| 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 | 58.4 | Low | 81.9 | Confident | 183 Ų | 183 | 115.4 Ų | 115.4 | 90% | 0.901 | 57% | 0.571 | S | S | * | * | 0 | 124.5 | 0 | -164.7 | 171.7 | -77.4 | 0 | 0 | 108.8 | |||||
| 2 | S | 73.4 | Confident | 82.8 | Confident | 70 Ų | 70 | 113.7 Ų | 113.7 | 49% | 0.49 | 56% | 0.564 | S | S | . | * | trans | -70 | 149.2 | -174.6 | 180 | 0 | 0 | 0 | 0 | 111.7 | K4 T5 K6 | S2-K4 PolarHBondContact O-N 3.19Å; S2-K4 PolarHBondContact OG-N 2.87Å; S2-T5 PolarHBondContact N-OG1 3.25Å; S2-T5 PolarHBondContact O-N 2.92Å; S2-T5 PolarHBondContact O-OG1 3.18Å; S2-K6 PolarHBondContact O-N 3.39Å | ||
| 3 | K | 77.3 | Confident | 83.6 | Confident | 182 Ų | 182 | 112.7 Ų | 112.7 | 79% | 0.791 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62 | -33.6 | 172.6 | -71.7 | -177.8 | 179.8 | 177.8 | 0 | 111.4 | K6 N7 | K3-K6 PolarHBondContact O-N 3.21Å; K3-N7 PolarHBondContact O-N 3.1Å |
| 4 | K | 75.7 | Confident | 84.2 | Confident | 144 Ų | 144 | 110.1 Ų | 110.1 | 63% | 0.626 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61 | -46.3 | 178.6 | -171.9 | 178.6 | 177.1 | -175.5 | 0 | 111.7 | S2 K6 N7 E8 | S2-K4 PolarHBondContact O-N 3.19Å; S2-K4 PolarHBondContact OG-N 2.87Å; K4-K6 VanDerWaalsContact C-N 3.3Å; K4-K6 PolarHBondContact O-N 3.35Å; K4-N7 PolarHBondContact O-N 3.34Å; K4-E8 VanDerWaalsContact CE-OE1 3.28Å; K4-E8 WeakPolarHBondContact CE-OE1 3.4Å; K4-E8 PolarHBondContact O-N 3.46Å; K4-E8 VanDerWaalsContact O-N 3.1Å |
| 5 | T | 83.3 | Confident | 84.6 | Confident | 50 Ų | 50 | 110.3 Ų | 110.3 | 31% | 0.307 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.5 | -32.2 | 179.6 | 54.5 | 0 | 0 | 0 | 0 | 112.4 | S2 Q9 | S2-T5 PolarHBondContact N-OG1 3.25Å; S2-T5 PolarHBondContact O-N 2.92Å; S2-T5 PolarHBondContact O-OG1 3.18Å; T5-Q9 WeakPolarHBondContact O-CB 3.28Å; T5-Q9 VanDerWaalsContact O-CG 3.24Å; T5-Q9 WeakPolarHBondContact O-CG 3.24Å; T5-Q9 PolarHBondContact O-N 3.31Å |
| 6 | K | 84.4 | Confident | 85 | Confident | 122 Ų | 122 | 113.3 Ų | 113.3 | 53% | 0.53 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.2 | -40.1 | 174.8 | -70.4 | -173.5 | 177.9 | -173.2 | 0 | 112.2 | S2 K3 K4 K10 | S2-K6 PolarHBondContact O-N 3.39Å; K3-K6 PolarHBondContact O-N 3.21Å; K4-K6 VanDerWaalsContact C-N 3.3Å; K4-K6 PolarHBondContact O-N 3.35Å; K6-K10 WeakPolarHBondContact O-CB 3.29Å; K6-K10 PolarHBondContact O-N 3.29Å |
| 7 | N | 87.4 | Confident | 85.3 | Confident | 116 Ų | 116 | 112.2 Ų | 112.2 | 62% | 0.62 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -68.1 | -40.8 | 178 | -72.8 | -8.1 | 0 | 0 | 0 | 111.6 | K3 K4 K10 A11 | K3-N7 PolarHBondContact O-N 3.1Å; K4-N7 PolarHBondContact O-N 3.34Å; N7-K10 PolarHBondContact O-N 3.42Å; N7-A11 PolarHBondContact O-N 2.8Å |
| 8 | E | 89.4 | Confident | 85.5 | Confident | 93 Ų | 93 | 112.2 Ų | 112.2 | 44% | 0.435 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.3 | -46.6 | 174.9 | -71 | 166.3 | 178.4 | 0 | 0 | 111.3 | K4 K10 A11 I12 | K4-E8 VanDerWaalsContact CE-OE1 3.28Å; K4-E8 WeakPolarHBondContact CE-OE1 3.4Å; K4-E8 PolarHBondContact O-N 3.46Å; K4-E8 VanDerWaalsContact O-N 3.1Å; E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 2.98Å; E8-A11 PolarHBondContact O-N 2.96Å; E8-I12 VanDerWaalsContact O-CG1 3.29Å; E8-I12 WeakPolarHBondContact O-CG1 3.37Å; E8-I12 PolarHBondContact O-N 3.35Å |
| 9 | Q | 88.7 | Confident | 85.5 | Confident | 114 Ų | 114 | 113.3 Ų | 113.3 | 53% | 0.533 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.6 | -40.1 | 175.1 | -74.7 | 174.1 | -20 | 0 | 0 | 112.3 | T5 I12 L13 | T5-Q9 WeakPolarHBondContact O-CB 3.28Å; T5-Q9 VanDerWaalsContact O-CG 3.24Å; T5-Q9 WeakPolarHBondContact O-CG 3.24Å; T5-Q9 PolarHBondContact O-N 3.31Å; Q9-I12 PolarHBondContact O-N 3.47Å; Q9-L13 WeakPolarHBondContact O-CB 3.38Å; Q9-L13 PolarHBondContact O-N 2.91Å |
| 10 | K | 91.3 | Very high | 85.6 | Confident | 144 Ų | 144 | 115 Ų | 115 | 63% | 0.626 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.9 | -45.8 | 175.5 | -172.9 | 178.9 | 179.3 | -177.5 | 0 | 111.4 | K6 N7 E8 L13 T14 | K6-K10 WeakPolarHBondContact O-CB 3.29Å; K6-K10 PolarHBondContact O-N 3.29Å; N7-K10 PolarHBondContact O-N 3.42Å; E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 2.98Å; K10-L13 PolarHBondContact O-N 3.43Å; K10-T14 PolarHBondContact O-N 3.14Å; K10-T14 PolarHBondContact O-OG1 2.78Å; K10-T14 VanDerWaalsContact O-OG1 3.08Å |
| 11 | A | 92.1 | Very high | 85.5 | Confident | 51 Ų | 51 | 113 Ų | 113 | 42% | 0.421 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.3 | -43.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | N7 E8 L13 T14 N15 | N7-A11 PolarHBondContact O-N 2.8Å; E8-A11 PolarHBondContact O-N 2.96Å; A11-L13 VanDerWaalsContact C-N 3.35Å; A11-L13 PolarHBondContact O-N 3.46Å; A11-T14 PolarHBondContact O-N 3.38Å; A11-N15 PolarHBondContact O-N 2.95Å |
| 12 | I | 92.4 | Very high | 86.5 | Confident | 95 Ų | 95 | 108.2 Ų | 108.2 | 49% | 0.487 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.9 | -44.6 | 175.9 | -67.5 | 165 | 0 | 0 | 0 | 110.7 | E8 Q9 N15 R16 | E8-I12 VanDerWaalsContact O-CG1 3.29Å; E8-I12 WeakPolarHBondContact O-CG1 3.37Å; E8-I12 PolarHBondContact O-N 3.35Å; Q9-I12 PolarHBondContact O-N 3.47Å; I12-N15 PolarHBondContact O-N 2.94Å; I12-R16 WeakPolarHBondContact O-CG 3.4Å; I12-R16 PolarHBondContact O-N 3.08Å |
| 13 | L | 93.4 | Very high | 86.7 | Confident | 101 Ų | 101 | 106.8 Ų | 106.8 | 53% | 0.529 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 178.2 | -179 | 61.8 | 0 | 0 | 0 | 111.6 | Q9 K10 A11 N15 R16 I17 | Q9-L13 WeakPolarHBondContact O-CB 3.38Å; Q9-L13 PolarHBondContact O-N 2.91Å; K10-L13 PolarHBondContact O-N 3.43Å; A11-L13 VanDerWaalsContact C-N 3.35Å; A11-L13 PolarHBondContact O-N 3.46Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 2.98Å; L13-R16 PolarHBondContact O-N 3.47Å; L13-I17 HydrophobicContact CD1-CD1 4.25Å; L13-I17 HydrophobicContact CD1-CG1 4.43Å; L13-I17 HydrophobicContact CG-CD1 4.04Å; L13-I17 WeakPolarHBondContact O-CG1 2.9Å; L13-I17 PolarHBondContact O-N 2.94Å |
| 14 | T | 91.5 | Very high | 86.7 | Confident | 77 Ų | 77 | 103.8 Ų | 103.8 | 47% | 0.472 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 175.9 | -62.4 | 0 | 0 | 0 | 0 | 111.5 | K10 A11 R16 I17 H18 | K10-T14 PolarHBondContact O-N 3.14Å; K10-T14 PolarHBondContact O-OG1 2.78Å; K10-T14 VanDerWaalsContact O-OG1 3.08Å; A11-T14 PolarHBondContact O-N 3.38Å; T14-R16 VanDerWaalsContact C-N 3.34Å; T14-R16 PolarHBondContact O-N 3.3Å; T14-I17 PolarHBondContact O-N 3.24Å; T14-H18 WeakPolarHBondContact O-CB 3.33Å; T14-H18 PolarHBondContact O-N 3.4Å |
| 15 | N | 90.6 | Very high | 86.6 | Confident | 113 Ų | 113 | 100 Ų | 100 | 60% | 0.604 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.1 | -39.6 | 177.5 | -73 | -11.5 | 0 | 0 | 0 | 112.2 | A11 I12 L13 H18 F19 | A11-N15 PolarHBondContact O-N 2.95Å; I12-N15 PolarHBondContact O-N 2.94Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 2.98Å; N15-H18 PolarHBondContact O-N 3.14Å; N15-F19 WeakPolarHBondContact O-CB 3.49Å; N15-F19 PolarHBondContact O-N 3.08Å |
| 16 | R | 91.4 | Very high | 86 | Confident | 157 Ų | 157 | 104.9 Ų | 104.9 | 59% | 0.592 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.2 | -48 | 175.2 | -75.7 | 179.2 | 178.6 | -164.7 | -0.7 | 111.8 | I12 L13 T14 H18 F19 Y20 | I12-R16 WeakPolarHBondContact O-CG 3.4Å; I12-R16 PolarHBondContact O-N 3.08Å; L13-R16 PolarHBondContact O-N 3.47Å; T14-R16 VanDerWaalsContact C-N 3.34Å; T14-R16 PolarHBondContact O-N 3.3Å; R16-H18 VanDerWaalsContact C-N 3.31Å; R16-H18 PolarHBondContact O-N 3.07Å; R16-F19 PolarHBondContact O-N 2.69Å; R16-Y20 HydrophobicContact CB-CE2 4.33Å; R16-Y20 WeakPolarHBondContact O-CD2 3.47Å; R16-Y20 PolarHBondContact O-N 3.45Å |
| 17 | I | 90.1 | Very high | 85.4 | Confident | 95 Ų | 95 | 104.7 Ų | 104.7 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.3 | -47.1 | 177.6 | -67.8 | 167.5 | 0 | 0 | 0 | 109.9 | L13 T14 F19 Y20 T21 | L13-I17 HydrophobicContact CD1-CD1 4.25Å; L13-I17 HydrophobicContact CD1-CG1 4.43Å; L13-I17 HydrophobicContact CG-CD1 4.04Å; L13-I17 WeakPolarHBondContact O-CG1 2.9Å; L13-I17 PolarHBondContact O-N 2.94Å; T14-I17 PolarHBondContact O-N 3.24Å; I17-F19 PolarHBondContact O-N 3.27Å; I17-Y20 PolarHBondContact O-N 2.96Å; I17-T21 PolarHBondContact O-N 3.38Å; I17-T21 PolarHBondContact O-OG1 3.43Å |
| 18 | H | 88.2 | Confident | 84.5 | Confident | 112 Ų | 112 | 107 Ų | 107 | 52% | 0.519 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.5 | -43.9 | 179.1 | -174.2 | 65.1 | 0 | 0 | 0 | 112.6 | T14 N15 R16 Y20 T21 N22 | T14-H18 WeakPolarHBondContact O-CB 3.33Å; T14-H18 PolarHBondContact O-N 3.4Å; N15-H18 PolarHBondContact O-N 3.14Å; R16-H18 VanDerWaalsContact C-N 3.31Å; R16-H18 PolarHBondContact O-N 3.07Å; H18-Y20 PolarHBondContact O-N 3.49Å; H18-T21 PolarHBondContact O-N 2.95Å; H18-N22 PolarHBondContact CD2-ND2 3.45Å; H18-N22 PolarHBondContact CE1-ND2 3.34Å; H18-N22 VanDerWaalsContact CE1-ND2 3.29Å; H18-N22 PolarHBondContact NE2-ND2 3.44Å; H18-N22 VanDerWaalsContact O-CG 3.32Å; H18-N22 PolarHBondContact O-N 3.24Å |
| 19 | F | 86.5 | Confident | 83.2 | Confident | 133 Ų | 133 | 105.6 Ų | 105.6 | 58% | 0.583 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.3 | -46.7 | 175.4 | 179 | -94.5 | 0 | 0 | 0 | 112.1 | N15 R16 I17 S23 | N15-F19 WeakPolarHBondContact O-CB 3.49Å; N15-F19 PolarHBondContact O-N 3.08Å; R16-F19 PolarHBondContact O-N 2.69Å; I17-F19 PolarHBondContact O-N 3.27Å; F19-S23 WeakPolarHBondContact O-CB 3.02Å; F19-S23 PolarHBondContact O-N 2.94Å; F19-S23 PolarHBondContact O-OG 3.29Å |
| 20 | Y | 86.5 | Confident | 81.8 | Confident | 148 Ų | 148 | 103.8 Ų | 103.8 | 58% | 0.58 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.4 | -41.4 | 178.3 | -70.9 | -60 | 0 | 0 | 0 | 112.2 | R16 I17 H18 S23 F24 | R16-Y20 HydrophobicContact CB-CE2 4.33Å; R16-Y20 WeakPolarHBondContact O-CD2 3.47Å; R16-Y20 PolarHBondContact O-N 3.45Å; I17-Y20 PolarHBondContact O-N 2.96Å; H18-Y20 PolarHBondContact O-N 3.49Å; Y20-S23 PolarHBondContact O-N 3.21Å; Y20-F24 WeakPolarHBondContact O-CB 3.37Å; Y20-F24 PolarHBondContact O-N 2.75Å |
| 21 | T | 84.4 | Confident | 80.3 | Confident | 74 Ų | 74 | 103.9 Ų | 103.9 | 45% | 0.454 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.6 | -50.1 | 176.7 | -57.7 | 0 | 0 | 0 | 0 | 111.1 | I17 H18 S23 F24 T25 | I17-T21 PolarHBondContact O-N 3.38Å; I17-T21 PolarHBondContact O-OG1 3.43Å; H18-T21 PolarHBondContact O-N 2.95Å; T21-S23 VanDerWaalsContact C-N 3.31Å; T21-S23 PolarHBondContact O-N 3.49Å; T21-F24 PolarHBondContact O-N 2.96Å; T21-T25 PolarHBondContact O-N 2.99Å; T21-T25 PolarHBondContact O-OG1 3.28Å |
| 22 | N | 78.9 | Confident | 78.7 | Confident | 82 Ų | 82 | 107.2 Ų | 107.2 | 44% | 0.439 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.3 | -40.3 | 179 | -68.7 | -11 | 0 | 0 | 0 | 111.8 | H18 T25 Y26 | H18-N22 PolarHBondContact CD2-ND2 3.45Å; H18-N22 PolarHBondContact CE1-ND2 3.34Å; H18-N22 VanDerWaalsContact CE1-ND2 3.29Å; H18-N22 PolarHBondContact NE2-ND2 3.44Å; H18-N22 VanDerWaalsContact O-CG 3.32Å; H18-N22 PolarHBondContact O-N 3.24Å; N22-T25 PolarHBondContact O-N 3.4Å; N22-Y26 WeakPolarHBondContact O-CB 3.46Å; N22-Y26 PolarHBondContact O-N 3Å |
| 23 | S | 78.2 | Confident | 77.1 | Confident | 39 Ų | 39 | 104.8 Ų | 104.8 | 27% | 0.273 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.1 | -43 | 177.2 | -57.2 | 0 | 0 | 0 | 0 | 111.5 | F19 Y20 T21 Y26 I27 | F19-S23 WeakPolarHBondContact O-CB 3.02Å; F19-S23 PolarHBondContact O-N 2.94Å; F19-S23 PolarHBondContact O-OG 3.29Å; Y20-S23 PolarHBondContact O-N 3.21Å; T21-S23 VanDerWaalsContact C-N 3.31Å; T21-S23 PolarHBondContact O-N 3.49Å; S23-Y26 PolarHBondContact O-N 2.95Å; S23-I27 WeakPolarHBondContact O-CD1 3.37Å; S23-I27 VanDerWaalsContact O-CG1 3.24Å; S23-I27 WeakPolarHBondContact O-CG1 3.32Å; S23-I27 PolarHBondContact O-N 3.02Å |
| 24 | F | 77.2 | Confident | 75.2 | Confident | 120 Ų | 120 | 106.8 Ų | 106.8 | 53% | 0.526 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -46 | 174 | -116 | -98.9 | 0 | 0 | 0 | 111 | Y20 T21 Y26 I27 Y28 | Y20-F24 WeakPolarHBondContact O-CB 3.37Å; Y20-F24 PolarHBondContact O-N 2.75Å; T21-F24 PolarHBondContact O-N 2.96Å; F24-Y26 VanDerWaalsContact C-N 3.27Å; F24-Y26 PolarHBondContact O-N 3.25Å; F24-I27 PolarHBondContact O-N 3.23Å; F24-Y28 AromaticContact CD1-CD2 3.33Å; F24-Y28 HydrophobicContact CD1-CD2 3.33Å; F24-Y28 AromaticContact CD1-CE2 3.19Å; F24-Y28 HydrophobicContact CD1-CE2 3.19Å; F24-Y28 HydrophobicContact CD1-CG 4.36Å; F24-Y28 AromaticContact CE1-CD2 3.7Å; F24-Y28 HydrophobicContact CE1-CD2 3.7Å; F24-Y28 AromaticContact CE1-CE2 3.02Å; F24-Y28 HydrophobicContact CE1-CE2 3.02Å; F24-Y28 AromaticContact CE1-CZ 3.56Å; F24-Y28 HydrophobicContact CE2-CE2 4.48Å; F24-Y28 HydrophobicContact CG-CD2 4.09Å; F24-Y28 HydrophobicContact CG-CE2 4.02Å; F24-Y28 AromaticContact CZ-CE2 3.74Å; F24-Y28 HydrophobicContact CZ-CE2 3.74Å; F24-Y28 WeakPolarHBondContact O-CB 3.24Å; F24-Y28 VanDerWaalsContact O-CD2 3.28Å; F24-Y28 WeakPolarHBondContact O-CD2 3.48Å; F24-Y28 PolarHBondContact O-N 2.89Å |
| 25 | T | 73.9 | Confident | 73.5 | Confident | 64 Ų | 64 | 107 Ų | 107 | 39% | 0.393 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.2 | -40.8 | 176.7 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | T21 N22 N29 | T21-T25 PolarHBondContact O-N 2.99Å; T21-T25 PolarHBondContact O-OG1 3.28Å; N22-T25 PolarHBondContact O-N 3.4Å; T25-N29 CarbonylContact O-C 3.44Å; T25-N29 WeakPolarHBondContact O-CA 3.38Å; T25-N29 PolarHBondContact O-N 3.34Å |
| 26 | Y | 69.2 | Low | 71.7 | Confident | 152 Ų | 152 | 106 Ų | 106 | 60% | 0.596 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.1 | -41.5 | 176.3 | -175.2 | -94.3 | 0 | 0 | 0 | 112.7 | N22 S23 F24 S33 | N22-Y26 WeakPolarHBondContact O-CB 3.46Å; N22-Y26 PolarHBondContact O-N 3Å; S23-Y26 PolarHBondContact O-N 2.95Å; F24-Y26 VanDerWaalsContact C-N 3.27Å; F24-Y26 PolarHBondContact O-N 3.25Å; Y26-S33 VanDerWaalsContact CD2-OG 3.32Å; Y26-S33 WeakPolarHBondContact CD2-OG 3.39Å |
| 27 | I | 72.1 | Confident | 69.9 | Low | 118 Ų | 118 | 105 Ų | 105 | 61% | 0.605 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -71.4 | -44.7 | -179.6 | -67.4 | 164.4 | 0 | 0 | 0 | 111.6 | S23 F24 | S23-I27 WeakPolarHBondContact O-CD1 3.37Å; S23-I27 VanDerWaalsContact O-CG1 3.24Å; S23-I27 WeakPolarHBondContact O-CG1 3.32Å; S23-I27 PolarHBondContact O-N 3.02Å; F24-I27 PolarHBondContact O-N 3.23Å |
| 28 | Y | 68.5 | Low | 68.4 | Low | 165 Ų | 165 | 107.5 Ų | 107.5 | 65% | 0.647 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -90.6 | -18.6 | -172.5 | -74.2 | -91.9 | 0 | 0 | 0 | 113.5 | F24 | F24-Y28 AromaticContact CD1-CD2 3.33Å; F24-Y28 HydrophobicContact CD1-CD2 3.33Å; F24-Y28 AromaticContact CD1-CE2 3.19Å; F24-Y28 HydrophobicContact CD1-CE2 3.19Å; F24-Y28 HydrophobicContact CD1-CG 4.36Å; F24-Y28 AromaticContact CE1-CD2 3.7Å; F24-Y28 HydrophobicContact CE1-CD2 3.7Å; F24-Y28 AromaticContact CE1-CE2 3.02Å; F24-Y28 HydrophobicContact CE1-CE2 3.02Å; F24-Y28 AromaticContact CE1-CZ 3.56Å; F24-Y28 HydrophobicContact CE2-CE2 4.48Å; F24-Y28 HydrophobicContact CG-CD2 4.09Å; F24-Y28 HydrophobicContact CG-CE2 4.02Å; F24-Y28 AromaticContact CZ-CE2 3.74Å; F24-Y28 HydrophobicContact CZ-CE2 3.74Å; F24-Y28 WeakPolarHBondContact O-CB 3.24Å; F24-Y28 VanDerWaalsContact O-CD2 3.28Å; F24-Y28 WeakPolarHBondContact O-CD2 3.48Å; F24-Y28 PolarHBondContact O-N 2.89Å |
| 29 | N | 61.3 | Low | 66.7 | Low | 63 Ų | 63 | 109.6 Ų | 109.6 | 34% | 0.337 | 54% | 0.544 | S | S | . | . | trans | -139.3 | 68.1 | 175.9 | -153.3 | -26 | 0 | 0 | 0 | 111.9 | T25 Q31 I32 | T25-N29 CarbonylContact O-C 3.44Å; T25-N29 WeakPolarHBondContact O-CA 3.38Å; T25-N29 PolarHBondContact O-N 3.34Å; N29-Q31 PolarHBondContact O-N 3.38Å; N29-I32 HydrophobicContact CB-CB 4.44Å; N29-I32 HydrophobicContact CB-CD1 4.08Å; N29-I32 HydrophobicContact CB-CG1 4.26Å; N29-I32 VanDerWaalsContact CG-CD1 3.46Å; N29-I32 VanDerWaalsContact CG-CG1 3.48Å; N29-I32 WeakPolarHBondContact ND2-CD1 3.47Å; N29-I32 WeakPolarHBondContact ND2-CG1 3.02Å; N29-I32 PolarHBondContact O-N 2.82Å; N29-I32 PolarHBondContact OD1-N 2.99Å | ||
| 30 | P | 60.3 | Low | 65 | Low | 77 Ų | 77 | 109.5 Ų | 109.5 | 50% | 0.5 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -12.3 | 179.5 | 26.8 | -35.4 | 0 | 0 | 0 | 112.9 | S33 | P30-S33 WeakPolarHBondContact CA-OG 3.28Å; P30-S33 PolarHBondContact O-OG 3.33Å |
| 31 | Q | 60.6 | Low | 63 | Low | 146 Ų | 146 | 113.9 Ų | 113.9 | 68% | 0.682 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -25.1 | 176.8 | -61.2 | -161.1 | -11.5 | 0 | 0 | 113.4 | N29 S33 | N29-Q31 PolarHBondContact O-N 3.38Å; Q31-S33 VanDerWaalsContact C-N 3.33Å |
| 32 | I | 58.2 | Low | 61.5 | Low | 120 Ų | 120 | 116.1 Ų | 116.1 | 62% | 0.615 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | -26.1 | 173.4 | -67.3 | 178.3 | 0 | 0 | 0 | 110.9 | N29 | N29-I32 HydrophobicContact CB-CB 4.44Å; N29-I32 HydrophobicContact CB-CD1 4.08Å; N29-I32 HydrophobicContact CB-CG1 4.26Å; N29-I32 VanDerWaalsContact CG-CD1 3.46Å; N29-I32 VanDerWaalsContact CG-CG1 3.48Å; N29-I32 WeakPolarHBondContact ND2-CD1 3.47Å; N29-I32 WeakPolarHBondContact ND2-CG1 3.02Å; N29-I32 PolarHBondContact O-N 2.82Å; N29-I32 PolarHBondContact OD1-N 2.99Å |
| 33 | S | 57.3 | Low | 60 | Low | 44 Ų | 44 | 117.8 Ų | 117.8 | 31% | 0.308 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.7 | 17.5 | 176.4 | 52.1 | 0 | 0 | 0 | 0 | 113.9 | Y26 P30 Q31 P35 | Y26-S33 VanDerWaalsContact CD2-OG 3.32Å; Y26-S33 WeakPolarHBondContact CD2-OG 3.39Å; P30-S33 WeakPolarHBondContact CA-OG 3.28Å; P30-S33 PolarHBondContact O-OG 3.33Å; Q31-S33 VanDerWaalsContact C-N 3.33Å; S33-P35 WeakPolarHBondContact O-CD 3.47Å |
| 34 | K | 54.4 | Low | 58.8 | Low | 143 Ų | 143 | 122 Ų | 122 | 62% | 0.622 | 61% | 0.605 | S | S | * | * | trans | -71 | 106.6 | 163.8 | -77.1 | -174.8 | -180 | 179.6 | 0 | 107.8 | N36 | K34-N36 PolarHBondContact O-N 3.25Š| ||
| 35 | P | 55.7 | Low | 57.5 | Low | 83 Ų | 83 | 127.5 Ų | 127.5 | 54% | 0.539 | 62% | 0.623 | S | S | . | * | trans | -53.5 | 134.2 | 154.4 | 26.9 | -33 | 0 | 0 | 0 | 106.2 | S33 L37 | S33-P35 WeakPolarHBondContact O-CD 3.47Å; P35-L37 PolarHBondContact O-N 3.01Å | ||
| 36 | N | 52 | Low | 56.6 | Low | 92 Ų | 92 | 129.5 Ų | 129.5 | 49% | 0.492 | 64% | 0.636 | S | S | . | * | trans | -57.3 | 86.4 | 177.6 | -163 | 8.3 | 0 | 0 | 0 | 108.8 | K34 D38 Q39 | K34-N36 PolarHBondContact O-N 3.25Å; N36-D38 PolarHBondContact O-N 2.98Å; N36-D38 VanDerWaalsContact O-N 3.08Å; N36-Q39 VanDerWaalsContact ND2-CD 3.34Å; N36-Q39 PolarHBondContact ND2-OE1 3.39Å; N36-Q39 PolarHBondContact O-N 2.83Å | ||
| 37 | L | 55.3 | Low | 55.8 | Low | 134 Ų | 134 | 127.3 Ų | 127.3 | 70% | 0.702 | 64% | 0.643 | S | S | * | * | G | 310 helix | trans | -60.9 | -18.5 | -173.1 | -97.3 | 146.7 | 0 | 0 | 0 | 111.8 | P35 Q39 | P35-L37 PolarHBondContact O-N 3.01Å; L37-Q39 VanDerWaalsContact C-N 3.32Å; L37-Q39 PolarHBondContact O-N 3.37Å |
| 38 | D | 58.5 | Low | 54.6 | Low | 148 Ų | 148 | 130.8 Ų | 130.8 | 79% | 0.791 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -74.6 | -15.2 | 173.9 | -77 | -30.6 | 0 | 0 | 0 | 114.2 | N36 | N36-D38 PolarHBondContact O-N 2.98Å; N36-D38 VanDerWaalsContact O-N 3.08Å |
| 39 | Q | 51.2 | Low | 54 | Low | 157 Ų | 157 | 128 Ų | 128 | 73% | 0.734 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -97.1 | -9.7 | 178.2 | -75.2 | -177.5 | -30.8 | 0 | 0 | 114.4 | N36 L37 | N36-Q39 VanDerWaalsContact ND2-CD 3.34Å; N36-Q39 PolarHBondContact ND2-OE1 3.39Å; N36-Q39 PolarHBondContact O-N 2.83Å; L37-Q39 VanDerWaalsContact C-N 3.32Å; L37-Q39 PolarHBondContact O-N 3.37Å |
| 40 | Q | 50.6 | Low | 53.7 | Low | 130 Ų | 130 | 130.5 Ų | 130.5 | 61% | 0.607 | 68% | 0.676 | S | S | * | * | trans | -105 | 43.9 | 176.2 | -79.4 | -173.9 | -35.3 | 0 | 0 | 112.4 | I42 | Q40-I42 PolarHBondContact O-N 2.85Š| ||
| 41 | R | 45.8 | Very low | 53.5 | Low | 241 Ų | 241 | 135.9 Ų | 135.9 | 91% | 0.909 | 69% | 0.692 | S | S | * | * | trans | -71 | 54.5 | 163 | -139.8 | 176.3 | -172.7 | -169.6 | 2.6 | 109.7 | S43 | R41-S43 PolarHBondContact O-N 3.46Š| ||
| 42 | I | 52.4 | Low | 53.1 | Low | 121 Ų | 121 | 134.4 Ų | 134.4 | 62% | 0.621 | 70% | 0.698 | S | S | * | * | trans | -78.3 | 101.1 | 168.1 | -58 | 177 | 0 | 0 | 0 | 105.1 | Q40 I44 | Q40-I42 PolarHBondContact O-N 2.85Å; I42-I44 VanDerWaalsContact C-N 3.3Å; I42-I44 HydrophobicContact CG2-CD1 4.43Å; I42-I44 HydrophobicContact CG2-CG1 3.92Å; I42-I44 PolarHBondContact O-N 3.05Å | ||
| 43 | S | 47.4 | Very low | 53.4 | Low | 116 Ų | 116 | 137.6 Ų | 137.6 | 81% | 0.811 | 71% | 0.707 | S | S | * | * | trans | -56.4 | 89 | 168.7 | 36.9 | 0 | 0 | 0 | 0 | 110.4 | R41 | R41-S43 PolarHBondContact O-N 3.46Š| ||
| 44 | I | 53.1 | Low | 53.6 | Low | 129 Ų | 129 | 144.2 Ų | 144.2 | 66% | 0.662 | 73% | 0.734 | S | S | * | * | trans | -95.8 | 97 | 165.2 | -54.1 | 179.5 | 0 | 0 | 0 | 107 | I42 T46 | I42-I44 VanDerWaalsContact C-N 3.3Å; I42-I44 HydrophobicContact CG2-CD1 4.43Å; I42-I44 HydrophobicContact CG2-CG1 3.92Å; I42-I44 PolarHBondContact O-N 3.05Å; I44-T46 HydrophobicContact CG2-CG2 3.91Å; I44-T46 PolarHBondContact O-N 3.28Å | ||
| 45 | Y | 48.8 | Very low | 53.8 | Low | 234 Ų | 234 | 144.6 Ų | 144.6 | 92% | 0.918 | 74% | 0.742 | S | S | * | * | trans | -77.4 | 91.3 | 173.5 | -150 | -89.3 | 0 | 0 | 0 | 108 | ||||
| 46 | T | 56.3 | Low | 54 | Low | 107 Ų | 107 | 144.5 Ų | 144.5 | 66% | 0.656 | 75% | 0.748 | S | S | * | * | trans | -134.5 | 104.7 | 169.8 | 56 | 0 | 0 | 0 | 0 | 109.9 | I44 | I44-T46 HydrophobicContact CG2-CG2 3.91Å; I44-T46 PolarHBondContact O-N 3.28Å | ||
| 47 | S | 51.9 | Low | 54.3 | Low | 106 Ų | 106 | 145.1 Ų | 145.1 | 74% | 0.741 | 76% | 0.758 | S | S | * | * | trans | 20.7 | 112 | 155 | 55.3 | 0 | 0 | 0 | 0 | 118 | T49 | S47-T49 PolarHBondContact O-N 3.46Å; S47-T49 VanDerWaalsContact O-N 3.14Å | ||
| 48 | H | 47.8 | Very low | 54.6 | Low | 190 Ų | 190 | 147.7 Ų | 147.7 | 88% | 0.88 | 77% | 0.766 | S | S | * | * | trans | -40.2 | 105.1 | 169.1 | -65.8 | -91.5 | 0 | 0 | 0 | 115.4 | ||||
| 49 | T | 54.5 | Low | 54.2 | Low | 107 Ų | 107 | 147.6 Ų | 147.6 | 66% | 0.656 | 77% | 0.766 | S | S | * | * | trans | -143.6 | 99.6 | 142.2 | 47.8 | 0 | 0 | 0 | 0 | 108.1 | S47 F51 | S47-T49 PolarHBondContact O-N 3.46Å; S47-T49 VanDerWaalsContact O-N 3.14Å; T49-F51 PolarHBondContact O-N 3.04Å; T49-F51 VanDerWaalsContact O-N 3.14Å | ||
| 50 | P | 55.2 | Low | 54 | Low | 115 Ų | 115 | 145.2 Ų | 145.2 | 75% | 0.747 | 77% | 0.767 | S | S | * | * | trans | -66.3 | 113.5 | 167.5 | 25.9 | -27.8 | 0 | 0 | 0 | 107.7 | S52 | P50-S52 PolarHBondContact O-N 2.98Å; P50-S52 VanDerWaalsContact O-N 3.07Å | ||
| 51 | F | 56 | Low | 54 | Low | 191 Ų | 191 | 152.7 Ų | 152.7 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | trans | -61.5 | 107.3 | 167.2 | -83.4 | -92.4 | 0 | 0 | 0 | 108.3 | T49 | T49-F51 PolarHBondContact O-N 3.04Å; T49-F51 VanDerWaalsContact O-N 3.14Å | ||
| 52 | S | 53 | Low | 54.4 | Low | 115 Ų | 115 | 148.3 Ų | 148.3 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -77.9 | 117.2 | 166.9 | -57.9 | 0 | 0 | 0 | 0 | 108.6 | P50 | P50-S52 PolarHBondContact O-N 2.98Å; P50-S52 VanDerWaalsContact O-N 3.07Å | ||
| 53 | F | 63.9 | Low | 54.5 | Low | 186 Ų | 186 | 149.7 Ų | 149.7 | 82% | 0.816 | 80% | 0.801 | S | S | * | * | trans | -87.5 | 106.2 | 162.1 | 42.1 | -89.7 | 0 | 0 | 0 | 107.7 | L55 | F53-L55 PolarHBondContact O-N 2.88Š| ||
| 54 | E | 62.9 | Low | 54.9 | Low | 184 Ų | 184 | 151.6 Ų | 151.6 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | trans | -85.7 | 103 | 167.4 | -165.7 | 168.9 | -164.3 | 0 | 0 | 107 | A56 | E54-A56 VanDerWaalsContact C-N 3.28Å; E54-A56 PolarHBondContact O-N 2.86Å | ||
| 55 | L | 58.2 | Low | 55 | Low | 151 Ų | 151 | 152.9 Ų | 152.9 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -78.3 | 86.3 | 172.3 | -143.6 | 103.2 | 0 | 0 | 0 | 106.9 | F53 C57 | F53-L55 PolarHBondContact O-N 2.88Å; L55-C57 PolarHBondContact O-N 2.99Å | ||
| 56 | A | 60 | Low | 55.4 | Low | 81 Ų | 81 | 147.8 Ų | 147.8 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | trans | -65.4 | 100.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | E54 E58 | E54-A56 VanDerWaalsContact C-N 3.28Å; E54-A56 PolarHBondContact O-N 2.86Å; A56-E58 VanDerWaalsContact C-N 3.3Å; A56-E58 PolarHBondContact O-N 3.18Å | ||
| 57 | C | 58.7 | Low | 55.3 | Low | 105 Ų | 105 | 150.5 Ų | 150.5 | 71% | 0.709 | 81% | 0.811 | S | S | * | * | trans | -76.9 | 89.4 | 153.3 | -73.9 | 0 | 0 | 0 | 0 | 106 | L55 D59 | L55-C57 PolarHBondContact O-N 2.99Å; C57-D59 PolarHBondContact O-N 3.35Å | ||
| 58 | E | 59.7 | Low | 55.6 | Low | 187 Ų | 187 | 153.7 Ų | 153.7 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | -70.5 | 123.5 | 168.5 | -87.5 | -171.6 | 162.4 | 0 | 0 | 109.7 | A56 | A56-E58 VanDerWaalsContact C-N 3.3Å; A56-E58 PolarHBondContact O-N 3.18Å | ||
| 59 | D | 51.9 | Low | 56.2 | Low | 146 Ų | 146 | 150.9 Ų | 150.9 | 78% | 0.781 | 81% | 0.811 | S | S | * | * | trans | -63.4 | 154.9 | -172.9 | -79 | -51.6 | 0 | 0 | 0 | 114.7 | C57 | C57-D59 PolarHBondContact O-N 3.35Š| ||
| 60 | S | 46.3 | Very low | 56.3 | Low | 108 Ų | 108 | 154.6 Ų | 154.6 | 76% | 0.755 | 82% | 0.824 | S | S | * | * | trans | 34.1 | 118.4 | 141 | 77.2 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 61 | K | 50.2 | Low | 56.4 | Low | 286 Ų | 286 | 158.2 Ų | 158.2 | 100% | 1.243 | 83% | 0.831 | S | S | * | * | -118.5 | 0 | 126.1 | -86.3 | -173 | 177.8 | 177.5 | 0 | 109.2 |
Retrieved 61 of 61 residues in 223.3 ms
(Link to these results)