolarHBondContact O-CB 2.96Å; V32-L36 WeakPolarHBondContact O-CG 2.84Å; V32-L36 PolarHBondContact O-N 2.83Å |
| 33 | K | 87.8 | Confident | 78.4 | Confident | 158 Ų | 158 | 99.2 Ų | 99.2 | 69% | 0.687 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62 | -42.9 | 176.1 | -176.2 | -178.9 | 177.8 | -177.2 | 0 | 111.3 | R29 Q30 Q31 S37 | R29-K33 VanDerWaalsContact O-CB 3.25Å; R29-K33 WeakPolarHBondContact O-CB 3.37Å; R29-K33 PolarHBondContact O-N 3.49Å; Q30-K33 PolarHBondContact O-N 3.31Å; Q31-K33 VanDerWaalsContact C-N 3.33Å; Q31-K33 PolarHBondContact O-N 3.48Å; K33-S37 WeakPolarHBondContact O-CA 3.28Å; K33-S37 WeakPolarHBondContact O-CB 2.88Å; K33-S37 PolarHBondContact O-N 3.34Å |
| 34 | Q | 84.5 | Confident | 76.8 | Confident | 136 Ų | 136 | 101 Ų | 101 | 64% | 0.636 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.8 | -42 | 177.3 | -174.1 | 178.6 | 5.3 | 0 | 0 | 111.1 | Q30 Q31 V32 S37 T38 | Q30-Q34 WeakPolarHBondContact O-CB 3.47Å; Q30-Q34 PolarHBondContact O-N 2.86Å; Q31-Q34 PolarHBondContact O-N 3.35Å; V32-Q34 PolarHBondContact O-N 2.8Å; Q34-S37 PolarHBondContact O-N 2.88Å; Q34-T38 HydrophobicContact CG-CG2 4.28Å; Q34-T38 WeakPolarHBondContact O-CB 3.28Å; Q34-T38 VanDerWaalsContact O-CG2 3.27Å; Q34-T38 WeakPolarHBondContact O-CG2 3.4Å; Q34-T38 PolarHBondContact O-N 3.49Å; Q34-T38 PolarHBondContact O-OG1 3.45Å |
| 35 | Y | 84 | Confident | 74.8 | Confident | 130 Ų | 130 | 98.1 Ų | 98.1 | 51% | 0.51 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.2 | -51.7 | 175.4 | 175.5 | -102.2 | 0 | 0 | 0 | 111.2 | Q31 V32 S37 T38 T39 | Q31-Y35 WeakPolarHBondContact O-CB 3.42Å; Q31-Y35 PolarHBondContact O-N 3.4Å; V32-Y35 PolarHBondContact O-N 2.75Å; Y35-S37 PolarHBondContact O-N 2.74Å; Y35-T38 PolarHBondContact O-N 3.29Å; Y35-T38 PolarHBondContact O-OG1 2.98Å; Y35-T39 WeakPolarHBondContact CE2-OG1 3.16Å; Y35-T39 WeakPolarHBondContact O-CB 3.43Å; Y35-T39 PolarHBondContact O-N 2.77Å; Y35-T39 PolarHBondContact O-OG1 3.16Å |
| 36 | L | 85.9 | Confident | 72.8 | Confident | 95 Ų | 95 | 100.3 Ų | 100.3 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 176.4 | -67.5 | 177.1 | 0 | 0 | 0 | 111.4 | V32 T38 L40 | V32-L36 HydrophobicContact CG1-CD1 3.9Å; V32-L36 HydrophobicContact CG1-CG 4.25Å; V32-L36 WeakPolarHBondContact O-CB 2.96Å; V32-L36 WeakPolarHBondContact O-CG 2.84Å; V32-L36 PolarHBondContact O-N 2.83Å; L36-T38 PolarHBondContact O-N 3.47Å; L36-L40 VanDerWaalsContact O-CA 3.28Å; L36-L40 WeakPolarHBondContact O-CA 3.27Å; L36-L40 WeakPolarHBondContact O-CB 3.33Å; L36-L40 PolarHBondContact O-N 3.28Å |
| 37 | S | 79.1 | Confident | 70.8 | Confident | 72 Ų | 72 | 104.8 Ų | 104.8 | 50% | 0.503 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 177.6 | -172.5 | 0 | 0 | 0 | 0 | 111.3 | K33 Q34 Y35 A41 | K33-S37 WeakPolarHBondContact O-CA 3.28Å; K33-S37 WeakPolarHBondContact O-CB 2.88Å; K33-S37 PolarHBondContact O-N 3.34Å; Q34-S37 PolarHBondContact O-N 2.88Å; Y35-S37 PolarHBondContact O-N 2.74Å; S37-A41 WeakPolarHBondContact O-CA 3.2Å; S37-A41 WeakPolarHBondContact O-CB 3.49Å; S37-A41 PolarHBondContact O-N 2.72Å |
| 38 | T | 68.2 | Low | 68.9 | Low | 55 Ų | 55 | 107.5 Ų | 107.5 | 34% | 0.337 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -73.4 | -46.7 | -179.3 | 55 | 0 | 0 | 0 | 0 | 111.1 | Q34 Y35 L36 N42 N72 | Q34-T38 HydrophobicContact CG-CG2 4.28Å; Q34-T38 WeakPolarHBondContact O-CB 3.28Å; Q34-T38 VanDerWaalsContact O-CG2 3.27Å; Q34-T38 WeakPolarHBondContact O-CG2 3.4Å; Q34-T38 PolarHBondContact O-N 3.49Å; Q34-T38 PolarHBondContact O-OG1 3.45Å; Y35-T38 PolarHBondContact O-N 3.29Å; Y35-T38 PolarHBondContact O-OG1 2.98Å; L36-T38 PolarHBondContact O-N 3.47Å; T38-N42 WeakPolarHBondContact O-CB 3.22Å; T38-N42 PolarHBondContact O-N 3.4Å; T38-N72 PolarHBondContact OG1-ND2 2.93Å |
| 39 | T | 64.8 | Low | 66.7 | Low | 51 Ų | 51 | 109.2 Ų | 109.2 | 31% | 0.313 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -73.3 | -35.8 | -179.1 | -54.5 | 0 | 0 | 0 | 0 | 113.3 | Y35 | Y35-T39 WeakPolarHBondContact CE2-OG1 3.16Å; Y35-T39 WeakPolarHBondContact O-CB 3.43Å; Y35-T39 PolarHBondContact O-N 2.77Å; Y35-T39 PolarHBondContact O-OG1 3.16Å |
| 40 | L | 62.4 | Low | 64.2 | Low | 104 Ų | 104 | 105.2 Ų | 105.2 | 55% | 0.545 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -81.7 | -35.7 | 177.4 | -161.6 | 103.6 | 0 | 0 | 0 | 111.7 | L36 N42 K43 | L36-L40 VanDerWaalsContact O-CA 3.28Å; L36-L40 WeakPolarHBondContact O-CA 3.27Å; L36-L40 WeakPolarHBondContact O-CB 3.33Å; L36-L40 PolarHBondContact O-N 3.28Å; L40-N42 VanDerWaalsContact C-N 3.33Å; L40-K43 WeakPolarHBondContact O-CG 3.45Å |
| 41 | A | 53.8 | Low | 61.9 | Low | 50 Ų | 50 | 106.2 Ų | 106.2 | 41% | 0.413 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -71.4 | -29.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | S37 K43 H44 A45 | S37-A41 WeakPolarHBondContact O-CA 3.2Å; S37-A41 WeakPolarHBondContact O-CB 3.49Å; S37-A41 PolarHBondContact O-N 2.72Å; A41-K43 VanDerWaalsContact C-N 3.26Å; A41-K43 PolarHBondContact O-N 2.91Å; A41-H44 CarbonylContact O-C 3.48Å; A41-H44 PolarHBondContact O-N 3.4Å; A41-A45 WeakPolarHBondContact O-CB 3.24Å; A41-A45 PolarHBondContact O-N 2.94Å |
| 42 | N | 49.2 | Very low | 59.6 | Low | 72 Ų | 72 | 105 Ų | 105 | 39% | 0.385 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -69.6 | -15.6 | -179.8 | -162.5 | 46.5 | 0 | 0 | 0 | 115.1 | T38 L40 H44 N46 | T38-N42 WeakPolarHBondContact O-CB 3.22Å; T38-N42 PolarHBondContact O-N 3.4Å; L40-N42 VanDerWaalsContact C-N 3.33Å; N42-H44 PolarHBondContact O-N 3.18Å; N42-N46 PolarHBondContact O-N 2.79Å; N42-N46 PolarHBondContact O-ND2 3.48Å; N42-N46 VanDerWaalsContact O-ND2 3.1Å |
| 43 | K | 51.3 | Low | 57.1 | Low | 140 Ų | 140 | 106.3 Ų | 106.3 | 61% | 0.609 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -74.4 | -13 | 167.4 | 42.8 | 177.6 | 166.2 | -112.2 | 0 | 113.7 | L40 A41 | L40-K43 WeakPolarHBondContact O-CG 3.45Å; A41-K43 VanDerWaalsContact C-N 3.26Å; A41-K43 PolarHBondContact O-N 2.91Å |
| 44 | H | 47 | Very low | 54.8 | Low | 156 Ų | 156 | 104.2 Ų | 104.2 | 72% | 0.722 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -111.9 | -19.3 | 165.7 | -78.1 | -103.2 | 0 | 0 | 0 | 113.1 | A41 N42 Q47 | A41-H44 CarbonylContact O-C 3.48Å; A41-H44 PolarHBondContact O-N 3.4Å; N42-H44 PolarHBondContact O-N 3.18Å; H44-Q47 PolarHBondContact O-N 3.27Å |
| 45 | A | 43.4 | Very low | 52.7 | Low | 26 Ų | 26 | 104.9 Ų | 104.9 | 22% | 0.215 | 58% | 0.582 | C | S | . | * | H | α-helix | trans | -95.8 | 9 | -174 | 0 | 0 | 0 | 0 | 0 | 114.9 | A41 Q47 V48 L49 | A41-A45 WeakPolarHBondContact O-CB 3.24Å; A41-A45 PolarHBondContact O-N 2.94Å; A45-Q47 PolarHBondContact O-N 2.95Å; A45-V48 PolarHBondContact O-N 3.25Å; A45-L49 PolarHBondContact O-N 3.19Å |
| 46 | N | 45.4 | Very low | 50.6 | Low | 130 Ų | 130 | 107.6 Ų | 107.6 | 70% | 0.695 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -2 | 152.1 | -84.1 | -76.8 | 0 | 0 | 0 | 112.4 | N42 | N42-N46 PolarHBondContact O-N 2.79Å; N42-N46 PolarHBondContact O-ND2 3.48Å; N42-N46 VanDerWaalsContact O-ND2 3.1Å |
| 47 | Q | 45.7 | Very low | 48.4 | Very low | 171 Ų | 171 | 109.3 Ų | 109.3 | 80% | 0.799 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.5 | -7 | 167.8 | -74.5 | -170.7 | 73.5 | 0 | 0 | 114.9 | H44 A45 | H44-Q47 PolarHBondContact O-N 3.27Å; A45-Q47 PolarHBondContact O-N 2.95Å |
| 48 | V | 42.6 | Very low | 46.4 | Very low | 109 Ų | 109 | 109.3 Ų | 109.3 | 66% | 0.661 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139 | 19.4 | -172.4 | -155.4 | 0 | 0 | 0 | 0 | 113.8 | A45 | A45-V48 PolarHBondContact O-N 3.25Š|
| 49 | L | 44.8 | Very low | 45.5 | Very low | 145 Ų | 145 | 113.5 Ų | 113.5 | 76% | 0.759 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -116 | 28.7 | 150 | -148.2 | 77 | 0 | 0 | 0 | 111.2 | A45 L51 | A45-L49 PolarHBondContact O-N 3.19Å; L49-L51 VanDerWaalsContact C-N 3.28Å; L49-L51 HydrophobicContact CD1-CD1 4.41Å |
| 50 | S | 40.5 | Very low | 44.4 | Very low | 83 Ų | 83 | 119.9 Ų | 119.9 | 58% | 0.58 | 67% | 0.674 | S | S | * | * | trans | -84.4 | 84.6 | 138.2 | -41.3 | 0 | 0 | 0 | 0 | 105.5 | P52 | S50-P52 VanDerWaalsContact C-N 3.32Å; S50-P52 WeakPolarHBondContact O-CD 3.43Å | ||
| 51 | L | 40.3 | Very low | 43.8 | Very low | 138 Ų | 138 | 121.9 Ų | 121.9 | 72% | 0.723 | 69% | 0.69 | S | S | * | * | trans | -67.8 | 110.4 | 135.8 | -88.6 | 92.2 | 0 | 0 | 0 | 102.9 | L49 C53 | L49-L51 VanDerWaalsContact C-N 3.28Å; L49-L51 HydrophobicContact CD1-CD1 4.41Å; L51-C53 VanDerWaalsContact C-N 3.26Å; L51-C53 PolarHBondContact O-N 3.1Å | ||
| 52 | P | 41.9 | Very low | 43.7 | Very low | 106 Ų | 106 | 127.2 Ų | 127.2 | 69% | 0.688 | 71% | 0.708 | S | S | * | * | trans | -67.5 | 104.5 | 163.4 | 10.5 | 6.1 | 0 | 0 | 0 | 103.5 | S50 P54 | S50-P52 VanDerWaalsContact C-N 3.32Å; S50-P52 WeakPolarHBondContact O-CD 3.43Å; P52-P54 VanDerWaalsContact O-CD 3.24Å; P52-P54 WeakPolarHBondContact O-CD 3.01Å; P52-P54 VanDerWaalsContact O-N 3.08Å | ||
| 53 | C | 35.6 | Very low | 43.6 | Very low | 105 Ų | 105 | 128.4 Ų | 128.4 | 71% | 0.709 | 72% | 0.719 | S | S | * | * | trans | -48.2 | 116.3 | 145.3 | -66.7 | 0 | 0 | 0 | 0 | 104.8 | L51 N55 | L51-C53 VanDerWaalsContact C-N 3.26Å; L51-C53 PolarHBondContact O-N 3.1Å; C53-N55 PolarHBondContact O-N 3.39Å | ||
| 54 | P | 40.5 | Very low | 43.7 | Very low | 115 Ų | 115 | 128 Ų | 128 | 75% | 0.747 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 73.2 | -176.1 | 31 | -30.7 | 0 | 0 | 0 | 107.1 | P52 | P52-P54 VanDerWaalsContact O-CD 3.24Å; P52-P54 WeakPolarHBondContact O-CD 3.01Å; P52-P54 VanDerWaalsContact O-N 3.08Å |
| 55 | N | 40.7 | Very low | 43.7 | Very low | 150 Ų | 150 | 125.9 Ų | 125.9 | 80% | 0.802 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 178.5 | 44.3 | 164.3 | -99.5 | -39.1 | 0 | 0 | 0 | 116.8 | C53 | C53-N55 PolarHBondContact O-N 3.39Š|
| 56 | Q | 38.5 | Very low | 44.1 | Very low | 187 Ų | 187 | 131 Ų | 131 | 87% | 0.874 | 76% | 0.76 | S | S | * | * | trans | -135.7 | 110.4 | 160.5 | -76.6 | -169.9 | -104.7 | 0 | 0 | 112.7 | ||||
| 57 | P | 40.4 | Very low | 44.5 | Very low | 130 Ų | 130 | 127.6 Ų | 127.6 | 84% | 0.844 | 76% | 0.755 | S | S | * | * | trans | -83.4 | 140.1 | 164 | 33.5 | -27.4 | 0 | 0 | 0 | 109.1 | ||||
| 58 | G | 36.7 | Very low | 44.9 | Very low | 73 Ų | 73 | 125.7 Ų | 125.7 | 75% | 0.753 | 76% | 0.761 | S | S | * | * | trans | 144.8 | 98.7 | 163.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 59 | D | 50 | Low | 45.4 | Very low | 143 Ų | 143 | 123.2 Ų | 123.2 | 77% | 0.765 | 75% | 0.749 | S | S | * | * | trans | -15.4 | 128.1 | 145.2 | -79 | -75.4 | 0 | 0 | 0 | 113.8 | ||||
| 60 | H | 41.4 | Very low | 46.1 | Very low | 185 Ų | 185 | 118.4 Ų | 118.4 | 86% | 0.856 | 73% | 0.73 | S | S | * | * | trans | -170.3 | 103.8 | 132.8 | -92.1 | -59.9 | 0 | 0 | 0 | 109.5 | M62 | H60-M62 PolarHBondContact O-N 2.84Š| ||
| 61 | V | 50 | Low | 47 | Very low | 146 Ų | 146 | 120 Ų | 120 | 89% | 0.885 | 74% | 0.738 | S | S | * | * | trans | -62 | 107 | 165.6 | 179.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 62 | M | 50.8 | Low | 48 | Very low | 162 Ų | 162 | 117.5 Ų | 117.5 | 80% | 0.798 | 73% | 0.726 | S | S | * | * | trans | -94.6 | 136.9 | 177.5 | -146.6 | 155.2 | 77.2 | 0 | 0 | 109.9 | H60 | H60-M62 PolarHBondContact O-N 2.84Š| ||
| 63 | P | 48.5 | Very low | 48.9 | Very low | 96 Ų | 96 | 113.8 Ų | 113.8 | 62% | 0.623 | 70% | 0.702 | S | S | * | * | trans | -72.9 | 155.1 | -174.5 | 31.3 | -33.7 | 0 | 0 | 0 | 110.9 | V65 | P63-V65 PolarHBondContact O-N 2.82Š| ||
| 64 | P | 52.9 | Low | 50 | Low | 132 Ų | 132 | 113.6 Ų | 113.6 | 86% | 0.857 | 70% | 0.7 | S | S | * | * | trans | -67.3 | 110.5 | 177.1 | 27.3 | -31.2 | 0 | 0 | 0 | 109.5 | ||||
| 65 | V | 46.8 | Very low | 51.3 | Low | 111 Ų | 111 | 113.9 Ų | 113.9 | 67% | 0.673 | 69% | 0.692 | S | S | * | * | trans | -65.6 | 141.9 | 178 | 173 | 0 | 0 | 0 | 0 | 110.2 | P63 G67 | P63-V65 PolarHBondContact O-N 2.82Å; V65-G67 PolarHBondContact O-N 3.06Å | ||
| 66 | P | 53.3 | Low | 52.5 | Low | 134 Ų | 134 | 107.2 Ų | 107.2 | 87% | 0.87 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -67.9 | 99.2 | 177.1 | -10.2 | 25.4 | 0 | 0 | 0 | 109.9 | ||
| 67 | G | 52.3 | Low | 53.6 | Low | 58 Ų | 58 | 105 Ų | 105 | 60% | 0.598 | 65% | 0.65 | S | S | * | * | trans | 162.3 | 52.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | V65 S69 | V65-G67 PolarHBondContact O-N 3.06Å; G67-S69 PolarHBondContact O-N 3.15Å | ||
| 68 | S | 54.4 | Low | 54.9 | Low | 132 Ų | 132 | 104.9 Ų | 104.9 | 92% | 0.923 | 64% | 0.641 | S | S | * | * | trans | -69.2 | 65.9 | -178.1 | 178.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 69 | S | 53.6 | Low | 56.1 | Low | 56 Ų | 56 | 105.7 Ų | 105.7 | 39% | 0.392 | 63% | 0.632 | S | S | . | * | S | Bend | trans | -90.9 | 141.9 | 154.1 | -59.7 | 0 | 0 | 0 | 0 | 107.1 | G67 | G67-S69 PolarHBondContact O-N 3.15Š|
| 70 | A | 58.7 | Low | 56.5 | Low | 45 Ų | 45 | 105.2 Ų | 105.2 | 37% | 0.372 | 63% | 0.628 | S | S | . | * | trans | -49.4 | 140.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | N72 S73 | A70-N72 WeakPolarHBondContact CB-OD1 3.5Å; A70-N72 PolarHBondContact O-N 3.31Å; A70-S73 WeakPolarHBondContact O-CB 3.21Å; A70-S73 PolarHBondContact O-N 2.84Å | ||
| 71 | P | 59.6 | Low | 57.2 | Low | 116 Ų | 116 | 103.5 Ų | 103.5 | 75% | 0.753 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | -9.9 | -172.9 | 21.7 | -33.7 | 0 | 0 | 0 | 114.3 | ||
| 72 | N | 61.6 | Low | 57.3 | Low | 86 Ų | 86 | 100.4 Ų | 100.4 | 46% | 0.46 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -118 | 15.2 | 178.2 | 61.9 | 0.1 | 0 | 0 | 0 | 113.9 | T38 A70 | T38-N72 PolarHBondContact OG1-ND2 2.93Å; A70-N72 WeakPolarHBondContact CB-OD1 3.5Å; A70-N72 PolarHBondContact O-N 3.31Å |
| 73 | S | 60.2 | Low | 57.5 | Low | 27 Ų | 27 | 99.4 Ų | 99.4 | 19% | 0.189 | 61% | 0.608 | C | S | . | * | trans | -64.5 | 144.7 | 174.3 | 166.1 | 0 | 0 | 0 | 0 | 110.8 | A70 M75 A76 M77 | A70-S73 WeakPolarHBondContact O-CB 3.21Å; A70-S73 PolarHBondContact O-N 2.84Å; S73-M75 PolarHBondContact O-N 3.3Å; S73-M75 VanDerWaalsContact O-N 3.15Å; S73-M75 VanDerWaalsContact OG-CB 3.27Å; S73-M75 WeakPolarHBondContact OG-CB 3.42Å; S73-M75 PolarHBondContact OG-N 3.41Å; S73-A76 WeakPolarHBondContact O-CA 3.27Å; S73-A76 VanDerWaalsContact O-CB 3.27Å; S73-A76 WeakPolarHBondContact O-CB 3.27Å; S73-A76 PolarHBondContact O-N 3.41Å; S73-M77 PolarHBondContact O-N 3.41Å | ||
| 74 | P | 59.8 | Low | 57.5 | Low | 102 Ų | 102 | 99.8 Ų | 99.8 | 66% | 0.662 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -53.2 | -33.3 | 168.6 | -22 | 31.3 | 0 | 0 | 0 | 112.2 | A76 M77 L78 | P74-A76 VanDerWaalsContact C-N 3.31Å; P74-A76 PolarHBondContact O-N 3.15Å; P74-M77 PolarHBondContact O-N 3.42Å; P74-L78 WeakPolarHBondContact O-CG 3.37Å; P74-L78 PolarHBondContact O-N 3.17Å |
| 75 | M | 66.4 | Low | 56.9 | Low | 120 Ų | 120 | 102.2 Ų | 102.2 | 59% | 0.591 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -66.3 | -32.7 | 174.6 | -151.9 | 84.8 | 172.5 | 0 | 0 | 112 | S73 L78 T79 | S73-M75 PolarHBondContact O-N 3.3Å; S73-M75 VanDerWaalsContact O-N 3.15Å; S73-M75 VanDerWaalsContact OG-CB 3.27Å; S73-M75 WeakPolarHBondContact OG-CB 3.42Å; S73-M75 PolarHBondContact OG-N 3.41Å; M75-L78 WeakPolarHBondContact O-CB 3.27Å; M75-L78 PolarHBondContact O-N 3.48Å; M75-T79 PolarHBondContact O-N 2.78Å; M75-T79 VanDerWaalsContact O-N 3.17Å |
| 76 | A | 67.5 | Low | 57.3 | Low | 10 Ų | 10 | 105.3 Ų | 105.3 | 8% | 0.083 | 62% | 0.616 | C | S | . | * | H | α-helix | trans | -69.3 | -36.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | S73 P74 L78 T79 L80 | S73-A76 WeakPolarHBondContact O-CA 3.27Å; S73-A76 VanDerWaalsContact O-CB 3.27Å; S73-A76 WeakPolarHBondContact O-CB 3.27Å; S73-A76 PolarHBondContact O-N 3.41Å; P74-A76 VanDerWaalsContact C-N 3.31Å; P74-A76 PolarHBondContact O-N 3.15Å; A76-L78 VanDerWaalsContact C-N 3.28Å; A76-L78 PolarHBondContact O-N 3.18Å; A76-T79 WeakPolarHBondContact CA-OG1 3.49Å; A76-T79 PolarHBondContact O-N 3.02Å; A76-T79 VanDerWaalsContact O-N 3.15Å; A76-T79 PolarHBondContact O-OG1 2.69Å; A76-L80 VanDerWaalsContact O-CG 3.27Å; A76-L80 WeakPolarHBondContact O-CG 3.49Å; A76-L80 PolarHBondContact O-N 3.48Å |
| 77 | M | 61.8 | Low | 56.9 | Low | 141 Ų | 141 | 107.5 Ų | 107.5 | 70% | 0.695 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -63.2 | -36 | 172.7 | -70.2 | -168.7 | 67 | 0 | 0 | 112.4 | S73 P74 T79 L80 N81 | S73-M77 PolarHBondContact O-N 3.41Å; P74-M77 PolarHBondContact O-N 3.42Å; M77-T79 VanDerWaalsContact C-N 3.3Å; M77-T79 PolarHBondContact O-N 3.3Å; M77-L80 PolarHBondContact O-N 3.39Å; M77-N81 PolarHBondContact O-N 2.72Å |
| 78 | L | 66.8 | Low | 56.7 | Low | 127 Ų | 127 | 114.4 Ų | 114.4 | 67% | 0.665 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -67.2 | -32 | 175.3 | -60.8 | 175.1 | 0 | 0 | 0 | 111.8 | P74 M75 A76 | P74-L78 WeakPolarHBondContact O-CG 3.37Å; P74-L78 PolarHBondContact O-N 3.17Å; M75-L78 WeakPolarHBondContact O-CB 3.27Å; M75-L78 PolarHBondContact O-N 3.48Å; A76-L78 VanDerWaalsContact C-N 3.28Å; A76-L78 PolarHBondContact O-N 3.18Å |
| 79 | T | 61.8 | Low | 56.4 | Low | 91 Ų | 91 | 116.9 Ų | 116.9 | 56% | 0.558 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -76.1 | -31.4 | 175.4 | 57.4 | 0 | 0 | 0 | 0 | 113.6 | M75 A76 M77 S82 | M75-T79 PolarHBondContact O-N 2.78Å; M75-T79 VanDerWaalsContact O-N 3.17Å; A76-T79 WeakPolarHBondContact CA-OG1 3.49Å; A76-T79 PolarHBondContact O-N 3.02Å; A76-T79 VanDerWaalsContact O-N 3.15Å; A76-T79 PolarHBondContact O-OG1 2.69Å; M77-T79 VanDerWaalsContact C-N 3.3Å; M77-T79 PolarHBondContact O-N 3.3Å; T79-S82 PolarHBondContact O-N 2.94Å |
| 80 | L | 58.1 | Low | 55.9 | Low | 132 Ų | 132 | 123.2 Ų | 123.2 | 69% | 0.691 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -74.3 | -23.2 | -178.5 | -69.7 | 166.4 | 0 | 0 | 0 | 113.2 | A76 M77 S82 | A76-L80 VanDerWaalsContact O-CG 3.27Å; A76-L80 WeakPolarHBondContact O-CG 3.49Å; A76-L80 PolarHBondContact O-N 3.48Å; M77-L80 PolarHBondContact O-N 3.39Å; L80-S82 VanDerWaalsContact C-N 3.34Å |
| 81 | N | 55.6 | Low | 54.9 | Low | 150 Ų | 150 | 132 Ų | 132 | 80% | 0.802 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -5.4 | 174.3 | -157.3 | 68.9 | 0 | 0 | 0 | 113 | M77 N83 | M77-N81 PolarHBondContact O-N 2.72Å; N81-N83 PolarHBondContact O-N 3.38Å |
| 82 | S | 53 | Low | 54.6 | Low | 81 Ų | 81 | 132.8 Ų | 132.8 | 57% | 0.566 | 68% | 0.678 | S | S | * | * | trans | -88.4 | 87.2 | 164.2 | -78.8 | 0 | 0 | 0 | 0 | 108.3 | T79 L80 C84 | T79-S82 PolarHBondContact O-N 2.94Å; L80-S82 VanDerWaalsContact C-N 3.34Å; S82-C84 PolarHBondContact O-N 3.06Å | ||
| 83 | N | 54.3 | Low | 54.3 | Low | 140 Ų | 140 | 135.2 Ų | 135.2 | 75% | 0.749 | 69% | 0.69 | S | S | * | * | trans | -57.8 | 93.2 | 158.7 | -81.3 | 8.4 | 0 | 0 | 0 | 107.4 | N81 E85 | N81-N83 PolarHBondContact O-N 3.38Å; N83-E85 PolarHBondContact O-N 2.89Å | ||
| 84 | C | 49.1 | Very low | 53.9 | Low | 104 Ų | 104 | 141.2 Ų | 141.2 | 70% | 0.703 | 72% | 0.717 | S | S | * | * | trans | -71.2 | 81.3 | 163.7 | -87.1 | 0 | 0 | 0 | 0 | 107 | S82 K86 | S82-C84 PolarHBondContact O-N 3.06Å; C84-K86 PolarHBondContact O-N 2.8Å | ||
| 85 | E | 40.5 | Very low | 53.6 | Low | 183 Ų | 183 | 143.5 Ų | 143.5 | 86% | 0.855 | 72% | 0.721 | S | S | * | * | trans | -61.7 | 80.9 | 157.2 | 50.5 | -171.7 | 101.6 | 0 | 0 | 108.4 | N83 | N83-E85 PolarHBondContact O-N 2.89Š| ||
| 86 | K | 54.1 | Low | 52.8 | Low | 176 Ų | 176 | 145 Ų | 145 | 77% | 0.765 | 73% | 0.729 | S | S | * | * | trans | -125.1 | 66.7 | 166.5 | -75 | -171.1 | -179.4 | 177.6 | 0 | 108.7 | C84 | C84-K86 PolarHBondContact O-N 2.8Š| ||
| 87 | E | 45.4 | Very low | 51.8 | Low | 180 Ų | 180 | 154 Ų | 154 | 84% | 0.841 | 77% | 0.772 | S | S | * | * | trans | -106.2 | 61.9 | 155.7 | -71.6 | -66.7 | 148.4 | 0 | 0 | 108.1 | ||||
| 88 | F | 49.5 | Very low | 51.1 | Low | 203 Ų | 203 | 154.9 Ų | 154.9 | 89% | 0.89 | 78% | 0.777 | S | S | * | * | trans | -122.5 | 100.1 | 145.3 | -89.9 | -76.9 | 0 | 0 | 0 | 106.2 | ||||
| 89 | M | 48.1 | Very low | 49.9 | Very low | 184 Ų | 184 | 157.1 Ų | 157.1 | 91% | 0.906 | 79% | 0.786 | S | S | * | * | trans | 163.2 | 94.1 | 135.1 | -81.6 | -98.1 | -134.7 | 0 | 0 | 108.4 | ||||
| 90 | K | 42.3 | Very low | 48.9 | Very low | 190 Ų | 190 | 162.6 Ų | 162.6 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | 170.3 | 95.9 | 125.5 | -173.3 | 172.8 | -172.2 | 178 | 0 | 110.9 | |||||
| 91 | Q | 36.9 | Very low | 48.1 | Very low | 228 Ų | 228 | 165.4 Ų | 165.4 | 100% | 1.065 | 82% | 0.815 | S | S | * | * | 175.4 | 0 | 105.6 | -169.4 | 61.3 | 82.2 | 0 | 0 | 110.7 |
Retrieved 91 of 91 residues in 20.3 ms
(Link to these results)