| 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 | 49.6 | Very low | 60.4 | Low | 241 Ų | 241 | 126 Ų | 126 | 100% | 1.187 | 72% | 0.724 | S | S | * | * | 0 | 116.1 | 0 | -68.9 | -175.6 | 176.6 | 0 | 0 | 106.5 | |||||
| 2 | S | 55.6 | Low | 61.8 | Low | 122 Ų | 122 | 124.4 Ų | 124.4 | 85% | 0.853 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 124.4 | 173.9 | -44.6 | 0 | 0 | 0 | 0 | 107.4 | ||
| 3 | N | 59.5 | Low | 63.5 | Low | 148 Ų | 148 | 122.9 Ų | 122.9 | 79% | 0.791 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 131 | 171.6 | -87.8 | -8.9 | 0 | 0 | 0 | 108.1 | E5 | N3-E5 PolarHBondContact O-N 3.36Å; N3-E5 VanDerWaalsContact O-N 3.15Å |
| 4 | P | 59.7 | Low | 65.2 | Low | 119 Ų | 119 | 122.9 Ų | 122.9 | 77% | 0.773 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 118.2 | 169.6 | 26.7 | -29 | 0 | 0 | 0 | 107 | A6 | P4-A6 PolarHBondContact O-N 2.83Š|
| 5 | E | 59.4 | Low | 66.8 | Low | 178 Ų | 178 | 124.7 Ų | 124.7 | 83% | 0.832 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 128.4 | 172.5 | -76.9 | 171.8 | 160.4 | 0 | 0 | 108.5 | N3 P7 | N3-E5 PolarHBondContact O-N 3.36Å; N3-E5 VanDerWaalsContact O-N 3.15Å; E5-P7 WeakPolarHBondContact O-CD 3.34Å |
| 6 | A | 61 | Low | 68.5 | Low | 66 Ų | 66 | 122.2 Ų | 122.2 | 55% | 0.545 | 67% | 0.671 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 124.2 | -173 | 0 | 0 | 0 | 0 | 0 | 108.8 | P4 G8 E9 | P4-A6 PolarHBondContact O-N 2.83Å; A6-G8 PolarHBondContact O-N 3.46Å; A6-E9 PolarHBondContact O-N 3.47Å |
| 7 | P | 58.5 | Low | 70 | Confident | 115 Ų | 115 | 119.4 Ų | 119.4 | 75% | 0.747 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | 12.6 | -173.1 | 24.5 | -33.4 | 0 | 0 | 0 | 115.1 | E5 | E5-P7 WeakPolarHBondContact O-CD 3.34Š|
| 8 | G | 60.5 | Low | 71.4 | Confident | 40 Ų | 40 | 116.8 Ų | 116.8 | 41% | 0.412 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.6 | -23.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115 | A6 N12 | A6-G8 PolarHBondContact O-N 3.46Å; G8-N12 PolarHBondContact O-N 3.02Å |
| 9 | E | 60.6 | Low | 72.6 | Confident | 136 Ų | 136 | 117.5 Ų | 117.5 | 64% | 0.636 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -72.4 | -43.6 | -177.7 | -72.5 | -179.4 | 171.3 | 0 | 0 | 111.6 | A6 K11 N12 D13 | A6-E9 PolarHBondContact O-N 3.47Å; E9-K11 VanDerWaalsContact C-N 3.35Å; E9-K11 PolarHBondContact O-N 3.01Å; E9-N12 PolarHBondContact O-N 3.14Å; E9-D13 PolarHBondContact O-N 2.94Å |
| 10 | S | 68.2 | Low | 73.8 | Confident | 85 Ų | 85 | 115.1 Ų | 115.1 | 59% | 0.594 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -67.1 | -29.5 | -177.3 | 72.5 | 0 | 0 | 0 | 0 | 114.7 | F14 | S10-F14 WeakPolarHBondContact O-CB 2.89Å; S10-F14 PolarHBondContact O-N 3.01Å |
| 11 | K | 71.7 | Confident | 74.9 | Confident | 136 Ų | 136 | 114.1 Ų | 114.1 | 59% | 0.591 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -75.5 | -39.3 | 174.7 | -73.4 | -173.9 | 179.1 | -180 | 0 | 111.6 | E9 F14 Y15 | E9-K11 VanDerWaalsContact C-N 3.35Å; E9-K11 PolarHBondContact O-N 3.01Å; K11-F14 PolarHBondContact O-N 3.28Å; K11-Y15 HydrophobicContact CB-CE2 4.34Å; K11-Y15 WeakPolarHBondContact O-CD2 3.44Å; K11-Y15 PolarHBondContact O-N 2.96Å |
| 12 | N | 77.4 | Confident | 77.2 | Confident | 107 Ų | 107 | 106.2 Ų | 106.2 | 57% | 0.572 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.7 | -39.1 | 177.5 | -78.9 | -12.1 | 0 | 0 | 0 | 111.4 | G8 E9 F14 Y15 T16 | G8-N12 PolarHBondContact O-N 3.02Å; E9-N12 PolarHBondContact O-N 3.14Å; N12-F14 VanDerWaalsContact C-N 3.34Å; N12-F14 PolarHBondContact O-N 3.41Å; N12-Y15 PolarHBondContact O-N 3.39Å; N12-T16 VanDerWaalsContact O-CB 3.25Å; N12-T16 WeakPolarHBondContact O-CB 3.46Å; N12-T16 PolarHBondContact O-N 3.27Å; N12-T16 PolarHBondContact O-OG1 2.88Å |
| 13 | D | 83.7 | Confident | 79.2 | Confident | 105 Ų | 105 | 103.7 Ų | 103.7 | 56% | 0.561 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.9 | -40.4 | 174.4 | -70.1 | -16.8 | 0 | 0 | 0 | 111.8 | E9 T17 | E9-D13 PolarHBondContact O-N 2.94Å; D13-T17 WeakPolarHBondContact O-CB 3.45Å; D13-T17 PolarHBondContact O-N 3.48Å; D13-T17 PolarHBondContact O-OG1 2.75Å |
| 14 | F | 86.7 | Confident | 81 | Confident | 123 Ų | 123 | 102 Ų | 102 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.8 | -52.7 | 175.2 | 177.8 | -95.7 | 0 | 0 | 0 | 112 | S10 K11 N12 T16 T17 M18 | S10-F14 WeakPolarHBondContact O-CB 2.89Å; S10-F14 PolarHBondContact O-N 3.01Å; K11-F14 PolarHBondContact O-N 3.28Å; N12-F14 VanDerWaalsContact C-N 3.34Å; N12-F14 PolarHBondContact O-N 3.41Å; F14-T16 VanDerWaalsContact C-N 3.35Å; F14-T16 PolarHBondContact O-N 3.48Å; F14-T17 PolarHBondContact O-N 3.48Å; F14-M18 HydrophobicContact CD1-CG 4.3Å; F14-M18 HydrophobicContact CE1-CG 3.86Å; F14-M18 HydrophobicContact CE2-CG 4.25Å; F14-M18 HydrophobicContact CZ-CG 3.84Å; F14-M18 HydrophobicContact CZ-SD 4.26Å; F14-M18 WeakPolarHBondContact O-CG 3.37Å; F14-M18 PolarHBondContact O-N 3.42Å |
| 15 | Y | 90.4 | Very high | 82.8 | Confident | 150 Ų | 150 | 102.3 Ų | 102.3 | 59% | 0.588 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.3 | -36.5 | -179.7 | -68.5 | -58.3 | 0 | 0 | 0 | 112.7 | K11 N12 M18 F19 | K11-Y15 HydrophobicContact CB-CE2 4.34Å; K11-Y15 WeakPolarHBondContact O-CD2 3.44Å; K11-Y15 PolarHBondContact O-N 2.96Å; N12-Y15 PolarHBondContact O-N 3.39Å; Y15-M18 PolarHBondContact O-N 3.35Å; Y15-F19 WeakPolarHBondContact O-CB 3.47Å; Y15-F19 PolarHBondContact O-N 2.96Å |
| 16 | T | 92.9 | Very high | 84.7 | Confident | 84 Ų | 84 | 98.7 Ų | 98.7 | 52% | 0.515 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -46.2 | 175.1 | -58.7 | 0 | 0 | 0 | 0 | 110.6 | N12 F14 M18 F19 V20 | N12-T16 VanDerWaalsContact O-CB 3.25Å; N12-T16 WeakPolarHBondContact O-CB 3.46Å; N12-T16 PolarHBondContact O-N 3.27Å; N12-T16 PolarHBondContact O-OG1 2.88Å; F14-T16 VanDerWaalsContact C-N 3.35Å; F14-T16 PolarHBondContact O-N 3.48Å; T16-M18 PolarHBondContact O-N 3.47Å; T16-F19 PolarHBondContact O-N 3.24Å; T16-V20 WeakPolarHBondContact O-CG2 3.37Å; T16-V20 PolarHBondContact O-N 3.29Å |
| 17 | T | 94.2 | Very high | 86.4 | Confident | 75 Ų | 75 | 97.6 Ų | 97.6 | 46% | 0.46 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 176.6 | -57.6 | 0 | 0 | 0 | 0 | 111.2 | D13 F14 F19 V20 Q21 | D13-T17 WeakPolarHBondContact O-CB 3.45Å; D13-T17 PolarHBondContact O-N 3.48Å; D13-T17 PolarHBondContact O-OG1 2.75Å; F14-T17 PolarHBondContact O-N 3.48Å; T17-F19 VanDerWaalsContact C-N 3.32Å; T17-F19 PolarHBondContact O-N 3.25Å; T17-V20 PolarHBondContact O-N 2.88Å; T17-Q21 WeakPolarHBondContact O-CG 3.42Å; T17-Q21 PolarHBondContact O-N 3.37Å |
| 18 | M | 95.2 | Very high | 88.3 | Confident | 72 Ų | 72 | 96.3 Ų | 96.3 | 36% | 0.355 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 176.6 | -75 | -58.9 | -46.1 | 0 | 0 | 112.1 | F14 Y15 T16 Q21 I22 | F14-M18 HydrophobicContact CD1-CG 4.3Å; F14-M18 HydrophobicContact CE1-CG 3.86Å; F14-M18 HydrophobicContact CE2-CG 4.25Å; F14-M18 HydrophobicContact CZ-CG 3.84Å; F14-M18 HydrophobicContact CZ-SD 4.26Å; F14-M18 WeakPolarHBondContact O-CG 3.37Å; F14-M18 PolarHBondContact O-N 3.42Å; Y15-M18 PolarHBondContact O-N 3.35Å; T16-M18 PolarHBondContact O-N 3.47Å; M18-Q21 PolarHBondContact O-N 2.91Å; M18-I22 WeakPolarHBondContact O-CB 3.36Å; M18-I22 WeakPolarHBondContact O-CD1 3.34Å; M18-I22 VanDerWaalsContact O-CG1 3.24Å; M18-I22 WeakPolarHBondContact O-CG1 3.34Å; M18-I22 PolarHBondContact O-N 2.93Å |
| 19 | F | 95.4 | Very high | 90.1 | Very high | 130 Ų | 130 | 99.8 Ų | 99.8 | 57% | 0.57 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.8 | -47.8 | 178.4 | -179.6 | -94.3 | 0 | 0 | 0 | 111.8 | Y15 T16 T17 Q21 I22 E23 | Y15-F19 WeakPolarHBondContact O-CB 3.47Å; Y15-F19 PolarHBondContact O-N 2.96Å; T16-F19 PolarHBondContact O-N 3.24Å; T17-F19 VanDerWaalsContact C-N 3.32Å; T17-F19 PolarHBondContact O-N 3.25Å; F19-Q21 VanDerWaalsContact C-N 3.33Å; F19-Q21 PolarHBondContact O-N 3Å; F19-I22 PolarHBondContact O-N 3.22Å; F19-E23 HydrophobicContact CD1-CG 4.34Å; F19-E23 HydrophobicContact CE1-CG 3.84Å; F19-E23 HydrophobicContact CE2-CG 4.34Å; F19-E23 HydrophobicContact CZ-CG 3.83Å; F19-E23 PolarHBondContact O-N 2.87Å |
| 20 | V | 96 | Very high | 91.9 | Very high | 70 Ų | 70 | 100.1 Ų | 100.1 | 42% | 0.424 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 177.4 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | T16 T17 I22 E23 E24 | T16-V20 WeakPolarHBondContact O-CG2 3.37Å; T16-V20 PolarHBondContact O-N 3.29Å; T17-V20 PolarHBondContact O-N 2.88Å; V20-I22 VanDerWaalsContact C-N 3.35Å; V20-I22 PolarHBondContact O-N 3.38Å; V20-E23 PolarHBondContact O-N 3.32Å; V20-E24 WeakPolarHBondContact O-CG 3.5Å; V20-E24 PolarHBondContact O-N 3.47Å |
| 21 | Q | 96.8 | Very high | 93.3 | Very high | 94 Ų | 94 | 101.4 Ų | 101.4 | 44% | 0.439 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.3 | -41.1 | 177.7 | -73.1 | 178.9 | -17.5 | 0 | 0 | 112.5 | T17 M18 F19 E23 E24 M25 | T17-Q21 WeakPolarHBondContact O-CG 3.42Å; T17-Q21 PolarHBondContact O-N 3.37Å; M18-Q21 PolarHBondContact O-N 2.91Å; F19-Q21 VanDerWaalsContact C-N 3.33Å; F19-Q21 PolarHBondContact O-N 3Å; Q21-E23 PolarHBondContact O-N 3.03Å; Q21-E24 PolarHBondContact O-N 3.38Å; Q21-M25 WeakPolarHBondContact O-CB 3.5Å; Q21-M25 VanDerWaalsContact O-CG 3.27Å; Q21-M25 WeakPolarHBondContact O-CG 3.4Å; Q21-M25 PolarHBondContact O-N 2.96Å |
| 22 | I | 97 | Very high | 94.4 | Very high | 75 Ų | 75 | 99.4 Ų | 99.4 | 39% | 0.385 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.5 | -42.8 | 176.3 | -73.3 | 166 | 0 | 0 | 0 | 111.1 | M18 F19 V20 M25 K26 | M18-I22 WeakPolarHBondContact O-CB 3.36Å; M18-I22 WeakPolarHBondContact O-CD1 3.34Å; M18-I22 VanDerWaalsContact O-CG1 3.24Å; M18-I22 WeakPolarHBondContact O-CG1 3.34Å; M18-I22 PolarHBondContact O-N 2.93Å; F19-I22 PolarHBondContact O-N 3.22Å; V20-I22 VanDerWaalsContact C-N 3.35Å; V20-I22 PolarHBondContact O-N 3.38Å; I22-M25 PolarHBondContact O-N 3.45Å; I22-K26 HydrophobicContact CG2-CD 4.34Å; I22-K26 WeakPolarHBondContact O-CG 3.49Å; I22-K26 PolarHBondContact O-N 3.42Å |
| 23 | E | 97.9 | Very high | 95.3 | Very high | 69 Ų | 69 | 100.8 Ų | 100.8 | 32% | 0.322 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.4 | -36.8 | 178.3 | -69.2 | -55 | 125.9 | 0 | 0 | 112.4 | F19 V20 Q21 K26 S27 | F19-E23 HydrophobicContact CD1-CG 4.34Å; F19-E23 HydrophobicContact CE1-CG 3.84Å; F19-E23 HydrophobicContact CE2-CG 4.34Å; F19-E23 HydrophobicContact CZ-CG 3.83Å; F19-E23 PolarHBondContact O-N 2.87Å; V20-E23 PolarHBondContact O-N 3.32Å; Q21-E23 PolarHBondContact O-N 3.03Å; E23-K26 PolarHBondContact O-N 3.24Å; E23-K26 WeakPolarHBondContact OE1-CD 3.48Å; E23-K26 IonicContact OE1-NZ 3.49Å; E23-K26 PolarHBondContact OE1-NZ 3.05Å; E23-S27 WeakPolarHBondContact O-CB 3.44Å; E23-S27 PolarHBondContact O-N 3.49Å |
| 24 | E | 98.1 | Very high | 95.8 | Very high | 114 Ų | 114 | 101.6 Ų | 101.6 | 53% | 0.533 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.9 | -44 | 171.4 | -74.3 | -179.8 | 178.9 | 0 | 0 | 111.8 | V20 Q21 K26 S27 N28 | V20-E24 WeakPolarHBondContact O-CG 3.5Å; V20-E24 PolarHBondContact O-N 3.47Å; Q21-E24 PolarHBondContact O-N 3.38Å; E24-K26 PolarHBondContact O-N 2.94Å; E24-S27 WeakPolarHBondContact O-CB 3.41Å; E24-S27 PolarHBondContact O-N 3.38Å; E24-N28 PolarHBondContact O-N 3.24Å; E24-N28 PolarHBondContact O-ND2 3.15Å |
| 25 | M | 97.8 | Very high | 96.3 | Very high | 124 Ų | 124 | 102.2 Ų | 102.2 | 61% | 0.611 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61 | -44.2 | 175.6 | -73.5 | 176.8 | 69.8 | 0 | 0 | 111.6 | Q21 I22 S27 N28 L29 | Q21-M25 WeakPolarHBondContact O-CB 3.5Å; Q21-M25 VanDerWaalsContact O-CG 3.27Å; Q21-M25 WeakPolarHBondContact O-CG 3.4Å; Q21-M25 PolarHBondContact O-N 2.96Å; I22-M25 PolarHBondContact O-N 3.45Å; M25-S27 VanDerWaalsContact C-N 3.33Å; M25-S27 PolarHBondContact O-N 3.06Å; M25-N28 PolarHBondContact O-N 2.89Å; M25-L29 WeakPolarHBondContact O-CG 3.34Å; M25-L29 PolarHBondContact O-N 3.23Å |
| 26 | K | 97.7 | Very high | 96.3 | Very high | 102 Ų | 102 | 100.2 Ų | 100.2 | 44% | 0.443 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.2 | -40.8 | 174.5 | -72.9 | 174 | -175 | 170.4 | 0 | 112.1 | I22 E23 E24 L29 R30 | I22-K26 HydrophobicContact CG2-CD 4.34Å; I22-K26 WeakPolarHBondContact O-CG 3.49Å; I22-K26 PolarHBondContact O-N 3.42Å; E23-K26 PolarHBondContact O-N 3.24Å; E23-K26 WeakPolarHBondContact OE1-CD 3.48Å; E23-K26 IonicContact OE1-NZ 3.49Å; E23-K26 PolarHBondContact OE1-NZ 3.05Å; E24-K26 PolarHBondContact O-N 2.94Å; K26-L29 PolarHBondContact O-N 2.7Å; K26-R30 PolarHBondContact O-N 3.11Å; K26-R30 VanDerWaalsContact O-N 3.12Å |
| 27 | S | 98 | Very high | 96.3 | Very high | 43 Ų | 43 | 102.7 Ų | 102.7 | 30% | 0.301 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 175.8 | -173 | 0 | 0 | 0 | 0 | 111.7 | E23 E24 M25 R30 K31 | E23-S27 WeakPolarHBondContact O-CB 3.44Å; E23-S27 PolarHBondContact O-N 3.49Å; E24-S27 WeakPolarHBondContact O-CB 3.41Å; E24-S27 PolarHBondContact O-N 3.38Å; M25-S27 VanDerWaalsContact C-N 3.33Å; M25-S27 PolarHBondContact O-N 3.06Å; S27-R30 PolarHBondContact O-N 2.98Å; S27-K31 PolarHBondContact O-N 3.4Å; S27-K31 VanDerWaalsContact O-N 3.17Å |
| 28 | N | 98.2 | Very high | 96.2 | Very high | 89 Ų | 89 | 104.9 Ų | 104.9 | 48% | 0.476 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.1 | -38.5 | 177.6 | -70.1 | -26.9 | 0 | 0 | 0 | 112.5 | E24 M25 K31 I32 | E24-N28 PolarHBondContact O-N 3.24Å; E24-N28 PolarHBondContact O-ND2 3.15Å; M25-N28 PolarHBondContact O-N 2.89Å; N28-K31 PolarHBondContact O-N 3.45Å; N28-I32 WeakPolarHBondContact O-CG1 3.31Å; N28-I32 PolarHBondContact O-N 2.89Å |
| 29 | L | 98.1 | Very high | 96.1 | Very high | 113 Ų | 113 | 105.9 Ų | 105.9 | 59% | 0.592 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.8 | -43.5 | 174.6 | -75.5 | 172.3 | 0 | 0 | 0 | 112 | M25 K26 K31 I32 E33 | M25-L29 WeakPolarHBondContact O-CG 3.34Å; M25-L29 PolarHBondContact O-N 3.23Å; K26-L29 PolarHBondContact O-N 2.7Å; L29-K31 PolarHBondContact O-N 2.96Å; L29-I32 PolarHBondContact O-N 3.42Å; L29-I32 VanDerWaalsContact O-N 3.17Å; L29-E33 PolarHBondContact O-N 3.38Å |
| 30 | R | 97.5 | Very high | 95.9 | Very high | 142 Ų | 142 | 103 Ų | 103 | 54% | 0.536 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 175.1 | -77.1 | -174.4 | -74.1 | -152.2 | -3.2 | 112.6 | K26 S27 I32 E33 E34 | K26-R30 PolarHBondContact O-N 3.11Å; K26-R30 VanDerWaalsContact O-N 3.12Å; S27-R30 PolarHBondContact O-N 2.98Å; R30-I32 VanDerWaalsContact C-N 3.29Å; R30-I32 PolarHBondContact O-N 2.9Å; R30-E33 WeakPolarHBondContact O-CB 3.37Å; R30-E33 PolarHBondContact O-N 2.95Å; R30-E34 WeakPolarHBondContact O-CG 3.36Å; R30-E34 PolarHBondContact O-N 2.96Å |
| 31 | K | 97.6 | Very high | 95.6 | Very high | 112 Ų | 112 | 103.1 Ų | 103.1 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -34.3 | 176.1 | -67.9 | 174.6 | -175.4 | 173.5 | 0 | 112.9 | S27 N28 L29 K35 | S27-K31 PolarHBondContact O-N 3.4Å; S27-K31 VanDerWaalsContact O-N 3.17Å; N28-K31 PolarHBondContact O-N 3.45Å; L29-K31 PolarHBondContact O-N 2.96Å; K31-K35 WeakPolarHBondContact O-CG 3.4Å; K31-K35 PolarHBondContact O-N 3.15Å |
| 32 | I | 96.2 | Very high | 95.4 | Very high | 94 Ų | 94 | 104.2 Ų | 104.2 | 48% | 0.482 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.9 | -43.6 | 175.1 | -68.9 | 166.6 | 0 | 0 | 0 | 109.8 | N28 L29 R30 K35 L36 | N28-I32 WeakPolarHBondContact O-CG1 3.31Å; N28-I32 PolarHBondContact O-N 2.89Å; L29-I32 PolarHBondContact O-N 3.42Å; L29-I32 VanDerWaalsContact O-N 3.17Å; R30-I32 VanDerWaalsContact C-N 3.29Å; R30-I32 PolarHBondContact O-N 2.9Å; I32-K35 PolarHBondContact O-N 3.45Å; I32-L36 HydrophobicContact CG2-CD1 4Å; I32-L36 HydrophobicContact CG2-CG 4.35Å; I32-L36 WeakPolarHBondContact O-CG 3.44Å; I32-L36 PolarHBondContact O-N 3.32Å |
| 33 | E | 95.4 | Very high | 95.2 | Very high | 137 Ų | 137 | 105.4 Ų | 105.4 | 64% | 0.64 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.5 | -47 | 176.4 | -173.3 | 177 | -169.5 | 0 | 0 | 111.9 | L29 R30 K35 L36 F37 | L29-E33 PolarHBondContact O-N 3.38Å; R30-E33 WeakPolarHBondContact O-CB 3.37Å; R30-E33 PolarHBondContact O-N 2.95Å; E33-K35 PolarHBondContact O-N 3.16Å; E33-L36 PolarHBondContact O-N 2.74Å; E33-F37 PolarHBondContact O-N 3.49Å |
| 34 | E | 95.7 | Very high | 94.9 | Very high | 121 Ų | 121 | 107.6 Ų | 107.6 | 57% | 0.565 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -56.3 | -47.8 | 174.9 | -72.9 | 167.3 | -179 | 0 | 0 | 111.5 | R30 L36 F37 E38 | R30-E34 WeakPolarHBondContact O-CG 3.36Å; R30-E34 PolarHBondContact O-N 2.96Å; E34-L36 PolarHBondContact O-N 2.93Å; E34-F37 WeakPolarHBondContact O-CB 3.43Å; E34-F37 PolarHBondContact O-N 2.92Å; E34-E38 WeakPolarHBondContact O-CG 3.39Å; E34-E38 PolarHBondContact O-N 3.03Å |
| 35 | K | 95.5 | Very high | 94.5 | Very high | 136 Ų | 136 | 104.7 Ų | 104.7 | 59% | 0.591 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.2 | -36.6 | 177.5 | -75.8 | -176.3 | 176.1 | -170.8 | 0 | 113.5 | K31 I32 E33 F37 E38 I39 | K31-K35 WeakPolarHBondContact O-CG 3.4Å; K31-K35 PolarHBondContact O-N 3.15Å; I32-K35 PolarHBondContact O-N 3.45Å; E33-K35 PolarHBondContact O-N 3.16Å; K35-F37 VanDerWaalsContact C-N 3.28Å; K35-E38 PolarHBondContact O-N 3.21Å; K35-I39 VanDerWaalsContact O-CG1 3.27Å; K35-I39 WeakPolarHBondContact O-CG1 3.48Å; K35-I39 PolarHBondContact O-N 2.98Å |
| 36 | L | 91.5 | Very high | 94.3 | Very high | 109 Ų | 109 | 103.7 Ų | 103.7 | 57% | 0.571 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.1 | -37.7 | 175.8 | -75.8 | 172.6 | 0 | 0 | 0 | 110.9 | I32 E33 E34 S40 | I32-L36 HydrophobicContact CG2-CD1 4Å; I32-L36 HydrophobicContact CG2-CG 4.35Å; I32-L36 WeakPolarHBondContact O-CG 3.44Å; I32-L36 PolarHBondContact O-N 3.32Å; E33-L36 PolarHBondContact O-N 2.74Å; E34-L36 PolarHBondContact O-N 2.93Å; L36-S40 WeakPolarHBondContact O-CB 3.36Å; L36-S40 PolarHBondContact O-N 3.33Å |
| 37 | F | 92.2 | Very high | 93.9 | Very high | 135 Ų | 135 | 104 Ų | 104 | 59% | 0.592 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.7 | -48.3 | 174.2 | -166.6 | -93.2 | 0 | 0 | 0 | 111.3 | E33 E34 K35 I39 S40 D41 | E33-F37 PolarHBondContact O-N 3.49Å; E34-F37 WeakPolarHBondContact O-CB 3.43Å; E34-F37 PolarHBondContact O-N 2.92Å; K35-F37 VanDerWaalsContact C-N 3.28Å; F37-I39 PolarHBondContact O-N 3.23Å; F37-S40 WeakPolarHBondContact O-CB 3.49Å; F37-S40 PolarHBondContact O-N 3.25Å; F37-S40 VanDerWaalsContact O-N 3.14Å; F37-D41 WeakPolarHBondContact CE1-OD2 3.44Å; F37-D41 PolarHBondContact O-N 3.38Å |
| 38 | E | 92.2 | Very high | 93.5 | Very high | 121 Ų | 121 | 104.5 Ų | 104.5 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -56.4 | -47.1 | 175.7 | -70.6 | 174.4 | 177 | 0 | 0 | 112.4 | E34 K35 S40 D41 D42 | E34-E38 WeakPolarHBondContact O-CG 3.39Å; E34-E38 PolarHBondContact O-N 3.03Å; K35-E38 PolarHBondContact O-N 3.21Å; E38-S40 VanDerWaalsContact C-N 3.32Å; E38-S40 PolarHBondContact O-N 2.84Å; E38-D41 PolarHBondContact O-N 2.84Å; E38-D42 PolarHBondContact O-N 2.88Å |
| 39 | I | 92.3 | Very high | 93.1 | Very high | 93 Ų | 93 | 106 Ų | 106 | 48% | 0.477 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.6 | -39.9 | 178 | -68.3 | 165.5 | 0 | 0 | 0 | 111.1 | K35 F37 D42 L43 | K35-I39 VanDerWaalsContact O-CG1 3.27Å; K35-I39 WeakPolarHBondContact O-CG1 3.48Å; K35-I39 PolarHBondContact O-N 2.98Å; F37-I39 PolarHBondContact O-N 3.23Å; I39-D42 PolarHBondContact O-N 3.11Å; I39-L43 HydrophobicContact CG2-CD1 3.96Å; I39-L43 HydrophobicContact CG2-CG 4.28Å; I39-L43 WeakPolarHBondContact O-CB 3.3Å; I39-L43 VanDerWaalsContact O-CG 3.29Å; I39-L43 WeakPolarHBondContact O-CG 3.41Å; I39-L43 PolarHBondContact O-N 2.86Å |
| 40 | S | 92.2 | Very high | 92.7 | Very high | 69 Ų | 69 | 104.3 Ų | 104.3 | 48% | 0.483 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62 | -44 | 177.2 | -178.6 | 0 | 0 | 0 | 0 | 111.3 | L36 F37 E38 L43 F44 | L36-S40 WeakPolarHBondContact O-CB 3.36Å; L36-S40 PolarHBondContact O-N 3.33Å; F37-S40 WeakPolarHBondContact O-CB 3.49Å; F37-S40 PolarHBondContact O-N 3.25Å; F37-S40 VanDerWaalsContact O-N 3.14Å; E38-S40 VanDerWaalsContact C-N 3.32Å; E38-S40 PolarHBondContact O-N 2.84Å; S40-L43 PolarHBondContact O-N 2.82Å; S40-F44 VanDerWaalsContact O-CB 3.3Å; S40-F44 WeakPolarHBondContact O-CB 3.39Å; S40-F44 PolarHBondContact O-N 3.46Å |
| 41 | D | 90.7 | Very high | 92.3 | Very high | 73 Ų | 73 | 99.3 Ų | 99.3 | 39% | 0.39 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 177.2 | -78.3 | -7.8 | 0 | 0 | 0 | 112.1 | F37 E38 F44 S45 | F37-D41 WeakPolarHBondContact CE1-OD2 3.44Å; F37-D41 PolarHBondContact O-N 3.38Å; E38-D41 PolarHBondContact O-N 2.84Å; D41-F44 PolarHBondContact O-N 3.17Å; D41-S45 VanDerWaalsContact O-CB 3.29Å; D41-S45 WeakPolarHBondContact O-CB 3.45Å; D41-S45 PolarHBondContact O-N 3.43Å; D41-S45 PolarHBondContact O-OG 3.39Å |
| 42 | D | 92.6 | Very high | 92 | Very high | 118 Ų | 118 | 99.4 Ų | 99.4 | 63% | 0.631 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.8 | -45.5 | 175.7 | -82.2 | -16.3 | 0 | 0 | 0 | 112 | E38 I39 S45 M46 | E38-D42 PolarHBondContact O-N 2.88Å; I39-D42 PolarHBondContact O-N 3.11Å; D42-S45 PolarHBondContact O-N 3.46Å; D42-M46 WeakPolarHBondContact O-CB 3.47Å; D42-M46 PolarHBondContact O-N 3.06Å |
| 43 | L | 92.2 | Very high | 91.7 | Very high | 99 Ų | 99 | 104.3 Ų | 104.3 | 52% | 0.518 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 177.1 | -74.5 | 176.2 | 0 | 0 | 0 | 111.4 | I39 S40 M46 F47 | I39-L43 HydrophobicContact CG2-CD1 3.96Å; I39-L43 HydrophobicContact CG2-CG 4.28Å; I39-L43 WeakPolarHBondContact O-CB 3.3Å; I39-L43 VanDerWaalsContact O-CG 3.29Å; I39-L43 WeakPolarHBondContact O-CG 3.41Å; I39-L43 PolarHBondContact O-N 2.86Å; S40-L43 PolarHBondContact O-N 2.82Å; L43-M46 HydrophobicContact CD2-CE 3.9Å; L43-M46 PolarHBondContact O-N 3.48Å; L43-F47 WeakPolarHBondContact O-CB 3.44Å; L43-F47 PolarHBondContact O-N 3.23Å |
| 44 | F | 90.8 | Very high | 91.6 | Very high | 115 Ų | 115 | 101.9 Ų | 101.9 | 50% | 0.504 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -42.8 | 176.3 | -174.8 | -109.8 | 0 | 0 | 0 | 111.4 | S40 D41 M46 F47 L48 | S40-F44 VanDerWaalsContact O-CB 3.3Å; S40-F44 WeakPolarHBondContact O-CB 3.39Å; S40-F44 PolarHBondContact O-N 3.46Å; D41-F44 PolarHBondContact O-N 3.17Å; F44-M46 VanDerWaalsContact C-N 3.33Å; F44-M46 PolarHBondContact O-N 3.3Å; F44-F47 HydrophobicContact CD2-CD1 4.42Å; F44-F47 HydrophobicContact CE2-CD1 4.37Å; F44-F47 WeakPolarHBondContact O-CB 3.31Å; F44-F47 PolarHBondContact O-N 3.15Å; F44-F47 VanDerWaalsContact O-N 3.17Å; F44-L48 HydrophobicContact CD1-CD1 4Å; F44-L48 HydrophobicContact CD1-CG 4.36Å; F44-L48 HydrophobicContact CE1-CD1 3.52Å; F44-L48 HydrophobicContact CE1-CD2 4.43Å; F44-L48 HydrophobicContact CE1-CG 4Å; F44-L48 HydrophobicContact CZ-CD1 4.01Å; F44-L48 HydrophobicContact CZ-CD2 4.07Å; F44-L48 HydrophobicContact CZ-CG 4.08Å; F44-L48 WeakPolarHBondContact O-CG 3.41Å; F44-L48 PolarHBondContact O-N 2.97Å |
| 45 | S | 90.8 | Very high | 91.5 | Very high | 53 Ų | 53 | 100.1 Ų | 100.1 | 37% | 0.371 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 174.6 | -64.6 | 0 | 0 | 0 | 0 | 112.2 | D41 D42 L48 K49 | D41-S45 VanDerWaalsContact O-CB 3.29Å; D41-S45 WeakPolarHBondContact O-CB 3.45Å; D41-S45 PolarHBondContact O-N 3.43Å; D41-S45 PolarHBondContact O-OG 3.39Å; D42-S45 PolarHBondContact O-N 3.46Å; S45-L48 PolarHBondContact O-N 3.24Å; S45-K49 WeakPolarHBondContact O-CG 3.39Å; S45-K49 PolarHBondContact O-N 3.4Å |
| 46 | M | 92.3 | Very high | 91.2 | Very high | 103 Ų | 103 | 97.2 Ų | 97.2 | 51% | 0.507 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.1 | -41.5 | 174 | -175.4 | 178.5 | 66.1 | 0 | 0 | 111.6 | D42 L43 F44 K49 N50 | D42-M46 WeakPolarHBondContact O-CB 3.47Å; D42-M46 PolarHBondContact O-N 3.06Å; L43-M46 HydrophobicContact CD2-CE 3.9Å; L43-M46 PolarHBondContact O-N 3.48Å; F44-M46 VanDerWaalsContact C-N 3.33Å; F44-M46 PolarHBondContact O-N 3.3Å; M46-K49 PolarHBondContact O-N 3.14Å; M46-N50 PolarHBondContact O-N 2.99Å; M46-N50 PolarHBondContact O-ND2 3.29Å |
| 47 | F | 90.3 | Very high | 91.2 | Very high | 109 Ų | 109 | 99.9 Ų | 99.9 | 48% | 0.478 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.4 | -47.8 | 174.8 | 169.2 | -98.6 | 0 | 0 | 0 | 111.6 | L43 F44 K49 N50 M51 | L43-F47 WeakPolarHBondContact O-CB 3.44Å; L43-F47 PolarHBondContact O-N 3.23Å; F44-F47 HydrophobicContact CD2-CD1 4.42Å; F44-F47 HydrophobicContact CE2-CD1 4.37Å; F44-F47 WeakPolarHBondContact O-CB 3.31Å; F44-F47 PolarHBondContact O-N 3.15Å; F44-F47 VanDerWaalsContact O-N 3.17Å; F47-K49 PolarHBondContact O-N 2.95Å; F47-N50 PolarHBondContact O-N 3.4Å; F47-N50 VanDerWaalsContact O-N 3.15Å; F47-M51 HydrophobicContact CD1-CG 4.29Å; F47-M51 HydrophobicContact CD2-CG 4.26Å; F47-M51 HydrophobicContact CE1-CG 3.79Å; F47-M51 HydrophobicContact CE2-CG 3.74Å; F47-M51 HydrophobicContact CE2-SD 4.11Å; F47-M51 HydrophobicContact CZ-CG 3.49Å; F47-M51 VanDerWaalsContact CZ-CG 3.49Å; F47-M51 HydrophobicContact CZ-SD 3.98Å; F47-M51 WeakPolarHBondContact O-CG 3.15Å; F47-M51 PolarHBondContact O-N 2.81Å |
| 48 | L | 88.3 | Confident | 91.1 | Very high | 54 Ų | 54 | 98.3 Ų | 98.3 | 28% | 0.283 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 177.1 | -70.9 | -179.1 | 0 | 0 | 0 | 111.7 | F44 S45 N50 M51 E52 L59 | F44-L48 HydrophobicContact CD1-CD1 4Å; F44-L48 HydrophobicContact CD1-CG 4.36Å; F44-L48 HydrophobicContact CE1-CD1 3.52Å; F44-L48 HydrophobicContact CE1-CD2 4.43Å; F44-L48 HydrophobicContact CE1-CG 4Å; F44-L48 HydrophobicContact CZ-CD1 4.01Å; F44-L48 HydrophobicContact CZ-CD2 4.07Å; F44-L48 HydrophobicContact CZ-CG 4.08Å; F44-L48 WeakPolarHBondContact O-CG 3.41Å; F44-L48 PolarHBondContact O-N 2.97Å; S45-L48 PolarHBondContact O-N 3.24Å; L48-N50 VanDerWaalsContact C-N 3.27Å; L48-N50 PolarHBondContact O-N 3.29Å; L48-M51 WeakPolarHBondContact O-CB 3.29Å; L48-M51 PolarHBondContact O-N 2.87Å; L48-M51 VanDerWaalsContact O-N 3.11Å; L48-E52 WeakPolarHBondContact O-CG 3.34Å; L48-E52 PolarHBondContact O-N 2.97Å; L48-L59 HydrophobicContact CD2-CD1 3.99Å |
| 49 | K | 90.5 | Very high | 91 | Very high | 121 Ų | 121 | 93.8 Ų | 93.8 | 53% | 0.526 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.6 | -36.6 | 175.7 | -73.6 | 173.5 | -177.8 | 172.1 | 0 | 112.8 | S45 M46 F47 R53 | S45-K49 WeakPolarHBondContact O-CG 3.39Å; S45-K49 PolarHBondContact O-N 3.4Å; M46-K49 PolarHBondContact O-N 3.14Å; F47-K49 PolarHBondContact O-N 2.95Å; K49-R53 VanDerWaalsContact O-CG 3.31Å; K49-R53 WeakPolarHBondContact O-CG 3.41Å; K49-R53 PolarHBondContact O-N 2.86Å |
| 50 | N | 90 | Very high | 90.9 | Very high | 77 Ų | 77 | 95.1 Ų | 95.1 | 41% | 0.412 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -70.6 | -40.8 | 175.4 | -74.6 | -19.8 | 0 | 0 | 0 | 111.5 | M46 F47 L48 R53 S54 | M46-N50 PolarHBondContact O-N 2.99Å; M46-N50 PolarHBondContact O-ND2 3.29Å; F47-N50 PolarHBondContact O-N 3.4Å; F47-N50 VanDerWaalsContact O-N 3.15Å; L48-N50 VanDerWaalsContact C-N 3.27Å; L48-N50 PolarHBondContact O-N 3.29Å; N50-R53 PolarHBondContact O-N 3.33Å; N50-S54 WeakPolarHBondContact O-CB 3.47Å; N50-S54 PolarHBondContact O-N 2.89Å; N50-S54 PolarHBondContact O-OG 3.35Å |
| 51 | M | 89.5 | Confident | 90.8 | Very high | 37 Ų | 37 | 96 Ų | 96 | 18% | 0.182 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -63.2 | -42.1 | 175.1 | -74.7 | -65.8 | -68.7 | 0 | 0 | 112.3 | F47 L48 R53 S54 N55 L58 | F47-M51 HydrophobicContact CD1-CG 4.29Å; F47-M51 HydrophobicContact CD2-CG 4.26Å; F47-M51 HydrophobicContact CE1-CG 3.79Å; F47-M51 HydrophobicContact CE2-CG 3.74Å; F47-M51 HydrophobicContact CE2-SD 4.11Å; F47-M51 HydrophobicContact CZ-CG 3.49Å; F47-M51 VanDerWaalsContact CZ-CG 3.49Å; F47-M51 HydrophobicContact CZ-SD 3.98Å; F47-M51 WeakPolarHBondContact O-CG 3.15Å; F47-M51 PolarHBondContact O-N 2.81Å; L48-M51 WeakPolarHBondContact O-CB 3.29Å; L48-M51 PolarHBondContact O-N 2.87Å; L48-M51 VanDerWaalsContact O-N 3.11Å; M51-R53 PolarHBondContact O-N 3.48Å; M51-S54 PolarHBondContact O-N 2.88Å; M51-N55 HydrophobicContact CE-CB 4.48Å; M51-N55 CarbonylContact O-C 3.13Å; M51-N55 WeakPolarHBondContact O-CA 3.37Å; M51-N55 PolarHBondContact O-N 3.41Å; M51-L58 HydrophobicContact CE-CD2 3.9Å; M51-L58 HydrophobicContact CE-CG 4.22Å |
| 52 | E | 90.4 | Very high | 90.5 | Very high | 114 Ų | 114 | 95.2 Ų | 95.2 | 53% | 0.533 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -56.3 | -39.8 | 173.6 | -76.5 | 176.4 | 178.6 | 0 | 0 | 111.9 | L48 P56 L59 | L48-E52 WeakPolarHBondContact O-CG 3.34Å; L48-E52 PolarHBondContact O-N 2.97Å; E52-P56 WeakPolarHBondContact O-CB 3.37Å; E52-P56 WeakPolarHBondContact O-CD 3.43Å; E52-L59 HydrophobicContact CB-CD2 4.28Å; E52-L59 HydrophobicContact CG-CD2 3.25Å |
| 53 | R | 91.5 | Very high | 90.3 | Very high | 197 Ų | 197 | 94.1 Ų | 94.1 | 74% | 0.743 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -78.3 | -45.3 | -179.5 | -70.2 | 171.6 | -178.4 | 179.3 | -0.3 | 112.8 | K49 N50 M51 | K49-R53 VanDerWaalsContact O-CG 3.31Å; K49-R53 WeakPolarHBondContact O-CG 3.41Å; K49-R53 PolarHBondContact O-N 2.86Å; N50-R53 PolarHBondContact O-N 3.33Å; M51-R53 PolarHBondContact O-N 3.48Å |
| 54 | S | 92.6 | Very high | 90.3 | Very high | 85 Ų | 85 | 93.5 Ų | 93.5 | 59% | 0.594 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -84.6 | -38.3 | -171.7 | -62.3 | 0 | 0 | 0 | 0 | 112.7 | N50 M51 | N50-S54 WeakPolarHBondContact O-CB 3.47Å; N50-S54 PolarHBondContact O-N 2.89Å; N50-S54 PolarHBondContact O-OG 3.35Å; M51-S54 PolarHBondContact O-N 2.88Å |
| 55 | N | 92.3 | Very high | 90.2 | Very high | 84 Ų | 84 | 90.6 Ų | 90.6 | 45% | 0.449 | 47% | 0.473 | S | S | . | . | trans | -145.9 | 60.6 | -172.3 | -63.5 | -69.8 | 0 | 0 | 0 | 112.2 | M51 K57 L58 L59 | M51-N55 HydrophobicContact CE-CB 4.48Å; M51-N55 CarbonylContact O-C 3.13Å; M51-N55 WeakPolarHBondContact O-CA 3.37Å; M51-N55 PolarHBondContact O-N 3.41Å; N55-K57 VanDerWaalsContact C-N 3.29Å; N55-K57 PolarHBondContact O-N 2.92Å; N55-L58 HydrophobicContact CB-CB 4.04Å; N55-L58 PolarHBondContact O-N 3.5Å; N55-L59 PolarHBondContact O-N 3.2Å | ||
| 56 | P | 90.6 | Very high | 90.1 | Very high | 75 Ų | 75 | 91.7 Ų | 91.7 | 49% | 0.487 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -57 | -39.3 | -174.1 | 19.4 | -31.3 | 0 | 0 | 0 | 113.4 | E52 L58 L59 E60 | E52-P56 WeakPolarHBondContact O-CB 3.37Å; E52-P56 WeakPolarHBondContact O-CD 3.43Å; P56-L58 VanDerWaalsContact C-N 3.31Å; P56-L58 PolarHBondContact O-N 2.91Å; P56-L59 PolarHBondContact O-N 2.97Å; P56-E60 PolarHBondContact O-N 3.43Å |
| 57 | K | 91.7 | Very high | 90.1 | Very high | 165 Ų | 165 | 89.8 Ų | 89.8 | 72% | 0.717 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.8 | -36.1 | 178 | -69.4 | -174.9 | 177.5 | -177.5 | 0 | 113.2 | N55 T61 | N55-K57 VanDerWaalsContact C-N 3.29Å; N55-K57 PolarHBondContact O-N 2.92Å; K57-T61 WeakPolarHBondContact O-CB 3.33Å; K57-T61 PolarHBondContact O-N 3.31Å; K57-T61 PolarHBondContact O-OG1 3.43Å |
| 58 | L | 89.7 | Confident | 90 | Very high | 102 Ų | 102 | 90.9 Ų | 90.9 | 53% | 0.534 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -70.4 | -38.7 | 178.8 | -178.7 | 59.4 | 0 | 0 | 0 | 110.4 | M51 N55 P56 T61 A62 | M51-L58 HydrophobicContact CE-CD2 3.9Å; M51-L58 HydrophobicContact CE-CG 4.22Å; N55-L58 HydrophobicContact CB-CB 4.04Å; N55-L58 PolarHBondContact O-N 3.5Å; P56-L58 VanDerWaalsContact C-N 3.31Å; P56-L58 PolarHBondContact O-N 2.91Å; L58-T61 PolarHBondContact O-N 3.45Å; L58-A62 WeakPolarHBondContact O-CB 3.27Å; L58-A62 PolarHBondContact O-N 2.9Å |
| 59 | L | 89.4 | Confident | 90.1 | Very high | 26 Ų | 26 | 94.9 Ų | 94.9 | 14% | 0.136 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -65.1 | -45.8 | 174.4 | -178.4 | 63.9 | 0 | 0 | 0 | 111.8 | L48 E52 N55 P56 T61 A62 I63 | L48-L59 HydrophobicContact CD2-CD1 3.99Å; E52-L59 HydrophobicContact CB-CD2 4.28Å; E52-L59 HydrophobicContact CG-CD2 3.25Å; N55-L59 PolarHBondContact O-N 3.2Å; P56-L59 PolarHBondContact O-N 2.97Å; L59-T61 VanDerWaalsContact C-N 3.34Å; L59-T61 PolarHBondContact O-N 3.42Å; L59-A62 WeakPolarHBondContact O-CB 3.48Å; L59-A62 PolarHBondContact O-N 3Å; L59-A62 VanDerWaalsContact O-N 3.15Å; L59-I63 HydrophobicContact CD1-CD1 4.33Å; L59-I63 HydrophobicContact CG-CD1 4.02Å; L59-I63 WeakPolarHBondContact O-CG1 3.29Å; L59-I63 PolarHBondContact O-N 2.99Å |
| 60 | E | 89.8 | Confident | 90.1 | Very high | 121 Ų | 121 | 93 Ų | 93 | 57% | 0.565 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -57.3 | -47.1 | 174.9 | -174.5 | 177.5 | -161.4 | 0 | 0 | 111.3 | P56 A62 I63 D64 | P56-E60 PolarHBondContact O-N 3.43Å; E60-A62 VanDerWaalsContact C-N 3.29Å; E60-A62 PolarHBondContact O-N 3.21Å; E60-I63 PolarHBondContact O-N 3.18Å; E60-I63 VanDerWaalsContact O-N 3.16Å; E60-D64 PolarHBondContact O-N 2.71Å |
| 61 | T | 90.2 | Very high | 90.2 | Very high | 88 Ų | 88 | 94.2 Ų | 94.2 | 54% | 0.54 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.7 | -39.5 | 176.1 | -55.3 | 0 | 0 | 0 | 0 | 111.9 | K57 L58 L59 A65 | K57-T61 WeakPolarHBondContact O-CB 3.33Å; K57-T61 PolarHBondContact O-N 3.31Å; K57-T61 PolarHBondContact O-OG1 3.43Å; L58-T61 PolarHBondContact O-N 3.45Å; L59-T61 VanDerWaalsContact C-N 3.34Å; L59-T61 PolarHBondContact O-N 3.42Å; T61-A65 VanDerWaalsContact O-CB 3.31Å; T61-A65 WeakPolarHBondContact O-CB 3.49Å; T61-A65 PolarHBondContact O-N 3.21Å |
| 62 | A | 86.1 | Confident | 90.2 | Very high | 57 Ų | 57 | 96.4 Ų | 96.4 | 47% | 0.471 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.9 | -39.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L58 L59 E60 S66 | L58-A62 WeakPolarHBondContact O-CB 3.27Å; L58-A62 PolarHBondContact O-N 2.9Å; L59-A62 WeakPolarHBondContact O-CB 3.48Å; L59-A62 PolarHBondContact O-N 3Å; L59-A62 VanDerWaalsContact O-N 3.15Å; E60-A62 VanDerWaalsContact C-N 3.29Å; E60-A62 PolarHBondContact O-N 3.21Å; A62-S66 WeakPolarHBondContact O-CB 3.35Å; A62-S66 PolarHBondContact O-N 2.92Å |
| 63 | I | 88.3 | Confident | 90.3 | Very high | 95 Ų | 95 | 98 Ų | 98 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.3 | -44.3 | 175.8 | -69 | 167.6 | 0 | 0 | 0 | 110.6 | L59 E60 S66 S67 | L59-I63 HydrophobicContact CD1-CD1 4.33Å; L59-I63 HydrophobicContact CG-CD1 4.02Å; L59-I63 WeakPolarHBondContact O-CG1 3.29Å; L59-I63 PolarHBondContact O-N 2.99Å; E60-I63 PolarHBondContact O-N 3.18Å; E60-I63 VanDerWaalsContact O-N 3.16Å; I63-S66 PolarHBondContact O-N 3.45Å; I63-S67 WeakPolarHBondContact O-CB 3.38Å; I63-S67 PolarHBondContact O-N 3.41Å; I63-S67 PolarHBondContact O-OG 3.39Å |
| 64 | D | 91.9 | Very high | 90.4 | Very high | 86 Ų | 86 | 95.1 Ų | 95.1 | 46% | 0.46 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.3 | -46.7 | 177.5 | -77.9 | -12.9 | 0 | 0 | 0 | 111.5 | E60 S66 S67 Q68 | E60-D64 PolarHBondContact O-N 2.71Å; D64-S66 VanDerWaalsContact C-N 3.32Å; D64-S66 PolarHBondContact O-N 3.12Å; D64-S67 PolarHBondContact O-N 3.48Å; D64-Q68 WeakPolarHBondContact O-CG 3.41Å; D64-Q68 PolarHBondContact O-N 2.95Å |
| 65 | A | 88.3 | Confident | 90.5 | Very high | 54 Ų | 54 | 96 Ų | 96 | 45% | 0.446 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | T61 Q68 F69 | T61-A65 VanDerWaalsContact O-CB 3.31Å; T61-A65 WeakPolarHBondContact O-CB 3.49Å; T61-A65 PolarHBondContact O-N 3.21Å; A65-Q68 PolarHBondContact O-N 3.34Å; A65-F69 WeakPolarHBondContact O-CB 3.43Å; A65-F69 PolarHBondContact O-N 3.44Å |
| 66 | S | 88 | Confident | 90.6 | Very high | 76 Ų | 76 | 95.6 Ų | 95.6 | 53% | 0.531 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.6 | -45.5 | 175.3 | -174 | 0 | 0 | 0 | 0 | 111.6 | A62 I63 D64 Q68 F69 E70 | A62-S66 WeakPolarHBondContact O-CB 3.35Å; A62-S66 PolarHBondContact O-N 2.92Å; I63-S66 PolarHBondContact O-N 3.45Å; D64-S66 VanDerWaalsContact C-N 3.32Å; D64-S66 PolarHBondContact O-N 3.12Å; S66-Q68 PolarHBondContact O-N 2.94Å; S66-F69 PolarHBondContact O-N 2.93Å; S66-E70 PolarHBondContact O-N 3.04Å |
| 67 | S | 92.1 | Very high | 90.7 | Very high | 62 Ų | 62 | 95.8 Ų | 95.8 | 43% | 0.434 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.9 | -41.4 | 177.9 | -58 | 0 | 0 | 0 | 0 | 112 | I63 D64 E70 I71 | I63-S67 WeakPolarHBondContact O-CB 3.38Å; I63-S67 PolarHBondContact O-N 3.41Å; I63-S67 PolarHBondContact O-OG 3.39Å; D64-S67 PolarHBondContact O-N 3.48Å; S67-E70 PolarHBondContact O-N 3.29Å; S67-I71 WeakPolarHBondContact O-CG1 3.34Å; S67-I71 PolarHBondContact O-N 3.17Å; S67-I71 VanDerWaalsContact O-N 3.15Å |
| 68 | Q | 89.9 | Confident | 90.9 | Very high | 132 Ų | 132 | 93.1 Ų | 93.1 | 62% | 0.617 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.4 | -41.6 | 175.1 | -71.9 | -178.3 | 9.5 | 0 | 0 | 112.1 | D64 A65 S66 E70 I71 V72 | D64-Q68 WeakPolarHBondContact O-CG 3.41Å; D64-Q68 PolarHBondContact O-N 2.95Å; A65-Q68 PolarHBondContact O-N 3.34Å; S66-Q68 PolarHBondContact O-N 2.94Å; Q68-E70 VanDerWaalsContact C-N 3.31Å; Q68-E70 PolarHBondContact O-N 3.17Å; Q68-I71 PolarHBondContact O-N 3.37Å; Q68-V72 WeakPolarHBondContact O-CG2 3.49Å; Q68-V72 PolarHBondContact O-N 3.2Å |
| 69 | F | 90.3 | Very high | 91.1 | Very high | 139 Ų | 139 | 94.3 Ų | 94.3 | 61% | 0.61 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.2 | -41.3 | 176.3 | -175.2 | -97.6 | 0 | 0 | 0 | 111.8 | A65 S66 V72 R73 | A65-F69 WeakPolarHBondContact O-CB 3.43Å; A65-F69 PolarHBondContact O-N 3.44Å; S66-F69 PolarHBondContact O-N 2.93Å; F69-V72 PolarHBondContact O-N 3.41Å; F69-R73 WeakPolarHBondContact O-CB 3.24Å; F69-R73 PolarHBondContact O-N 3.25Å |
| 70 | E | 90.4 | Very high | 91.3 | Very high | 81 Ų | 81 | 99.2 Ų | 99.2 | 38% | 0.379 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 175.9 | -79.2 | -60.3 | 150 | 0 | 0 | 113.1 | S66 S67 Q68 R73 K74 | S66-E70 PolarHBondContact O-N 3.04Å; S67-E70 PolarHBondContact O-N 3.29Å; Q68-E70 VanDerWaalsContact C-N 3.31Å; Q68-E70 PolarHBondContact O-N 3.17Å; E70-R73 VanDerWaalsContact CD-NH2 3.29Å; E70-R73 PolarHBondContact O-N 2.87Å; E70-R73 IonicContact OE1-CZ 3.21Å; E70-R73 IonicContact OE1-NE 3.05Å; E70-R73 PolarHBondContact OE1-NE 2.97Å; E70-R73 IonicContact OE1-NH2 2.7Å; E70-R73 PolarHBondContact OE1-NH2 3.22Å; E70-R73 VanDerWaalsContact OE1-NH2 3.11Å; E70-R73 IonicContact OE2-CZ 3.99Å; E70-R73 IonicContact OE2-NE 3.11Å; E70-R73 PolarHBondContact OE2-NE 3.5Å; E70-R73 IonicContact OE2-NH2 3.32Å; E70-R73 PolarHBondContact OE2-NH2 3.01Å; E70-K74 WeakPolarHBondContact O-CB 3.48Å; E70-K74 PolarHBondContact O-N 3.36Å |
| 71 | I | 90.8 | Very high | 91.6 | Very high | 103 Ų | 103 | 99.7 Ų | 99.7 | 53% | 0.528 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.7 | -49 | 174 | -67.7 | 166.4 | 0 | 0 | 0 | 110.3 | S67 Q68 R73 K74 I75 | S67-I71 WeakPolarHBondContact O-CG1 3.34Å; S67-I71 PolarHBondContact O-N 3.17Å; S67-I71 VanDerWaalsContact O-N 3.15Å; Q68-I71 PolarHBondContact O-N 3.37Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 3.48Å; I71-K74 PolarHBondContact O-N 3.42Å; I71-I75 HydrophobicContact CG2-CD1 3.88Å; I71-I75 WeakPolarHBondContact O-CG1 3.27Å; I71-I75 PolarHBondContact O-N 3.38Å |
| 72 | V | 88.9 | Confident | 91.8 | Very high | 82 Ų | 82 | 99.2 Ų | 99.2 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 178.8 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | Q68 F69 K74 I75 C76 | Q68-V72 WeakPolarHBondContact O-CG2 3.49Å; Q68-V72 PolarHBondContact O-N 3.2Å; F69-V72 PolarHBondContact O-N 3.41Å; V72-K74 VanDerWaalsContact C-N 3.31Å; V72-K74 PolarHBondContact O-N 3.22Å; V72-I75 PolarHBondContact O-N 2.93Å; V72-C76 WeakPolarHBondContact O-CB 3.48Å; V72-C76 PolarHBondContact O-N 2.92Å; V72-C76 PolarHBondContact O-SG 2.72Å; V72-C76 VanDerWaalsContact O-SG 3.35Å |
| 73 | R | 92.8 | Very high | 92.2 | Very high | 147 Ų | 147 | 99.5 Ų | 99.5 | 56% | 0.555 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58 | -43.6 | 176.8 | -170.8 | 178 | 72.5 | 152.3 | -3 | 111.6 | F69 E70 I71 C76 S77 | F69-R73 WeakPolarHBondContact O-CB 3.24Å; F69-R73 PolarHBondContact O-N 3.25Å; E70-R73 VanDerWaalsContact CD-NH2 3.29Å; E70-R73 PolarHBondContact O-N 2.87Å; E70-R73 IonicContact OE1-CZ 3.21Å; E70-R73 IonicContact OE1-NE 3.05Å; E70-R73 PolarHBondContact OE1-NE 2.97Å; E70-R73 IonicContact OE1-NH2 2.7Å; E70-R73 PolarHBondContact OE1-NH2 3.22Å; E70-R73 VanDerWaalsContact OE1-NH2 3.11Å; E70-R73 IonicContact OE2-CZ 3.99Å; E70-R73 IonicContact OE2-NE 3.11Å; E70-R73 PolarHBondContact OE2-NE 3.5Å; E70-R73 IonicContact OE2-NH2 3.32Å; E70-R73 PolarHBondContact OE2-NH2 3.01Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 3.48Å; R73-C76 PolarHBondContact O-N 3.28Å; R73-S77 WeakPolarHBondContact O-CB 3.45Å; R73-S77 PolarHBondContact O-N 3.2Å |
| 74 | K | 94 | Very high | 92.4 | Very high | 138 Ų | 138 | 97.8 Ų | 97.8 | 60% | 0.6 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63 | -46.6 | 177.2 | -171.6 | 178.8 | 177.5 | -175.6 | 0 | 111.8 | E70 I71 V72 C76 S77 E78 | E70-K74 WeakPolarHBondContact O-CB 3.48Å; E70-K74 PolarHBondContact O-N 3.36Å; I71-K74 PolarHBondContact O-N 3.42Å; V72-K74 VanDerWaalsContact C-N 3.31Å; V72-K74 PolarHBondContact O-N 3.22Å; K74-C76 PolarHBondContact O-N 2.91Å; K74-S77 PolarHBondContact O-N 3.4Å; K74-E78 WeakPolarHBondContact CE-OE1 3.4Å; K74-E78 PolarHBondContact O-N 2.9Å |
| 75 | I | 94 | Very high | 92.5 | Very high | 103 Ų | 103 | 99.9 Ų | 99.9 | 53% | 0.528 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.4 | -47.7 | 177.4 | -67.5 | 166.9 | 0 | 0 | 0 | 110.7 | I71 V72 S77 E78 H79 | I71-I75 HydrophobicContact CG2-CD1 3.88Å; I71-I75 WeakPolarHBondContact O-CG1 3.27Å; I71-I75 PolarHBondContact O-N 3.38Å; V72-I75 PolarHBondContact O-N 2.93Å; I75-S77 VanDerWaalsContact C-N 3.32Å; I75-S77 PolarHBondContact O-N 3.43Å; I75-E78 PolarHBondContact O-N 3.37Å; I75-H79 WeakPolarHBondContact O-CB 3.44Å; I75-H79 PolarHBondContact O-N 3.46Å |
| 76 | C | 94.3 | Very high | 92.1 | Very high | 76 Ų | 76 | 103.5 Ų | 103.5 | 51% | 0.514 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.3 | -39 | 178.4 | -71 | 0 | 0 | 0 | 0 | 112.2 | V72 R73 K74 H79 H80 | V72-C76 WeakPolarHBondContact O-CB 3.48Å; V72-C76 PolarHBondContact O-N 2.92Å; V72-C76 PolarHBondContact O-SG 2.72Å; V72-C76 VanDerWaalsContact O-SG 3.35Å; R73-C76 PolarHBondContact O-N 3.28Å; K74-C76 PolarHBondContact O-N 2.91Å; C76-H79 PolarHBondContact O-N 3.46Å; C76-H80 WeakPolarHBondContact O-CB 3.25Å; C76-H80 PolarHBondContact O-N 3.5Å |
| 77 | S | 94.4 | Very high | 91.1 | Very high | 78 Ų | 78 | 110.9 Ų | 110.9 | 55% | 0.545 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.3 | -46.7 | 176.5 | -174 | 0 | 0 | 0 | 0 | 112.1 | R73 K74 I75 H79 H80 K81 | R73-S77 WeakPolarHBondContact O-CB 3.45Å; R73-S77 PolarHBondContact O-N 3.2Å; K74-S77 PolarHBondContact O-N 3.4Å; I75-S77 VanDerWaalsContact C-N 3.32Å; I75-S77 PolarHBondContact O-N 3.43Å; S77-H79 VanDerWaalsContact C-N 3.34Å; S77-H79 PolarHBondContact O-N 3.02Å; S77-H80 PolarHBondContact O-N 3.35Å; S77-K81 PolarHBondContact O-N 3.41Å |
| 78 | E | 95.4 | Very high | 91 | Very high | 109 Ų | 109 | 113.4 Ų | 113.4 | 51% | 0.509 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.6 | -43.3 | 174.9 | -75.3 | 179.8 | 172.3 | 0 | 0 | 111.4 | K74 I75 H80 K81 V82 | K74-E78 WeakPolarHBondContact CE-OE1 3.4Å; K74-E78 PolarHBondContact O-N 2.9Å; I75-E78 PolarHBondContact O-N 3.37Å; E78-H80 PolarHBondContact O-N 3.48Å; E78-K81 WeakPolarHBondContact O-CB 3.39Å; E78-K81 PolarHBondContact O-N 2.93Å; E78-V82 WeakPolarHBondContact O-CG2 3.04Å; E78-V82 PolarHBondContact O-N 2.92Å |
| 79 | H | 93.9 | Very high | 91.1 | Very high | 127 Ų | 127 | 112.4 Ų | 112.4 | 59% | 0.588 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60.8 | -45.6 | 175.6 | -174.1 | 69.5 | 0 | 0 | 0 | 111.8 | I75 C76 S77 K81 V82 V83 | I75-H79 WeakPolarHBondContact O-CB 3.44Å; I75-H79 PolarHBondContact O-N 3.46Å; C76-H79 PolarHBondContact O-N 3.46Å; S77-H79 VanDerWaalsContact C-N 3.34Å; S77-H79 PolarHBondContact O-N 3.02Å; H79-K81 VanDerWaalsContact C-N 3.3Å; H79-K81 PolarHBondContact O-N 3.01Å; H79-V82 PolarHBondContact O-N 2.98Å; H79-V83 WeakPolarHBondContact O-CG2 3.36Å; H79-V83 PolarHBondContact O-N 2.98Å |
| 80 | H | 93.6 | Very high | 91.1 | Very high | 130 Ų | 130 | 110.9 Ų | 110.9 | 60% | 0.602 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.2 | -40.3 | 177 | -176.6 | 68.2 | 0 | 0 | 0 | 112.2 | C76 S77 E78 S84 | C76-H80 WeakPolarHBondContact O-CB 3.25Å; C76-H80 PolarHBondContact O-N 3.5Å; S77-H80 PolarHBondContact O-N 3.35Å; E78-H80 PolarHBondContact O-N 3.48Å; H80-S84 WeakPolarHBondContact O-CB 3.37Å; H80-S84 PolarHBondContact O-N 3.38Å; H80-S84 PolarHBondContact O-OG 3.22Å |
| 81 | K | 95.4 | Very high | 91.1 | Very high | 130 Ų | 130 | 112.6 Ų | 112.6 | 57% | 0.565 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.2 | -51.6 | 174.7 | -176.9 | -179.7 | 173.9 | -177.1 | 0 | 111.4 | S77 E78 H79 V83 S84 E85 | S77-K81 PolarHBondContact O-N 3.41Å; E78-K81 WeakPolarHBondContact O-CB 3.39Å; E78-K81 PolarHBondContact O-N 2.93Å; H79-K81 VanDerWaalsContact C-N 3.3Å; H79-K81 PolarHBondContact O-N 3.01Å; K81-V83 VanDerWaalsContact C-N 3.35Å; K81-V83 PolarHBondContact O-N 3.37Å; K81-S84 PolarHBondContact O-N 3.32Å; K81-S84 VanDerWaalsContact O-N 3.14Å; K81-E85 WeakPolarHBondContact CE-OE1 3.46Å; K81-E85 WeakPolarHBondContact CG-OE1 3.49Å; K81-E85 IonicContact NZ-OE1 2.71Å; K81-E85 WeakPolarHBondContact O-CG 3.32Å; K81-E85 PolarHBondContact O-N 2.75Å |
| 82 | V | 95.2 | Very high | 91.2 | Very high | 79 Ų | 79 | 113.3 Ų | 113.3 | 48% | 0.479 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -61.3 | -41.5 | 179.6 | 173.3 | 0 | 0 | 0 | 0 | 112 | E78 H79 S84 E85 N86 | E78-V82 WeakPolarHBondContact O-CG2 3.04Å; E78-V82 PolarHBondContact O-N 2.92Å; H79-V82 PolarHBondContact O-N 2.98Å; V82-S84 VanDerWaalsContact C-N 3.3Å; V82-S84 PolarHBondContact O-N 2.74Å; V82-E85 PolarHBondContact O-N 3.3Å; V82-N86 PolarHBondContact O-N 3.26Å; V82-N86 PolarHBondContact O-ND2 3.15Å |
| 83 | V | 94.5 | Very high | 91.3 | Very high | 62 Ų | 62 | 115.3 Ų | 115.3 | 38% | 0.376 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.6 | -35.4 | 177.4 | 170.6 | 0 | 0 | 0 | 0 | 111.5 | H79 K81 | H79-V83 WeakPolarHBondContact O-CG2 3.36Å; H79-V83 PolarHBondContact O-N 2.98Å; K81-V83 VanDerWaalsContact C-N 3.35Å; K81-V83 PolarHBondContact O-N 3.37Å |
| 84 | S | 93.3 | Very high | 91.2 | Very high | 59 Ų | 59 | 113.1 Ų | 113.1 | 41% | 0.413 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -73.9 | -34 | 179.7 | -57.8 | 0 | 0 | 0 | 0 | 112.6 | H80 K81 V82 N86 | H80-S84 WeakPolarHBondContact O-CB 3.37Å; H80-S84 PolarHBondContact O-N 3.38Å; H80-S84 PolarHBondContact O-OG 3.22Å; K81-S84 PolarHBondContact O-N 3.32Å; K81-S84 VanDerWaalsContact O-N 3.14Å; V82-S84 VanDerWaalsContact C-N 3.3Å; V82-S84 PolarHBondContact O-N 2.74Å; S84-N86 VanDerWaalsContact C-N 3.32Å |
| 85 | E | 92.7 | Very high | 91 | Very high | 130 Ų | 130 | 111.2 Ų | 111.2 | 61% | 0.607 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -75.1 | -17.8 | 178.5 | -71.8 | 172.6 | 179.3 | 0 | 0 | 113.6 | K81 V82 | K81-E85 WeakPolarHBondContact CE-OE1 3.46Å; K81-E85 WeakPolarHBondContact CG-OE1 3.49Å; K81-E85 IonicContact NZ-OE1 2.71Å; K81-E85 WeakPolarHBondContact O-CG 3.32Å; K81-E85 PolarHBondContact O-N 2.75Å; V82-E85 PolarHBondContact O-N 3.3Å |
| 86 | N | 81.2 | Confident | 90.7 | Very high | 131 Ų | 131 | 111.8 Ų | 111.8 | 70% | 0.701 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | 10.1 | -179.9 | -73.8 | -58.2 | 0 | 0 | 0 | 114.1 | V82 S84 | V82-N86 PolarHBondContact O-N 3.26Å; V82-N86 PolarHBondContact O-ND2 3.15Å; S84-N86 VanDerWaalsContact C-N 3.32Å |
| 87 | K | 65.2 | Low | 90.4 | Very high | 231 Ų | 231 | 115.1 Ų | 115.1 | 100% | 1.004 | 58% | 0.581 | S | S | * | * | trans | -100.4 | 0 | 172.3 | -75.9 | -176.4 | 178.8 | -179.4 | 0 | 110.9 |
Retrieved 87 of 87 residues in 265.5 ms
(Link to these results)