| 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 | 46.1 | Very low | 54.4 | Low | 243 Ų | 243 | 150.9 Ų | 150.9 | 100% | 1.197 | 78% | 0.777 | S | S | * | * | 0 | 98.1 | 0 | -70.6 | 167.2 | 109 | 0 | 0 | 107.8 | S3 | M1-S3 PolarHBondContact O-N 2.9Š| |||
| 2 | Q | 43.6 | Very low | 55.7 | Low | 195 Ų | 195 | 147.5 Ų | 147.5 | 91% | 0.911 | 76% | 0.761 | S | S | * | * | trans | -90.6 | 93.1 | 173.2 | -90.9 | 174.9 | -23.4 | 0 | 0 | 107.8 | S4 | Q2-S4 VanDerWaalsContact C-N 3.34Å; Q2-S4 PolarHBondContact O-N 3.24Å; Q2-S4 VanDerWaalsContact O-N 3.13Å | ||
| 3 | S | 57.2 | Low | 57 | Low | 116 Ų | 116 | 145.2 Ų | 145.2 | 81% | 0.811 | 74% | 0.744 | S | S | * | * | trans | -82.2 | 87.3 | 170.7 | 58.5 | 0 | 0 | 0 | 0 | 109.3 | M1 S5 | M1-S3 PolarHBondContact O-N 2.9Å; S3-S5 PolarHBondContact O-N 3.3Å | ||
| 4 | S | 50.2 | Low | 58.4 | Low | 102 Ų | 102 | 145.7 Ų | 145.7 | 71% | 0.713 | 74% | 0.739 | S | S | * | * | trans | 5.8 | 108.4 | 147.7 | -46.1 | 0 | 0 | 0 | 0 | 116.7 | Q2 R6 | Q2-S4 VanDerWaalsContact C-N 3.34Å; Q2-S4 PolarHBondContact O-N 3.24Å; Q2-S4 VanDerWaalsContact O-N 3.13Å; S4-R6 PolarHBondContact O-N 3.29Å | ||
| 5 | S | 55.8 | Low | 59.8 | Low | 117 Ų | 117 | 145.9 Ų | 145.9 | 82% | 0.818 | 73% | 0.728 | S | S | * | * | trans | -66.2 | 44.4 | 172.8 | 61.9 | 0 | 0 | 0 | 0 | 114.5 | S3 | S3-S5 PolarHBondContact O-N 3.3Š| ||
| 6 | R | 55.1 | Low | 61.2 | Low | 235 Ų | 235 | 143.8 Ų | 143.8 | 89% | 0.887 | 72% | 0.72 | S | S | * | * | trans | -93.3 | 7.1 | -170.5 | -126.1 | 178.1 | -173.8 | 173.3 | 1.3 | 114.9 | S4 | S4-R6 PolarHBondContact O-N 3.29Š| ||
| 7 | K | 55.2 | Low | 62.6 | Low | 187 Ų | 187 | 142.1 Ų | 142.1 | 81% | 0.813 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -102.8 | -16.3 | -169.4 | -145 | 166.4 | -177.4 | 178.2 | 0 | 116.2 | ||
| 8 | D | 56.3 | Low | 63.9 | Low | 127 Ų | 127 | 141.1 Ų | 141.1 | 68% | 0.679 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -97.1 | -11.2 | -170.2 | -62.7 | -38.5 | 0 | 0 | 0 | 115.9 | S10 G11 | D8-S10 VanDerWaalsContact C-N 3.31Å; D8-S10 PolarHBondContact O-N 3.13Å; D8-G11 PolarHBondContact O-N 3.13Å |
| 9 | R | 56.7 | Low | 65.3 | Low | 229 Ų | 229 | 140.5 Ų | 140.5 | 86% | 0.864 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -67.7 | -28.8 | -179.6 | -74.6 | -172.8 | 177.3 | -179.7 | -1.5 | 113.8 | Q13 | R9-Q13 PolarHBondContact O-N 3.3Å |
| 10 | S | 60.5 | Low | 66.5 | Low | 83 Ų | 83 | 135.7 Ų | 135.7 | 58% | 0.58 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -75.1 | -25 | 180 | 77.1 | 0 | 0 | 0 | 0 | 113.5 | D8 K14 | D8-S10 VanDerWaalsContact C-N 3.31Å; D8-S10 PolarHBondContact O-N 3.13Å; S10-K14 WeakPolarHBondContact O-CG 3.21Å |
| 11 | G | 62.1 | Low | 67.7 | Low | 26 Ų | 26 | 133 Ų | 133 | 27% | 0.268 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -72 | -51.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | D8 Q13 K14 Y15 | D8-G11 PolarHBondContact O-N 3.13Å; G11-Q13 VanDerWaalsContact C-N 3.32Å; G11-Q13 PolarHBondContact O-N 3.38Å; G11-K14 PolarHBondContact O-N 2.87Å; G11-K14 VanDerWaalsContact O-N 3.16Å; G11-Y15 WeakPolarHBondContact O-CD2 3.19Å; G11-Y15 PolarHBondContact O-N 3.15Å |
| 12 | N | 69.7 | Low | 69.8 | Low | 110 Ų | 110 | 124.2 Ų | 124.2 | 59% | 0.588 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -60.5 | -40 | -179.6 | -76.3 | 12.6 | 0 | 0 | 0 | 112.7 | K14 Y15 D16 | N12-K14 VanDerWaalsContact C-N 3.3Å; N12-K14 PolarHBondContact O-N 3.11Å; N12-Y15 PolarHBondContact O-N 2.89Å; N12-Y15 VanDerWaalsContact O-N 3.13Å; N12-D16 PolarHBondContact O-N 2.93Å |
| 13 | Q | 72.9 | Confident | 72 | Confident | 117 Ų | 117 | 119.1 Ų | 119.1 | 55% | 0.547 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -61.7 | -37.1 | 178 | -170.3 | 174.5 | -3.8 | 0 | 0 | 112.7 | R9 G11 D16 E17 | R9-Q13 PolarHBondContact O-N 3.3Å; G11-Q13 VanDerWaalsContact C-N 3.32Å; G11-Q13 PolarHBondContact O-N 3.38Å; Q13-D16 PolarHBondContact O-N 3.13Å; Q13-E17 WeakPolarHBondContact O-CB 3.48Å; Q13-E17 WeakPolarHBondContact O-CG 3.31Å; Q13-E17 PolarHBondContact O-N 2.99Å |
| 14 | K | 76.1 | Confident | 73.7 | Confident | 153 Ų | 153 | 119.8 Ų | 119.8 | 67% | 0.665 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -68.7 | -35.8 | 175.4 | -72.8 | -173.9 | 177.6 | -169.8 | 0 | 112.7 | S10 G11 N12 F18 | S10-K14 WeakPolarHBondContact O-CG 3.21Å; G11-K14 PolarHBondContact O-N 2.87Å; G11-K14 VanDerWaalsContact O-N 3.16Å; N12-K14 VanDerWaalsContact C-N 3.3Å; N12-K14 PolarHBondContact O-N 3.11Å; K14-F18 VanDerWaalsContact O-CB 3.31Å; K14-F18 WeakPolarHBondContact O-CB 3.49Å; K14-F18 PolarHBondContact O-N 3.06Å |
| 15 | Y | 79.7 | Confident | 75.5 | Confident | 149 Ų | 149 | 119.5 Ų | 119.5 | 58% | 0.584 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -68 | -42.9 | 174.8 | -70.4 | -66.6 | 0 | 0 | 0 | 110.9 | G11 N12 E17 F18 F19 | G11-Y15 WeakPolarHBondContact O-CD2 3.19Å; G11-Y15 PolarHBondContact O-N 3.15Å; N12-Y15 PolarHBondContact O-N 2.89Å; N12-Y15 VanDerWaalsContact O-N 3.13Å; Y15-E17 PolarHBondContact O-N 3.16Å; Y15-F18 PolarHBondContact O-N 3.17Å; Y15-F19 WeakPolarHBondContact O-CD2 3.49Å; Y15-F19 PolarHBondContact O-N 2.93Å |
| 16 | D | 81.9 | Confident | 77.2 | Confident | 112 Ų | 112 | 117.7 Ų | 117.7 | 60% | 0.599 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62.7 | -42.3 | 177 | -67 | -25.6 | 0 | 0 | 0 | 111.6 | N12 Q13 F19 G20 | N12-D16 PolarHBondContact O-N 2.93Å; Q13-D16 PolarHBondContact O-N 3.13Å; D16-F19 PolarHBondContact O-N 3.06Å; D16-G20 PolarHBondContact O-N 3.21Å |
| 17 | E | 84.4 | Confident | 78.9 | Confident | 114 Ų | 114 | 111.4 Ų | 111.4 | 53% | 0.533 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64 | -41.1 | 174 | -76.8 | 172.1 | -166.8 | 0 | 0 | 112.3 | Q13 Y15 G20 T21 | Q13-E17 WeakPolarHBondContact O-CB 3.48Å; Q13-E17 WeakPolarHBondContact O-CG 3.31Å; Q13-E17 PolarHBondContact O-N 2.99Å; Y15-E17 PolarHBondContact O-N 3.16Å; E17-G20 PolarHBondContact O-N 2.93Å; E17-T21 WeakPolarHBondContact O-CB 3.47Å; E17-T21 PolarHBondContact O-N 3.43Å; E17-T21 PolarHBondContact O-OG1 3.42Å |
| 18 | F | 86.8 | Confident | 80.6 | Confident | 125 Ų | 125 | 106.8 Ų | 106.8 | 55% | 0.548 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.7 | -50.2 | 175.4 | 175.4 | -99.6 | 0 | 0 | 0 | 111.3 | K14 Y15 G20 T21 V22 | K14-F18 VanDerWaalsContact O-CB 3.31Å; K14-F18 WeakPolarHBondContact O-CB 3.49Å; K14-F18 PolarHBondContact O-N 3.06Å; Y15-F18 PolarHBondContact O-N 3.17Å; F18-G20 VanDerWaalsContact C-N 3.33Å; F18-G20 PolarHBondContact O-N 2.99Å; F18-T21 PolarHBondContact O-N 3.1Å; F18-V22 HydrophobicContact CD1-CG2 4.34Å; F18-V22 HydrophobicContact CD2-CG2 4.43Å; F18-V22 HydrophobicContact CE1-CG2 3.91Å; F18-V22 HydrophobicContact CE2-CG2 4.02Å; F18-V22 HydrophobicContact CZ-CG2 3.74Å; F18-V22 WeakPolarHBondContact O-CG2 3.36Å; F18-V22 PolarHBondContact O-N 3.39Å |
| 19 | F | 89.6 | Confident | 82.1 | Confident | 130 Ų | 130 | 105.3 Ų | 105.3 | 57% | 0.57 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.9 | -38.3 | 178 | -78.7 | -64.2 | 0 | 0 | 0 | 112 | Y15 D16 V22 N23 | Y15-F19 WeakPolarHBondContact O-CD2 3.49Å; Y15-F19 PolarHBondContact O-N 2.93Å; D16-F19 PolarHBondContact O-N 3.06Å; F19-V22 PolarHBondContact O-N 3.37Å; F19-N23 VanDerWaalsContact O-CB 3.27Å; F19-N23 WeakPolarHBondContact O-CB 3.42Å; F19-N23 PolarHBondContact O-N 3.19Å |
| 20 | G | 90.3 | Very high | 83.6 | Confident | 43 Ų | 43 | 97.7 Ų | 97.7 | 44% | 0.443 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | D16 E17 F18 N23 F24 | D16-G20 PolarHBondContact O-N 3.21Å; E17-G20 PolarHBondContact O-N 2.93Å; F18-G20 VanDerWaalsContact C-N 3.33Å; F18-G20 PolarHBondContact O-N 2.99Å; G20-N23 PolarHBondContact O-N 3.21Å; G20-F24 WeakPolarHBondContact O-CB 3.47Å; G20-F24 PolarHBondContact O-N 3.4Å |
| 21 | T | 91.9 | Very high | 84.9 | Confident | 80 Ų | 80 | 98.7 Ų | 98.7 | 49% | 0.491 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.4 | -44.9 | 177.4 | -54.9 | 0 | 0 | 0 | 0 | 111.6 | E17 F18 N23 F24 L25 | E17-T21 WeakPolarHBondContact O-CB 3.47Å; E17-T21 PolarHBondContact O-N 3.43Å; E17-T21 PolarHBondContact O-OG1 3.42Å; F18-T21 PolarHBondContact O-N 3.1Å; T21-N23 PolarHBondContact O-N 3.31Å; T21-F24 PolarHBondContact O-N 3.46Å; T21-L25 HydrophobicContact CG2-CD1 4.22Å; T21-L25 WeakPolarHBondContact O-CG 3.37Å; T21-L25 PolarHBondContact O-N 3.17Å |
| 22 | V | 90.2 | Very high | 85.9 | Confident | 58 Ų | 58 | 102.9 Ų | 102.9 | 35% | 0.352 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | F18 F19 F24 L25 V26 | F18-V22 HydrophobicContact CD1-CG2 4.34Å; F18-V22 HydrophobicContact CD2-CG2 4.43Å; F18-V22 HydrophobicContact CE1-CG2 3.91Å; F18-V22 HydrophobicContact CE2-CG2 4.02Å; F18-V22 HydrophobicContact CZ-CG2 3.74Å; F18-V22 WeakPolarHBondContact O-CG2 3.36Å; F18-V22 PolarHBondContact O-N 3.39Å; F19-V22 PolarHBondContact O-N 3.37Å; V22-F24 VanDerWaalsContact C-N 3.35Å; V22-F24 PolarHBondContact O-N 3.37Å; V22-L25 PolarHBondContact O-N 3.18Å; V22-V26 HydrophobicContact CG1-CG2 4.4Å; V22-V26 WeakPolarHBondContact O-CG2 3.48Å; V22-V26 PolarHBondContact O-N 3.44Å |
| 23 | N | 90.2 | Very high | 86.4 | Confident | 89 Ų | 89 | 102.2 Ų | 102.2 | 48% | 0.476 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.3 | -40.2 | 179.4 | -168.7 | 60.2 | 0 | 0 | 0 | 112 | F19 G20 T21 V26 Q27 | F19-N23 VanDerWaalsContact O-CB 3.27Å; F19-N23 WeakPolarHBondContact O-CB 3.42Å; F19-N23 PolarHBondContact O-N 3.19Å; G20-N23 PolarHBondContact O-N 3.21Å; T21-N23 PolarHBondContact O-N 3.31Å; N23-V26 PolarHBondContact O-N 3.02Å; N23-Q27 PolarHBondContact ND2-NE2 3.3Å; N23-Q27 WeakPolarHBondContact O-CG 3.36Å; N23-Q27 PolarHBondContact O-N 3.27Å |
| 24 | F | 91.7 | Very high | 86.7 | Confident | 130 Ų | 130 | 100.5 Ų | 100.5 | 57% | 0.57 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.4 | -45.7 | 173.4 | 176.1 | -97.3 | 0 | 0 | 0 | 111.9 | G20 T21 V22 V26 Q27 H28 | G20-F24 WeakPolarHBondContact O-CB 3.47Å; G20-F24 PolarHBondContact O-N 3.4Å; T21-F24 PolarHBondContact O-N 3.46Å; V22-F24 VanDerWaalsContact C-N 3.35Å; V22-F24 PolarHBondContact O-N 3.37Å; F24-V26 PolarHBondContact O-N 2.91Å; F24-Q27 PolarHBondContact O-N 3.31Å; F24-H28 WeakPolarHBondContact O-CB 3.49Å; F24-H28 PolarHBondContact O-N 3.27Å |
| 25 | L | 89.4 | Confident | 86.9 | Confident | 96 Ų | 96 | 96.9 Ų | 96.9 | 50% | 0.503 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.9 | -41.1 | 178 | -73 | 168.5 | 0 | 0 | 0 | 112.2 | T21 V22 H28 I29 | T21-L25 HydrophobicContact CG2-CD1 4.22Å; T21-L25 WeakPolarHBondContact O-CG 3.37Å; T21-L25 PolarHBondContact O-N 3.17Å; V22-L25 PolarHBondContact O-N 3.18Å; L25-H28 PolarHBondContact O-N 3.43Å; L25-I29 VanDerWaalsContact O-CG1 3.3Å; L25-I29 WeakPolarHBondContact O-CG1 3.5Å; L25-I29 PolarHBondContact O-N 3.46Å |
| 26 | V | 90.4 | Very high | 86.9 | Confident | 78 Ų | 78 | 94.9 Ų | 94.9 | 47% | 0.473 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.9 | -44.6 | 176.6 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | V22 N23 F24 I29 V30 | V22-V26 HydrophobicContact CG1-CG2 4.4Å; V22-V26 WeakPolarHBondContact O-CG2 3.48Å; V22-V26 PolarHBondContact O-N 3.44Å; N23-V26 PolarHBondContact O-N 3.02Å; F24-V26 PolarHBondContact O-N 2.91Å; V26-I29 PolarHBondContact O-N 2.96Å; V26-V30 WeakPolarHBondContact O-CG2 3.49Å; V26-V30 PolarHBondContact O-N 3.22Å |
| 27 | Q | 91.3 | Very high | 86.8 | Confident | 103 Ų | 103 | 93 Ų | 93 | 48% | 0.481 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -45.4 | 176.3 | -75.3 | 174.7 | -12 | 0 | 0 | 111.5 | N23 F24 I29 V30 D31 | N23-Q27 PolarHBondContact ND2-NE2 3.3Å; N23-Q27 WeakPolarHBondContact O-CG 3.36Å; N23-Q27 PolarHBondContact O-N 3.27Å; F24-Q27 PolarHBondContact O-N 3.31Å; Q27-I29 VanDerWaalsContact C-N 3.33Å; Q27-I29 PolarHBondContact O-N 3.42Å; Q27-V30 PolarHBondContact O-N 2.95Å; Q27-V30 VanDerWaalsContact O-N 3.14Å; Q27-D31 PolarHBondContact O-N 3.39Å |
| 28 | H | 91.2 | Very high | 86.3 | Confident | 91 Ų | 91 | 93.3 Ų | 93.3 | 42% | 0.421 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.7 | -41.6 | 177.3 | -171.2 | -84.3 | 0 | 0 | 0 | 112.6 | F24 L25 D31 E32 | F24-H28 WeakPolarHBondContact O-CB 3.49Å; F24-H28 PolarHBondContact O-N 3.27Å; L25-H28 PolarHBondContact O-N 3.43Å; H28-D31 PolarHBondContact O-N 2.93Å; H28-E32 IonicContact CE1-OE1 3.23Å; H28-E32 PolarHBondContact CE1-OE1 3.04Å; H28-E32 VanDerWaalsContact CE1-OE1 3.23Å; H28-E32 IonicContact ND1-OE1 3.97Å; H28-E32 PolarHBondContact O-N 3.41Å |
| 29 | I | 88.4 | Confident | 86.1 | Confident | 96 Ų | 96 | 90.5 Ų | 90.5 | 49% | 0.492 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 176.1 | -69.3 | 165.5 | 0 | 0 | 0 | 110.9 | L25 V26 Q27 E32 L33 | L25-I29 VanDerWaalsContact O-CG1 3.3Å; L25-I29 WeakPolarHBondContact O-CG1 3.5Å; L25-I29 PolarHBondContact O-N 3.46Å; V26-I29 PolarHBondContact O-N 2.96Å; Q27-I29 VanDerWaalsContact C-N 3.33Å; Q27-I29 PolarHBondContact O-N 3.42Å; I29-E32 PolarHBondContact O-N 3.36Å; I29-L33 HydrophobicContact CG2-CD1 3.92Å; I29-L33 HydrophobicContact CG2-CG 4.39Å; I29-L33 WeakPolarHBondContact O-CB 3.41Å; I29-L33 VanDerWaalsContact O-CG 3.25Å; I29-L33 WeakPolarHBondContact O-CG 3.28Å; I29-L33 PolarHBondContact O-N 2.97Å |
| 30 | V | 87.3 | Confident | 85.8 | Confident | 68 Ų | 68 | 89 Ų | 89 | 41% | 0.412 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.3 | -43.8 | 177.6 | 170.5 | 0 | 0 | 0 | 0 | 111 | V26 Q27 L33 N34 | V26-V30 WeakPolarHBondContact O-CG2 3.49Å; V26-V30 PolarHBondContact O-N 3.22Å; Q27-V30 PolarHBondContact O-N 2.95Å; Q27-V30 VanDerWaalsContact O-N 3.14Å; V30-L33 PolarHBondContact O-N 3.37Å; V30-N34 WeakPolarHBondContact O-CB 3.48Å; V30-N34 VanDerWaalsContact O-CG 3.27Å; V30-N34 PolarHBondContact O-N 3.43Å; V30-N34 PolarHBondContact O-ND2 3.24Å |
| 31 | D | 87.4 | Confident | 85.3 | Confident | 105 Ų | 105 | 89.9 Ų | 89.9 | 56% | 0.561 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.1 | -42.6 | 178.7 | -69.3 | -20.8 | 0 | 0 | 0 | 111.6 | Q27 H28 N34 S35 | Q27-D31 PolarHBondContact O-N 3.39Å; H28-D31 PolarHBondContact O-N 2.93Å; D31-N34 PolarHBondContact O-N 3.12Å; D31-S35 WeakPolarHBondContact O-CB 3.42Å; D31-S35 PolarHBondContact O-N 2.87Å |
| 32 | E | 84.3 | Confident | 84.7 | Confident | 113 Ų | 113 | 94.3 Ų | 94.3 | 53% | 0.528 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62 | -44.4 | 173.9 | -80.1 | -161.5 | 167.4 | 0 | 0 | 111.9 | H28 I29 N34 S35 L36 | H28-E32 IonicContact CE1-OE1 3.23Å; H28-E32 PolarHBondContact CE1-OE1 3.04Å; H28-E32 VanDerWaalsContact CE1-OE1 3.23Å; H28-E32 IonicContact ND1-OE1 3.97Å; H28-E32 PolarHBondContact O-N 3.41Å; I29-E32 PolarHBondContact O-N 3.36Å; E32-N34 VanDerWaalsContact C-N 3.35Å; E32-N34 PolarHBondContact O-N 3.19Å; E32-S35 PolarHBondContact O-N 3.5Å; E32-S35 PolarHBondContact O-OG 2.89Å; E32-L36 PolarHBondContact O-N 3.01Å |
| 33 | L | 78.7 | Confident | 84.2 | Confident | 97 Ų | 97 | 100.5 Ų | 100.5 | 51% | 0.508 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 177.2 | -74.7 | 172.6 | 0 | 0 | 0 | 111.9 | I29 V30 L36 T37 | I29-L33 HydrophobicContact CG2-CD1 3.92Å; I29-L33 HydrophobicContact CG2-CG 4.39Å; I29-L33 WeakPolarHBondContact O-CB 3.41Å; I29-L33 VanDerWaalsContact O-CG 3.25Å; I29-L33 WeakPolarHBondContact O-CG 3.28Å; I29-L33 PolarHBondContact O-N 2.97Å; V30-L33 PolarHBondContact O-N 3.37Å; L33-L36 PolarHBondContact O-N 3.29Å; L33-T37 WeakPolarHBondContact O-CB 3.5Å; L33-T37 VanDerWaalsContact O-CG2 3.26Å; L33-T37 WeakPolarHBondContact O-CG2 3.42Å; L33-T37 PolarHBondContact O-N 2.94Å; L33-T37 PolarHBondContact O-OG1 2.95Å |
| 34 | N | 79.5 | Confident | 83.9 | Confident | 80 Ų | 80 | 101.4 Ų | 101.4 | 43% | 0.428 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.3 | -43.2 | 175.7 | -71.7 | -23.5 | 0 | 0 | 0 | 111.1 | V30 D31 E32 L36 T37 E38 | V30-N34 WeakPolarHBondContact O-CB 3.48Å; V30-N34 VanDerWaalsContact O-CG 3.27Å; V30-N34 PolarHBondContact O-N 3.43Å; V30-N34 PolarHBondContact O-ND2 3.24Å; D31-N34 PolarHBondContact O-N 3.12Å; E32-N34 VanDerWaalsContact C-N 3.35Å; E32-N34 PolarHBondContact O-N 3.19Å; N34-L36 PolarHBondContact O-N 3.35Å; N34-T37 WeakPolarHBondContact CA-OG1 3.41Å; N34-T37 PolarHBondContact O-N 3.44Å; N34-T37 PolarHBondContact O-OG1 2.97Å; N34-E38 PolarHBondContact O-N 3.5Å; N34-E38 VanDerWaalsContact O-N 3.1Å |
| 35 | S | 80.3 | Confident | 83.5 | Confident | 78 Ų | 78 | 97.5 Ų | 97.5 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.3 | -26.4 | 177.7 | 81.3 | 0 | 0 | 0 | 0 | 113.4 | D31 E32 P39 | D31-S35 WeakPolarHBondContact O-CB 3.42Å; D31-S35 PolarHBondContact O-N 2.87Å; E32-S35 PolarHBondContact O-N 3.5Å; E32-S35 PolarHBondContact O-OG 2.89Å; S35-P39 WeakPolarHBondContact O-CD 3.49Å; S35-P39 WeakPolarHBondContact O-CG 3.41Å |
| 36 | L | 80 | Confident | 83 | Confident | 106 Ų | 106 | 94.7 Ų | 94.7 | 56% | 0.555 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -88.5 | -40 | 177.2 | -176.4 | 65.3 | 0 | 0 | 0 | 112.5 | E32 L33 N34 P39 M40 | E32-L36 PolarHBondContact O-N 3.01Å; L33-L36 PolarHBondContact O-N 3.29Å; N34-L36 PolarHBondContact O-N 3.35Å; L36-P39 WeakPolarHBondContact O-CD 3.33Å; L36-M40 HydrophobicContact CG-CE 4.33Å; L36-M40 WeakPolarHBondContact O-CB 3.49Å; L36-M40 PolarHBondContact O-N 3.37Å |
| 37 | T | 79.9 | Confident | 82.6 | Confident | 72 Ų | 72 | 95.6 Ų | 95.6 | 44% | 0.442 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.7 | -38.9 | -175.7 | 47.4 | 0 | 0 | 0 | 0 | 112.1 | L33 N34 M40 A41 | L33-T37 WeakPolarHBondContact O-CB 3.5Å; L33-T37 VanDerWaalsContact O-CG2 3.26Å; L33-T37 WeakPolarHBondContact O-CG2 3.42Å; L33-T37 PolarHBondContact O-N 2.94Å; L33-T37 PolarHBondContact O-OG1 2.95Å; N34-T37 WeakPolarHBondContact CA-OG1 3.41Å; N34-T37 PolarHBondContact O-N 3.44Å; N34-T37 PolarHBondContact O-OG1 2.97Å; T37-M40 PolarHBondContact O-N 3.06Å; T37-A41 WeakPolarHBondContact O-CB 3.41Å; T37-A41 PolarHBondContact O-N 3.27Å |
| 38 | E | 74.1 | Confident | 82.3 | Confident | 122 Ų | 122 | 93.6 Ų | 93.6 | 57% | 0.57 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.2 | -55.9 | 178.4 | -79 | -177.5 | -174.5 | 0 | 0 | 112.3 | N34 M40 A41 Y42 | N34-E38 PolarHBondContact O-N 3.5Å; N34-E38 VanDerWaalsContact O-N 3.1Å; E38-M40 PolarHBondContact O-N 3.48Å; E38-A41 PolarHBondContact O-N 3.3Å; E38-Y42 WeakPolarHBondContact O-CD2 3.49Å; E38-Y42 PolarHBondContact O-N 2.9Å |
| 39 | P | 83 | Confident | 82 | Confident | 66 Ų | 66 | 91.8 Ų | 91.8 | 43% | 0.429 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.6 | -34.8 | 176.5 | -23.1 | 32.5 | 0 | 0 | 0 | 113.2 | S35 L36 Y42 R43 | S35-P39 WeakPolarHBondContact O-CD 3.49Å; S35-P39 WeakPolarHBondContact O-CG 3.41Å; L36-P39 WeakPolarHBondContact O-CD 3.33Å; P39-Y42 PolarHBondContact O-N 3.05Å; P39-R43 WeakPolarHBondContact O-CB 3.43Å; P39-R43 VanDerWaalsContact O-CG 3.28Å; P39-R43 WeakPolarHBondContact O-CG 3.1Å; P39-R43 PolarHBondContact O-N 2.9Å |
| 40 | M | 82.4 | Confident | 81.8 | Confident | 99 Ų | 99 | 91 Ų | 91 | 49% | 0.488 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.4 | -42.9 | 178.4 | -167.7 | 178.9 | -61.9 | 0 | 0 | 111.2 | L36 T37 E38 R43 L44 | L36-M40 HydrophobicContact CG-CE 4.33Å; L36-M40 WeakPolarHBondContact O-CB 3.49Å; L36-M40 PolarHBondContact O-N 3.37Å; T37-M40 PolarHBondContact O-N 3.06Å; E38-M40 PolarHBondContact O-N 3.48Å; M40-R43 PolarHBondContact O-N 3.22Å; M40-L44 HydrophobicContact CG-CD1 4.16Å; M40-L44 HydrophobicContact CG-CG 4.5Å; M40-L44 WeakPolarHBondContact O-CB 3.38Å; M40-L44 VanDerWaalsContact O-CG 3.29Å; M40-L44 WeakPolarHBondContact O-CG 3.41Å; M40-L44 PolarHBondContact O-N 3.24Å |
| 41 | A | 80.7 | Confident | 81.8 | Confident | 60 Ų | 60 | 93.1 Ų | 93.1 | 50% | 0.496 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | T37 E38 R43 L44 A45 | T37-A41 WeakPolarHBondContact O-CB 3.41Å; T37-A41 PolarHBondContact O-N 3.27Å; E38-A41 PolarHBondContact O-N 3.3Å; A41-R43 PolarHBondContact O-N 3.46Å; A41-L44 PolarHBondContact O-N 3.19Å; A41-A45 WeakPolarHBondContact O-CB 3.28Å; A41-A45 PolarHBondContact O-N 2.95Å |
| 42 | Y | 78.6 | Confident | 81.6 | Confident | 173 Ų | 173 | 92.6 Ų | 92.6 | 68% | 0.678 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.4 | -42.8 | 175 | -77.4 | -68.9 | 0 | 0 | 0 | 112.5 | E38 P39 A45 A46 | E38-Y42 WeakPolarHBondContact O-CD2 3.49Å; E38-Y42 PolarHBondContact O-N 2.9Å; P39-Y42 PolarHBondContact O-N 3.05Å; Y42-A45 PolarHBondContact O-N 3.38Å; Y42-A46 WeakPolarHBondContact O-CB 3.36Å; Y42-A46 PolarHBondContact O-N 3.33Å |
| 43 | R | 79.2 | Confident | 81.2 | Confident | 188 Ų | 188 | 89.8 Ų | 89.8 | 71% | 0.709 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.6 | -41.8 | 177 | -78.1 | 177.3 | 135.8 | -158.6 | -4.8 | 112.1 | P39 M40 A41 A46 L47 | P39-R43 WeakPolarHBondContact O-CB 3.43Å; P39-R43 VanDerWaalsContact O-CG 3.28Å; P39-R43 WeakPolarHBondContact O-CG 3.1Å; P39-R43 PolarHBondContact O-N 2.9Å; M40-R43 PolarHBondContact O-N 3.22Å; A41-R43 PolarHBondContact O-N 3.46Å; R43-A46 PolarHBondContact O-N 3.27Å; R43-L47 WeakPolarHBondContact O-CB 2.96Å; R43-L47 WeakPolarHBondContact O-CG 3.17Å; R43-L47 PolarHBondContact O-N 3.37Å |
| 44 | L | 85.2 | Confident | 81.5 | Confident | 108 Ų | 108 | 90.1 Ų | 90.1 | 57% | 0.565 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.1 | -42.6 | 176.4 | -74.1 | 170.8 | 0 | 0 | 0 | 111.4 | M40 A41 L47 S48 | M40-L44 HydrophobicContact CG-CD1 4.16Å; M40-L44 HydrophobicContact CG-CG 4.5Å; M40-L44 WeakPolarHBondContact O-CB 3.38Å; M40-L44 VanDerWaalsContact O-CG 3.29Å; M40-L44 WeakPolarHBondContact O-CG 3.41Å; M40-L44 PolarHBondContact O-N 3.24Å; A41-L44 PolarHBondContact O-N 3.19Å; L44-L47 PolarHBondContact O-N 3.5Å; L44-S48 PolarHBondContact O-N 3.2Å |
| 45 | A | 81.9 | Confident | 81.6 | Confident | 48 Ų | 48 | 89.6 Ų | 89.6 | 40% | 0.397 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -46 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A41 Y42 L47 S48 V49 | A41-A45 WeakPolarHBondContact O-CB 3.28Å; A41-A45 PolarHBondContact O-N 2.95Å; Y42-A45 PolarHBondContact O-N 3.38Å; A45-L47 VanDerWaalsContact C-N 3.32Å; A45-L47 PolarHBondContact O-N 3.47Å; A45-S48 WeakPolarHBondContact O-CB 3.45Å; A45-S48 PolarHBondContact O-N 3.1Å; A45-V49 WeakPolarHBondContact O-CG2 3.38Å; A45-V49 PolarHBondContact O-N 3.33Å; A45-V49 VanDerWaalsContact O-N 3.1Å |
| 46 | A | 78.9 | Confident | 81.4 | Confident | 38 Ų | 38 | 88.8 Ų | 88.8 | 31% | 0.314 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.9 | -38.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y42 R43 K50 | Y42-A46 WeakPolarHBondContact O-CB 3.36Å; Y42-A46 PolarHBondContact O-N 3.33Å; R43-A46 PolarHBondContact O-N 3.27Å; A46-K50 WeakPolarHBondContact O-CG 3.29Å; A46-K50 PolarHBondContact O-N 3.21Å |
| 47 | L | 82.9 | Confident | 81.3 | Confident | 96 Ų | 96 | 89.2 Ų | 89.2 | 50% | 0.503 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -67.2 | -40.2 | 174.5 | -74.6 | 172.6 | 0 | 0 | 0 | 112 | R43 L44 A45 V49 K50 I51 | R43-L47 WeakPolarHBondContact O-CB 2.96Å; R43-L47 WeakPolarHBondContact O-CG 3.17Å; R43-L47 PolarHBondContact O-N 3.37Å; L44-L47 PolarHBondContact O-N 3.5Å; A45-L47 VanDerWaalsContact C-N 3.32Å; A45-L47 PolarHBondContact O-N 3.47Å; L47-V49 PolarHBondContact O-N 3.21Å; L47-K50 PolarHBondContact O-N 2.95Å; L47-I51 WeakPolarHBondContact O-CG1 3.38Å; L47-I51 PolarHBondContact O-N 3.41Å |
| 48 | S | 85.5 | Confident | 81.3 | Confident | 62 Ų | 62 | 88.2 Ų | 88.2 | 43% | 0.434 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -57.5 | -49.3 | 176.7 | -166.5 | 0 | 0 | 0 | 0 | 111.1 | L44 A45 K50 I51 D52 | L44-S48 PolarHBondContact O-N 3.2Å; A45-S48 WeakPolarHBondContact O-CB 3.45Å; A45-S48 PolarHBondContact O-N 3.1Å; S48-K50 VanDerWaalsContact C-N 3.29Å; S48-K50 PolarHBondContact O-N 2.87Å; S48-I51 WeakPolarHBondContact O-CB 3.36Å; S48-I51 PolarHBondContact O-N 2.91Å; S48-I51 VanDerWaalsContact O-N 3.08Å; S48-D52 PolarHBondContact O-N 3.08Å |
| 49 | V | 83.9 | Confident | 81.4 | Confident | 53 Ų | 53 | 85.7 Ų | 85.7 | 32% | 0.321 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.7 | -38.7 | 179 | 180 | 0 | 0 | 0 | 0 | 111.5 | A45 L47 I51 D52 N53 I123 | A45-V49 WeakPolarHBondContact O-CG2 3.38Å; A45-V49 PolarHBondContact O-N 3.33Å; A45-V49 VanDerWaalsContact O-N 3.1Å; L47-V49 PolarHBondContact O-N 3.21Å; V49-I51 VanDerWaalsContact C-N 3.35Å; V49-I51 PolarHBondContact O-N 2.98Å; V49-D52 PolarHBondContact O-N 2.84Å; V49-N53 PolarHBondContact O-N 3.27Å; V49-I123 HydrophobicContact CB-CD1 4.41Å; V49-I123 HydrophobicContact CG1-CD1 3.54Å |
| 50 | K | 84.6 | Confident | 81 | Confident | 80 Ų | 80 | 84.3 Ų | 84.3 | 35% | 0.348 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.9 | -40.3 | 175.3 | -72.8 | -179.7 | -177.5 | -170.9 | 0 | 112 | A46 L47 S48 N53 I54 | A46-K50 WeakPolarHBondContact O-CG 3.29Å; A46-K50 PolarHBondContact O-N 3.21Å; L47-K50 PolarHBondContact O-N 2.95Å; S48-K50 VanDerWaalsContact C-N 3.29Å; S48-K50 PolarHBondContact O-N 2.87Å; K50-N53 PolarHBondContact O-N 3.46Å; K50-I54 VanDerWaalsContact O-CG1 3.28Å; K50-I54 WeakPolarHBondContact O-CG1 3.38Å; K50-I54 PolarHBondContact O-N 3.28Å |
| 51 | I | 87.3 | Confident | 80.8 | Confident | 111 Ų | 111 | 84.9 Ų | 84.9 | 57% | 0.569 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -64.6 | -43.9 | 176.5 | -69.4 | 167.4 | 0 | 0 | 0 | 110.3 | L47 S48 V49 N53 I54 S55 | L47-I51 WeakPolarHBondContact O-CG1 3.38Å; L47-I51 PolarHBondContact O-N 3.41Å; S48-I51 WeakPolarHBondContact O-CB 3.36Å; S48-I51 PolarHBondContact O-N 2.91Å; S48-I51 VanDerWaalsContact O-N 3.08Å; V49-I51 VanDerWaalsContact C-N 3.35Å; V49-I51 PolarHBondContact O-N 2.98Å; I51-N53 VanDerWaalsContact C-N 3.33Å; I51-N53 PolarHBondContact O-N 2.93Å; I51-I54 PolarHBondContact O-N 3.4Å; I51-S55 WeakPolarHBondContact O-CB 3.34Å; I51-S55 PolarHBondContact O-N 3.25Å |
| 52 | D | 83.2 | Confident | 80.8 | Confident | 95 Ų | 95 | 87.7 Ų | 87.7 | 51% | 0.508 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 177 | -66.3 | -26.8 | 0 | 0 | 0 | 111.3 | S48 V49 I54 S55 A56 | S48-D52 PolarHBondContact O-N 3.08Å; V49-D52 PolarHBondContact O-N 2.84Å; D52-I54 PolarHBondContact O-N 3.18Å; D52-S55 PolarHBondContact O-N 3.04Å; D52-A56 WeakPolarHBondContact O-CB 3.4Å; D52-A56 PolarHBondContact O-N 2.92Å |
| 53 | N | 76.5 | Confident | 80.7 | Confident | 53 Ų | 53 | 81 Ų | 81 | 28% | 0.283 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 175.1 | -75.5 | -11.1 | 0 | 0 | 0 | 112.3 | V49 K50 I51 S55 A56 M57 | V49-N53 PolarHBondContact O-N 3.27Å; K50-N53 PolarHBondContact O-N 3.46Å; I51-N53 VanDerWaalsContact C-N 3.33Å; I51-N53 PolarHBondContact O-N 2.93Å; N53-S55 VanDerWaalsContact C-N 3.32Å; N53-A56 PolarHBondContact O-N 3.42Å; N53-M57 WeakPolarHBondContact O-CG 3.26Å; N53-M57 PolarHBondContact O-N 2.93Å |
| 54 | I | 84 | Confident | 80.4 | Confident | 105 Ų | 105 | 79.9 Ų | 79.9 | 54% | 0.538 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.8 | -42.4 | 175.7 | -70.1 | 165.4 | 0 | 0 | 0 | 110.3 | K50 I51 D52 M57 A58 | K50-I54 VanDerWaalsContact O-CG1 3.28Å; K50-I54 WeakPolarHBondContact O-CG1 3.38Å; K50-I54 PolarHBondContact O-N 3.28Å; I51-I54 PolarHBondContact O-N 3.4Å; D52-I54 PolarHBondContact O-N 3.18Å; I54-M57 HydrophobicContact CB-CE 4.47Å; I54-M57 HydrophobicContact CG1-CE 4.05Å; I54-M57 PolarHBondContact O-N 3.33Å; I54-A58 WeakPolarHBondContact O-CB 3.41Å; I54-A58 PolarHBondContact O-N 2.87Å |
| 55 | S | 80.6 | Confident | 79.9 | Confident | 68 Ų | 68 | 79.9 Ų | 79.9 | 48% | 0.476 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 177.8 | -167 | 0 | 0 | 0 | 0 | 111.5 | I51 D52 N53 A58 S59 | I51-S55 WeakPolarHBondContact O-CB 3.34Å; I51-S55 PolarHBondContact O-N 3.25Å; D52-S55 PolarHBondContact O-N 3.04Å; N53-S55 VanDerWaalsContact C-N 3.32Å; S55-A58 PolarHBondContact O-N 2.85Å; S55-S59 PolarHBondContact O-N 2.86Å; S55-S59 PolarHBondContact O-OG 3.28Å |
| 56 | A | 76.9 | Confident | 79.3 | Confident | 62 Ų | 62 | 81.5 Ų | 81.5 | 51% | 0.512 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.9 | -43.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | D52 N53 A58 S59 A60 | D52-A56 WeakPolarHBondContact O-CB 3.4Å; D52-A56 PolarHBondContact O-N 2.92Å; N53-A56 PolarHBondContact O-N 3.42Å; A56-A58 PolarHBondContact O-N 3.41Å; A56-S59 PolarHBondContact O-N 3.4Å; A56-A60 WeakPolarHBondContact O-CB 3.27Å; A56-A60 PolarHBondContact O-N 2.88Å |
| 57 | M | 79 | Confident | 78.6 | Confident | 115 Ų | 115 | 85.3 Ų | 85.3 | 57% | 0.567 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.6 | -43.1 | 174.4 | -72.8 | -171.4 | -62.1 | 0 | 0 | 111.9 | N53 I54 A60 L61 | N53-M57 WeakPolarHBondContact O-CG 3.26Å; N53-M57 PolarHBondContact O-N 2.93Å; I54-M57 HydrophobicContact CB-CE 4.47Å; I54-M57 HydrophobicContact CG1-CE 4.05Å; I54-M57 PolarHBondContact O-N 3.33Å; M57-A60 PolarHBondContact O-N 3.27Å; M57-L61 WeakPolarHBondContact O-CG 3.36Å; M57-L61 PolarHBondContact O-N 3.17Å |
| 58 | A | 79.3 | Confident | 77.4 | Confident | 51 Ų | 51 | 86.7 Ų | 86.7 | 42% | 0.421 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.5 | -44.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | I54 S55 A56 A60 L61 E62 | I54-A58 WeakPolarHBondContact O-CB 3.41Å; I54-A58 PolarHBondContact O-N 2.87Å; S55-A58 PolarHBondContact O-N 2.85Å; A56-A58 PolarHBondContact O-N 3.41Å; A58-A60 PolarHBondContact O-N 3.49Å; A58-L61 PolarHBondContact O-N 3.31Å; A58-E62 WeakPolarHBondContact O-CB 3.47Å; A58-E62 PolarHBondContact O-N 3.26Å |
| 59 | S | 75 | Confident | 75.7 | Confident | 68 Ų | 68 | 89.9 Ų | 89.9 | 48% | 0.476 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.9 | -38.7 | 175.7 | -62.6 | 0 | 0 | 0 | 0 | 112.8 | S55 A56 E62 G63 | S55-S59 PolarHBondContact O-N 2.86Å; S55-S59 PolarHBondContact O-OG 3.28Å; A56-S59 PolarHBondContact O-N 3.4Å; S59-E62 PolarHBondContact O-N 2.79Å; S59-G63 PolarHBondContact O-N 2.91Å |
| 60 | A | 76.1 | Confident | 73.9 | Confident | 38 Ų | 38 | 92.7 Ų | 92.7 | 31% | 0.314 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.1 | -41.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | A56 M57 A58 G63 R64 | A56-A60 WeakPolarHBondContact O-CB 3.27Å; A56-A60 PolarHBondContact O-N 2.88Å; M57-A60 PolarHBondContact O-N 3.27Å; A58-A60 PolarHBondContact O-N 3.49Å; A60-G63 PolarHBondContact O-N 3.32Å; A60-R64 WeakPolarHBondContact O-CG 3.3Å; A60-R64 PolarHBondContact O-N 3.1Å |
| 61 | L | 78.1 | Confident | 72.2 | Confident | 110 Ų | 110 | 93.3 Ų | 93.3 | 58% | 0.576 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.6 | -40.8 | 175.2 | -71.9 | 172.4 | 0 | 0 | 0 | 112.1 | M57 A58 R64 L65 | M57-L61 WeakPolarHBondContact O-CG 3.36Å; M57-L61 PolarHBondContact O-N 3.17Å; A58-L61 PolarHBondContact O-N 3.31Å; L61-R64 PolarHBondContact O-N 3.26Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 PolarHBondContact O-N 2.94Å |
| 62 | E | 80.5 | Confident | 70 | Confident | 120 Ų | 120 | 99 Ų | 99 | 56% | 0.561 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 175.1 | -174.7 | 174.6 | -164.7 | 0 | 0 | 111.6 | A58 S59 R64 L65 N66 | A58-E62 WeakPolarHBondContact O-CB 3.47Å; A58-E62 PolarHBondContact O-N 3.26Å; S59-E62 PolarHBondContact O-N 2.79Å; E62-R64 VanDerWaalsContact C-N 3.33Å; E62-R64 PolarHBondContact O-N 2.72Å; E62-L65 PolarHBondContact O-N 3.36Å; E62-N66 WeakPolarHBondContact O-CB 3.34Å; E62-N66 VanDerWaalsContact O-CG 3.32Å; E62-N66 PolarHBondContact O-N 3.34Å; E62-N66 PolarHBondContact O-ND2 2.85Å |
| 63 | G | 75.9 | Confident | 67.9 | Low | 31 Ų | 31 | 103 Ų | 103 | 32% | 0.32 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -59.5 | -42.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S59 A60 N66 N67 | S59-G63 PolarHBondContact O-N 2.91Å; A60-G63 PolarHBondContact O-N 3.32Å; G63-N66 PolarHBondContact O-N 3.21Å; G63-N67 WeakPolarHBondContact O-CB 3.39Å; G63-N67 PolarHBondContact O-N 3.44Å |
| 64 | R | 73.8 | Confident | 65.8 | Low | 165 Ų | 165 | 109.1 Ų | 109.1 | 62% | 0.623 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.6 | -45.8 | 175 | -72.8 | 177 | 67.1 | -178.8 | 2 | 111.9 | A60 L61 E62 N66 N67 D68 | A60-R64 WeakPolarHBondContact O-CG 3.3Å; A60-R64 PolarHBondContact O-N 3.1Å; L61-R64 PolarHBondContact O-N 3.26Å; E62-R64 VanDerWaalsContact C-N 3.33Å; E62-R64 PolarHBondContact O-N 2.72Å; R64-N66 VanDerWaalsContact C-N 3.31Å; R64-N66 PolarHBondContact O-N 3.46Å; R64-N67 PolarHBondContact O-N 3.03Å; R64-D68 WeakPolarHBondContact O-CB 3.25Å; R64-D68 PolarHBondContact O-N 3.47Å |
| 65 | L | 73.2 | Confident | 63.6 | Low | 108 Ų | 108 | 109.3 Ų | 109.3 | 57% | 0.565 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -59.3 | -44 | 178.5 | -168.1 | 92.9 | 0 | 0 | 0 | 111.4 | L61 E62 D68 Q69 | L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 PolarHBondContact O-N 2.94Å; E62-L65 PolarHBondContact O-N 3.36Å; L65-D68 PolarHBondContact O-N 2.89Å; L65-Q69 WeakPolarHBondContact O-CG 3.37Å; L65-Q69 PolarHBondContact O-N 3.33Å; L65-Q69 VanDerWaalsContact O-N 3.12Å |
| 66 | N | 69.7 | Low | 61.4 | Low | 82 Ų | 82 | 115.3 Ų | 115.3 | 44% | 0.439 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -67.1 | -39.8 | 180 | -71.3 | -24.2 | 0 | 0 | 0 | 112 | E62 G63 R64 Q69 V70 | E62-N66 WeakPolarHBondContact O-CB 3.34Å; E62-N66 VanDerWaalsContact O-CG 3.32Å; E62-N66 PolarHBondContact O-N 3.34Å; E62-N66 PolarHBondContact O-ND2 2.85Å; G63-N66 PolarHBondContact O-N 3.21Å; R64-N66 VanDerWaalsContact C-N 3.31Å; R64-N66 PolarHBondContact O-N 3.46Å; N66-Q69 PolarHBondContact O-N 2.94Å; N66-V70 WeakPolarHBondContact O-CG2 3.1Å; N66-V70 PolarHBondContact O-N 3.23Å |
| 67 | N | 63.9 | Low | 59.4 | Low | 118 Ų | 118 | 120 Ų | 120 | 63% | 0.631 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -68 | -37.4 | 176.1 | -72.9 | -12.5 | 0 | 0 | 0 | 112.4 | G63 R64 Q69 V70 S71 | G63-N67 WeakPolarHBondContact O-CB 3.39Å; G63-N67 PolarHBondContact O-N 3.44Å; R64-N67 PolarHBondContact O-N 3.03Å; N67-Q69 VanDerWaalsContact C-N 3.3Å; N67-Q69 PolarHBondContact O-N 2.89Å; N67-V70 PolarHBondContact O-N 3.14Å; N67-S71 PolarHBondContact O-N 3.37Å; N67-S71 VanDerWaalsContact O-N 3.1Å |
| 68 | D | 57.4 | Low | 57.1 | Low | 125 Ų | 125 | 124.3 Ų | 124.3 | 67% | 0.668 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -66.3 | -33 | 177 | -126.2 | 12.9 | 0 | 0 | 0 | 112 | R64 L65 R72 | R64-D68 WeakPolarHBondContact O-CB 3.25Å; R64-D68 PolarHBondContact O-N 3.47Å; L65-D68 PolarHBondContact O-N 2.89Å; D68-R72 PolarHBondContact O-N 3.42Å |
| 69 | Q | 50.2 | Low | 54.9 | Low | 130 Ų | 130 | 127.2 Ų | 127.2 | 61% | 0.607 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -72.8 | -29.4 | 173.9 | -70.5 | -148.4 | 6.9 | 0 | 0 | 113.6 | L65 N66 N67 | L65-Q69 WeakPolarHBondContact O-CG 3.37Å; L65-Q69 PolarHBondContact O-N 3.33Å; L65-Q69 VanDerWaalsContact O-N 3.12Å; N66-Q69 PolarHBondContact O-N 2.94Å; N67-Q69 VanDerWaalsContact C-N 3.3Å; N67-Q69 PolarHBondContact O-N 2.89Å |
| 70 | V | 46.9 | Very low | 52.9 | Low | 112 Ų | 112 | 128.6 Ų | 128.6 | 68% | 0.679 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -72.2 | -37.2 | 174.5 | 175.7 | 0 | 0 | 0 | 0 | 110.6 | N66 N67 R72 K73 | N66-V70 WeakPolarHBondContact O-CG2 3.1Å; N66-V70 PolarHBondContact O-N 3.23Å; N67-V70 PolarHBondContact O-N 3.14Å; V70-R72 VanDerWaalsContact C-N 3.28Å; V70-R72 PolarHBondContact O-N 3.35Å; V70-K73 PolarHBondContact O-N 2.99Å |
| 71 | S | 47.8 | Very low | 50.9 | Low | 93 Ų | 93 | 134.9 Ų | 134.9 | 65% | 0.65 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -70.9 | -22.3 | 178.1 | -147.9 | 0 | 0 | 0 | 0 | 113.5 | N67 K73 | N67-S71 PolarHBondContact O-N 3.37Å; N67-S71 VanDerWaalsContact O-N 3.1Å; S71-K73 VanDerWaalsContact C-N 3.29Å; S71-K73 PolarHBondContact O-N 3.5Å |
| 72 | R | 41.1 | Very low | 48.7 | Very low | 231 Ų | 231 | 138 Ų | 138 | 87% | 0.872 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | 3.7 | 178.6 | -128.5 | 174.4 | -175.8 | 164.9 | 1.5 | 114.8 | D68 V70 | D68-R72 PolarHBondContact O-N 3.42Å; V70-R72 VanDerWaalsContact C-N 3.28Å; V70-R72 PolarHBondContact O-N 3.35Å |
| 73 | K | 40.3 | Very low | 46.8 | Very low | 178 Ų | 178 | 137.3 Ų | 137.3 | 77% | 0.774 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.2 | 34.2 | 175.4 | -69.2 | -169.2 | -179.7 | -179.8 | 0 | 113.6 | V70 S71 P75 | V70-K73 PolarHBondContact O-N 2.99Å; S71-K73 VanDerWaalsContact C-N 3.29Å; S71-K73 PolarHBondContact O-N 3.5Å; K73-P75 VanDerWaalsContact O-CD 3.31Å; K73-P75 WeakPolarHBondContact O-CD 3.48Å |
| 74 | Q | 32.2 | Very low | 44.5 | Very low | 181 Ų | 181 | 143.7 Ų | 143.7 | 85% | 0.846 | 74% | 0.737 | S | S | * | * | trans | -79.7 | 116 | 161.2 | -86.7 | -157.5 | -39.1 | 0 | 0 | 110.2 | ||||
| 75 | P | 37.6 | Very low | 42.5 | Very low | 109 Ų | 109 | 140 Ų | 140 | 71% | 0.708 | 74% | 0.742 | S | S | * | * | trans | -76.1 | 150.6 | 176.3 | 32.9 | -31.6 | 0 | 0 | 0 | 110.4 | K73 L77 | K73-P75 VanDerWaalsContact O-CD 3.31Å; K73-P75 WeakPolarHBondContact O-CD 3.48Å; P75-L77 PolarHBondContact O-N 3.39Å | ||
| 76 | E | 34.2 | Very low | 40.3 | Very low | 195 Ų | 195 | 138.8 Ų | 138.8 | 91% | 0.911 | 75% | 0.747 | S | S | * | * | trans | -30.7 | 114.1 | 171 | -63 | 177.6 | 139.9 | 0 | 0 | 114 | ||||
| 77 | L | 35.3 | Very low | 38.4 | Very low | 161 Ų | 161 | 143 Ų | 143 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | -127.2 | 99.7 | 159.6 | -90.1 | 162.4 | 0 | 0 | 0 | 109.3 | P75 S79 | P75-L77 PolarHBondContact O-N 3.39Å; L77-S79 PolarHBondContact O-N 2.93Å; L77-S79 VanDerWaalsContact O-N 3.13Å | ||
| 78 | K | 31.5 | Very low | 37 | Very low | 205 Ų | 205 | 141.7 Ų | 141.7 | 89% | 0.891 | 77% | 0.774 | S | S | * | * | trans | -27.8 | 107.6 | 158.7 | -64.7 | 167.6 | 176.1 | 175 | 0 | 111.5 | ||||
| 79 | S | 32.2 | Very low | 35.7 | Very low | 112 Ų | 112 | 144.4 Ų | 144.4 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | trans | -100.5 | 95.5 | 153.1 | 47.8 | 0 | 0 | 0 | 0 | 107.4 | L77 I81 | L77-S79 PolarHBondContact O-N 2.93Å; L77-S79 VanDerWaalsContact O-N 3.13Å; S79-I81 PolarHBondContact O-N 2.94Å | ||
| 80 | S | 34.1 | Very low | 34.8 | Very low | 97 Ų | 97 | 141.6 Ų | 141.6 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | trans | -54.1 | 122.3 | 159.9 | -168.9 | 0 | 0 | 0 | 0 | 107.3 | E82 | S80-E82 VanDerWaalsContact C-N 3.25Å; S80-E82 PolarHBondContact O-N 3.47Å | ||
| 81 | I | 33.3 | Very low | 33.9 | Very low | 169 Ų | 169 | 143.6 Ų | 143.6 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -63.6 | 92.3 | 167.2 | -65.7 | 161.7 | 0 | 0 | 0 | 105.8 | S79 | S79-I81 PolarHBondContact O-N 2.94Š| ||
| 82 | E | 31.6 | Very low | 33 | Very low | 176 Ų | 176 | 147 Ų | 147 | 82% | 0.822 | 81% | 0.811 | S | S | * | * | trans | -101.1 | 110.5 | 159.1 | -79.6 | -171.1 | 167.8 | 0 | 0 | 107.7 | S80 | S80-E82 VanDerWaalsContact C-N 3.25Å; S80-E82 PolarHBondContact O-N 3.47Å | ||
| 83 | S | 40.7 | Very low | 32.6 | Very low | 106 Ų | 106 | 140.4 Ų | 140.4 | 74% | 0.741 | 81% | 0.806 | S | S | * | * | trans | -52.7 | 129.5 | 176.1 | 42.2 | 0 | 0 | 0 | 0 | 112.3 | A85 | S83-A85 PolarHBondContact O-N 3.37Š| ||
| 84 | D | 27.5 | Very low | 32.1 | Very low | 165 Ų | 165 | 138.6 Ų | 138.6 | 88% | 0.882 | 81% | 0.811 | S | S | * | * | trans | -41 | 110.3 | 163.5 | -159.7 | 2 | 0 | 0 | 0 | 112.3 | ||||
| 85 | A | 31 | Very low | 32.1 | Very low | 88 Ų | 88 | 136.4 Ų | 136.4 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | trans | -149.4 | 84.4 | 165.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | S83 | S83-A85 PolarHBondContact O-N 3.37Š| ||
| 86 | A | 28.9 | Very low | 31.7 | Very low | 81 Ų | 81 | 136.1 Ų | 136.1 | 67% | 0.669 | 81% | 0.81 | S | S | * | * | trans | 56.6 | 123.2 | 133 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 87 | L | 29.5 | Very low | 31.7 | Very low | 172 Ų | 172 | 131.5 Ų | 131.5 | 90% | 0.901 | 81% | 0.805 | S | S | * | * | trans | 114.8 | 135.8 | 142.4 | -57.7 | 173.8 | 0 | 0 | 0 | 116.9 | ||||
| 88 | A | 34.1 | Very low | 31.4 | Very low | 89 Ų | 89 | 131.3 Ų | 131.3 | 74% | 0.736 | 80% | 0.804 | S | S | * | * | trans | 88.4 | 99.2 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 89 | L | 30.4 | Very low | 31.4 | Very low | 182 Ų | 182 | 124.5 Ų | 124.5 | 95% | 0.953 | 79% | 0.792 | S | S | * | * | 91.7 | 120.2 | 82.4 | -126 | 85 | 0 | 0 | 0 | 112 | |||||
| 90 | G | 30.3 | Very low | 31.3 | Very low | 71 Ų | 71 | 126.1 Ų | 126.1 | 73% | 0.732 | 79% | 0.792 | S | S | * | * | trans | 123.3 | 79.8 | 149.2 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 91 | N | 28.6 | Very low | 31.4 | Very low | 154 Ų | 154 | 126.7 Ų | 126.7 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | 24 | 129 | 135.7 | -55.6 | -11.2 | 0 | 0 | 0 | 122.1 | ||||
| 92 | N | 29.3 | Very low | 31.5 | Very low | 164 Ų | 164 | 125.5 Ų | 125.5 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | 62.6 | 105.3 | 143.3 | -73.4 | 3.9 | 0 | 0 | 0 | 120.6 | ||||
| 93 | A | 31.3 | Very low | 31.9 | Very low | 93 Ų | 93 | 121.1 Ų | 121.1 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -160.5 | 127.7 | 130.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 94 | T | 29.5 | Very low | 31.5 | Very low | 141 Ų | 141 | 122.8 Ų | 122.8 | 87% | 0.865 | 78% | 0.775 | S | S | * | * | trans | -32.8 | 124.8 | 165.4 | 38.9 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 95 | T | 33.4 | Very low | 31.9 | Very low | 135 Ų | 135 | 120.9 Ų | 120.9 | 83% | 0.828 | 76% | 0.764 | S | S | * | * | trans | -139.9 | 112.1 | 155.7 | 54.7 | 0 | 0 | 0 | 0 | 110.7 | A97 | T95-A97 PolarHBondContact O-N 2.94Š| ||
| 96 | S | 28.1 | Very low | 32.5 | Very low | 102 Ų | 102 | 123.6 Ų | 123.6 | 71% | 0.713 | 76% | 0.756 | S | S | * | * | trans | -13.6 | 107.3 | 157.7 | -173.2 | 0 | 0 | 0 | 0 | 115.7 | I98 | S96-I98 VanDerWaalsContact C-N 3.35Å; S96-I98 PolarHBondContact O-N 3.01Å; S96-I98 VanDerWaalsContact O-N 3.13Å | ||
| 97 | A | 35.1 | Very low | 32.9 | Very low | 98 Ų | 98 | 126.3 Ų | 126.3 | 81% | 0.81 | 77% | 0.767 | S | S | * | * | trans | -77.6 | 91.1 | 159.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | T95 | T95-A97 PolarHBondContact O-N 2.94Š| ||
| 98 | I | 29.7 | Very low | 33.5 | Very low | 157 Ų | 157 | 124.1 Ų | 124.1 | 81% | 0.805 | 76% | 0.756 | S | S | * | * | trans | -69.9 | 119.1 | 160.2 | -67 | 166.7 | 0 | 0 | 0 | 106.3 | S96 | S96-I98 VanDerWaalsContact C-N 3.35Å; S96-I98 PolarHBondContact O-N 3.01Å; S96-I98 VanDerWaalsContact O-N 3.13Å | ||
| 99 | G | 30.3 | Very low | 33.5 | Very low | 62 Ų | 62 | 122.5 Ų | 122.5 | 64% | 0.639 | 75% | 0.748 | S | S | * | * | trans | 94 | 52.7 | 146.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | S101 | G99-S101 VanDerWaalsContact C-N 3.27Å; G99-S101 PolarHBondContact O-N 3.32Å | ||
| 100 | D | 30 | Very low | 33.6 | Very low | 147 Ų | 147 | 116.8 Ų | 116.8 | 79% | 0.786 | 72% | 0.723 | S | S | * | * | trans | -86 | 69 | 154 | -80.6 | -24.4 | 0 | 0 | 0 | 109.8 | L102 | D100-L102 VanDerWaalsContact C-N 3.28Š| ||
| 101 | S | 36.7 | Very low | 34 | Very low | 109 Ų | 109 | 118.9 Ų | 118.9 | 76% | 0.762 | 72% | 0.717 | S | S | * | * | trans | -97.5 | 66.5 | 155.6 | -85.3 | 0 | 0 | 0 | 0 | 107.8 | G99 S103 | G99-S101 VanDerWaalsContact C-N 3.27Å; G99-S101 PolarHBondContact O-N 3.32Å; S101-S103 PolarHBondContact O-N 2.99Å; S101-S103 VanDerWaalsContact O-N 3.15Å | ||
| 102 | L | 35.1 | Very low | 34.3 | Very low | 143 Ų | 143 | 112.9 Ų | 112.9 | 75% | 0.749 | 69% | 0.692 | S | S | * | * | trans | -62.8 | 111.2 | 162.2 | -84.1 | 161.3 | 0 | 0 | 0 | 106.7 | D100 E104 | D100-L102 VanDerWaalsContact C-N 3.28Å; L102-E104 VanDerWaalsContact C-N 3.29Å; L102-E104 PolarHBondContact O-N 3.37Å | ||
| 103 | S | 39.5 | Very low | 34.5 | Very low | 85 Ų | 85 | 109.5 Ų | 109.5 | 59% | 0.594 | 68% | 0.677 | S | S | * | * | trans | -58.7 | 98.7 | 163.6 | -56.9 | 0 | 0 | 0 | 0 | 107.1 | S101 L105 | S101-S103 PolarHBondContact O-N 2.99Å; S101-S103 VanDerWaalsContact O-N 3.15Å; S103-L105 PolarHBondContact O-N 3.47Å | ||
| 104 | E | 33 | Very low | 34.6 | Very low | 141 Ų | 141 | 113.5 Ų | 113.5 | 66% | 0.659 | 68% | 0.679 | S | S | * | * | trans | -64.3 | 106.3 | 168.2 | -75.5 | -170.8 | 158.8 | 0 | 0 | 107 | L102 W106 | L102-E104 VanDerWaalsContact C-N 3.29Å; L102-E104 PolarHBondContact O-N 3.37Å; E104-W106 VanDerWaalsContact O-CD1 3.32Å; E104-W106 PolarHBondContact O-N 2.83Å; E104-W106 VanDerWaalsContact O-N 3.13Å | ||
| 105 | L | 35.7 | Very low | 35 | Very low | 124 Ų | 124 | 113.6 Ų | 113.6 | 65% | 0.649 | 67% | 0.665 | S | S | * | * | B | Isolated β-bridge | trans | -65.4 | 106.5 | 164.1 | -174.3 | 73.6 | 0 | 0 | 0 | 105.8 | S103 | S103-L105 PolarHBondContact O-N 3.47Å |
| 106 | W | 44.2 | Very low | 34.8 | Very low | 145 Ų | 145 | 116.3 Ų | 116.3 | 55% | 0.549 | 67% | 0.668 | S | S | . | * | trans | -62.4 | 149.9 | 176.4 | -72.1 | 78.9 | 0 | 0 | 0 | 108.9 | E104 D108 G109 S110 | E104-W106 VanDerWaalsContact O-CD1 3.32Å; E104-W106 PolarHBondContact O-N 2.83Å; E104-W106 VanDerWaalsContact O-N 3.13Å; W106-D108 WeakPolarHBondContact CB-OD1 3.31Å; W106-D108 PolarHBondContact O-N 3.23Å; W106-G109 PolarHBondContact O-N 2.9Å; W106-S110 PolarHBondContact N-O 3.42Å | ||
| 107 | P | 37.8 | Very low | 34.7 | Very low | 139 Ų | 139 | 114.2 Ų | 114.2 | 90% | 0.903 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | -9.2 | -175.6 | -22.8 | 32.3 | 0 | 0 | 0 | 115.1 | ||
| 108 | D | 42.6 | Very low | 34.3 | Very low | 125 Ų | 125 | 118.4 Ų | 118.4 | 67% | 0.668 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | 0.1 | 176.3 | 65.4 | -5.7 | 0 | 0 | 0 | 113.8 | W106 S110 | W106-D108 WeakPolarHBondContact CB-OD1 3.31Å; W106-D108 PolarHBondContact O-N 3.23Å; D108-S110 VanDerWaalsContact C-N 3.32Å; D108-S110 WeakPolarHBondContact OD1-CB 3.35Å; D108-S110 PolarHBondContact OD1-N 2.93Å |
| 109 | G | 33.6 | Very low | 34.6 | Very low | 55 Ų | 55 | 116.8 Ų | 116.8 | 57% | 0.567 | 66% | 0.663 | S | S | * | * | S | Bend | trans | 80.3 | 9.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | W106 | W106-G109 PolarHBondContact O-N 2.9Š|
| 110 | S | 32.6 | Very low | 34.7 | Very low | 62 Ų | 62 | 120.1 Ų | 120.1 | 43% | 0.434 | 67% | 0.671 | S | S | . | * | trans | -79 | 127 | 174.3 | -166.8 | 0 | 0 | 0 | 0 | 111.2 | W106 D108 G112 | W106-S110 PolarHBondContact N-O 3.42Å; D108-S110 VanDerWaalsContact C-N 3.32Å; D108-S110 WeakPolarHBondContact OD1-CB 3.35Å; D108-S110 PolarHBondContact OD1-N 2.93Å; S110-G112 PolarHBondContact O-N 3.42Å | ||
| 111 | L | 37.9 | Very low | 34.8 | Very low | 115 Ų | 115 | 116 Ų | 116 | 60% | 0.602 | 66% | 0.656 | S | S | * | * | B | Isolated β-bridge | trans | -77 | 99.2 | 169.8 | -101.2 | 137.1 | 0 | 0 | 0 | 108.2 | V113 | L111-V113 VanDerWaalsContact C-N 3.31Å; L111-V113 HydrophobicContact CB-CG2 4.47Å; L111-V113 WeakPolarHBondContact O-CG2 3.49Å; L111-V113 PolarHBondContact O-N 3.45Å |
| 112 | G | 34.1 | Very low | 34.7 | Very low | 29 Ų | 29 | 115.5 Ų | 115.5 | 30% | 0.299 | 66% | 0.659 | S | S | . | * | trans | -67.3 | 90.8 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | S110 H114 | S110-G112 PolarHBondContact O-N 3.42Å; G112-H114 PolarHBondContact O-N 2.86Å; G112-H114 VanDerWaalsContact O-N 3.11Å | ||
| 113 | V | 34.3 | Very low | 34.8 | Very low | 93 Ų | 93 | 112.8 Ų | 112.8 | 56% | 0.564 | 65% | 0.645 | S | S | * | * | trans | -80.5 | 94.9 | 174.8 | -153.3 | 0 | 0 | 0 | 0 | 108.1 | L111 Y115 | L111-V113 VanDerWaalsContact C-N 3.31Å; L111-V113 HydrophobicContact CB-CG2 4.47Å; L111-V113 WeakPolarHBondContact O-CG2 3.49Å; L111-V113 PolarHBondContact O-N 3.45Å; V113-Y115 VanDerWaalsContact C-N 3.3Å; V113-Y115 HydrophobicContact CB-CD2 4.13Å; V113-Y115 HydrophobicContact CB-CE2 4.31Å; V113-Y115 HydrophobicContact CG1-CD2 3.38Å; V113-Y115 HydrophobicContact CG1-CE2 3.24Å; V113-Y115 HydrophobicContact CG1-CG 4.43Å; V113-Y115 PolarHBondContact O-N 3.47Å | ||
| 114 | H | 32.8 | Very low | 34.5 | Very low | 177 Ų | 177 | 115.6 Ų | 115.6 | 82% | 0.819 | 65% | 0.653 | S | S | * | * | trans | -75.2 | 83.2 | 173.9 | -147.1 | -69.3 | 0 | 0 | 0 | 108.7 | G112 | G112-H114 PolarHBondContact O-N 2.86Å; G112-H114 VanDerWaalsContact O-N 3.11Å | ||
| 115 | Y | 38.9 | Very low | 34.6 | Very low | 142 Ų | 142 | 113.5 Ų | 113.5 | 56% | 0.557 | 64% | 0.643 | S | S | * | * | trans | -87.2 | 110.3 | 167.9 | -86.4 | -73.2 | 0 | 0 | 0 | 109.1 | V113 G117 | V113-Y115 VanDerWaalsContact C-N 3.3Å; V113-Y115 HydrophobicContact CB-CD2 4.13Å; V113-Y115 HydrophobicContact CB-CE2 4.31Å; V113-Y115 HydrophobicContact CG1-CD2 3.38Å; V113-Y115 HydrophobicContact CG1-CE2 3.24Å; V113-Y115 HydrophobicContact CG1-CG 4.43Å; V113-Y115 PolarHBondContact O-N 3.47Å; Y115-G117 PolarHBondContact O-N 3.26Å | ||
| 116 | E | 28.4 | Very low | 34.2 | Very low | 192 Ų | 192 | 117.4 Ų | 117.4 | 90% | 0.897 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | 108.7 | 154 | -86.4 | -170.7 | 144.9 | 0 | 0 | 107.8 | ||
| 117 | G | 27.3 | Very low | 33.7 | Very low | 59 Ų | 59 | 116.6 Ų | 116.6 | 61% | 0.608 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 126.1 | -5 | 153.2 | 0 | 0 | 0 | 0 | 0 | 120 | Y115 | Y115-G117 PolarHBondContact O-N 3.26Š|
| 118 | F | 26 | Very low | 33.2 | Very low | 185 Ų | 185 | 116.9 Ų | 116.9 | 81% | 0.811 | 64% | 0.644 | S | S | * | * | trans | -145.1 | 124 | 176.5 | -81.8 | -87.1 | 0 | 0 | 0 | 113.4 | V120 | F118-V120 PolarHBondContact O-N 2.99Š| ||
| 119 | P | 36 | Very low | 32.7 | Very low | 124 Ų | 124 | 117.2 Ų | 117.2 | 81% | 0.805 | 65% | 0.645 | S | S | * | * | trans | -72.3 | 111.1 | 173.9 | 28.3 | -30.6 | 0 | 0 | 0 | 109.8 | A121 | P119-A121 PolarHBondContact O-N 3.5Š| ||
| 120 | V | 31.7 | Very low | 32.7 | Very low | 132 Ų | 132 | 122.1 Ų | 122.1 | 80% | 0.8 | 66% | 0.659 | S | S | * | * | trans | -71.3 | 102.6 | 164.6 | 177 | 0 | 0 | 0 | 0 | 107.2 | F118 A122 | F118-V120 PolarHBondContact O-N 2.99Å; V120-A122 PolarHBondContact O-N 2.84Å | ||
| 121 | A | 32.4 | Very low | 32.4 | Very low | 59 Ų | 59 | 125.8 Ų | 125.8 | 49% | 0.488 | 68% | 0.678 | S | S | . | * | trans | -75.5 | 108.5 | 173 | 0 | 0 | 0 | 0 | 0 | 109.4 | P119 I123 | P119-A121 PolarHBondContact O-N 3.5Å; A121-I123 PolarHBondContact O-N 2.77Å | ||
| 122 | A | 35.4 | Very low | 32.2 | Very low | 100 Ų | 100 | 127 Ų | 127 | 83% | 0.826 | 69% | 0.69 | S | S | * | * | trans | -66.3 | 118.5 | 168 | 0 | 0 | 0 | 0 | 0 | 109.2 | V120 | V120-A122 PolarHBondContact O-N 2.84Š| ||
| 123 | I | 37 | Very low | 31.9 | Very low | 86 Ų | 86 | 133.2 Ų | 133.2 | 44% | 0.441 | 72% | 0.716 | S | S | . | * | trans | -103.8 | 103 | 177.8 | -61.7 | 172.2 | 0 | 0 | 0 | 107.9 | V49 A121 | V49-I123 HydrophobicContact CB-CD1 4.41Å; V49-I123 HydrophobicContact CG1-CD1 3.54Å; A121-I123 PolarHBondContact O-N 2.77Å | ||
| 124 | D | 33.1 | Very low | 31.5 | Very low | 143 Ų | 143 | 131.9 Ų | 131.9 | 77% | 0.765 | 72% | 0.722 | S | S | * | * | trans | -88 | 124.4 | 162.2 | -165.2 | 8.4 | 0 | 0 | 0 | 108.3 | ||||
| 125 | Q | 34.1 | Very low | 31.2 | Very low | 97 Ų | 97 | 129 Ų | 129 | 45% | 0.453 | 73% | 0.729 | S | S | . | * | trans | -118.4 | 80.8 | -178.2 | -162 | 176.4 | 29.9 | 0 | 0 | 108.9 | I127 | Q125-I127 HydrophobicContact CG-CD1 4.09Å; Q125-I127 HydrophobicContact CG-CG1 4.03Å; Q125-I127 PolarHBondContact O-N 3.41Å | ||
| 126 | R | 27 | Very low | 30.7 | Very low | 207 Ų | 207 | 126 Ų | 126 | 78% | 0.781 | 73% | 0.733 | S | S | * | * | trans | -80.9 | 90.3 | 159.5 | -78.5 | -174.7 | 172.7 | -124.8 | 0.5 | 109.1 | E128 | R126-E128 VanDerWaalsContact C-N 3.33Å; R126-E128 PolarHBondContact O-N 3.16Å | ||
| 127 | I | 34.4 | Very low | 30.8 | Very low | 127 Ų | 127 | 126.4 Ų | 126.4 | 65% | 0.651 | 73% | 0.732 | S | S | * | * | trans | -88.5 | 86.2 | 155.3 | -63.3 | 170.8 | 0 | 0 | 0 | 105.7 | Q125 | Q125-I127 HydrophobicContact CG-CD1 4.09Å; Q125-I127 HydrophobicContact CG-CG1 4.03Å; Q125-I127 PolarHBondContact O-N 3.41Å | ||
| 128 | E | 28.6 | Very low | 30.8 | Very low | 145 Ų | 145 | 132.6 Ų | 132.6 | 68% | 0.678 | 75% | 0.745 | S | S | * | * | trans | -77.4 | 128.7 | 164.6 | -163.9 | 165.6 | -165.4 | 0 | 0 | 107.3 | R126 | R126-E128 VanDerWaalsContact C-N 3.33Å; R126-E128 PolarHBondContact O-N 3.16Å | ||
| 129 | N | 30.3 | Very low | 31.2 | Very low | 132 Ų | 132 | 129.4 Ų | 129.4 | 71% | 0.706 | 74% | 0.743 | S | S | * | * | trans | 81.2 | 78.2 | 177.6 | -49 | -36.4 | 0 | 0 | 0 | 116.7 | ||||
| 130 | N | 33.6 | Very low | 30.7 | Very low | 159 Ų | 159 | 129.7 Ų | 129.7 | 85% | 0.85 | 75% | 0.747 | S | S | * | * | -166.1 | 126.8 | 114.6 | -94.9 | -26.1 | 0 | 0 | 0 | 112.1 | V132 | N130-V132 PolarHBondContact O-N 3.34Š| |||
| 131 | V | 27.9 | Very low | 30.4 | Very low | 138 Ų | 138 | 133.8 Ų | 133.8 | 84% | 0.836 | 75% | 0.753 | S | S | * | * | trans | -52.8 | 111.3 | 178.9 | 178.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 132 | V | 33.7 | Very low | 30.2 | Very low | 141 Ų | 141 | 134.2 Ų | 134.2 | 86% | 0.855 | 76% | 0.764 | S | S | * | * | trans | -139 | 117.7 | 145.5 | 179.6 | 0 | 0 | 0 | 0 | 107.9 | N130 | N130-V132 PolarHBondContact O-N 3.34Š| ||
| 133 | D | 26.5 | Very low | 29.9 | Very low | 159 Ų | 159 | 138.4 Ų | 138.4 | 85% | 0.85 | 77% | 0.766 | S | S | * | * | trans | -34.9 | 145.6 | 175.7 | -98 | -44.8 | 0 | 0 | 0 | 117.5 | ||||
| 134 | G | 26.5 | Very low | 29.5 | Very low | 66 Ų | 66 | 141.2 Ų | 141.2 | 68% | 0.68 | 79% | 0.787 | S | S | * | * | 108.3 | 82.8 | 127.3 | 0 | 0 | 0 | 0 | 0 | 118.5 | A136 | G134-A136 PolarHBondContact O-N 3.44Š| |||
| 135 | A | 26.9 | Very low | 29.2 | Very low | 117 Ų | 117 | 142.7 Ų | 142.7 | 97% | 0.967 | 79% | 0.794 | S | S | * | * | trans | 71.3 | 27 | 138.4 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 136 | A | 28.8 | Very low | 29 | Very low | 77 Ų | 77 | 142.5 Ų | 142.5 | 64% | 0.636 | 81% | 0.809 | S | S | * | * | trans | -123.6 | 133.1 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | G134 | G134-A136 PolarHBondContact O-N 3.44Š| ||
| 137 | F | 29.8 | Very low | 29.1 | Very low | 202 Ų | 202 | 144.8 Ų | 144.8 | 89% | 0.886 | 82% | 0.818 | S | S | * | * | trans | 83.5 | 75.1 | -174.6 | -48.8 | -74.3 | 0 | 0 | 0 | 115.5 | P139 | F137-P139 WeakPolarHBondContact O-CD 3.05Š| ||
| 138 | Q | 26.3 | Very low | 28.8 | Very low | 189 Ų | 189 | 143.3 Ų | 143.3 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 123.3 | 151.2 | -100.1 | 179.2 | -20.7 | 0 | 0 | 108.9 | C140 | Q138-C140 PolarHBondContact O-N 2.98Š|
| 139 | P | 35 | Very low | 28.7 | Very low | 118 Ų | 118 | 143 Ų | 143 | 77% | 0.766 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 128.1 | 164.2 | 26.1 | -29.3 | 0 | 0 | 0 | 109 | F137 K141 | F137-P139 WeakPolarHBondContact O-CD 3.05Å; P139-K141 PolarHBondContact O-N 3.35Å |
| 140 | C | 26.1 | Very low | 28.6 | Very low | 130 Ų | 130 | 143.8 Ų | 143.8 | 88% | 0.878 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 122.9 | 171.2 | -66.3 | 0 | 0 | 0 | 0 | 109 | Q138 G142 | Q138-C140 PolarHBondContact O-N 2.98Å; C140-G142 VanDerWaalsContact C-N 3.29Å; C140-G142 PolarHBondContact O-N 2.97Å |
| 141 | K | 25.6 | Very low | 28.3 | Very low | 217 Ų | 217 | 141.7 Ų | 141.7 | 94% | 0.943 | 82% | 0.824 | S | S | * | * | trans | -65.9 | 90.5 | 167.7 | -74.2 | 178.8 | 175.9 | 178.2 | 0 | 108.3 | P139 | P139-K141 PolarHBondContact O-N 3.35Š| ||
| 142 | G | 27.6 | Very low | 28.2 | Very low | 68 Ų | 68 | 142.8 Ų | 142.8 | 70% | 0.701 | 82% | 0.82 | S | S | * | * | trans | -108.8 | 135 | 166 | 0 | 0 | 0 | 0 | 0 | 108.9 | C140 | C140-G142 VanDerWaalsContact C-N 3.29Å; C140-G142 PolarHBondContact O-N 2.97Å | ||
| 143 | E | 28.1 | Very low | 27.8 | Very low | 189 Ų | 189 | 140.1 Ų | 140.1 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | -65.4 | 149.3 | -164 | -67.1 | 166 | 140.8 | 0 | 0 | 114.7 | L145 | E143-L145 PolarHBondContact O-N 3.24Š| ||
| 144 | T | 28.6 | Very low | 27.8 | Very low | 144 Ų | 144 | 139.1 Ų | 139.1 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -37.9 | 117.6 | 172.1 | -19 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 145 | L | 28.6 | Very low | 27.9 | Very low | 174 Ų | 174 | 145.7 Ų | 145.7 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | trans | -135.3 | 145.2 | 158 | -103.4 | 131.6 | 0 | 0 | 0 | 110.3 | E143 | E143-L145 PolarHBondContact O-N 3.24Š| ||
| 146 | A | 29.4 | Very low | 27.9 | Very low | 93 Ų | 93 | 146.4 Ų | 146.4 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -65.2 | 148.2 | -147.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | S148 | A146-S148 PolarHBondContact O-N 3.49Å; A146-S148 VanDerWaalsContact O-N 3.16Å | ||
| 147 | R | 28.9 | Very low | 28.1 | Very low | 256 Ų | 256 | 149.2 Ų | 149.2 | 97% | 0.966 | 80% | 0.799 | S | S | * | * | trans | -45.9 | 111.5 | 159.9 | -83.4 | 172 | 154.6 | 161.5 | -7.5 | 110.8 | ||||
| 148 | S | 27.3 | Very low | 28 | Very low | 96 Ų | 96 | 144.7 Ų | 144.7 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | trans | -150.3 | 126.9 | 150.1 | -153.5 | 0 | 0 | 0 | 0 | 108.4 | A146 | A146-S148 PolarHBondContact O-N 3.49Å; A146-S148 VanDerWaalsContact O-N 3.16Å | ||
| 149 | D | 27.5 | Very low | 28.2 | Very low | 137 Ų | 137 | 141.3 Ų | 141.3 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | trans | 66.8 | 81.2 | 161.5 | -47 | -43.4 | 0 | 0 | 0 | 117.6 | V151 | D149-V151 PolarHBondContact O-N 2.91Š| ||
| 150 | V | 27.4 | Very low | 27.8 | Very low | 149 Ų | 149 | 143.3 Ų | 143.3 | 90% | 0.903 | 79% | 0.788 | S | S | * | * | trans | -67.8 | 95.5 | 156.4 | 178.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 151 | V | 26.7 | Very low | 27.9 | Very low | 115 Ų | 115 | 142.1 Ų | 142.1 | 70% | 0.697 | 78% | 0.781 | S | S | * | * | trans | -90.9 | 102.1 | 164.4 | -177.2 | 0 | 0 | 0 | 0 | 107.4 | D149 V153 | D149-V151 PolarHBondContact O-N 2.91Å; V151-V153 HydrophobicContact CG1-CG2 3.76Å; V151-V153 PolarHBondContact O-N 3.13Å; V151-V153 VanDerWaalsContact O-N 3.17Å | ||
| 152 | E | 26 | Very low | 28.1 | Very low | 161 Ų | 161 | 138.6 Ų | 138.6 | 75% | 0.752 | 78% | 0.778 | S | S | * | * | trans | -74.6 | 95.9 | 176.6 | -163.2 | 178.1 | -154.4 | 0 | 0 | 109 | ||||
| 153 | V | 25.8 | Very low | 28 | Very low | 86 Ų | 86 | 138.1 Ų | 138.1 | 52% | 0.521 | 77% | 0.772 | S | S | . | * | trans | -97.4 | 94.2 | 176.1 | -164.8 | 0 | 0 | 0 | 0 | 109.7 | V151 Y155 | V151-V153 HydrophobicContact CG1-CG2 3.76Å; V151-V153 PolarHBondContact O-N 3.13Å; V151-V153 VanDerWaalsContact O-N 3.17Å; V153-Y155 HydrophobicContact CB-CD2 4.43Å; V153-Y155 HydrophobicContact CB-CE2 4.08Å; V153-Y155 HydrophobicContact CG1-CD2 3.64Å; V153-Y155 HydrophobicContact CG1-CE1 4.43Å; V153-Y155 HydrophobicContact CG1-CE2 3.13Å; V153-Y155 HydrophobicContact CG1-CG 4.48Å; V153-Y155 PolarHBondContact O-N 3.2Å | ||
| 154 | N | 26 | Very low | 28 | Very low | 137 Ų | 137 | 140 Ų | 140 | 73% | 0.733 | 77% | 0.771 | S | S | * | * | trans | -75.4 | 113.1 | 169.8 | -79.9 | -53.3 | 0 | 0 | 0 | 109.8 | ||||
| 155 | Y | 29.8 | Very low | 28 | Very low | 204 Ų | 204 | 142.9 Ų | 142.9 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | trans | -103 | 130 | 171.3 | -79.3 | -75.9 | 0 | 0 | 0 | 111.6 | V153 | V153-Y155 HydrophobicContact CB-CD2 4.43Å; V153-Y155 HydrophobicContact CB-CE2 4.08Å; V153-Y155 HydrophobicContact CG1-CD2 3.64Å; V153-Y155 HydrophobicContact CG1-CE1 4.43Å; V153-Y155 HydrophobicContact CG1-CE2 3.13Å; V153-Y155 HydrophobicContact CG1-CG 4.48Å; V153-Y155 PolarHBondContact O-N 3.2Å | ||
| 156 | V | 27.5 | Very low | 28 | Very low | 133 Ų | 133 | 142.9 Ų | 142.9 | 81% | 0.806 | 77% | 0.771 | S | S | * | * | trans | -82.5 | 121.4 | 172.3 | 176.3 | 0 | 0 | 0 | 0 | 108.7 | S158 | V156-S158 PolarHBondContact O-N 3.35Š| ||
| 157 | I | 32.9 | Very low | 28.3 | Very low | 136 Ų | 136 | 151.4 Ų | 151.4 | 70% | 0.697 | 80% | 0.795 | S | S | * | * | trans | -80.2 | 109.3 | 171.5 | -62.7 | 174 | 0 | 0 | 0 | 108.4 | V159 | I157-V159 HydrophobicContact CG2-CG2 4.19Å; I157-V159 PolarHBondContact O-N 2.83Å | ||
| 158 | S | 26.1 | Very low | 28.3 | Very low | 106 Ų | 106 | 146.2 Ų | 146.2 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | -72.4 | 100.8 | 162.4 | -65.8 | 0 | 0 | 0 | 0 | 108.5 | V156 L160 | V156-S158 PolarHBondContact O-N 3.35Å; S158-L160 PolarHBondContact O-N 3.49Å | ||
| 159 | V | 30.4 | Very low | 28.3 | Very low | 118 Ų | 118 | 148.8 Ų | 148.8 | 72% | 0.715 | 79% | 0.793 | S | S | * | * | trans | -68.9 | 98.4 | 169.2 | -177.1 | 0 | 0 | 0 | 0 | 107.6 | I157 S161 | I157-V159 HydrophobicContact CG2-CG2 4.19Å; I157-V159 PolarHBondContact O-N 2.83Å; V159-S161 PolarHBondContact O-N 3.13Å | ||
| 160 | L | 28.1 | Very low | 28.4 | Very low | 160 Ų | 160 | 149.5 Ų | 149.5 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | trans | -66.7 | 104 | 163.4 | -86.6 | 162.2 | 0 | 0 | 0 | 107.4 | S158 V162 | S158-L160 PolarHBondContact O-N 3.49Å; L160-V162 PolarHBondContact O-N 3.36Å | ||
| 161 | S | 28 | Very low | 28.4 | Very low | 105 Ų | 105 | 149.5 Ų | 149.5 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -32.1 | 107.4 | 166.7 | 168.4 | 0 | 0 | 0 | 0 | 112.1 | V159 G163 | V159-S161 PolarHBondContact O-N 3.13Å; S161-G163 PolarHBondContact O-N 3.48Å | ||
| 162 | V | 28.8 | Very low | 28.5 | Very low | 144 Ų | 144 | 151.7 Ų | 151.7 | 87% | 0.873 | 80% | 0.795 | S | S | * | * | trans | -70.9 | 80.8 | 161.7 | -177.3 | 0 | 0 | 0 | 0 | 107.1 | L160 | L160-V162 PolarHBondContact O-N 3.36Š| ||
| 163 | G | 26.6 | Very low | 28.7 | Very low | 57 Ų | 57 | 151.1 Ų | 151.1 | 59% | 0.588 | 80% | 0.798 | S | S | * | * | trans | -121.2 | 56.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | S161 | S161-G163 PolarHBondContact O-N 3.48Š| ||
| 164 | R | 27.7 | Very low | 28.9 | Very low | 229 Ų | 229 | 155.7 Ų | 155.7 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | trans | -157.2 | 75.3 | 166.4 | -84.4 | -153.9 | 172.8 | 159.5 | -1.8 | 111.2 | ||||
| 165 | F | 28.6 | Very low | 29.1 | Very low | 204 Ų | 204 | 157.2 Ų | 157.2 | 90% | 0.895 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -157.5 | 88.8 | 150.7 | -95.2 | -76.8 | 0 | 0 | 0 | 106.1 | ||
| 166 | I | 29.3 | Very low | 29.1 | Very low | 175 Ų | 175 | 153.3 Ų | 153.3 | 90% | 0.897 | 83% | 0.827 | S | S | * | * | trans | 170.8 | 90.8 | 150.8 | -77.7 | 145.5 | 0 | 0 | 0 | 103.9 | ||||
| 167 | E | 35 | Very low | 29.2 | Very low | 272 Ų | 272 | 155.1 Ų | 155.1 | 100% | 1.271 | 83% | 0.829 | S | S | * | * | trans | -168.4 | 0 | 143.9 | -110.2 | -177.5 | -179.6 | 0 | 0 | 108.6 |
Retrieved 167 of 167 residues in 154.2 ms
(Link to these results)