| 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 | 62.9 | Low | 82.3 | Confident | 189 Ų | 189 | 112.8 Ų | 112.8 | 93% | 0.931 | 54% | 0.539 | S | S | * | . | 0 | 97.6 | 0 | -149 | 173.5 | -67.3 | 0 | 0 | 107.6 | |||||
| 2 | R | 72.1 | Confident | 83.2 | Confident | 205 Ų | 205 | 119.6 Ų | 119.6 | 77% | 0.774 | 56% | 0.555 | S | S | * | * | trans | -126.6 | 123 | -148.7 | -59.1 | -174.2 | 174.6 | 96.5 | -1.3 | 112.1 | D4 | R2-D4 PolarHBondContact O-N 2.94Å; R2-D4 VanDerWaalsContact O-OD1 3.12Å | ||
| 3 | S | 72.3 | Confident | 83.8 | Confident | 88 Ų | 88 | 118.4 Ų | 118.4 | 62% | 0.615 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.8 | -69.9 | 174.1 | 61.2 | 0 | 0 | 0 | 0 | 119.3 | H5 L6 T7 | S3-H5 VanDerWaalsContact C-N 3.26Å; S3-H5 PolarHBondContact O-N 3.43Å; S3-L6 PolarHBondContact O-N 3.33Å; S3-T7 PolarHBondContact O-N 3.38Å; S3-T7 PolarHBondContact O-OG1 3.47Å |
| 4 | D | 84.1 | Confident | 84.2 | Confident | 65 Ų | 65 | 117.3 Ų | 117.3 | 35% | 0.348 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.9 | -38.5 | -170 | 80 | -73.5 | 0 | 0 | 0 | 111.6 | R2 L6 T7 K8 | R2-D4 PolarHBondContact O-N 2.94Å; R2-D4 VanDerWaalsContact O-OD1 3.12Å; D4-L6 VanDerWaalsContact C-N 3.33Å; D4-L6 PolarHBondContact O-N 3.15Å; D4-T7 PolarHBondContact O-N 3.18Å; D4-K8 WeakPolarHBondContact O-CB 3.33Å; D4-K8 WeakPolarHBondContact O-CD 3.13Å; D4-K8 WeakPolarHBondContact O-CG 3.3Å; D4-K8 PolarHBondContact O-N 3.45Å; D4-K8 IonicContact OD2-NZ 2.94Å; D4-K8 PolarHBondContact OD2-NZ 2.99Å |
| 5 | H | 90 | Very high | 84.5 | Confident | 117 Ų | 117 | 118.5 Ų | 118.5 | 54% | 0.542 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.9 | -40.7 | 176.8 | -65.6 | 80.5 | 0 | 0 | 0 | 111.2 | S3 H9 | S3-H5 VanDerWaalsContact C-N 3.26Å; S3-H5 PolarHBondContact O-N 3.43Å; H5-H9 WeakPolarHBondContact O-CB 3.36Å; H5-H9 PolarHBondContact O-N 3Å; H5-H9 VanDerWaalsContact O-N 3.08Å |
| 6 | L | 83.8 | Confident | 84.7 | Confident | 106 Ų | 106 | 114 Ų | 114 | 56% | 0.555 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -72.3 | -41.8 | 179.7 | -61.1 | 179 | 0 | 0 | 0 | 111.6 | S3 D4 H9 A10 | S3-L6 PolarHBondContact O-N 3.33Å; D4-L6 VanDerWaalsContact C-N 3.33Å; D4-L6 PolarHBondContact O-N 3.15Å; L6-H9 PolarHBondContact O-N 3.2Å; L6-A10 WeakPolarHBondContact O-CB 3.31Å; L6-A10 PolarHBondContact O-N 3.44Å |
| 7 | T | 84 | Confident | 84.9 | Confident | 47 Ų | 47 | 114.4 Ų | 114.4 | 29% | 0.288 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.3 | -42.9 | 176.6 | -59.5 | 0 | 0 | 0 | 0 | 111.4 | S3 D4 A10 R11 L21 | S3-T7 PolarHBondContact O-N 3.38Å; S3-T7 PolarHBondContact O-OG1 3.47Å; D4-T7 PolarHBondContact O-N 3.18Å; T7-A10 PolarHBondContact O-N 3.16Å; T7-R11 WeakPolarHBondContact O-CG 3.22Å; T7-R11 PolarHBondContact O-N 3.23Å; T7-L21 HydrophobicContact CG2-CD2 4.05Å |
| 8 | K | 90.3 | Very high | 84.6 | Confident | 112 Ų | 112 | 112.8 Ų | 112.8 | 49% | 0.487 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.9 | -45.1 | 176.3 | -76.3 | 167.6 | -176.6 | 161.8 | 0 | 111.6 | D4 R11 | D4-K8 WeakPolarHBondContact O-CB 3.33Å; D4-K8 WeakPolarHBondContact O-CD 3.13Å; D4-K8 WeakPolarHBondContact O-CG 3.3Å; D4-K8 PolarHBondContact O-N 3.45Å; D4-K8 IonicContact OD2-NZ 2.94Å; D4-K8 PolarHBondContact OD2-NZ 2.99Å; K8-R11 PolarHBondContact O-N 3.34Å |
| 9 | H | 92.4 | Very high | 84.5 | Confident | 117 Ų | 117 | 108.6 Ų | 108.6 | 54% | 0.542 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.5 | -47.6 | 177.9 | 176.5 | 72.9 | 0 | 0 | 0 | 111.6 | H5 L6 R11 R12 H13 | H5-H9 WeakPolarHBondContact O-CB 3.36Å; H5-H9 PolarHBondContact O-N 3Å; H5-H9 VanDerWaalsContact O-N 3.08Å; L6-H9 PolarHBondContact O-N 3.2Å; H9-R11 VanDerWaalsContact C-N 3.3Å; H9-R11 PolarHBondContact O-N 3.15Å; H9-R12 PolarHBondContact O-N 3.09Å; H9-H13 AromaticContact CD2-NE2 3.78Å; H9-H13 AromaticContact CE1-NE2 3.38Å; H9-H13 PolarHBondContact CE1-NE2 2.78Å; H9-H13 AromaticContact NE2-CD2 3.93Å; H9-H13 AromaticContact NE2-NE2 3.05Å; H9-H13 PolarHBondContact NE2-NE2 2.84Å; H9-H13 PolarHBondContact O-CD2 3.31Å |
| 10 | A | 86.3 | Confident | 84.3 | Confident | 26 Ų | 26 | 109.1 Ų | 109.1 | 22% | 0.215 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -59.4 | -41.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112 | L6 T7 R12 H13 F16 | L6-A10 WeakPolarHBondContact O-CB 3.31Å; L6-A10 PolarHBondContact O-N 3.44Å; T7-A10 PolarHBondContact O-N 3.16Å; A10-R12 PolarHBondContact O-N 3.06Å; A10-R12 VanDerWaalsContact O-N 3.09Å; A10-H13 PolarHBondContact O-N 3.3Å; A10-H13 VanDerWaalsContact O-N 3.15Å; A10-F16 HydrophobicContact CB-CD2 3.57Å; A10-F16 HydrophobicContact CB-CE2 3.37Å; A10-F16 HydrophobicContact CB-CG 4.42Å; A10-F16 HydrophobicContact CB-CZ 4.07Å; A10-F16 WeakPolarHBondContact O-CB 3.12Å; A10-F16 WeakPolarHBondContact O-CD2 3.49Å; A10-F16 WeakPolarHBondContact O-CG 3.4Å |
| 11 | R | 87.7 | Confident | 83.8 | Confident | 169 Ų | 169 | 108.8 Ų | 108.8 | 64% | 0.638 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -14 | 177.9 | -70.3 | 176.1 | 68.3 | -165.9 | 1.5 | 115.1 | T7 K8 H9 F16 | T7-R11 WeakPolarHBondContact O-CG 3.22Å; T7-R11 PolarHBondContact O-N 3.23Å; K8-R11 PolarHBondContact O-N 3.34Å; H9-R11 VanDerWaalsContact C-N 3.3Å; H9-R11 PolarHBondContact O-N 3.15Å; R11-F16 HydrophobicContact CG-CD1 4.19Å; R11-F16 HydrophobicContact CG-CE1 3.73Å; R11-F16 HydrophobicContact CG-CZ 4.33Å |
| 12 | R | 92.3 | Very high | 84.3 | Confident | 194 Ų | 194 | 106.5 Ų | 106.5 | 73% | 0.732 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.4 | -6.9 | 178.2 | -63.2 | -56.4 | -162.2 | -79.9 | 4 | 113.4 | H9 A10 | H9-R12 PolarHBondContact O-N 3.09Å; A10-R12 PolarHBondContact O-N 3.06Å; A10-R12 VanDerWaalsContact O-N 3.09Å |
| 13 | H | 91.7 | Very high | 83.8 | Confident | 104 Ų | 104 | 106.6 Ų | 106.6 | 48% | 0.481 | 54% | 0.535 | S | S | . | . | S | Bend | trans | -88.4 | 140 | 178.5 | -72.8 | -85.8 | 0 | 0 | 0 | 111.5 | H9 A10 N15 F16 | H9-H13 AromaticContact CD2-NE2 3.78Å; H9-H13 AromaticContact CE1-NE2 3.38Å; H9-H13 PolarHBondContact CE1-NE2 2.78Å; H9-H13 AromaticContact NE2-CD2 3.93Å; H9-H13 AromaticContact NE2-NE2 3.05Å; H9-H13 PolarHBondContact NE2-NE2 2.84Å; H9-H13 PolarHBondContact O-CD2 3.31Å; A10-H13 PolarHBondContact O-N 3.3Å; A10-H13 VanDerWaalsContact O-N 3.15Å; H13-N15 VanDerWaalsContact C-N 3.27Å; H13-N15 PolarHBondContact O-N 2.92Å; H13-F16 HydrophobicContact CB-CB 4.3Å; H13-F16 VanDerWaalsContact O-CB 3.3Å; H13-F16 WeakPolarHBondContact O-CB 3.34Å; H13-F16 PolarHBondContact O-N 3.27Å |
| 14 | A | 88.9 | Confident | 83.2 | Confident | 103 Ų | 103 | 111.4 Ų | 111.4 | 85% | 0.851 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -31.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | F16 | A14-F16 VanDerWaalsContact C-N 3.3Å; A14-F16 PolarHBondContact O-N 2.91Å |
| 15 | N | 88.8 | Confident | 81.9 | Confident | 136 Ų | 136 | 113 Ų | 113 | 73% | 0.727 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | 19.3 | -179.5 | -57.2 | -54.7 | 0 | 0 | 0 | 112.8 | H13 H17 | H13-N15 VanDerWaalsContact C-N 3.27Å; H13-N15 PolarHBondContact O-N 2.92Å; N15-H17 PolarHBondContact O-CD2 3.45Å; N15-H17 VanDerWaalsContact O-CD2 3.3Å |
| 16 | F | 87.9 | Confident | 80.3 | Confident | 46 Ų | 46 | 109.7 Ų | 109.7 | 20% | 0.202 | 57% | 0.569 | C | S | . | * | trans | -83.4 | 119.9 | 179.2 | 179.9 | -102.4 | 0 | 0 | 0 | 111 | A10 R11 H13 A14 M20 | A10-F16 HydrophobicContact CB-CD2 3.57Å; A10-F16 HydrophobicContact CB-CE2 3.37Å; A10-F16 HydrophobicContact CB-CG 4.42Å; A10-F16 HydrophobicContact CB-CZ 4.07Å; A10-F16 WeakPolarHBondContact O-CB 3.12Å; A10-F16 WeakPolarHBondContact O-CD2 3.49Å; A10-F16 WeakPolarHBondContact O-CG 3.4Å; R11-F16 HydrophobicContact CG-CD1 4.19Å; R11-F16 HydrophobicContact CG-CE1 3.73Å; R11-F16 HydrophobicContact CG-CZ 4.33Å; H13-F16 HydrophobicContact CB-CB 4.3Å; H13-F16 VanDerWaalsContact O-CB 3.3Å; H13-F16 WeakPolarHBondContact O-CB 3.34Å; H13-F16 PolarHBondContact O-N 3.27Å; A14-F16 VanDerWaalsContact C-N 3.3Å; A14-F16 PolarHBondContact O-N 2.91Å; F16-M20 HydrophobicContact CD2-CE 4.12Å; F16-M20 HydrophobicContact CD2-SD 4.05Å; F16-M20 HydrophobicContact CE2-CB 4.24Å; F16-M20 HydrophobicContact CE2-SD 4.49Å | ||
| 17 | H | 87.3 | Confident | 79 | Confident | 120 Ų | 120 | 107.5 Ų | 107.5 | 56% | 0.556 | 57% | 0.572 | S | S | * | * | trans | -107.5 | 135.4 | 175 | -58.9 | -77.8 | 0 | 0 | 0 | 110.3 | N15 G19 M20 | N15-H17 PolarHBondContact O-CD2 3.45Å; N15-H17 VanDerWaalsContact O-CD2 3.3Å; H17-G19 PolarHBondContact O-N 3.46Å; H17-M20 HydrophobicContact CB-CG 4.45Å; H17-M20 HydrophobicContact CB-SD 4.31Å; H17-M20 PolarHBondContact N-SD 2.91Å; H17-M20 VanDerWaalsContact N-SD 3.43Å; H17-M20 VanDerWaalsContact O-CB 3.31Å; H17-M20 WeakPolarHBondContact O-CB 3.36Å; H17-M20 WeakPolarHBondContact O-CG 3.43Å; H17-M20 PolarHBondContact O-N 3.03Å | ||
| 18 | P | 79.7 | Confident | 77.7 | Confident | 87 Ų | 87 | 110.6 Ų | 110.6 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.4 | -30.8 | 178.8 | -27.8 | 34.2 | 0 | 0 | 0 | 114.1 | M20 L21 Q22 | P18-M20 PolarHBondContact O-N 3.22Å; P18-M20 VanDerWaalsContact O-N 3.15Å; P18-L21 PolarHBondContact O-N 3.08Å; P18-Q22 PolarHBondContact O-NE2 3.05Å |
| 19 | G | 82.4 | Confident | 76.1 | Confident | 33 Ų | 33 | 116.2 Ų | 116.2 | 34% | 0.34 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -53.9 | -26.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | H17 L21 Q22 | H17-G19 PolarHBondContact O-N 3.46Å; G19-L21 VanDerWaalsContact C-N 3.28Å; G19-L21 PolarHBondContact O-N 3.27Å; G19-Q22 VanDerWaalsContact CA-OE1 3.3Å; G19-Q22 PolarHBondContact O-N 3.33Å |
| 20 | M | 80.5 | Confident | 74.3 | Confident | 118 Ų | 118 | 116.3 Ų | 116.3 | 58% | 0.581 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -69.1 | -26.6 | -178.4 | -64.1 | 167.6 | 58.1 | 0 | 0 | 112.6 | F16 H17 P18 | F16-M20 HydrophobicContact CD2-CE 4.12Å; F16-M20 HydrophobicContact CD2-SD 4.05Å; F16-M20 HydrophobicContact CE2-CB 4.24Å; F16-M20 HydrophobicContact CE2-SD 4.49Å; H17-M20 HydrophobicContact CB-CG 4.45Å; H17-M20 HydrophobicContact CB-SD 4.31Å; H17-M20 PolarHBondContact N-SD 2.91Å; H17-M20 VanDerWaalsContact N-SD 3.43Å; H17-M20 VanDerWaalsContact O-CB 3.31Å; H17-M20 WeakPolarHBondContact O-CB 3.36Å; H17-M20 WeakPolarHBondContact O-CG 3.43Å; H17-M20 PolarHBondContact O-N 3.03Å; P18-M20 PolarHBondContact O-N 3.22Å; P18-M20 VanDerWaalsContact O-N 3.15Å |
| 21 | L | 75.3 | Confident | 72.9 | Confident | 102 Ų | 102 | 117.7 Ų | 117.7 | 53% | 0.534 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -88.3 | -24.7 | 176.9 | -174.7 | 62.3 | 0 | 0 | 0 | 112.7 | T7 P18 G19 R23 | T7-L21 HydrophobicContact CG2-CD2 4.05Å; P18-L21 PolarHBondContact O-N 3.08Å; G19-L21 VanDerWaalsContact C-N 3.28Å; G19-L21 PolarHBondContact O-N 3.27Å; L21-R23 PolarHBondContact O-N 2.97Å |
| 22 | Q | 71.9 | Confident | 71.5 | Confident | 142 Ų | 142 | 114.3 Ų | 114.3 | 66% | 0.664 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -70.9 | -18.2 | -174.3 | -68.3 | 151.1 | 24.6 | 0 | 0 | 112.9 | P18 G19 R24 | P18-Q22 PolarHBondContact O-NE2 3.05Å; G19-Q22 VanDerWaalsContact CA-OE1 3.3Å; G19-Q22 PolarHBondContact O-N 3.33Å; Q22-R24 PolarHBondContact O-N 3.4Å; Q22-R24 VanDerWaalsContact O-N 3.16Å |
| 23 | R | 62 | Low | 70 | Confident | 207 Ų | 207 | 112.6 Ų | 112.6 | 78% | 0.781 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -8.2 | -174.4 | -75.3 | -83.7 | -60 | -69 | -2.2 | 115.5 | L21 | L21-R23 PolarHBondContact O-N 2.97Š|
| 24 | R | 60.6 | Low | 68.2 | Low | 189 Ų | 189 | 111.8 Ų | 111.8 | 71% | 0.713 | 65% | 0.652 | S | S | * | * | trans | -163.2 | 83.7 | -177.5 | -100 | 149.7 | -173.5 | -144.1 | 2.4 | 111.3 | Q22 G26 | Q22-R24 PolarHBondContact O-N 3.4Å; Q22-R24 VanDerWaalsContact O-N 3.16Å; R24-G26 PolarHBondContact O-N 3.38Å | ||
| 25 | G | 57 | Low | 66.8 | Low | 98 Ų | 98 | 111.6 Ų | 111.6 | 100% | 1.01 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -69.7 | 36.7 | 160 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 26 | G | 56.5 | Low | 65.4 | Low | 47 Ų | 47 | 115 Ų | 115 | 49% | 0.485 | 64% | 0.641 | S | S | . | * | S | Bend | trans | -156.5 | 110.3 | -177 | 0 | 0 | 0 | 0 | 0 | 106.1 | R24 | R24-G26 PolarHBondContact O-N 3.38Š|
| 27 | G | 54.7 | Low | 64.1 | Low | 61 Ų | 61 | 118.6 Ų | 118.6 | 63% | 0.629 | 67% | 0.671 | S | S | * | * | trans | -47.7 | 154.8 | -169.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | R29 | G27-R29 PolarHBondContact O-N 2.6Š| ||
| 28 | S | 57.8 | Low | 63 | Low | 111 Ų | 111 | 122 Ų | 122 | 78% | 0.776 | 68% | 0.679 | S | S | * | * | trans | -54.2 | 78.1 | 162.5 | -56.8 | 0 | 0 | 0 | 0 | 109.7 | T30 | S28-T30 VanDerWaalsContact C-N 3.31Š| ||
| 29 | R | 56.8 | Low | 62 | Low | 231 Ų | 231 | 123 Ų | 123 | 87% | 0.872 | 69% | 0.688 | S | S | * | * | trans | -104.9 | 40.7 | 168.2 | -69.1 | -169.4 | 170.8 | 173.7 | -1.6 | 108.5 | G27 G31 | G27-R29 PolarHBondContact O-N 2.6Å; R29-G31 PolarHBondContact O-N 2.91Å | ||
| 30 | T | 55.1 | Low | 60.9 | Low | 119 Ų | 119 | 128.7 Ų | 128.7 | 73% | 0.73 | 71% | 0.711 | S | S | * | * | trans | -70.3 | 70 | 137.1 | 118.6 | 0 | 0 | 0 | 0 | 104.4 | S28 S32 | S28-T30 VanDerWaalsContact C-N 3.31Å; T30-S32 PolarHBondContact O-N 2.81Å | ||
| 31 | G | 55.6 | Low | 59.9 | Low | 54 Ų | 54 | 127.4 Ų | 127.4 | 56% | 0.557 | 72% | 0.719 | S | S | * | * | trans | -59.7 | 103.9 | 158 | 0 | 0 | 0 | 0 | 0 | 103.1 | R29 L33 | R29-G31 PolarHBondContact O-N 2.91Å; G31-L33 PolarHBondContact O-N 2.93Å | ||
| 32 | S | 58.3 | Low | 59.2 | Low | 98 Ų | 98 | 127.8 Ų | 127.8 | 69% | 0.685 | 73% | 0.731 | S | S | * | * | trans | -54.3 | 100.8 | 154.5 | -175.4 | 0 | 0 | 0 | 0 | 103.2 | T30 S34 | T30-S32 PolarHBondContact O-N 2.81Å; S32-S34 PolarHBondContact O-N 2.94Å | ||
| 33 | L | 60.4 | Low | 58.4 | Low | 159 Ų | 159 | 126.3 Ų | 126.3 | 83% | 0.832 | 74% | 0.736 | S | S | * | * | trans | -65.4 | 78.8 | 169.4 | -76.6 | 157.6 | 0 | 0 | 0 | 104.2 | G31 D35 | G31-L33 PolarHBondContact O-N 2.93Å; L33-D35 PolarHBondContact O-N 2.76Å | ||
| 34 | S | 54.9 | Low | 58.3 | Low | 86 Ų | 86 | 121.6 Ų | 121.6 | 60% | 0.601 | 73% | 0.732 | S | S | * | * | trans | -69.1 | 92.8 | 165.3 | -58.8 | 0 | 0 | 0 | 0 | 105 | S32 Y36 | S32-S34 PolarHBondContact O-N 2.94Å; S34-Y36 PolarHBondContact O-N 3.18Å | ||
| 35 | D | 59.7 | Low | 58.4 | Low | 99 Ų | 99 | 119.2 Ų | 119.2 | 53% | 0.529 | 74% | 0.739 | S | S | . | * | G | 310 helix | trans | -59 | 9.6 | 173.5 | -119.6 | -78.9 | 0 | 0 | 0 | 113.4 | L33 R38 | L33-D35 PolarHBondContact O-N 2.76Å; D35-R38 IonicContact OD1-CZ 2.78Å; D35-R38 VanDerWaalsContact OD1-CZ 3.27Å; D35-R38 IonicContact OD1-NE 2.78Å; D35-R38 PolarHBondContact OD1-NE 2.78Å; D35-R38 IonicContact OD1-NH2 3.27Å; D35-R38 PolarHBondContact OD1-NH2 2.94Å |
| 36 | Y | 59.7 | Low | 58.5 | Low | 209 Ų | 209 | 121.1 Ų | 121.1 | 82% | 0.82 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -89.5 | 5.8 | -172.4 | -112 | -85.5 | 0 | 0 | 0 | 114.9 | S34 | S34-Y36 PolarHBondContact O-N 3.18Š|
| 37 | S | 60.7 | Low | 58.8 | Low | 120 Ų | 120 | 124.8 Ų | 124.8 | 84% | 0.839 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -96.1 | 15.4 | 171.5 | -61.1 | 0 | 0 | 0 | 0 | 113.6 | S39 | S37-S39 PolarHBondContact O-N 2.84Š|
| 38 | R | 62.7 | Low | 59 | Low | 191 Ų | 191 | 127 Ų | 127 | 72% | 0.721 | 75% | 0.746 | S | S | * | * | trans | -85 | 56.8 | 165.3 | -52.2 | -168.5 | -155.1 | -154.8 | 5.3 | 110.6 | D35 D40 | D35-R38 IonicContact OD1-CZ 2.78Å; D35-R38 VanDerWaalsContact OD1-CZ 3.27Å; D35-R38 IonicContact OD1-NE 2.78Å; D35-R38 PolarHBondContact OD1-NE 2.78Å; D35-R38 IonicContact OD1-NH2 3.27Å; D35-R38 PolarHBondContact OD1-NH2 2.94Å; R38-D40 VanDerWaalsContact C-N 3.3Å | ||
| 39 | S | 59.1 | Low | 59.1 | Low | 108 Ų | 108 | 125.5 Ų | 125.5 | 76% | 0.755 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | 27.6 | 173.1 | -64.1 | 0 | 0 | 0 | 0 | 112.9 | S37 | S37-S39 PolarHBondContact O-N 2.84Š|
| 40 | D | 58.7 | Low | 58.8 | Low | 153 Ų | 153 | 120.7 Ų | 120.7 | 82% | 0.818 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | -9.9 | 172.1 | -165.9 | -112.6 | 0 | 0 | 0 | 112.7 | R38 S42 | R38-D40 VanDerWaalsContact C-N 3.3Å; D40-S42 VanDerWaalsContact C-N 3.33Å; D40-S42 PolarHBondContact O-N 3.32Å |
| 41 | A | 60.8 | Low | 58.6 | Low | 91 Ų | 91 | 120 Ų | 120 | 75% | 0.752 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -93.1 | 31.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 42 | S | 59.4 | Low | 58.9 | Low | 111 Ų | 111 | 127 Ų | 127 | 78% | 0.776 | 78% | 0.778 | S | S | * | * | trans | -146.6 | 52.2 | 173.9 | -64.2 | 0 | 0 | 0 | 0 | 112.3 | D40 P44 | D40-S42 VanDerWaalsContact C-N 3.33Å; D40-S42 PolarHBondContact O-N 3.32Å; S42-P44 VanDerWaalsContact O-CD 3.25Å; S42-P44 WeakPolarHBondContact O-CD 3.25Å | ||
| 43 | S | 56.7 | Low | 58.9 | Low | 111 Ų | 111 | 128.5 Ų | 128.5 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | -85.1 | 104.8 | 147.5 | -84.2 | 0 | 0 | 0 | 0 | 107.7 | T45 | S43-T45 PolarHBondContact O-N 2.89Š| ||
| 44 | P | 58.3 | Low | 58.8 | Low | 107 Ų | 107 | 126.8 Ų | 126.8 | 70% | 0.695 | 78% | 0.78 | S | S | * | * | trans | -64.9 | 121.9 | 164.1 | 29 | -30.4 | 0 | 0 | 0 | 106.8 | S42 I46 | S42-P44 VanDerWaalsContact O-CD 3.25Å; S42-P44 WeakPolarHBondContact O-CD 3.25Å; P44-I46 VanDerWaalsContact C-N 3.31Å; P44-I46 PolarHBondContact O-N 3.19Å | ||
| 45 | T | 64.5 | Low | 59.1 | Low | 139 Ų | 139 | 129.1 Ų | 129.1 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -60.8 | 91.5 | 169.1 | 55.6 | 0 | 0 | 0 | 0 | 108.8 | S43 | S43-T45 PolarHBondContact O-N 2.89Š| ||
| 46 | I | 59.2 | Low | 59 | Low | 139 Ų | 139 | 130.9 Ų | 130.9 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | -135.4 | 82.9 | 166.7 | -54.7 | -179.9 | 0 | 0 | 0 | 107.6 | P44 | P44-I46 VanDerWaalsContact C-N 3.31Å; P44-I46 PolarHBondContact O-N 3.19Å | ||
| 47 | S | 61 | Low | 59 | Low | 123 Ų | 123 | 126 Ų | 126 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -93.3 | 126.5 | 143.3 | -64.4 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 48 | P | 59.9 | Low | 58.9 | Low | 108 Ų | 108 | 126.4 Ų | 126.4 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | -137.2 | 133.6 | 118.2 | 32.9 | -19.6 | 0 | 0 | 0 | 112.7 | |||||
| 49 | A | 59.9 | Low | 58.6 | Low | 79 Ų | 79 | 121.8 Ų | 121.8 | 65% | 0.653 | 81% | 0.807 | S | S | * | * | trans | 23.5 | 128.1 | 145.3 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 50 | S | 51.2 | Low | 58.6 | Low | 130 Ų | 130 | 122.8 Ų | 122.8 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | -134.8 | 120.3 | 119.4 | -84.9 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 51 | S | 50 | Low | 58.6 | Low | 105 Ų | 105 | 120.3 Ų | 120.3 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -77.8 | -170.7 | 173.2 | -48.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 52 | P | 61.8 | Low | 58.3 | Low | 201 Ų | 201 | 123 Ų | 123 | 100% | 1.305 | 82% | 0.816 | S | S | * | * | -65.6 | 0 | -106.2 | 37.8 | -34.4 | 0 | 0 | 0 | 116.3 |
Retrieved 52 of 52 residues in 69.9 ms
(Link to these results)