| 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 | P | 41.4 | Very low | 50.6 | Low | 185 Ų | 185 | 132.1 Ų | 132.1 | 100% | 1.201 | 85% | 0.845 | S | S | * | * | 0 | 105.4 | 0 | 8.1 | 14.4 | 0 | 0 | 0 | 110 | A3 | P1-A3 PolarHBondContact O-N 2.8Š| |||
| 2 | N | 39.4 | Very low | 50.8 | Low | 168 Ų | 168 | 125.3 Ų | 125.3 | 90% | 0.898 | 82% | 0.818 | S | S | * | * | trans | -57 | 128.7 | -169.1 | -83.7 | -40 | 0 | 0 | 0 | 113.4 | A4 | N2-A4 PolarHBondContact O-N 2.99Š| ||
| 3 | A | 46.4 | Very low | 51.2 | Low | 101 Ų | 101 | 130.3 Ų | 130.3 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -71.4 | 100.5 | 157.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | P1 G5 | P1-A3 PolarHBondContact O-N 2.8Å; A3-G5 PolarHBondContact O-N 2.81Å | ||
| 4 | A | 48.6 | Very low | 51.4 | Low | 100 Ų | 100 | 132.6 Ų | 132.6 | 83% | 0.826 | 82% | 0.821 | S | S | * | * | trans | -69.2 | 88.4 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | N2 | N2-A4 PolarHBondContact O-N 2.99Š| ||
| 5 | G | 51.2 | Low | 51.5 | Low | 67 Ų | 67 | 134.5 Ų | 134.5 | 69% | 0.691 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -54 | 134.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | A3 L7 | A3-G5 PolarHBondContact O-N 2.81Å; G5-L7 PolarHBondContact O-N 3.44Å |
| 6 | Q | 48.9 | Very low | 51.8 | Low | 195 Ų | 195 | 131.8 Ų | 131.8 | 91% | 0.911 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 132 | 179.9 | -57.3 | -168.8 | 88.1 | 0 | 0 | 111.5 | ||
| 7 | L | 52.1 | Low | 52 | Low | 158 Ų | 158 | 133.6 Ų | 133.6 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 129.6 | 171.9 | -74.3 | 155.8 | 0 | 0 | 0 | 109.4 | G5 T9 | G5-L7 PolarHBondContact O-N 3.44Å; L7-T9 PolarHBondContact O-N 2.72Å |
| 8 | P | 54.4 | Low | 52.3 | Low | 121 Ų | 121 | 131.8 Ų | 131.8 | 79% | 0.786 | 79% | 0.788 | S | S | * | * | trans | -68.4 | 107.2 | 168 | 26 | -30 | 0 | 0 | 0 | 109.4 | S10 | P8-S10 VanDerWaalsContact C-N 3.29Å; P8-S10 PolarHBondContact O-N 3.35Å | ||
| 9 | T | 63.7 | Low | 52.6 | Low | 134 Ų | 134 | 130.7 Ų | 130.7 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -74.3 | 81 | 169.5 | 51.6 | 0 | 0 | 0 | 0 | 110 | L7 | L7-T9 PolarHBondContact O-N 2.72Š|
| 10 | S | 55.6 | Low | 53.4 | Low | 96 Ų | 96 | 129.2 Ų | 129.2 | 67% | 0.671 | 78% | 0.777 | S | S | * | * | trans | 172.5 | 104.7 | 149.4 | -92.6 | 0 | 0 | 0 | 0 | 107.8 | P8 G12 | P8-S10 VanDerWaalsContact C-N 3.29Å; P8-S10 PolarHBondContact O-N 3.35Å; S10-G12 VanDerWaalsContact C-N 3.25Å; S10-G12 PolarHBondContact O-N 2.67Å | ||
| 11 | P | 55.3 | Low | 54.1 | Low | 128 Ų | 128 | 132.7 Ų | 132.7 | 83% | 0.831 | 78% | 0.778 | S | S | * | * | trans | -64.2 | 102.8 | 153.4 | -4 | 21.5 | 0 | 0 | 0 | 104.6 | H13 | P11-H13 PolarHBondContact O-N 2.94Š| ||
| 12 | G | 52.9 | Low | 55.5 | Low | 50 Ų | 50 | 129.8 Ų | 129.8 | 52% | 0.515 | 76% | 0.759 | S | S | . | * | trans | -45.9 | 145.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | S10 M14 | S10-G12 VanDerWaalsContact C-N 3.25Å; S10-G12 PolarHBondContact O-N 2.67Å; G12-M14 PolarHBondContact O-N 2.75Å | ||
| 13 | H | 55.5 | Low | 57.2 | Low | 191 Ų | 191 | 125.3 Ų | 125.3 | 88% | 0.884 | 73% | 0.733 | S | S | * | * | trans | -52.6 | 96.2 | 168.7 | -74.9 | 80.2 | 0 | 0 | 0 | 107.2 | P11 H15 | P11-H13 PolarHBondContact O-N 2.94Å; H13-H15 PolarHBondContact O-N 2.74Å | ||
| 14 | M | 53.7 | Low | 59.1 | Low | 162 Ų | 162 | 124.8 Ų | 124.8 | 80% | 0.798 | 72% | 0.721 | S | S | * | * | trans | -69.9 | 76.4 | 169.8 | -65.8 | -75.5 | -76.3 | 0 | 0 | 104.3 | G12 T16 | G12-M14 PolarHBondContact O-N 2.75Å; M14-T16 PolarHBondContact O-N 3.49Å | ||
| 15 | H | 53.7 | Low | 60.7 | Low | 161 Ų | 161 | 127.3 Ų | 127.3 | 75% | 0.745 | 72% | 0.716 | S | S | * | * | trans | -66.8 | 76.3 | 160.6 | -169.3 | 101.9 | 0 | 0 | 0 | 104.8 | H13 Q17 | H13-H15 PolarHBondContact O-N 2.74Å; H15-Q17 PolarHBondContact O-N 3.21Å | ||
| 16 | T | 56.4 | Low | 62.4 | Low | 91 Ų | 91 | 130.1 Ų | 130.1 | 56% | 0.558 | 71% | 0.714 | S | S | * | * | trans | -57 | 97.5 | 169.3 | -74.7 | 0 | 0 | 0 | 0 | 105 | M14 V18 | M14-T16 PolarHBondContact O-N 3.49Å; T16-V18 HydrophobicContact CG2-CB 4.48Å; T16-V18 HydrophobicContact CG2-CG1 3.75Å; T16-V18 PolarHBondContact O-N 3.02Å | ||
| 17 | Q | 54.4 | Low | 64.2 | Low | 163 Ų | 163 | 127 Ų | 127 | 76% | 0.762 | 70% | 0.695 | S | S | * | * | trans | -67.2 | 76.7 | 161.4 | -94.1 | -150.5 | 54 | 0 | 0 | 106.6 | H15 P19 | H15-Q17 PolarHBondContact O-N 3.21Å; Q17-P19 WeakPolarHBondContact O-CD 3.49Å | ||
| 18 | V | 58.6 | Low | 65.6 | Low | 102 Ų | 102 | 127.1 Ų | 127.1 | 62% | 0.618 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 122.8 | 149.5 | -84.2 | 0 | 0 | 0 | 0 | 105.2 | T16 P20 | T16-V18 HydrophobicContact CG2-CB 4.48Å; T16-V18 HydrophobicContact CG2-CG1 3.75Å; T16-V18 PolarHBondContact O-N 3.02Å; V18-P20 VanDerWaalsContact O-CD 3.3Å; V18-P20 WeakPolarHBondContact O-CD 3.3Å |
| 19 | P | 56.6 | Low | 67.2 | Low | 110 Ų | 110 | 129.1 Ų | 129.1 | 71% | 0.714 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 120.2 | 168.5 | 21.4 | -28.4 | 0 | 0 | 0 | 105.7 | Q17 Y21 | Q17-P19 WeakPolarHBondContact O-CD 3.49Å; P19-Y21 PolarHBondContact O-N 3.44Å |
| 20 | P | 69.9 | Low | 68.5 | Low | 100 Ų | 100 | 128 Ų | 128 | 65% | 0.649 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 120.8 | 179.6 | 21.8 | -28.3 | 0 | 0 | 0 | 105.4 | V18 P22 | V18-P20 VanDerWaalsContact O-CD 3.3Å; V18-P20 WeakPolarHBondContact O-CD 3.3Å; P20-P22 VanDerWaalsContact O-N 3.14Å |
| 21 | Y | 68.1 | Low | 70.2 | Confident | 203 Ų | 203 | 128.3 Ų | 128.3 | 80% | 0.796 | 65% | 0.651 | S | S | * | * | trans | -42.3 | 129.4 | 159.8 | -89.4 | -87.2 | 0 | 0 | 0 | 106.5 | P19 Q23 | P19-Y21 PolarHBondContact O-N 3.44Å; Y21-Q23 VanDerWaalsContact C-N 3.33Å; Y21-Q23 PolarHBondContact O-N 2.91Å; Y21-Q23 PolarHBondContact O-NE2 3.45Å | ||
| 22 | P | 71 | Confident | 72 | Confident | 124 Ų | 124 | 128.8 Ų | 128.8 | 81% | 0.805 | 64% | 0.642 | S | S | * | * | trans | -55 | 105.8 | -175.1 | 19.6 | -30.4 | 0 | 0 | 0 | 107.3 | P20 | P20-P22 VanDerWaalsContact O-N 3.14Š| ||
| 23 | Q | 75.4 | Confident | 73.9 | Confident | 75 Ų | 75 | 129.8 Ų | 129.8 | 35% | 0.35 | 63% | 0.633 | S | S | . | * | trans | -64.2 | 136.1 | -175.2 | -67.3 | -64.2 | -31.3 | 0 | 0 | 106.6 | Y21 Q25 Y27 R28 | Y21-Q23 VanDerWaalsContact C-N 3.33Å; Y21-Q23 PolarHBondContact O-N 2.91Å; Y21-Q23 PolarHBondContact O-NE2 3.45Å; Q23-Q25 PolarHBondContact O-N 3.48Å; Q23-Y27 HydrophobicContact CB-CD1 3.62Å; Q23-Y27 HydrophobicContact CB-CE1 4.42Å; Q23-Y27 HydrophobicContact CB-CG 4.3Å; Q23-Y27 HydrophobicContact CG-CD1 3.61Å; Q23-Y27 HydrophobicContact CG-CE1 3.91Å; Q23-Y27 VanDerWaalsContact OE1-CD1 3.31Å; Q23-R28 HydrophobicContact CB-CG 3.72Å | ||
| 24 | P | 84.7 | Confident | 75.8 | Confident | 90 Ų | 90 | 125.5 Ų | 125.5 | 58% | 0.584 | 62% | 0.616 | S | S | * | * | trans | -47.9 | 139.4 | 172.9 | -26.6 | 34 | 0 | 0 | 0 | 109.6 | L26 Y27 R28 | P24-L26 PolarHBondContact O-N 3.02Å; P24-Y27 WeakPolarHBondContact O-CA 3.41Å; P24-Y27 WeakPolarHBondContact O-CB 3.44Å; P24-Y27 PolarHBondContact O-N 3.44Å; P24-R28 PolarHBondContact O-N 3.35Å | ||
| 25 | Q | 82.3 | Confident | 77.7 | Confident | 153 Ų | 153 | 122.7 Ų | 122.7 | 72% | 0.715 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -52.3 | -32.6 | -174.1 | -67 | -72.3 | 24.5 | 0 | 0 | 112.6 | Q23 R28 R29 | Q23-Q25 PolarHBondContact O-N 3.48Å; Q25-R28 PolarHBondContact O-N 2.96Å; Q25-R29 WeakPolarHBondContact O-CB 3.43Å; Q25-R29 PolarHBondContact O-N 2.97Å |
| 26 | L | 86.5 | Confident | 79.6 | Confident | 125 Ų | 125 | 117.4 Ų | 117.4 | 65% | 0.654 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -59.8 | -44.1 | 173.9 | -178.1 | 60.6 | 0 | 0 | 0 | 113.1 | P24 R29 K30 | P24-L26 PolarHBondContact O-N 3.02Å; L26-R29 PolarHBondContact O-N 3.14Å; L26-K30 HydrophobicContact CD1-CG 4.45Å; L26-K30 WeakPolarHBondContact O-CB 3.41Å; L26-K30 WeakPolarHBondContact O-CG 3.36Å; L26-K30 PolarHBondContact O-N 3.4Å |
| 27 | Y | 87.8 | Confident | 81.4 | Confident | 130 Ų | 130 | 118.3 Ų | 118.3 | 51% | 0.51 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67 | -43.3 | 179.4 | -179.1 | -89.8 | 0 | 0 | 0 | 111.2 | Q23 P24 R29 K30 H31 | Q23-Y27 HydrophobicContact CB-CD1 3.62Å; Q23-Y27 HydrophobicContact CB-CE1 4.42Å; Q23-Y27 HydrophobicContact CB-CG 4.3Å; Q23-Y27 HydrophobicContact CG-CD1 3.61Å; Q23-Y27 HydrophobicContact CG-CE1 3.91Å; Q23-Y27 VanDerWaalsContact OE1-CD1 3.31Å; P24-Y27 WeakPolarHBondContact O-CA 3.41Å; P24-Y27 WeakPolarHBondContact O-CB 3.44Å; P24-Y27 PolarHBondContact O-N 3.44Å; Y27-R29 VanDerWaalsContact C-N 3.34Å; Y27-R29 PolarHBondContact O-N 3.5Å; Y27-K30 PolarHBondContact O-N 3.27Å; Y27-H31 WeakPolarHBondContact O-CB 3.39Å; Y27-H31 PolarHBondContact O-N 2.89Å |
| 28 | R | 82.2 | Confident | 83.2 | Confident | 160 Ų | 160 | 116.4 Ų | 116.4 | 60% | 0.604 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -60.2 | -45.9 | 176.5 | -66.1 | -164.1 | 66.7 | 176.3 | -1 | 111.8 | Q23 P24 Q25 H31 Q32 | Q23-R28 HydrophobicContact CB-CG 3.72Å; P24-R28 PolarHBondContact O-N 3.35Å; Q25-R28 PolarHBondContact O-N 2.96Å; R28-H31 PolarHBondContact O-N 2.8Å; R28-Q32 PolarHBondContact O-N 3Å |
| 29 | R | 86.6 | Confident | 84.9 | Confident | 164 Ų | 164 | 117.4 Ų | 117.4 | 62% | 0.619 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.2 | -48.1 | 177.8 | -174.3 | 179.8 | -178.6 | 142.8 | 4.6 | 111.4 | Q25 L26 Y27 H31 Q32 E33 | Q25-R29 WeakPolarHBondContact O-CB 3.43Å; Q25-R29 PolarHBondContact O-N 2.97Å; L26-R29 PolarHBondContact O-N 3.14Å; Y27-R29 VanDerWaalsContact C-N 3.34Å; Y27-R29 PolarHBondContact O-N 3.5Å; R29-H31 VanDerWaalsContact C-N 3.34Å; R29-H31 PolarHBondContact O-N 3.21Å; R29-Q32 PolarHBondContact O-N 3.49Å; R29-E33 WeakPolarHBondContact CG-OE1 3.48Å; R29-E33 IonicContact NE-OE1 3.14Å; R29-E33 PolarHBondContact NE-OE1 3.46Å; R29-E33 VanDerWaalsContact NE-OE1 3.14Å; R29-E33 WeakPolarHBondContact O-CG 3.49Å; R29-E33 PolarHBondContact O-N 2.89Å |
| 30 | K | 90.9 | Very high | 86.6 | Confident | 110 Ų | 110 | 118 Ų | 118 | 48% | 0.478 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62 | -41 | 178.5 | -80.3 | -73.7 | 166.6 | -143.7 | 0 | 112.5 | L26 Y27 Q32 E33 L34 | L26-K30 HydrophobicContact CD1-CG 4.45Å; L26-K30 WeakPolarHBondContact O-CB 3.41Å; L26-K30 WeakPolarHBondContact O-CG 3.36Å; L26-K30 PolarHBondContact O-N 3.4Å; Y27-K30 PolarHBondContact O-N 3.27Å; K30-Q32 VanDerWaalsContact C-N 3.34Å; K30-Q32 PolarHBondContact O-N 3.39Å; K30-E33 IonicContact NZ-OE2 2.8Å; K30-E33 PolarHBondContact NZ-OE2 3.11Å; K30-E33 PolarHBondContact O-N 3.23Å; K30-L34 WeakPolarHBondContact O-CB 3.39Å; K30-L34 VanDerWaalsContact O-CG 3.25Å; K30-L34 WeakPolarHBondContact O-CG 3.46Å; K30-L34 PolarHBondContact O-N 3.29Å |
| 31 | H | 92.3 | Very high | 87.7 | Confident | 102 Ų | 102 | 117.1 Ų | 117.1 | 47% | 0.472 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.3 | -43.7 | 175.4 | -177.3 | -83.7 | 0 | 0 | 0 | 111.8 | Y27 R28 R29 L34 Q35 | Y27-H31 WeakPolarHBondContact O-CB 3.39Å; Y27-H31 PolarHBondContact O-N 2.89Å; R28-H31 PolarHBondContact O-N 2.8Å; R29-H31 VanDerWaalsContact C-N 3.34Å; R29-H31 PolarHBondContact O-N 3.21Å; H31-L34 PolarHBondContact O-N 3.06Å; H31-Q35 WeakPolarHBondContact O-CB 3.35Å; H31-Q35 PolarHBondContact O-N 2.94Å |
| 32 | Q | 91.8 | Very high | 88.8 | Confident | 139 Ų | 139 | 114.3 Ų | 114.3 | 65% | 0.65 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.1 | -41.8 | 178.4 | -168.5 | 173.8 | 11.7 | 0 | 0 | 112.4 | R28 R29 K30 Q35 A36 | R28-Q32 PolarHBondContact O-N 3Å; R29-Q32 PolarHBondContact O-N 3.49Å; K30-Q32 VanDerWaalsContact C-N 3.34Å; K30-Q32 PolarHBondContact O-N 3.39Å; Q32-Q35 PolarHBondContact O-N 3.46Å; Q32-A36 WeakPolarHBondContact O-CB 3.48Å; Q32-A36 PolarHBondContact O-N 3.42Å |
| 33 | E | 94.1 | Very high | 89.9 | Confident | 70 Ų | 70 | 109.8 Ų | 109.8 | 33% | 0.327 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.4 | -47.6 | 173.8 | -73.4 | 170.7 | -178.8 | 0 | 0 | 111 | R29 K30 Q35 A36 M37 | R29-E33 WeakPolarHBondContact CG-OE1 3.48Å; R29-E33 IonicContact NE-OE1 3.14Å; R29-E33 PolarHBondContact NE-OE1 3.46Å; R29-E33 VanDerWaalsContact NE-OE1 3.14Å; R29-E33 WeakPolarHBondContact O-CG 3.49Å; R29-E33 PolarHBondContact O-N 2.89Å; K30-E33 IonicContact NZ-OE2 2.8Å; K30-E33 PolarHBondContact NZ-OE2 3.11Å; K30-E33 PolarHBondContact O-N 3.23Å; E33-Q35 PolarHBondContact O-N 3.37Å; E33-A36 PolarHBondContact O-N 2.89Å; E33-M37 WeakPolarHBondContact O-CB 3.36Å; E33-M37 WeakPolarHBondContact O-CG 3.41Å; E33-M37 PolarHBondContact O-N 3.32Å |
| 34 | L | 95.3 | Very high | 90.7 | Very high | 102 Ų | 102 | 110.1 Ų | 110.1 | 53% | 0.534 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.8 | -41.3 | 178.3 | -73.9 | 172 | 0 | 0 | 0 | 112.2 | K30 H31 M37 Q38 | K30-L34 WeakPolarHBondContact O-CB 3.39Å; K30-L34 VanDerWaalsContact O-CG 3.25Å; K30-L34 WeakPolarHBondContact O-CG 3.46Å; K30-L34 PolarHBondContact O-N 3.29Å; H31-L34 PolarHBondContact O-N 3.06Å; L34-M37 PolarHBondContact O-N 2.93Å; L34-Q38 WeakPolarHBondContact O-CG 3.4Å; L34-Q38 PolarHBondContact O-N 2.92Å |
| 35 | Q | 94.2 | Very high | 91.1 | Very high | 102 Ų | 102 | 112 Ų | 112 | 48% | 0.477 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.8 | -43.7 | 177.1 | -171.8 | 176.6 | 27.6 | 0 | 0 | 111.5 | H31 Q32 E33 Q38 M39 | H31-Q35 WeakPolarHBondContact O-CB 3.35Å; H31-Q35 PolarHBondContact O-N 2.94Å; Q32-Q35 PolarHBondContact O-N 3.46Å; E33-Q35 PolarHBondContact O-N 3.37Å; Q35-Q38 PolarHBondContact O-N 3.43Å; Q35-M39 WeakPolarHBondContact O-CG 3.38Å; Q35-M39 PolarHBondContact O-N 3.43Å; Q35-M39 VanDerWaalsContact O-N 3.11Å |
| 36 | A | 92.8 | Very high | 91.6 | Very high | 50 Ų | 50 | 108.6 Ų | 108.6 | 41% | 0.413 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q32 E33 Q38 M39 E40 | Q32-A36 WeakPolarHBondContact O-CB 3.48Å; Q32-A36 PolarHBondContact O-N 3.42Å; E33-A36 PolarHBondContact O-N 2.89Å; A36-Q38 PolarHBondContact O-N 3.45Å; A36-M39 PolarHBondContact O-N 2.8Å; A36-E40 PolarHBondContact O-N 2.96Å |
| 37 | M | 93.3 | Very high | 91.7 | Very high | 110 Ų | 110 | 108.6 Ų | 108.6 | 54% | 0.542 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.2 | -43.2 | 175 | -75.2 | -172.2 | 72.7 | 0 | 0 | 112 | E33 L34 M39 E40 L41 | E33-M37 WeakPolarHBondContact O-CB 3.36Å; E33-M37 WeakPolarHBondContact O-CG 3.41Å; E33-M37 PolarHBondContact O-N 3.32Å; L34-M37 PolarHBondContact O-N 2.93Å; M37-M39 VanDerWaalsContact C-N 3.3Å; M37-M39 PolarHBondContact O-N 3.26Å; M37-E40 PolarHBondContact O-N 3.2Å; M37-L41 WeakPolarHBondContact O-CB 3.11Å; M37-L41 WeakPolarHBondContact O-CG 3.25Å; M37-L41 PolarHBondContact O-N 3.25Å |
| 38 | Q | 93.4 | Very high | 91.9 | Very high | 123 Ų | 123 | 106.8 Ų | 106.8 | 58% | 0.575 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.4 | -40.2 | 177.2 | -77.6 | -179.1 | 10.4 | 0 | 0 | 112.3 | L34 Q35 A36 Q42 | L34-Q38 WeakPolarHBondContact O-CG 3.4Å; L34-Q38 PolarHBondContact O-N 2.92Å; Q35-Q38 PolarHBondContact O-N 3.43Å; A36-Q38 PolarHBondContact O-N 3.45Å; Q38-Q42 WeakPolarHBondContact O-CG 3.24Å; Q38-Q42 PolarHBondContact O-N 3.25Å |
| 39 | M | 93.4 | Very high | 92.2 | Very high | 124 Ų | 124 | 101.6 Ų | 101.6 | 61% | 0.611 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.2 | -42.6 | 176 | -67.6 | -165.8 | -66.9 | 0 | 0 | 111.7 | Q35 A36 M37 Q42 S43 | Q35-M39 WeakPolarHBondContact O-CG 3.38Å; Q35-M39 PolarHBondContact O-N 3.43Å; Q35-M39 VanDerWaalsContact O-N 3.11Å; A36-M39 PolarHBondContact O-N 2.8Å; M37-M39 VanDerWaalsContact C-N 3.3Å; M37-M39 PolarHBondContact O-N 3.26Å; M39-Q42 PolarHBondContact O-N 3.03Å; M39-S43 PolarHBondContact O-N 2.65Å |
| 40 | E | 93.4 | Very high | 92.2 | Very high | 123 Ų | 123 | 100 Ų | 100 | 58% | 0.575 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.1 | -44 | 176.9 | -169.4 | -178.3 | 139.2 | 0 | 0 | 111.8 | A36 M37 Q42 S43 Y46 | A36-E40 PolarHBondContact O-N 2.96Å; M37-E40 PolarHBondContact O-N 3.2Å; E40-Q42 PolarHBondContact O-N 3.25Å; E40-S43 VanDerWaalsContact O-CB 3.24Å; E40-S43 WeakPolarHBondContact O-CB 3.43Å; E40-S43 PolarHBondContact O-N 3.18Å; E40-S43 PolarHBondContact O-OG 3.26Å; E40-Y46 WeakPolarHBondContact O-CB 3.45Å |
| 41 | L | 91.8 | Very high | 92 | Very high | 81 Ų | 81 | 99.6 Ų | 99.6 | 42% | 0.424 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.1 | -30.1 | 177.2 | -72.5 | 176.9 | 0 | 0 | 0 | 113 | M37 Y46 | M37-L41 WeakPolarHBondContact O-CB 3.11Å; M37-L41 WeakPolarHBondContact O-CG 3.25Å; M37-L41 PolarHBondContact O-N 3.25Å; L41-Y46 HydrophobicContact CD2-CD1 3.99Å; L41-Y46 HydrophobicContact CD2-CD2 4.48Å; L41-Y46 HydrophobicContact CD2-CE1 3.31Å; L41-Y46 HydrophobicContact CD2-CE2 3.89Å; L41-Y46 WeakPolarHBondContact CD2-OH 3.13Å |
| 42 | Q | 92.9 | Very high | 91.5 | Very high | 144 Ų | 144 | 102 Ų | 102 | 67% | 0.673 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -82.5 | -16.3 | 177.1 | -70.8 | -176.9 | -5.7 | 0 | 0 | 113.2 | Q38 M39 E40 | Q38-Q42 WeakPolarHBondContact O-CG 3.24Å; Q38-Q42 PolarHBondContact O-N 3.25Å; M39-Q42 PolarHBondContact O-N 3.03Å; E40-Q42 PolarHBondContact O-N 3.25Å |
| 43 | S | 93.8 | Very high | 90.9 | Very high | 28 Ų | 28 | 99.2 Ų | 99.2 | 20% | 0.196 | 49% | 0.493 | C | S | . | . | S | Bend | trans | -58.6 | 136.7 | -178.3 | 71.6 | 0 | 0 | 0 | 0 | 111.1 | M39 E40 E45 Y46 K47 | M39-S43 PolarHBondContact O-N 2.65Å; E40-S43 VanDerWaalsContact O-CB 3.24Å; E40-S43 WeakPolarHBondContact O-CB 3.43Å; E40-S43 PolarHBondContact O-N 3.18Å; E40-S43 PolarHBondContact O-OG 3.26Å; S43-E45 PolarHBondContact O-N 2.91Å; S43-Y46 PolarHBondContact O-N 2.93Å; S43-Y46 WeakPolarHBondContact OG-CB 3.35Å; S43-Y46 PolarHBondContact OG-N 3.35Å; S43-K47 PolarHBondContact O-N 2.96Å |
| 44 | P | 91.7 | Very high | 89.8 | Confident | 82 Ų | 82 | 99.4 Ų | 99.4 | 53% | 0.532 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -51.9 | -37.6 | 171.4 | -26.1 | 34.5 | 0 | 0 | 0 | 112.5 | K47 L48 | P44-K47 PolarHBondContact O-N 2.86Å; P44-L48 WeakPolarHBondContact O-CB 3.21Å; P44-L48 PolarHBondContact O-N 3.23Å |
| 45 | E | 93.6 | Very high | 88.5 | Confident | 130 Ų | 130 | 98.3 Ų | 98.3 | 61% | 0.607 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.4 | -44.2 | -179.3 | -68.5 | 64.5 | -140.6 | 0 | 0 | 111.6 | S43 L48 S49 | S43-E45 PolarHBondContact O-N 2.91Å; E45-L48 PolarHBondContact O-N 2.91Å; E45-S49 WeakPolarHBondContact O-CB 3.47Å; E45-S49 PolarHBondContact O-N 2.79Å |
| 46 | Y | 92.7 | Very high | 86.9 | Confident | 81 Ų | 81 | 100.1 Ų | 100.1 | 32% | 0.318 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.2 | -43.6 | 175.7 | -179.6 | -91 | 0 | 0 | 0 | 111.3 | E40 L41 S43 L48 S49 K50 | E40-Y46 WeakPolarHBondContact O-CB 3.45Å; L41-Y46 HydrophobicContact CD2-CD1 3.99Å; L41-Y46 HydrophobicContact CD2-CD2 4.48Å; L41-Y46 HydrophobicContact CD2-CE1 3.31Å; L41-Y46 HydrophobicContact CD2-CE2 3.89Å; L41-Y46 WeakPolarHBondContact CD2-OH 3.13Å; S43-Y46 PolarHBondContact O-N 2.93Å; S43-Y46 WeakPolarHBondContact OG-CB 3.35Å; S43-Y46 PolarHBondContact OG-N 3.35Å; Y46-L48 PolarHBondContact O-N 3.35Å; Y46-S49 PolarHBondContact O-N 2.94Å; Y46-K50 HydrophobicContact CE1-CD 4.2Å; Y46-K50 WeakPolarHBondContact O-CB 3.34Å; Y46-K50 PolarHBondContact O-N 3.17Å |
| 47 | K | 88.4 | Confident | 85.4 | Confident | 126 Ų | 126 | 105.8 Ų | 105.8 | 55% | 0.548 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.5 | -44.2 | 177 | -70.2 | 179.9 | -65.9 | -167.3 | 0 | 111.8 | S43 P44 K50 L51 | S43-K47 PolarHBondContact O-N 2.96Å; P44-K47 PolarHBondContact O-N 2.86Å; K47-K50 PolarHBondContact O-N 3.48Å; K47-L51 WeakPolarHBondContact O-CB 3.5Å; K47-L51 PolarHBondContact O-N 3.39Å |
| 48 | L | 91.1 | Very high | 83.7 | Confident | 91 Ų | 91 | 103.5 Ų | 103.5 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.2 | -39.6 | 177.2 | -174.5 | 63.1 | 0 | 0 | 0 | 111.8 | P44 E45 Y46 L51 R52 | P44-L48 WeakPolarHBondContact O-CB 3.21Å; P44-L48 PolarHBondContact O-N 3.23Å; E45-L48 PolarHBondContact O-N 2.91Å; Y46-L48 PolarHBondContact O-N 3.35Å; L48-L51 PolarHBondContact O-N 2.83Å; L48-R52 WeakPolarHBondContact O-CB 3.21Å; L48-R52 WeakPolarHBondContact O-CG 3.32Å; L48-R52 PolarHBondContact O-N 3.32Å |
| 49 | S | 89.1 | Confident | 82.4 | Confident | 51 Ų | 51 | 105.5 Ų | 105.5 | 36% | 0.357 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.2 | -49.7 | 173.9 | -171.7 | 0 | 0 | 0 | 0 | 110.9 | E45 Y46 L51 R52 T53 | E45-S49 WeakPolarHBondContact O-CB 3.47Å; E45-S49 PolarHBondContact O-N 2.79Å; Y46-S49 PolarHBondContact O-N 2.94Å; S49-L51 VanDerWaalsContact C-N 3.33Å; S49-L51 PolarHBondContact O-N 2.84Å; S49-R52 PolarHBondContact O-N 3.15Å; S49-T53 WeakPolarHBondContact O-CG2 3.49Å; S49-T53 PolarHBondContact O-N 3.47Å; S49-T53 PolarHBondContact O-OG1 3.24Å; S49-T53 VanDerWaalsContact O-OG1 3.05Å |
| 50 | K | 86.7 | Confident | 80.8 | Confident | 130 Ų | 130 | 109.2 Ų | 109.2 | 57% | 0.565 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.9 | -40.2 | 176.1 | -171.9 | 176.6 | -177.4 | -177.9 | 0 | 112.5 | Y46 K47 T53 S54 | Y46-K50 HydrophobicContact CE1-CD 4.2Å; Y46-K50 WeakPolarHBondContact O-CB 3.34Å; Y46-K50 PolarHBondContact O-N 3.17Å; K47-K50 PolarHBondContact O-N 3.48Å; K50-T53 WeakPolarHBondContact CA-OG1 3.12Å; K50-T53 PolarHBondContact O-OG1 2.92Å; K50-S54 WeakPolarHBondContact O-CB 3.47Å; K50-S54 PolarHBondContact O-N 2.9Å |
| 51 | L | 87.3 | Confident | 79.3 | Confident | 103 Ų | 103 | 107.5 Ų | 107.5 | 54% | 0.539 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.6 | -50.9 | 174.8 | -179.9 | 61.5 | 0 | 0 | 0 | 110.8 | K47 L48 S49 T53 S54 T55 | K47-L51 WeakPolarHBondContact O-CB 3.5Å; K47-L51 PolarHBondContact O-N 3.39Å; L48-L51 PolarHBondContact O-N 2.83Å; S49-L51 VanDerWaalsContact C-N 3.33Å; S49-L51 PolarHBondContact O-N 2.84Å; L51-T53 PolarHBondContact O-N 3.4Å; L51-S54 CarbonylContact O-C 3.58Å; L51-S54 PolarHBondContact O-N 3.18Å; L51-T55 WeakPolarHBondContact O-CB 3.41Å; L51-T55 PolarHBondContact O-N 2.95Å; L51-T55 PolarHBondContact O-OG1 3.41Å |
| 52 | R | 81.3 | Confident | 78.1 | Confident | 151 Ų | 151 | 109.5 Ų | 109.5 | 57% | 0.57 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -59.2 | -44.4 | 179.6 | -72.6 | -174.5 | -63.6 | -174.9 | 1.5 | 112.4 | L48 S49 T55 I56 | L48-R52 WeakPolarHBondContact O-CB 3.21Å; L48-R52 WeakPolarHBondContact O-CG 3.32Å; L48-R52 PolarHBondContact O-N 3.32Å; S49-R52 PolarHBondContact O-N 3.15Å; R52-T55 PolarHBondContact O-N 3.34Å; R52-I56 WeakPolarHBondContact O-CD1 3.3Å; R52-I56 VanDerWaalsContact O-CG1 3.3Å; R52-I56 WeakPolarHBondContact O-CG1 3.48Å; R52-I56 PolarHBondContact O-N 3.05Å |
| 53 | T | 79.5 | Confident | 76.8 | Confident | 82 Ų | 82 | 109.4 Ų | 109.4 | 50% | 0.503 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -69.7 | -34.4 | 177.8 | 55.9 | 0 | 0 | 0 | 0 | 112.1 | S49 K50 L51 | S49-T53 WeakPolarHBondContact O-CG2 3.49Å; S49-T53 PolarHBondContact O-N 3.47Å; S49-T53 PolarHBondContact O-OG1 3.24Å; S49-T53 VanDerWaalsContact O-OG1 3.05Å; K50-T53 WeakPolarHBondContact CA-OG1 3.12Å; K50-T53 PolarHBondContact O-OG1 2.92Å; L51-T53 PolarHBondContact O-N 3.4Å |
| 54 | S | 70.4 | Confident | 75.3 | Confident | 74 Ų | 74 | 116.4 Ų | 116.4 | 52% | 0.517 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.6 | -32.3 | 172.9 | -172.4 | 0 | 0 | 0 | 0 | 113 | K50 L51 | K50-S54 WeakPolarHBondContact O-CB 3.47Å; K50-S54 PolarHBondContact O-N 2.9Å; L51-S54 CarbonylContact O-C 3.58Å; L51-S54 PolarHBondContact O-N 3.18Å |
| 55 | T | 67.2 | Low | 74 | Confident | 78 Ų | 78 | 118.3 Ų | 118.3 | 48% | 0.479 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -73.3 | -33.5 | 177.8 | -59.3 | 0 | 0 | 0 | 0 | 112.1 | L51 R52 M57 T58 | L51-T55 WeakPolarHBondContact O-CB 3.41Å; L51-T55 PolarHBondContact O-N 2.95Å; L51-T55 PolarHBondContact O-OG1 3.41Å; R52-T55 PolarHBondContact O-N 3.34Å; T55-M57 PolarHBondContact O-N 3.12Å; T55-T58 PolarHBondContact O-N 3.18Å; T55-T58 PolarHBondContact O-OG1 3.32Å; T55-T58 VanDerWaalsContact O-OG1 3.12Å |
| 56 | I | 61.1 | Low | 72.3 | Confident | 141 Ų | 141 | 123.8 Ų | 123.8 | 72% | 0.723 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -68 | -23.4 | 178.9 | -67.4 | 163.6 | 0 | 0 | 0 | 112 | R52 T58 | R52-I56 WeakPolarHBondContact O-CD1 3.3Å; R52-I56 VanDerWaalsContact O-CG1 3.3Å; R52-I56 WeakPolarHBondContact O-CG1 3.48Å; R52-I56 PolarHBondContact O-N 3.05Å; I56-T58 VanDerWaalsContact C-N 3.34Å |
| 57 | M | 60.5 | Low | 71.2 | Confident | 169 Ų | 169 | 126 Ų | 126 | 83% | 0.833 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -11.7 | 176.1 | -74.1 | -90.1 | -65.5 | 0 | 0 | 113.9 | T55 | T55-M57 PolarHBondContact O-N 3.12Š|
| 58 | T | 59.2 | Low | 70.3 | Confident | 62 Ų | 62 | 125.9 Ų | 125.9 | 38% | 0.38 | 64% | 0.643 | S | S | . | * | trans | -115.3 | 92.4 | 176.6 | 50.7 | 0 | 0 | 0 | 0 | 108.4 | T55 I56 Y60 | T55-T58 PolarHBondContact O-N 3.18Å; T55-T58 PolarHBondContact O-OG1 3.32Å; T55-T58 VanDerWaalsContact O-OG1 3.12Å; I56-T58 VanDerWaalsContact C-N 3.34Å; T58-Y60 HydrophobicContact CG2-CD2 4.4Å; T58-Y60 HydrophobicContact CG2-CE2 4.12Å; T58-Y60 PolarHBondContact O-N 2.74Å; T58-Y60 WeakPolarHBondContact OG1-CD2 3.45Å | ||
| 59 | D | 64.3 | Low | 69.2 | Low | 165 Ų | 165 | 127.9 Ų | 127.9 | 88% | 0.882 | 65% | 0.653 | S | S | * | * | trans | -59.6 | 80.2 | 149.6 | -94.1 | -59.2 | 0 | 0 | 0 | 106.8 | N61 | D59-N61 PolarHBondContact O-N 3.09Š| ||
| 60 | Y | 61.1 | Low | 68 | Low | 201 Ų | 201 | 132.4 Ų | 132.4 | 79% | 0.788 | 67% | 0.67 | S | S | * | * | trans | -61.3 | 94.9 | 162.6 | -94.1 | -86.4 | 0 | 0 | 0 | 105.2 | T58 P62 | T58-Y60 HydrophobicContact CG2-CD2 4.4Å; T58-Y60 HydrophobicContact CG2-CE2 4.12Å; T58-Y60 PolarHBondContact O-N 2.74Å; T58-Y60 WeakPolarHBondContact OG1-CD2 3.45Å; Y60-P62 WeakPolarHBondContact O-CD 3.09Å | ||
| 61 | N | 62.2 | Low | 66.8 | Low | 87 Ų | 87 | 132.6 Ų | 132.6 | 47% | 0.465 | 68% | 0.677 | S | S | . | * | trans | -75 | 105.3 | 167.2 | -179.2 | -2.2 | 0 | 0 | 0 | 107 | D59 N63 Y64 | D59-N61 PolarHBondContact O-N 3.09Å; N61-N63 PolarHBondContact O-N 3Å; N61-N63 WeakPolarHBondContact OD1-CB 3.33Å; N61-N63 PolarHBondContact OD1-N 3.13Å; N61-N63 PolarHBondContact OD1-ND2 3.05Å; N61-N63 VanDerWaalsContact OD1-ND2 3.13Å; N61-Y64 PolarHBondContact O-N 2.84Å; N61-Y64 VanDerWaalsContact O-N 3.09Å | ||
| 62 | P | 66.6 | Low | 65.5 | Low | 123 Ų | 123 | 134.5 Ų | 134.5 | 80% | 0.799 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -5.5 | -178.1 | 30.5 | -36.4 | 0 | 0 | 0 | 113.1 | Y60 | Y60-P62 WeakPolarHBondContact O-CD 3.09Š|
| 63 | N | 65.4 | Low | 64.3 | Low | 142 Ų | 142 | 133.4 Ų | 133.4 | 76% | 0.759 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -0.7 | 174.7 | -57.3 | -78.4 | 0 | 0 | 0 | 113.8 | N61 | N61-N63 PolarHBondContact O-N 3Å; N61-N63 WeakPolarHBondContact OD1-CB 3.33Å; N61-N63 PolarHBondContact OD1-N 3.13Å; N61-N63 PolarHBondContact OD1-ND2 3.05Å; N61-N63 VanDerWaalsContact OD1-ND2 3.13Å |
| 64 | Y | 61.2 | Low | 63.2 | Low | 175 Ų | 175 | 137.3 Ų | 137.3 | 69% | 0.686 | 71% | 0.709 | S | S | * | * | trans | -104.3 | 90 | 177 | -139.7 | -90.3 | 0 | 0 | 0 | 110.7 | N61 F66 | N61-Y64 PolarHBondContact O-N 2.84Å; N61-Y64 VanDerWaalsContact O-N 3.09Å; Y64-F66 HydrophobicContact CD1-CD2 4.24Å; Y64-F66 HydrophobicContact CD1-CE2 4.17Å; Y64-F66 HydrophobicContact CE1-CD2 4.2Å; Y64-F66 AromaticContact CE1-CE2 3.81Å; Y64-F66 HydrophobicContact CE1-CE2 3.81Å; Y64-F66 HydrophobicContact CE1-CZ 4.25Å | ||
| 65 | C | 65.1 | Low | 62.6 | Low | 122 Ų | 122 | 142.6 Ų | 142.6 | 82% | 0.824 | 73% | 0.725 | S | S | * | * | trans | -97.9 | 124.7 | 166.4 | -162.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 66 | F | 56.9 | Low | 62.2 | Low | 246 Ų | 246 | 148.5 Ų | 148.5 | 100% | 1.079 | 75% | 0.747 | S | S | * | * | trans | -75.1 | 0 | 169.1 | -99.4 | -85.6 | 0 | 0 | 0 | 110.9 | Y64 | Y64-F66 HydrophobicContact CD1-CD2 4.24Å; Y64-F66 HydrophobicContact CD1-CE2 4.17Å; Y64-F66 HydrophobicContact CE1-CD2 4.2Å; Y64-F66 AromaticContact CE1-CE2 3.81Å; Y64-F66 HydrophobicContact CE1-CE2 3.81Å; Y64-F66 HydrophobicContact CE1-CZ 4.25Å |
Retrieved 66 of 66 residues in 37.4 ms
(Link to these results)