| 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 | 47.1 | Very low | 55 | Low | 247 Ų | 247 | 143.8 Ų | 143.8 | 100% | 1.217 | 79% | 0.789 | S | S | * | * | 0 | 126.6 | 0 | -78.1 | 161.6 | 159.8 | 0 | 0 | 106.6 | |||||
| 2 | S | 54 | Low | 55.7 | Low | 121 Ų | 121 | 140.7 Ų | 140.7 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 133.8 | 173.7 | -51.7 | 0 | 0 | 0 | 0 | 108.4 | ||
| 3 | E | 58 | Low | 57.3 | Low | 186 Ų | 186 | 135.3 Ų | 135.3 | 87% | 0.869 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 135.7 | 168.1 | -106.9 | 178.4 | 90.7 | 0 | 0 | 109.8 | Q5 | E3-Q5 PolarHBondContact O-N 3.35Š|
| 4 | P | 57.8 | Low | 59.2 | Low | 117 Ų | 117 | 129.3 Ų | 129.3 | 76% | 0.76 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 119.8 | 166.7 | 29.6 | -30.9 | 0 | 0 | 0 | 108.6 | ||
| 5 | Q | 49 | Very low | 61.2 | Low | 173 Ų | 173 | 127.9 Ų | 127.9 | 81% | 0.808 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 142.1 | 167.5 | -82.9 | -87.6 | -89.2 | 0 | 0 | 109.8 | E3 D7 | E3-Q5 PolarHBondContact O-N 3.35Å; Q5-D7 PolarHBondContact O-N 3.18Å |
| 6 | P | 53.4 | Low | 63.1 | Low | 109 Ų | 109 | 129.1 Ų | 129.1 | 71% | 0.708 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 118.1 | 168.4 | 27.9 | -32.2 | 0 | 0 | 0 | 108.3 | ||
| 7 | D | 46.8 | Very low | 64.7 | Low | 155 Ų | 155 | 129.4 Ų | 129.4 | 83% | 0.829 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -64 | 137.6 | -176.9 | -153.2 | -16.2 | 0 | 0 | 0 | 110.3 | Q5 E9 | Q5-D7 PolarHBondContact O-N 3.18Å; D7-E9 VanDerWaalsContact C-N 3.28Å; D7-E9 PolarHBondContact O-N 3.26Å |
| 8 | L | 56.9 | Low | 66.3 | Low | 164 Ų | 164 | 127.9 Ų | 127.9 | 86% | 0.859 | 69% | 0.687 | S | S | * | * | trans | -89 | 72 | -164.3 | -129 | 166.1 | 0 | 0 | 0 | 109.8 | ||||
| 9 | E | 60.2 | Low | 67.7 | Low | 128 Ų | 128 | 128.2 Ų | 128.2 | 60% | 0.598 | 68% | 0.682 | S | S | * | * | trans | -45.8 | 138.5 | -174.9 | -90.3 | -109.9 | 82.4 | 0 | 0 | 113.4 | D7 H13 | D7-E9 VanDerWaalsContact C-N 3.28Å; D7-E9 PolarHBondContact O-N 3.26Å; E9-H13 IonicContact OE1-CE1 2.73Å; E9-H13 PolarHBondContact OE1-CE1 3.05Å; E9-H13 IonicContact OE1-ND1 3.88Å; E9-H13 IonicContact OE1-NE2 3.58Å; E9-H13 IonicContact OE2-CD2 2.74Å; E9-H13 IonicContact OE2-CE1 3.01Å; E9-H13 PolarHBondContact OE2-CE1 2.95Å; E9-H13 VanDerWaalsContact OE2-CE1 3.26Å; E9-H13 IonicContact OE2-CG 3.68Å; E9-H13 IonicContact OE2-ND1 3.96Å; E9-H13 IonicContact OE2-NE2 3.26Å | ||
| 10 | P | 60.9 | Low | 69.1 | Low | 67 Ų | 67 | 126.4 Ų | 126.4 | 44% | 0.435 | 67% | 0.672 | S | S | . | * | trans | -65.4 | 156.1 | -167.1 | 25.8 | -35.1 | 0 | 0 | 0 | 113 | Q12 H13 | P10-Q12 PolarHBondContact O-N 3.09Å; P10-H13 PolarHBondContact O-N 3.12Å; P10-H13 VanDerWaalsContact O-N 3.12Å; P10-H13 PolarHBondContact O-ND1 3.48Å; P10-H13 VanDerWaalsContact O-ND1 3.09Å | ||
| 11 | P | 60.3 | Low | 70.3 | Confident | 115 Ų | 115 | 125.9 Ų | 125.9 | 75% | 0.747 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -4.8 | -169.1 | 23.5 | -35.3 | 0 | 0 | 0 | 116 | H13 | P11-H13 PolarHBondContact O-N 3.39Š|
| 12 | Q | 64.3 | Low | 72.7 | Confident | 106 Ų | 106 | 118.2 Ų | 118.2 | 50% | 0.495 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -62.2 | -29.9 | 171 | -57.2 | -57.3 | -30.6 | 0 | 0 | 112.3 | P10 G14 L15 Y16 | P10-Q12 PolarHBondContact O-N 3.09Å; Q12-G14 VanDerWaalsContact C-N 3.3Å; Q12-G14 PolarHBondContact O-N 3.03Å; Q12-L15 WeakPolarHBondContact O-CB 3.31Å; Q12-L15 PolarHBondContact O-N 2.9Å; Q12-Y16 HydrophobicContact CB-CD2 4.23Å; Q12-Y16 HydrophobicContact CB-CE2 4.07Å; Q12-Y16 VanDerWaalsContact O-CD2 3.31Å; Q12-Y16 WeakPolarHBondContact O-CD2 3.2Å; Q12-Y16 PolarHBondContact O-N 3.02Å |
| 13 | H | 75.5 | Confident | 74.7 | Confident | 71 Ų | 71 | 115.9 Ų | 115.9 | 33% | 0.329 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.8 | -29.9 | -176.2 | -68.9 | 101.4 | 0 | 0 | 0 | 113.8 | E9 P10 P11 L15 Y16 M17 | E9-H13 IonicContact OE1-CE1 2.73Å; E9-H13 PolarHBondContact OE1-CE1 3.05Å; E9-H13 IonicContact OE1-ND1 3.88Å; E9-H13 IonicContact OE1-NE2 3.58Å; E9-H13 IonicContact OE2-CD2 2.74Å; E9-H13 IonicContact OE2-CE1 3.01Å; E9-H13 PolarHBondContact OE2-CE1 2.95Å; E9-H13 VanDerWaalsContact OE2-CE1 3.26Å; E9-H13 IonicContact OE2-CG 3.68Å; E9-H13 IonicContact OE2-ND1 3.96Å; E9-H13 IonicContact OE2-NE2 3.26Å; P10-H13 PolarHBondContact O-N 3.12Å; P10-H13 VanDerWaalsContact O-N 3.12Å; P10-H13 PolarHBondContact O-ND1 3.48Å; P10-H13 VanDerWaalsContact O-ND1 3.09Å; P11-H13 PolarHBondContact O-N 3.39Å; H13-L15 VanDerWaalsContact C-N 3.32Å; H13-L15 PolarHBondContact O-N 2.81Å; H13-Y16 PolarHBondContact O-N 3.31Å; H13-M17 VanDerWaalsContact O-CB 3.32Å; H13-M17 WeakPolarHBondContact O-CB 3.32Å; H13-M17 WeakPolarHBondContact O-CG 3.46Å; H13-M17 PolarHBondContact O-N 2.84Å |
| 14 | G | 84.4 | Confident | 76.6 | Confident | 51 Ų | 51 | 111 Ų | 111 | 53% | 0.526 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -62.6 | -38.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q12 L18 | Q12-G14 VanDerWaalsContact C-N 3.3Å; Q12-G14 PolarHBondContact O-N 3.03Å; G14-L18 VanDerWaalsContact O-CB 3.31Å; G14-L18 WeakPolarHBondContact O-CB 3.28Å; G14-L18 PolarHBondContact O-N 3.37Å |
| 15 | L | 89.1 | Confident | 78.4 | Confident | 108 Ų | 108 | 113.2 Ų | 113.2 | 57% | 0.565 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -72.7 | -41.9 | 178.2 | -59.7 | 179.3 | 0 | 0 | 0 | 111.8 | Q12 H13 L18 F19 | Q12-L15 WeakPolarHBondContact O-CB 3.31Å; Q12-L15 PolarHBondContact O-N 2.9Å; H13-L15 VanDerWaalsContact C-N 3.32Å; H13-L15 PolarHBondContact O-N 2.81Å; L15-L18 PolarHBondContact O-N 3.47Å; L15-F19 VanDerWaalsContact O-CB 3.29Å; L15-F19 WeakPolarHBondContact O-CB 3.38Å; L15-F19 PolarHBondContact O-N 2.86Å |
| 16 | Y | 91.1 | Very high | 80.7 | Confident | 147 Ų | 147 | 110.9 Ų | 110.9 | 58% | 0.576 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.4 | -43.1 | 174.3 | -74.5 | -65.4 | 0 | 0 | 0 | 112.2 | Q12 H13 F19 L20 | Q12-Y16 HydrophobicContact CB-CD2 4.23Å; Q12-Y16 HydrophobicContact CB-CE2 4.07Å; Q12-Y16 VanDerWaalsContact O-CD2 3.31Å; Q12-Y16 WeakPolarHBondContact O-CD2 3.2Å; Q12-Y16 PolarHBondContact O-N 3.02Å; H13-Y16 PolarHBondContact O-N 3.31Å; Y16-F19 PolarHBondContact O-N 3.43Å; Y16-L20 WeakPolarHBondContact O-CB 3.24Å; Y16-L20 VanDerWaalsContact O-CG 3.25Å; Y16-L20 WeakPolarHBondContact O-CG 3.28Å; Y16-L20 PolarHBondContact O-N 3.42Å |
| 17 | M | 90.9 | Very high | 82.8 | Confident | 135 Ų | 135 | 110.2 Ų | 110.2 | 67% | 0.665 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.4 | -41.1 | 175.6 | -71.9 | -67.6 | -176.8 | 0 | 0 | 112 | H13 L21 | H13-M17 VanDerWaalsContact O-CB 3.32Å; H13-M17 WeakPolarHBondContact O-CB 3.32Å; H13-M17 WeakPolarHBondContact O-CG 3.46Å; H13-M17 PolarHBondContact O-N 2.84Å; M17-L21 VanDerWaalsContact O-CB 3.28Å; M17-L21 WeakPolarHBondContact O-CB 3.34Å; M17-L21 PolarHBondContact O-N 2.91Å |
| 18 | L | 93.4 | Very high | 85.2 | Confident | 102 Ų | 102 | 108.9 Ų | 108.9 | 53% | 0.534 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.6 | -43.3 | 175 | -179.3 | 60.8 | 0 | 0 | 0 | 111.9 | G14 L15 L21 V22 | G14-L18 VanDerWaalsContact O-CB 3.31Å; G14-L18 WeakPolarHBondContact O-CB 3.28Å; G14-L18 PolarHBondContact O-N 3.37Å; L15-L18 PolarHBondContact O-N 3.47Å; L18-L21 PolarHBondContact O-N 2.99Å; L18-V22 HydrophobicContact CD1-CG2 4.29Å; L18-V22 WeakPolarHBondContact O-CG2 3.25Å; L18-V22 PolarHBondContact O-N 2.87Å |
| 19 | F | 93.9 | Very high | 87.1 | Confident | 134 Ų | 134 | 103 Ų | 103 | 59% | 0.588 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.7 | -44.8 | 176.4 | 179.1 | -97.5 | 0 | 0 | 0 | 111.7 | L15 Y16 V22 L23 | L15-F19 VanDerWaalsContact O-CB 3.29Å; L15-F19 WeakPolarHBondContact O-CB 3.38Å; L15-F19 PolarHBondContact O-N 2.86Å; Y16-F19 PolarHBondContact O-N 3.43Å; F19-V22 PolarHBondContact O-N 3.35Å; F19-L23 HydrophobicContact CE1-CD2 4.35Å; F19-L23 VanDerWaalsContact O-CB 3.24Å; F19-L23 WeakPolarHBondContact O-CB 3.38Å; F19-L23 PolarHBondContact O-N 2.86Å |
| 20 | L | 94.4 | Very high | 88.8 | Confident | 92 Ų | 92 | 100.8 Ų | 100.8 | 48% | 0.482 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.8 | -40.8 | 175 | -71.6 | 171.7 | 0 | 0 | 0 | 111.9 | Y16 L23 V24 | Y16-L20 WeakPolarHBondContact O-CB 3.24Å; Y16-L20 VanDerWaalsContact O-CG 3.25Å; Y16-L20 WeakPolarHBondContact O-CG 3.28Å; Y16-L20 PolarHBondContact O-N 3.42Å; L20-L23 PolarHBondContact O-N 3.3Å; L20-V24 WeakPolarHBondContact O-CB 3.29Å; L20-V24 VanDerWaalsContact O-CG2 3.28Å; L20-V24 WeakPolarHBondContact O-CG2 3.44Å; L20-V24 PolarHBondContact O-N 2.89Å |
| 21 | L | 95.6 | Very high | 90.5 | Very high | 115 Ų | 115 | 101.3 Ų | 101.3 | 60% | 0.602 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.8 | -44 | 176.7 | -178.6 | 61.9 | 0 | 0 | 0 | 111.9 | M17 L18 F25 | M17-L21 VanDerWaalsContact O-CB 3.28Å; M17-L21 WeakPolarHBondContact O-CB 3.34Å; M17-L21 PolarHBondContact O-N 2.91Å; L18-L21 PolarHBondContact O-N 2.99Å; L21-F25 VanDerWaalsContact O-CB 3.3Å; L21-F25 WeakPolarHBondContact O-CB 3.31Å; L21-F25 PolarHBondContact O-N 2.89Å |
| 22 | V | 96.7 | Very high | 92.2 | Very high | 87 Ų | 87 | 97.3 Ų | 97.3 | 53% | 0.527 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.4 | -41.9 | 175.2 | 171 | 0 | 0 | 0 | 0 | 111.1 | L18 F19 F25 F26 | L18-V22 HydrophobicContact CD1-CG2 4.29Å; L18-V22 WeakPolarHBondContact O-CG2 3.25Å; L18-V22 PolarHBondContact O-N 2.87Å; F19-V22 PolarHBondContact O-N 3.35Å; V22-F25 PolarHBondContact O-N 3.35Å; V22-F26 VanDerWaalsContact O-CB 3.29Å; V22-F26 WeakPolarHBondContact O-CB 3.36Å; V22-F26 PolarHBondContact O-N 3.4Å |
| 23 | L | 96.4 | Very high | 93.6 | Very high | 71 Ų | 71 | 98.6 Ų | 98.6 | 37% | 0.372 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.3 | -45.5 | 176.7 | 179.6 | 61.5 | 0 | 0 | 0 | 111.7 | F19 L20 F26 L27 | F19-L23 HydrophobicContact CE1-CD2 4.35Å; F19-L23 VanDerWaalsContact O-CB 3.24Å; F19-L23 WeakPolarHBondContact O-CB 3.38Å; F19-L23 PolarHBondContact O-N 2.86Å; L20-L23 PolarHBondContact O-N 3.3Å; L23-F26 PolarHBondContact O-N 3.48Å; L23-L27 HydrophobicContact CD1-CD1 4.26Å; L23-L27 HydrophobicContact CD1-CG 4.38Å; L23-L27 HydrophobicContact CG-CD1 4.13Å; L23-L27 WeakPolarHBondContact O-CB 3.27Å; L23-L27 VanDerWaalsContact O-CG 3.27Å; L23-L27 WeakPolarHBondContact O-CG 3.34Å; L23-L27 PolarHBondContact O-N 2.88Å |
| 24 | V | 96.9 | Very high | 94.5 | Very high | 84 Ų | 84 | 100.6 Ų | 100.6 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.2 | -43.5 | 175.7 | 168.7 | 0 | 0 | 0 | 0 | 110.9 | L20 F26 L27 M28 | L20-V24 WeakPolarHBondContact O-CB 3.29Å; L20-V24 VanDerWaalsContact O-CG2 3.28Å; L20-V24 WeakPolarHBondContact O-CG2 3.44Å; L20-V24 PolarHBondContact O-N 2.89Å; V24-F26 VanDerWaalsContact C-N 3.34Å; V24-F26 PolarHBondContact O-N 3.39Å; V24-L27 PolarHBondContact O-N 3.46Å; V24-M28 HydrophobicContact CG1-CG 4.35Å; V24-M28 WeakPolarHBondContact O-CB 3.27Å; V24-M28 VanDerWaalsContact O-CG 3.27Å; V24-M28 WeakPolarHBondContact O-CG 3.29Å; V24-M28 PolarHBondContact O-N 3.39Å |
| 25 | F | 97.3 | Very high | 94.9 | Very high | 163 Ų | 163 | 102.6 Ų | 102.6 | 72% | 0.715 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.4 | -41.6 | 175.4 | -178.1 | -97.9 | 0 | 0 | 0 | 112 | L21 V22 M28 G29 | L21-F25 VanDerWaalsContact O-CB 3.3Å; L21-F25 WeakPolarHBondContact O-CB 3.31Å; L21-F25 PolarHBondContact O-N 2.89Å; V22-F25 PolarHBondContact O-N 3.35Å; F25-M28 PolarHBondContact O-N 3.42Å; F25-G29 PolarHBondContact O-N 3.49Å |
| 26 | F | 97.3 | Very high | 95.1 | Very high | 124 Ų | 124 | 100 Ų | 100 | 54% | 0.544 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.6 | -45.2 | 176.7 | -175.8 | -108.1 | 0 | 0 | 0 | 112.1 | V22 L23 V24 G29 L30 | V22-F26 VanDerWaalsContact O-CB 3.29Å; V22-F26 WeakPolarHBondContact O-CB 3.36Å; V22-F26 PolarHBondContact O-N 3.4Å; L23-F26 PolarHBondContact O-N 3.48Å; V24-F26 VanDerWaalsContact C-N 3.34Å; V24-F26 PolarHBondContact O-N 3.39Å; F26-G29 PolarHBondContact O-N 2.91Å; F26-L30 HydrophobicContact CD1-CD1 4Å; F26-L30 HydrophobicContact CD1-CG 4.45Å; F26-L30 HydrophobicContact CE1-CD1 3.46Å; F26-L30 VanDerWaalsContact CE1-CD1 3.46Å; F26-L30 HydrophobicContact CE1-CG 4.16Å; F26-L30 HydrophobicContact CE2-CD1 4.47Å; F26-L30 HydrophobicContact CE2-CG 4.39Å; F26-L30 HydrophobicContact CZ-CD1 3.74Å; F26-L30 HydrophobicContact CZ-CD2 4.34Å; F26-L30 HydrophobicContact CZ-CG 4.12Å; F26-L30 WeakPolarHBondContact O-CG 3.3Å; F26-L30 PolarHBondContact O-N 2.89Å |
| 27 | L | 96.8 | Very high | 95.1 | Very high | 95 Ų | 95 | 96.3 Ų | 96.3 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 175.1 | -71.3 | 169.5 | 0 | 0 | 0 | 111.6 | L23 V24 G29 L30 V31 | L23-L27 HydrophobicContact CD1-CD1 4.26Å; L23-L27 HydrophobicContact CD1-CG 4.38Å; L23-L27 HydrophobicContact CG-CD1 4.13Å; L23-L27 WeakPolarHBondContact O-CB 3.27Å; L23-L27 VanDerWaalsContact O-CG 3.27Å; L23-L27 WeakPolarHBondContact O-CG 3.34Å; L23-L27 PolarHBondContact O-N 2.88Å; V24-L27 PolarHBondContact O-N 3.46Å; L27-G29 VanDerWaalsContact C-N 3.34Å; L27-G29 PolarHBondContact O-N 3.48Å; L27-L30 PolarHBondContact O-N 2.85Å; L27-V31 WeakPolarHBondContact O-CB 3.3Å; L27-V31 VanDerWaalsContact O-CG2 3.3Å; L27-V31 WeakPolarHBondContact O-CG2 3.42Å; L27-V31 PolarHBondContact O-N 2.82Å |
| 28 | M | 96.6 | Very high | 95.3 | Very high | 127 Ų | 127 | 93.2 Ų | 93.2 | 63% | 0.626 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.7 | -39.3 | 174.7 | -73.9 | -62.5 | -63 | 0 | 0 | 112.3 | V24 F25 V31 G32 | V24-M28 HydrophobicContact CG1-CG 4.35Å; V24-M28 WeakPolarHBondContact O-CB 3.27Å; V24-M28 VanDerWaalsContact O-CG 3.27Å; V24-M28 WeakPolarHBondContact O-CG 3.29Å; V24-M28 PolarHBondContact O-N 3.39Å; F25-M28 PolarHBondContact O-N 3.42Å; M28-V31 PolarHBondContact O-N 2.85Å; M28-G32 PolarHBondContact O-N 3.27Å |
| 29 | G | 96.4 | Very high | 95.2 | Very high | 42 Ų | 42 | 91.2 Ų | 91.2 | 43% | 0.433 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.4 | -43.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F25 F26 L27 G32 F33 | F25-G29 PolarHBondContact O-N 3.49Å; F26-G29 PolarHBondContact O-N 2.91Å; L27-G29 VanDerWaalsContact C-N 3.34Å; L27-G29 PolarHBondContact O-N 3.48Å; G29-G32 PolarHBondContact O-N 3.49Å; G29-F33 PolarHBondContact O-N 3.49Å |
| 30 | L | 96.8 | Very high | 94.9 | Very high | 80 Ų | 80 | 92.3 Ų | 92.3 | 42% | 0.419 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.7 | -41.4 | 174.4 | -72.2 | -175.3 | 0 | 0 | 0 | 112.1 | F26 L27 G32 F33 M34 | F26-L30 HydrophobicContact CD1-CD1 4Å; F26-L30 HydrophobicContact CD1-CG 4.45Å; F26-L30 HydrophobicContact CE1-CD1 3.46Å; F26-L30 VanDerWaalsContact CE1-CD1 3.46Å; F26-L30 HydrophobicContact CE1-CG 4.16Å; F26-L30 HydrophobicContact CE2-CD1 4.47Å; F26-L30 HydrophobicContact CE2-CG 4.39Å; F26-L30 HydrophobicContact CZ-CD1 3.74Å; F26-L30 HydrophobicContact CZ-CD2 4.34Å; F26-L30 HydrophobicContact CZ-CG 4.12Å; F26-L30 WeakPolarHBondContact O-CG 3.3Å; F26-L30 PolarHBondContact O-N 2.89Å; L27-L30 PolarHBondContact O-N 2.85Å; L30-G32 VanDerWaalsContact C-N 3.34Å; L30-F33 PolarHBondContact O-N 3.26Å; L30-M34 WeakPolarHBondContact O-CB 3.09Å; L30-M34 WeakPolarHBondContact O-CG 3.44Å; L30-M34 PolarHBondContact O-N 3.3Å |
| 31 | V | 96.9 | Very high | 94.7 | Very high | 79 Ų | 79 | 95.6 Ų | 95.6 | 48% | 0.479 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.6 | -43.5 | 173.1 | 167.7 | 0 | 0 | 0 | 0 | 110.5 | L27 M28 F33 M34 I35 | L27-V31 WeakPolarHBondContact O-CB 3.3Å; L27-V31 VanDerWaalsContact O-CG2 3.3Å; L27-V31 WeakPolarHBondContact O-CG2 3.42Å; L27-V31 PolarHBondContact O-N 2.82Å; M28-V31 PolarHBondContact O-N 2.85Å; V31-F33 PolarHBondContact O-N 3.34Å; V31-M34 PolarHBondContact O-N 2.84Å; V31-I35 HydrophobicContact CG1-CD1 3.76Å; V31-I35 HydrophobicContact CG1-CG1 4.49Å; V31-I35 WeakPolarHBondContact O-CB 3.26Å; V31-I35 VanDerWaalsContact O-CG1 3.26Å; V31-I35 WeakPolarHBondContact O-CG1 3.37Å; V31-I35 PolarHBondContact O-N 3.29Å |
| 32 | G | 95 | Very high | 94.2 | Very high | 30 Ų | 30 | 97.1 Ų | 97.1 | 31% | 0.309 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -57.3 | -47.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | M28 G29 L30 I35 C36 | M28-G32 PolarHBondContact O-N 3.27Å; G29-G32 PolarHBondContact O-N 3.49Å; L30-G32 VanDerWaalsContact C-N 3.34Å; G32-I35 PolarHBondContact O-N 3.49Å; G32-C36 WeakPolarHBondContact O-CB 3.44Å; G32-C36 PolarHBondContact O-N 3.4Å; G32-C36 PolarHBondContact O-SG 2.86Å |
| 33 | F | 94.2 | Very high | 93.7 | Very high | 134 Ų | 134 | 96.3 Ų | 96.3 | 59% | 0.588 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.6 | -42.6 | 175.8 | 178.5 | -98.9 | 0 | 0 | 0 | 112.7 | G29 L30 V31 I35 C36 H37 | G29-F33 PolarHBondContact O-N 3.49Å; L30-F33 PolarHBondContact O-N 3.26Å; V31-F33 PolarHBondContact O-N 3.34Å; F33-I35 PolarHBondContact O-N 2.87Å; F33-C36 PolarHBondContact O-N 2.91Å; F33-H37 WeakPolarHBondContact O-CB 3.37Å; F33-H37 PolarHBondContact O-N 2.86Å |
| 34 | M | 94.4 | Very high | 93.3 | Very high | 113 Ų | 113 | 99.9 Ų | 99.9 | 56% | 0.557 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.8 | -45.4 | 175.7 | -67.8 | -109.1 | 69.2 | 0 | 0 | 111.3 | L30 V31 H37 V38 | L30-M34 WeakPolarHBondContact O-CB 3.09Å; L30-M34 WeakPolarHBondContact O-CG 3.44Å; L30-M34 PolarHBondContact O-N 3.3Å; V31-M34 PolarHBondContact O-N 2.84Å; M34-H37 PolarHBondContact O-N 3.33Å; M34-V38 WeakPolarHBondContact O-CG2 3.36Å; M34-V38 PolarHBondContact O-N 3.18Å |
| 35 | I | 93.6 | Very high | 92.6 | Very high | 93 Ų | 93 | 100.9 Ų | 100.9 | 48% | 0.477 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.7 | -52 | 175.4 | -68.8 | 164.5 | 0 | 0 | 0 | 110 | V31 G32 F33 H37 V38 L39 | V31-I35 HydrophobicContact CG1-CD1 3.76Å; V31-I35 HydrophobicContact CG1-CG1 4.49Å; V31-I35 WeakPolarHBondContact O-CB 3.26Å; V31-I35 VanDerWaalsContact O-CG1 3.26Å; V31-I35 WeakPolarHBondContact O-CG1 3.37Å; V31-I35 PolarHBondContact O-N 3.29Å; G32-I35 PolarHBondContact O-N 3.49Å; F33-I35 PolarHBondContact O-N 2.87Å; I35-H37 VanDerWaalsContact C-N 3.27Å; I35-H37 PolarHBondContact O-N 3.27Å; I35-V38 PolarHBondContact O-N 2.99Å; I35-L39 HydrophobicContact CG2-CD1 3.74Å; I35-L39 HydrophobicContact CG2-CG 4.21Å; I35-L39 WeakPolarHBondContact O-CB 3.49Å; I35-L39 VanDerWaalsContact O-CG 3.28Å; I35-L39 WeakPolarHBondContact O-CG 3.4Å; I35-L39 PolarHBondContact O-N 3.46Å |
| 36 | C | 92.1 | Very high | 91.6 | Very high | 54 Ų | 54 | 96.3 Ų | 96.3 | 37% | 0.365 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -56.8 | -38.2 | 177.5 | -72.6 | 0 | 0 | 0 | 0 | 112.8 | G32 F33 K40 C46 | G32-C36 WeakPolarHBondContact O-CB 3.44Å; G32-C36 PolarHBondContact O-N 3.4Å; G32-C36 PolarHBondContact O-SG 2.86Å; F33-C36 PolarHBondContact O-N 2.91Å; C36-K40 WeakPolarHBondContact O-CB 3.33Å; C36-K40 PolarHBondContact O-N 3.39Å; C36-C46 VanDerWaalsContact SG-SG 3.63Å |
| 37 | H | 92.1 | Very high | 90.8 | Very high | 68 Ų | 68 | 97.2 Ų | 97.2 | 32% | 0.315 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -71.4 | -40 | 177.6 | 179 | -138.2 | 0 | 0 | 0 | 112.7 | F33 M34 I35 L39 K40 K41 | F33-H37 WeakPolarHBondContact O-CB 3.37Å; F33-H37 PolarHBondContact O-N 2.86Å; M34-H37 PolarHBondContact O-N 3.33Å; I35-H37 VanDerWaalsContact C-N 3.27Å; I35-H37 PolarHBondContact O-N 3.27Å; H37-L39 VanDerWaalsContact C-N 3.35Å; H37-K40 PolarHBondContact O-N 2.83Å; H37-K41 VanDerWaalsContact NE2-CE 3.33Å; H37-K41 WeakPolarHBondContact NE2-CE 3.33Å; H37-K41 WeakPolarHBondContact O-CB 3.45Å; H37-K41 PolarHBondContact O-N 3.27Å |
| 38 | V | 94.3 | Very high | 89.1 | Confident | 71 Ų | 71 | 99.5 Ų | 99.5 | 43% | 0.43 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.9 | -37.1 | 173.5 | 170.5 | 0 | 0 | 0 | 0 | 111.3 | M34 I35 K42 | M34-V38 WeakPolarHBondContact O-CG2 3.36Å; M34-V38 PolarHBondContact O-N 3.18Å; I35-V38 PolarHBondContact O-N 2.99Å; V38-K42 HydrophobicContact CG1-CD 4.34Å; V38-K42 WeakPolarHBondContact O-CG 3.28Å; V38-K42 PolarHBondContact O-N 2.96Å |
| 39 | L | 91.4 | Very high | 86.7 | Confident | 60 Ų | 60 | 98.2 Ų | 98.2 | 31% | 0.314 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.7 | -47.5 | 173.5 | -72.9 | 178.4 | 0 | 0 | 0 | 111.2 | I35 H37 K41 K42 G43 Y44 | I35-L39 HydrophobicContact CG2-CD1 3.74Å; I35-L39 HydrophobicContact CG2-CG 4.21Å; I35-L39 WeakPolarHBondContact O-CB 3.49Å; I35-L39 VanDerWaalsContact O-CG 3.28Å; I35-L39 WeakPolarHBondContact O-CG 3.4Å; I35-L39 PolarHBondContact O-N 3.46Å; H37-L39 VanDerWaalsContact C-N 3.35Å; L39-K41 VanDerWaalsContact C-N 3.34Å; L39-K41 PolarHBondContact O-N 2.85Å; L39-K42 CarbonylContact O-C 3.53Å; L39-K42 WeakPolarHBondContact O-CA 3.45Å; L39-K42 PolarHBondContact O-N 3.34Å; L39-G43 PolarHBondContact O-N 2.98Å; L39-Y44 CarbonylContact C-O 3.55Å; L39-Y44 HydrophobicContact CB-CD2 4.39Å; L39-Y44 HydrophobicContact CD2-CD2 3.61Å; L39-Y44 HydrophobicContact CD2-CE2 4.14Å; L39-Y44 HydrophobicContact CD2-CG 4.08Å; L39-Y44 PolarHBondContact O-N 3.27Å |
| 40 | K | 88.7 | Confident | 84.4 | Confident | 157 Ų | 157 | 107.3 Ų | 107.3 | 68% | 0.683 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -57.7 | -44.3 | 175.1 | -163.9 | -179.2 | 87.4 | 155.5 | 0 | 111.7 | C36 H37 K42 G43 | C36-K40 WeakPolarHBondContact O-CB 3.33Å; C36-K40 PolarHBondContact O-N 3.39Å; H37-K40 PolarHBondContact O-N 2.83Å; K40-K42 PolarHBondContact O-N 3.11Å; K40-G43 PolarHBondContact O-N 2.93Å |
| 41 | K | 89 | Confident | 82.1 | Confident | 161 Ų | 161 | 107.4 Ų | 107.4 | 70% | 0.7 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.1 | -16.6 | 175.7 | -81.9 | -172.5 | 167.6 | -175.8 | 0 | 114.4 | H37 L39 | H37-K41 VanDerWaalsContact NE2-CE 3.33Å; H37-K41 WeakPolarHBondContact NE2-CE 3.33Å; H37-K41 WeakPolarHBondContact O-CB 3.45Å; H37-K41 PolarHBondContact O-N 3.27Å; L39-K41 VanDerWaalsContact C-N 3.34Å; L39-K41 PolarHBondContact O-N 2.85Å |
| 42 | K | 86.3 | Confident | 79.3 | Confident | 146 Ų | 146 | 108.6 Ų | 108.6 | 64% | 0.635 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.4 | 8.1 | 174.4 | -69.8 | 174.4 | 179 | -177.8 | 0 | 113.1 | V38 L39 K40 Y44 | V38-K42 HydrophobicContact CG1-CD 4.34Å; V38-K42 WeakPolarHBondContact O-CG 3.28Å; V38-K42 PolarHBondContact O-N 2.96Å; L39-K42 CarbonylContact O-C 3.53Å; L39-K42 WeakPolarHBondContact O-CA 3.45Å; L39-K42 PolarHBondContact O-N 3.34Å; K40-K42 PolarHBondContact O-N 3.11Å; K42-Y44 VanDerWaalsContact C-N 3.35Å; K42-Y44 HydrophobicContact CB-CD2 3.65Å; K42-Y44 HydrophobicContact CB-CE2 3.67Å; K42-Y44 HydrophobicContact CD-CE2 4.18Å |
| 43 | G | 85.4 | Confident | 76.3 | Confident | 71 Ų | 71 | 116.2 Ų | 116.2 | 73% | 0.732 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 81.3 | 4.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | L39 K40 | L39-G43 PolarHBondContact O-N 2.98Å; K40-G43 PolarHBondContact O-N 2.93Å |
| 44 | Y | 87.6 | Confident | 74.1 | Confident | 145 Ų | 145 | 115.2 Ų | 115.2 | 57% | 0.569 | 61% | 0.61 | S | S | * | * | trans | -80.4 | 129.9 | 173 | -57.4 | -81.4 | 0 | 0 | 0 | 110.3 | L39 K42 | L39-Y44 CarbonylContact C-O 3.55Å; L39-Y44 HydrophobicContact CB-CD2 4.39Å; L39-Y44 HydrophobicContact CD2-CD2 3.61Å; L39-Y44 HydrophobicContact CD2-CE2 4.14Å; L39-Y44 HydrophobicContact CD2-CG 4.08Å; L39-Y44 PolarHBondContact O-N 3.27Å; K42-Y44 VanDerWaalsContact C-N 3.35Å; K42-Y44 HydrophobicContact CB-CD2 3.65Å; K42-Y44 HydrophobicContact CB-CE2 3.67Å; K42-Y44 HydrophobicContact CD-CE2 4.18Å | ||
| 45 | R | 82.3 | Confident | 71.8 | Confident | 106 Ų | 106 | 117 Ų | 117 | 40% | 0.4 | 62% | 0.622 | S | S | . | * | trans | -91.7 | 130.1 | 168.2 | -87.2 | -174 | 175.2 | 108.7 | 2.5 | 111.9 | R47 E63 D65 | R45-R47 VanDerWaalsContact C-N 3.28Å; R45-R47 PolarHBondContact O-N 3.19Å; R45-E63 VanDerWaalsContact CD-OE1 3.24Å; R45-E63 WeakPolarHBondContact CD-OE1 3.35Å; R45-E63 WeakPolarHBondContact CD-OE2 3.4Å; R45-E63 IonicContact CZ-OE1 3.88Å; R45-E63 IonicContact NE-OE1 3.05Å; R45-E63 PolarHBondContact NH1-O 3.02Å; R45-E63 IonicContact NH1-OE1 3.53Å; R45-E63 PolarHBondContact NH1-OE1 3.33Å; R45-E63 PolarHBondContact NH2-O 2.96Å; R45-D65 IonicContact CZ-OD2 3.93Å; R45-D65 VanDerWaalsContact CZ-OD2 3.23Å; R45-D65 IonicContact NE-OD2 3.6Å; R45-D65 PolarHBondContact NE-OD2 3.25Å; R45-D65 IonicContact NH2-OD2 3.19Å; R45-D65 PolarHBondContact NH2-OD2 3.01Å | ||
| 46 | C | 77.4 | Confident | 68.9 | Low | 66 Ų | 66 | 119.9 Ų | 119.9 | 45% | 0.446 | 64% | 0.638 | S | S | . | * | trans | -79.9 | 69.5 | 178.6 | -58.4 | 0 | 0 | 0 | 0 | 111.3 | C36 T48 | C36-C46 VanDerWaalsContact SG-SG 3.63Å; C46-T48 PolarHBondContact O-N 3.21Å | ||
| 47 | R | 80.3 | Confident | 66.9 | Low | 143 Ų | 143 | 122.3 Ų | 122.3 | 54% | 0.54 | 66% | 0.662 | S | S | . | * | trans | -68.2 | 120.3 | 171.8 | -72.8 | -171.9 | 176.5 | -172.7 | -0.2 | 109.6 | R45 S49 E63 | R45-R47 VanDerWaalsContact C-N 3.28Å; R45-R47 PolarHBondContact O-N 3.19Å; R47-S49 PolarHBondContact O-N 3.27Å; R47-E63 IonicContact CZ-OE2 3.46Å; R47-E63 VanDerWaalsContact CZ-OE2 3.27Å; R47-E63 IonicContact NE-OE2 2.75Å; R47-E63 PolarHBondContact NE-OE2 2.97Å; R47-E63 IonicContact NH2-OE1 3.12Å; R47-E63 IonicContact NH2-OE2 3.31Å; R47-E63 PolarHBondContact NH2-OE2 2.68Å | ||
| 48 | T | 59.8 | Low | 64.8 | Low | 144 Ų | 144 | 126.9 Ų | 126.9 | 88% | 0.883 | 68% | 0.684 | S | S | * | * | trans | -79.4 | 60.5 | 177.4 | 52.2 | 0 | 0 | 0 | 0 | 111.4 | C46 R50 | C46-T48 PolarHBondContact O-N 3.21Å; T48-R50 PolarHBondContact O-N 3.04Å | ||
| 49 | S | 46.7 | Very low | 62.6 | Low | 100 Ų | 100 | 130.9 Ų | 130.9 | 70% | 0.699 | 70% | 0.702 | S | S | * | * | trans | -65.7 | 118.6 | 178.7 | 52.3 | 0 | 0 | 0 | 0 | 110.9 | R47 G51 | R47-S49 PolarHBondContact O-N 3.27Å; S49-G51 PolarHBondContact O-N 2.97Å | ||
| 50 | R | 48.5 | Very low | 60.2 | Low | 233 Ų | 233 | 134.9 Ų | 134.9 | 88% | 0.879 | 72% | 0.719 | S | S | * | * | trans | -58.8 | 118.9 | 155.2 | -86.2 | 173.4 | 54.5 | 165.4 | -3.7 | 107.2 | T48 S52 | T48-R50 PolarHBondContact O-N 3.04Å; R50-S52 PolarHBondContact O-N 3.2Å | ||
| 51 | G | 48.8 | Very low | 58.1 | Low | 82 Ų | 82 | 132.5 Ų | 132.5 | 85% | 0.845 | 72% | 0.72 | S | S | * | * | trans | -67.2 | 113.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S49 | S49-G51 PolarHBondContact O-N 2.97Š| ||
| 52 | S | 37.4 | Very low | 56.3 | Low | 104 Ų | 104 | 130 Ų | 130 | 73% | 0.727 | 72% | 0.72 | S | S | * | * | trans | -153.8 | 115.4 | 162.5 | 55.6 | 0 | 0 | 0 | 0 | 109.6 | R50 | R50-S52 PolarHBondContact O-N 3.2Š| ||
| 53 | E | 32.5 | Very low | 54.4 | Low | 189 Ų | 189 | 126.2 Ų | 126.2 | 88% | 0.883 | 71% | 0.705 | S | S | * | * | trans | 73.5 | 138.2 | 170.2 | -131.4 | 152.6 | 119.9 | 0 | 0 | 118.5 | ||||
| 54 | P | 48.4 | Very low | 52.6 | Low | 114 Ų | 114 | 127.9 Ų | 127.9 | 74% | 0.74 | 70% | 0.697 | S | S | * | * | trans | -92.1 | 176.6 | 163.3 | 38.8 | -33.9 | 0 | 0 | 0 | 112.1 | ||||
| 55 | D | 45.1 | Very low | 51 | Low | 150 Ų | 150 | 126 Ų | 126 | 80% | 0.802 | 70% | 0.697 | S | S | * | * | trans | 61.8 | 148.1 | -159.8 | -78.6 | -15.6 | 0 | 0 | 0 | 113.2 | ||||
| 56 | D | 33.2 | Very low | 49.5 | Very low | 153 Ų | 153 | 127.8 Ų | 127.8 | 82% | 0.818 | 71% | 0.714 | S | S | * | * | cis | -106.8 | 147.7 | 3.1 | -80.1 | -73.8 | 0 | 0 | 0 | 113.4 | Q58 | D56-Q58 PolarHBondContact O-N 3.38Š| ||
| 57 | A | 49.9 | Very low | 48.4 | Very low | 105 Ų | 105 | 129.4 Ų | 129.4 | 87% | 0.868 | 72% | 0.716 | S | S | * | * | trans | -88.7 | 63.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 58 | Q | 47.6 | Very low | 47.3 | Very low | 165 Ų | 165 | 127.1 Ų | 127.1 | 77% | 0.771 | 72% | 0.715 | S | S | * | * | trans | -145 | 117.5 | 175 | -160 | 160.7 | -58.6 | 0 | 0 | 116.1 | D56 | D56-Q58 PolarHBondContact O-N 3.38Š| ||
| 59 | L | 49.2 | Very low | 47.2 | Very low | 155 Ų | 155 | 128 Ų | 128 | 81% | 0.812 | 71% | 0.709 | S | S | * | * | trans | 55.7 | 95.7 | 158.8 | -61 | 170.6 | 0 | 0 | 0 | 118.7 | ||||
| 60 | Q | 41.2 | Very low | 48.4 | Very low | 143 Ų | 143 | 126 Ų | 126 | 67% | 0.668 | 69% | 0.69 | S | S | * | * | trans | -128.3 | 136.8 | 143 | -69.6 | -171.5 | 2.6 | 0 | 0 | 109.2 | ||||
| 61 | P | 44.4 | Very low | 49.8 | Very low | 107 Ų | 107 | 118 Ų | 118 | 70% | 0.695 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 155.6 | 168.9 | -20 | 32.9 | 0 | 0 | 0 | 111.5 | E63 | P61-E63 PolarHBondContact O-N 2.84Š|
| 62 | P | 50.2 | Low | 51.5 | Low | 109 Ų | 109 | 118.6 Ų | 118.6 | 71% | 0.708 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 127.5 | 166.7 | 28.7 | -33.6 | 0 | 0 | 0 | 108.3 | ||
| 63 | E | 46.1 | Very low | 53.6 | Low | 67 Ų | 67 | 118.5 Ų | 118.5 | 31% | 0.313 | 64% | 0.642 | S | S | . | * | P | Polyproline II helix | trans | -75.1 | 144.1 | -171.9 | 64.7 | -82.6 | 63.6 | 0 | 0 | 112.5 | R45 R47 P61 D65 | R45-E63 VanDerWaalsContact CD-OE1 3.24Å; R45-E63 WeakPolarHBondContact CD-OE1 3.35Å; R45-E63 WeakPolarHBondContact CD-OE2 3.4Å; R45-E63 IonicContact CZ-OE1 3.88Å; R45-E63 IonicContact NE-OE1 3.05Å; R45-E63 PolarHBondContact NH1-O 3.02Å; R45-E63 IonicContact NH1-OE1 3.53Å; R45-E63 PolarHBondContact NH1-OE1 3.33Å; R45-E63 PolarHBondContact NH2-O 2.96Å; R47-E63 IonicContact CZ-OE2 3.46Å; R47-E63 VanDerWaalsContact CZ-OE2 3.27Å; R47-E63 IonicContact NE-OE2 2.75Å; R47-E63 PolarHBondContact NE-OE2 2.97Å; R47-E63 IonicContact NH2-OE1 3.12Å; R47-E63 IonicContact NH2-OE2 3.31Å; R47-E63 PolarHBondContact NH2-OE2 2.68Å; P61-E63 PolarHBondContact O-N 2.84Å; E63-D65 PolarHBondContact O-N 3.33Å |
| 64 | D | 48.5 | Very low | 55.9 | Low | 105 Ų | 105 | 117.1 Ų | 117.1 | 56% | 0.561 | 63% | 0.629 | S | S | * | * | trans | -96 | 93.7 | -176.5 | -67.5 | -71.3 | 0 | 0 | 0 | 111.6 | D66 M67 | D64-D66 PolarHBondContact O-N 3.23Å; D64-M67 HydrophobicContact CB-CB 3.48Å; D64-M67 VanDerWaalsContact CB-CB 3.48Å; D64-M67 HydrophobicContact CB-CG 3.5Å; D64-M67 VanDerWaalsContact CB-CG 3.5Å | ||
| 65 | D | 52.9 | Low | 57.7 | Low | 107 Ų | 107 | 116 Ų | 116 | 57% | 0.572 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -11.5 | 171.5 | -73.7 | -52.1 | 0 | 0 | 0 | 112.5 | R45 E63 N68 | R45-D65 IonicContact CZ-OD2 3.93Å; R45-D65 VanDerWaalsContact CZ-OD2 3.23Å; R45-D65 IonicContact NE-OD2 3.6Å; R45-D65 PolarHBondContact NE-OD2 3.25Å; R45-D65 IonicContact NH2-OD2 3.19Å; R45-D65 PolarHBondContact NH2-OD2 3.01Å; E63-D65 PolarHBondContact O-N 3.33Å; D65-N68 VanDerWaalsContact C-ND2 3.27Å; D65-N68 PolarHBondContact O-ND2 2.7Å |
| 66 | D | 52.1 | Low | 59.8 | Low | 143 Ų | 143 | 112.3 Ų | 112.3 | 77% | 0.765 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -31.9 | 174.3 | -83.1 | -73.1 | 0 | 0 | 0 | 113.6 | D64 N68 E69 | D64-D66 PolarHBondContact O-N 3.23Å; D66-N68 PolarHBondContact O-N 2.71Å; D66-E69 PolarHBondContact O-N 2.77Å |
| 67 | M | 54.3 | Low | 62.1 | Low | 100 Ų | 100 | 109.1 Ų | 109.1 | 49% | 0.493 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -69 | -15.9 | -177 | -71.1 | -75.3 | 148.1 | 0 | 0 | 113.7 | D64 T71 | D64-M67 HydrophobicContact CB-CB 3.48Å; D64-M67 VanDerWaalsContact CB-CB 3.48Å; D64-M67 HydrophobicContact CB-CG 3.5Å; D64-M67 VanDerWaalsContact CB-CG 3.5Å; M67-T71 WeakPolarHBondContact O-CB 3.24Å; M67-T71 PolarHBondContact O-N 3.49Å; M67-T71 PolarHBondContact O-OG1 2.74Å |
| 68 | N | 55.6 | Low | 63.4 | Low | 95 Ų | 95 | 108.2 Ų | 108.2 | 51% | 0.508 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -73 | -29.3 | -179.6 | 66.5 | 91.4 | 0 | 0 | 0 | 112.6 | D65 D66 T71 V72 | D65-N68 VanDerWaalsContact C-ND2 3.27Å; D65-N68 PolarHBondContact O-ND2 2.7Å; D66-N68 PolarHBondContact O-N 2.71Å; N68-T71 PolarHBondContact O-N 3.37Å; N68-V72 WeakPolarHBondContact O-CG2 3.43Å; N68-V72 PolarHBondContact O-N 2.8Å |
| 69 | E | 59.5 | Low | 65 | Low | 161 Ų | 161 | 104.5 Ų | 104.5 | 75% | 0.752 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -68.8 | -52.9 | 173.8 | -169.2 | 167 | 107.3 | 0 | 0 | 110.7 | D66 T71 V72 E73 | D66-E69 PolarHBondContact O-N 2.77Å; E69-T71 PolarHBondContact O-N 3.17Å; E69-V72 PolarHBondContact O-N 3.32Å; E69-E73 WeakPolarHBondContact O-CB 3.3Å; E69-E73 PolarHBondContact O-N 3Å |
| 70 | D | 70.1 | Confident | 66.6 | Low | 58 Ų | 58 | 102 Ų | 102 | 31% | 0.31 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.4 | -28.9 | 172.3 | -179.7 | 57.8 | 0 | 0 | 0 | 111.7 | R74 R77 | D70-R74 WeakPolarHBondContact O-CA 3.49Å; D70-R74 WeakPolarHBondContact O-CB 3.17Å; D70-R74 PolarHBondContact O-N 3.47Å; D70-R77 IonicContact OD1-CZ 3.92Å; D70-R77 IonicContact OD1-NH1 2.87Å; D70-R77 PolarHBondContact OD1-NH1 3.4Å; D70-R77 IonicContact OD1-NH2 3.23Å; D70-R77 PolarHBondContact OD1-NH2 2.89Å |
| 71 | T | 79.4 | Confident | 68.2 | Low | 67 Ų | 67 | 102.5 Ų | 102.5 | 41% | 0.411 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.8 | -45.4 | 174.3 | -65.2 | 0 | 0 | 0 | 0 | 111.7 | M67 N68 E69 I75 | M67-T71 WeakPolarHBondContact O-CB 3.24Å; M67-T71 PolarHBondContact O-N 3.49Å; M67-T71 PolarHBondContact O-OG1 2.74Å; N68-T71 PolarHBondContact O-N 3.37Å; E69-T71 PolarHBondContact O-N 3.17Å; T71-I75 HydrophobicContact CG2-CD1 3.82Å; T71-I75 WeakPolarHBondContact O-CB 2.88Å; T71-I75 WeakPolarHBondContact O-CD1 3.48Å; T71-I75 WeakPolarHBondContact O-CG1 3.43Å; T71-I75 PolarHBondContact O-N 3.4Å |
| 72 | V | 84.6 | Confident | 70 | Confident | 93 Ų | 93 | 101 Ų | 101 | 56% | 0.564 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.9 | -46.5 | 175.1 | 172.4 | 0 | 0 | 0 | 0 | 110.2 | N68 E69 R74 I75 V76 | N68-V72 WeakPolarHBondContact O-CG2 3.43Å; N68-V72 PolarHBondContact O-N 2.8Å; E69-V72 PolarHBondContact O-N 3.32Å; V72-R74 PolarHBondContact O-N 2.88Å; V72-I75 PolarHBondContact O-N 2.96Å; V72-V76 WeakPolarHBondContact O-CG2 3.5Å; V72-V76 PolarHBondContact O-N 2.9Å |
| 73 | E | 81.4 | Confident | 71.4 | Confident | 102 Ų | 102 | 103.2 Ų | 103.2 | 48% | 0.477 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.1 | -42.1 | 179.7 | -152 | -143.7 | 130.1 | 0 | 0 | 111.4 | E69 V76 R77 | E69-E73 WeakPolarHBondContact O-CB 3.3Å; E69-E73 PolarHBondContact O-N 3Å; E73-V76 CarbonylContact O-C 3.59Å; E73-V76 PolarHBondContact O-N 2.92Å; E73-R77 WeakPolarHBondContact O-CB 3.44Å; E73-R77 VanDerWaalsContact O-CG 3.3Å; E73-R77 WeakPolarHBondContact O-CG 3.3Å; E73-R77 PolarHBondContact O-N 2.77Å; E73-R77 IonicContact OE1-CZ 3.47Å; E73-R77 VanDerWaalsContact OE1-CZ 3.31Å; E73-R77 IonicContact OE1-NE 2.97Å; E73-R77 PolarHBondContact OE1-NE 2.74Å; E73-R77 IonicContact OE1-NH2 3.65Å; E73-R77 PolarHBondContact OE1-NH2 2.73Å; E73-R77 VanDerWaalsContact OE1-NH2 3.12Å; E73-R77 IonicContact OE2-CZ 2.72Å; E73-R77 IonicContact OE2-NE 2.84Å; E73-R77 IonicContact OE2-NH2 3.29Å; E73-R77 PolarHBondContact OE2-NH2 3.02Å |
| 74 | R | 79.6 | Confident | 72.9 | Confident | 161 Ų | 161 | 103 Ų | 103 | 61% | 0.608 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.7 | -34.4 | 176.2 | -177.3 | 174.9 | 175.3 | 175 | -3.2 | 112.9 | D70 V72 C78 | D70-R74 WeakPolarHBondContact O-CA 3.49Å; D70-R74 WeakPolarHBondContact O-CB 3.17Å; D70-R74 PolarHBondContact O-N 3.47Å; V72-R74 PolarHBondContact O-N 2.88Å; R74-C78 WeakPolarHBondContact O-CB 3.18Å; R74-C78 PolarHBondContact O-N 2.65Å |
| 75 | I | 87 | Confident | 74.2 | Confident | 91 Ų | 91 | 100.9 Ų | 100.9 | 47% | 0.467 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.8 | -45.9 | 169.6 | -74.1 | 166.2 | 0 | 0 | 0 | 109.8 | T71 V72 C78 I79 | T71-I75 HydrophobicContact CG2-CD1 3.82Å; T71-I75 WeakPolarHBondContact O-CB 2.88Å; T71-I75 WeakPolarHBondContact O-CD1 3.48Å; T71-I75 WeakPolarHBondContact O-CG1 3.43Å; T71-I75 PolarHBondContact O-N 3.4Å; V72-I75 PolarHBondContact O-N 2.96Å; I75-C78 CarbonylContact O-C 3.49Å; I75-C78 PolarHBondContact O-N 2.82Å; I75-I79 HydrophobicContact CG2-CD1 3.67Å; I75-I79 HydrophobicContact CG2-CG1 4.38Å; I75-I79 WeakPolarHBondContact O-CB 3.35Å; I75-I79 VanDerWaalsContact O-CG1 3.27Å; I75-I79 WeakPolarHBondContact O-CG1 3.37Å; I75-I79 PolarHBondContact O-N 3.24Å |
| 76 | V | 88.3 | Confident | 75.4 | Confident | 71 Ų | 71 | 97.9 Ų | 97.9 | 43% | 0.43 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 177.2 | 170.3 | 0 | 0 | 0 | 0 | 111.5 | V72 E73 C78 I79 I80 | V72-V76 WeakPolarHBondContact O-CG2 3.5Å; V72-V76 PolarHBondContact O-N 2.9Å; E73-V76 CarbonylContact O-C 3.59Å; E73-V76 PolarHBondContact O-N 2.92Å; V76-C78 VanDerWaalsContact C-N 3.31Å; V76-C78 PolarHBondContact O-N 3.27Å; V76-I79 PolarHBondContact O-N 3.04Å; V76-I80 HydrophobicContact CG1-CD1 3.66Å; V76-I80 HydrophobicContact CG1-CG1 4.46Å; V76-I80 WeakPolarHBondContact O-CG1 3.43Å; V76-I80 PolarHBondContact O-N 3.4Å |
| 77 | R | 82 | Confident | 76.6 | Confident | 87 Ų | 87 | 97.1 Ų | 97.1 | 33% | 0.328 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -53.4 | -48.6 | 171.5 | -71.1 | -177.6 | -131.4 | 127.7 | -0.8 | 110.5 | D70 E73 I79 I80 Q81 | D70-R77 IonicContact OD1-CZ 3.92Å; D70-R77 IonicContact OD1-NH1 2.87Å; D70-R77 PolarHBondContact OD1-NH1 3.4Å; D70-R77 IonicContact OD1-NH2 3.23Å; D70-R77 PolarHBondContact OD1-NH2 2.89Å; E73-R77 WeakPolarHBondContact O-CB 3.44Å; E73-R77 VanDerWaalsContact O-CG 3.3Å; E73-R77 WeakPolarHBondContact O-CG 3.3Å; E73-R77 PolarHBondContact O-N 2.77Å; E73-R77 IonicContact OE1-CZ 3.47Å; E73-R77 VanDerWaalsContact OE1-CZ 3.31Å; E73-R77 IonicContact OE1-NE 2.97Å; E73-R77 PolarHBondContact OE1-NE 2.74Å; E73-R77 IonicContact OE1-NH2 3.65Å; E73-R77 PolarHBondContact OE1-NH2 2.73Å; E73-R77 VanDerWaalsContact OE1-NH2 3.12Å; E73-R77 IonicContact OE2-CZ 2.72Å; E73-R77 IonicContact OE2-NE 2.84Å; E73-R77 IonicContact OE2-NH2 3.29Å; E73-R77 PolarHBondContact OE2-NH2 3.02Å; R77-I79 PolarHBondContact O-N 2.98Å; R77-I80 PolarHBondContact O-N 3.43Å; R77-Q81 WeakPolarHBondContact O-CB 3.48Å; R77-Q81 WeakPolarHBondContact O-CG 3.46Å; R77-Q81 PolarHBondContact O-N 3.2Å |
| 78 | C | 77.8 | Confident | 77.7 | Confident | 85 Ų | 85 | 94.4 Ų | 94.4 | 57% | 0.574 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -68.4 | -29.6 | -179.7 | -167.2 | 0 | 0 | 0 | 0 | 113.7 | R74 I75 V76 N82 | R74-C78 WeakPolarHBondContact O-CB 3.18Å; R74-C78 PolarHBondContact O-N 2.65Å; I75-C78 CarbonylContact O-C 3.49Å; I75-C78 PolarHBondContact O-N 2.82Å; V76-C78 VanDerWaalsContact C-N 3.31Å; V76-C78 PolarHBondContact O-N 3.27Å; C78-N82 WeakPolarHBondContact O-CB 3.46Å; C78-N82 PolarHBondContact O-N 3.19Å |
| 79 | I | 81.4 | Confident | 78.7 | Confident | 88 Ų | 88 | 93.4 Ų | 93.4 | 45% | 0.451 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -71.9 | -44.2 | 174.1 | -73.7 | 167.1 | 0 | 0 | 0 | 110.4 | I75 V76 R77 N85 | I75-I79 HydrophobicContact CG2-CD1 3.67Å; I75-I79 HydrophobicContact CG2-CG1 4.38Å; I75-I79 WeakPolarHBondContact O-CB 3.35Å; I75-I79 VanDerWaalsContact O-CG1 3.27Å; I75-I79 WeakPolarHBondContact O-CG1 3.37Å; I75-I79 PolarHBondContact O-N 3.24Å; V76-I79 PolarHBondContact O-N 3.04Å; R77-I79 PolarHBondContact O-N 2.98Å; I79-N85 VanDerWaalsContact O-CB 3.25Å; I79-N85 WeakPolarHBondContact O-CB 3.16Å; I79-N85 PolarHBondContact O-ND2 2.75Å |
| 80 | I | 81.1 | Confident | 79.3 | Confident | 101 Ų | 101 | 93.1 Ų | 93.1 | 52% | 0.518 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -73.8 | -35.3 | -178.3 | -65.3 | 169.1 | 0 | 0 | 0 | 111.6 | V76 R77 N82 | V76-I80 HydrophobicContact CG1-CD1 3.66Å; V76-I80 HydrophobicContact CG1-CG1 4.46Å; V76-I80 WeakPolarHBondContact O-CG1 3.43Å; V76-I80 PolarHBondContact O-N 3.4Å; R77-I80 PolarHBondContact O-N 3.43Å; I80-N82 VanDerWaalsContact C-N 3.34Å |
| 81 | Q | 76.8 | Confident | 79.3 | Confident | 154 Ų | 154 | 97.8 Ų | 97.8 | 72% | 0.72 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -84.6 | -3 | 179 | -66.6 | 173.6 | -13.6 | 0 | 0 | 113.9 | R77 E83 | R77-Q81 WeakPolarHBondContact O-CB 3.48Å; R77-Q81 WeakPolarHBondContact O-CG 3.46Å; R77-Q81 PolarHBondContact O-N 3.2Å; Q81-E83 PolarHBondContact O-N 2.89Å |
| 82 | N | 81 | Confident | 78.8 | Confident | 76 Ų | 76 | 101.4 Ų | 101.4 | 41% | 0.406 | 52% | 0.52 | S | S | . | . | trans | -72.6 | 115.6 | 171.4 | 179.5 | -21.6 | 0 | 0 | 0 | 108.9 | C78 I80 A84 N85 A86 | C78-N82 WeakPolarHBondContact O-CB 3.46Å; C78-N82 PolarHBondContact O-N 3.19Å; I80-N82 VanDerWaalsContact C-N 3.34Å; N82-A84 VanDerWaalsContact C-N 3.28Å; N82-A84 PolarHBondContact O-N 2.89Å; N82-A84 PolarHBondContact OD1-N 3.42Å; N82-A84 VanDerWaalsContact OD1-N 3.16Å; N82-N85 HydrophobicContact CB-CB 4.13Å; N82-N85 CarbonylContact O-C 3.59Å; N82-N85 WeakPolarHBondContact O-CA 3.48Å; N82-N85 WeakPolarHBondContact O-CB 3.36Å; N82-N85 PolarHBondContact O-N 2.9Å; N82-A86 PolarHBondContact O-N 3.2Å | ||
| 83 | E | 79.1 | Confident | 78 | Confident | 155 Ų | 155 | 103 Ų | 103 | 72% | 0.724 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -48.8 | -44.8 | -176.8 | -167 | 168 | -163.9 | 0 | 0 | 112.9 | Q81 N85 A86 E87 | Q81-E83 PolarHBondContact O-N 2.89Å; E83-N85 PolarHBondContact O-N 3.26Å; E83-A86 PolarHBondContact O-N 2.9Å; E83-E87 PolarHBondContact O-N 2.83Å |
| 84 | A | 77.7 | Confident | 77 | Confident | 64 Ų | 64 | 100.4 Ų | 100.4 | 53% | 0.529 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.2 | -31.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | N82 A88 | N82-A84 VanDerWaalsContact C-N 3.28Å; N82-A84 PolarHBondContact O-N 2.89Å; N82-A84 PolarHBondContact OD1-N 3.42Å; N82-A84 VanDerWaalsContact OD1-N 3.16Å; A84-A88 WeakPolarHBondContact O-CB 3.27Å; A84-A88 PolarHBondContact O-N 2.97Å |
| 85 | N | 76.8 | Confident | 75.7 | Confident | 59 Ų | 59 | 100.6 Ų | 100.6 | 32% | 0.316 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -75.8 | -36.2 | 172.9 | -67.2 | -12.7 | 0 | 0 | 0 | 111.1 | I79 N82 E83 A88 L89 | I79-N85 VanDerWaalsContact O-CB 3.25Å; I79-N85 WeakPolarHBondContact O-CB 3.16Å; I79-N85 PolarHBondContact O-ND2 2.75Å; N82-N85 HydrophobicContact CB-CB 4.13Å; N82-N85 CarbonylContact O-C 3.59Å; N82-N85 WeakPolarHBondContact O-CA 3.48Å; N82-N85 WeakPolarHBondContact O-CB 3.36Å; N82-N85 PolarHBondContact O-N 2.9Å; E83-N85 PolarHBondContact O-N 3.26Å; N85-A88 PolarHBondContact O-N 3.15Å; N85-L89 VanDerWaalsContact O-CB 3.3Å; N85-L89 WeakPolarHBondContact O-CB 3.49Å; N85-L89 WeakPolarHBondContact O-CD1 3.22Å; N85-L89 VanDerWaalsContact O-CG 3.25Å; N85-L89 WeakPolarHBondContact O-CG 3.21Å; N85-L89 PolarHBondContact O-N 2.95Å |
| 86 | A | 77.6 | Confident | 74.2 | Confident | 44 Ų | 44 | 101.6 Ų | 101.6 | 36% | 0.364 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.9 | -39.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | N82 E83 K90 | N82-A86 PolarHBondContact O-N 3.2Å; E83-A86 PolarHBondContact O-N 2.9Å; A86-K90 VanDerWaalsContact O-CB 3.26Å; A86-K90 WeakPolarHBondContact O-CB 3.38Å; A86-K90 PolarHBondContact O-N 3.42Å |
| 87 | E | 77.3 | Confident | 72.3 | Confident | 128 Ų | 128 | 107.4 Ų | 107.4 | 60% | 0.598 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.4 | -45.1 | 171.7 | -68.3 | -162.4 | 130.5 | 0 | 0 | 112 | E83 L89 K90 E91 | E83-E87 PolarHBondContact O-N 2.83Å; E87-L89 PolarHBondContact O-N 3.36Å; E87-K90 WeakPolarHBondContact O-CB 3.2Å; E87-K90 PolarHBondContact O-N 3.2Å; E87-E91 PolarHBondContact O-N 3.44Å |
| 88 | A | 76.9 | Confident | 70.5 | Confident | 42 Ų | 42 | 106.8 Ų | 106.8 | 35% | 0.347 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.2 | -36.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A84 N85 E91 M92 | A84-A88 WeakPolarHBondContact O-CB 3.27Å; A84-A88 PolarHBondContact O-N 2.97Å; N85-A88 PolarHBondContact O-N 3.15Å; A88-E91 PolarHBondContact O-N 3.3Å; A88-M92 WeakPolarHBondContact O-CG 3.31Å; A88-M92 PolarHBondContact O-N 3.45Å |
| 89 | L | 76.8 | Confident | 68.6 | Low | 74 Ų | 74 | 112.4 Ų | 112.4 | 39% | 0.387 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.5 | -40.6 | 172.5 | -78.2 | 163.8 | 0 | 0 | 0 | 111.4 | N85 E87 E91 M92 L93 | N85-L89 VanDerWaalsContact O-CB 3.3Å; N85-L89 WeakPolarHBondContact O-CB 3.49Å; N85-L89 WeakPolarHBondContact O-CD1 3.22Å; N85-L89 VanDerWaalsContact O-CG 3.25Å; N85-L89 WeakPolarHBondContact O-CG 3.21Å; N85-L89 PolarHBondContact O-N 2.95Å; E87-L89 PolarHBondContact O-N 3.36Å; L89-E91 VanDerWaalsContact C-N 3.33Å; L89-M92 HydrophobicContact CD2-CE 3.89Å; L89-M92 HydrophobicContact CG-CE 4.42Å; L89-M92 PolarHBondContact O-N 2.75Å; L89-L93 VanDerWaalsContact O-CD1 3.27Å; L89-L93 WeakPolarHBondContact O-CD1 3.36Å; L89-L93 PolarHBondContact O-N 3.12Å |
| 90 | K | 72.4 | Confident | 66.5 | Low | 156 Ų | 156 | 110.8 Ų | 110.8 | 68% | 0.678 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -64.4 | -36.3 | 175.9 | -179.9 | -170.6 | 173.3 | -164.9 | 0 | 112.1 | A86 E87 G94 | A86-K90 VanDerWaalsContact O-CB 3.26Å; A86-K90 WeakPolarHBondContact O-CB 3.38Å; A86-K90 PolarHBondContact O-N 3.42Å; E87-K90 WeakPolarHBondContact O-CB 3.2Å; E87-K90 PolarHBondContact O-N 3.2Å; K90-G94 PolarHBondContact O-N 3.44Å; K90-G94 VanDerWaalsContact O-N 3.15Å |
| 91 | E | 70.8 | Confident | 64.7 | Low | 155 Ų | 155 | 113 Ų | 113 | 72% | 0.724 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -65.1 | -51 | 172.4 | -170.8 | 178 | 178.9 | 0 | 0 | 110.9 | E87 A88 L89 L93 G94 | E87-E91 PolarHBondContact O-N 3.44Å; A88-E91 PolarHBondContact O-N 3.3Å; L89-E91 VanDerWaalsContact C-N 3.33Å; E91-L93 VanDerWaalsContact C-N 3.26Å; E91-L93 PolarHBondContact O-N 2.72Å; E91-G94 PolarHBondContact O-N 3.23Å; E91-G94 VanDerWaalsContact O-N 3.09Å |
| 92 | M | 67.4 | Low | 63 | Low | 144 Ų | 144 | 112.7 Ų | 112.7 | 71% | 0.709 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -64.3 | -23.2 | 180 | -71.3 | -172 | -60.7 | 0 | 0 | 115 | A88 L89 | A88-M92 WeakPolarHBondContact O-CG 3.31Å; A88-M92 PolarHBondContact O-N 3.45Å; L89-M92 HydrophobicContact CD2-CE 3.89Å; L89-M92 HydrophobicContact CG-CE 4.42Å; L89-M92 PolarHBondContact O-N 2.75Å |
| 93 | L | 67.8 | Low | 60.8 | Low | 127 Ų | 127 | 117.4 Ų | 117.4 | 67% | 0.665 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | -0 | 176.5 | -82.9 | 76 | 0 | 0 | 0 | 113.1 | L89 E91 | L89-L93 VanDerWaalsContact O-CD1 3.27Å; L89-L93 WeakPolarHBondContact O-CD1 3.36Å; L89-L93 PolarHBondContact O-N 3.12Å; E91-L93 VanDerWaalsContact C-N 3.26Å; E91-L93 PolarHBondContact O-N 2.72Å |
| 94 | G | 61.4 | Low | 59.3 | Low | 46 Ų | 46 | 118.6 Ų | 118.6 | 47% | 0.474 | 68% | 0.676 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.3 | -36.2 | -168.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | K90 E91 | K90-G94 PolarHBondContact O-N 3.44Å; K90-G94 VanDerWaalsContact O-N 3.15Å; E91-G94 PolarHBondContact O-N 3.23Å; E91-G94 VanDerWaalsContact O-N 3.09Å |
| 95 | D | 51.8 | Low | 57.4 | Low | 165 Ų | 165 | 121 Ų | 121 | 88% | 0.882 | 69% | 0.689 | S | S | * | * | trans | -111.5 | 45.1 | -166.2 | -66.1 | -50.7 | 0 | 0 | 0 | 113.5 | ||||
| 96 | S | 55.3 | Low | 55.7 | Low | 112 Ų | 112 | 123.5 Ų | 123.5 | 78% | 0.783 | 71% | 0.711 | S | S | * | * | trans | -104.3 | 24.5 | -176.8 | 62.6 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 97 | E | 49.4 | Very low | 54 | Low | 193 Ų | 193 | 128.5 Ų | 128.5 | 90% | 0.902 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -123.4 | 58 | 174.9 | 60.1 | 179 | 109.5 | 0 | 0 | 113.9 | ||
| 98 | G | 43 | Very low | 52 | Low | 74 Ų | 74 | 129.7 Ų | 129.7 | 76% | 0.763 | 75% | 0.747 | S | S | * | * | trans | -160.5 | 136.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 99 | E | 37.7 | Very low | 50 | Low | 203 Ų | 203 | 130.6 Ų | 130.6 | 95% | 0.949 | 75% | 0.754 | S | S | * | * | trans | -18.4 | 140.9 | 152.2 | -173.3 | -177 | 145.1 | 0 | 0 | 116.5 | ||||
| 100 | G | 38.9 | Very low | 48.2 | Very low | 54 Ų | 54 | 133.4 Ų | 133.4 | 56% | 0.557 | 78% | 0.775 | S | S | * | * | cis | 166.1 | 155.1 | 3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 101 | T | 43.1 | Very low | 46.3 | Very low | 148 Ų | 148 | 131.8 Ų | 131.8 | 91% | 0.908 | 78% | 0.783 | S | S | * | * | trans | 18.1 | 100.5 | 165.9 | 55.5 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 102 | V | 41.5 | Very low | 44.4 | Very low | 147 Ų | 147 | 129.5 Ų | 129.5 | 89% | 0.891 | 78% | 0.784 | S | S | * | * | trans | -124.9 | 135.1 | 153 | -175.6 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 103 | Q | 34.3 | Very low | 43.5 | Very low | 176 Ų | 176 | 130.3 Ų | 130.3 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | -78.5 | 159.2 | -160.1 | -60.4 | -174 | 82.2 | 0 | 0 | 115 | ||||
| 104 | L | 48.3 | Very low | 42.4 | Very low | 180 Ų | 180 | 132.8 Ų | 132.8 | 94% | 0.942 | 80% | 0.799 | S | S | * | * | trans | -57.6 | 130.7 | 152.3 | -68.3 | 162.6 | 0 | 0 | 0 | 109.9 | ||||
| 105 | S | 36.1 | Very low | 41.3 | Very low | 115 Ų | 115 | 137.4 Ų | 137.4 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -141 | 123.7 | 162.6 | 51.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 106 | S | 42 | Very low | 41.1 | Very low | 111 Ų | 111 | 133.3 Ų | 133.3 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | trans | -80.4 | 139.8 | 177.4 | -179.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 107 | V | 41.1 | Very low | 40.7 | Very low | 148 Ų | 148 | 133.5 Ų | 133.5 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | trans | -131 | 120.3 | 156.1 | -77.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 108 | D | 35.9 | Very low | 40.6 | Very low | 154 Ų | 154 | 130.1 Ų | 130.1 | 82% | 0.824 | 80% | 0.801 | S | S | * | * | trans | -103.3 | 178.6 | 175.7 | 179.9 | 36.5 | 0 | 0 | 0 | 109.9 | ||||
| 109 | A | 35.3 | Very low | 41.2 | Very low | 61 Ų | 61 | 132.3 Ų | 132.3 | 50% | 0.504 | 80% | 0.804 | S | S | . | * | trans | 88.3 | 84.5 | 151.8 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 110 | T | 39.3 | Very low | 42.1 | Very low | 133 Ų | 133 | 127.6 Ų | 127.6 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | 81.1 | 156 | 126.1 | 70.4 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 111 | S | 30.8 | Very low | 42.7 | Very low | 121 Ų | 121 | 133.1 Ų | 133.1 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | 72.4 | 146.6 | -179.7 | 82.4 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 112 | S | 32.8 | Very low | 43.4 | Very low | 107 Ų | 107 | 128.5 Ų | 128.5 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | cis | -125.6 | 148.1 | 4.5 | -169.1 | 0 | 0 | 0 | 0 | 113.1 | Q114 | S112-Q114 PolarHBondContact O-N 2.75Š| ||
| 113 | L | 46.8 | Very low | 44.3 | Very low | 162 Ų | 162 | 128.4 Ų | 128.4 | 85% | 0.848 | 76% | 0.761 | S | S | * | * | trans | -77.6 | 106.1 | 173.8 | 177.2 | 84.7 | 0 | 0 | 0 | 110 | ||||
| 114 | Q | 44.8 | Very low | 45.2 | Very low | 178 Ų | 178 | 126 Ų | 126 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | trans | -165.8 | 134.9 | 153.2 | -111.2 | 144 | 111.8 | 0 | 0 | 115.3 | S112 | S112-Q114 PolarHBondContact O-N 2.75Š| ||
| 115 | D | 38.8 | Very low | 45.5 | Very low | 144 Ų | 144 | 120.8 Ų | 120.8 | 77% | 0.77 | 73% | 0.729 | S | S | * | * | trans | 53.5 | 77.4 | 150 | -144.1 | 37.6 | 0 | 0 | 0 | 121 | T117 | D115-T117 PolarHBondContact O-N 3.21Š| ||
| 116 | G | 47.4 | Very low | 46.3 | Very low | 79 Ų | 79 | 123.4 Ų | 123.4 | 81% | 0.814 | 73% | 0.733 | S | S | * | * | 70 | 23.1 | 112.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | |||||
| 117 | T | 47.2 | Very low | 46.8 | Very low | 115 Ų | 115 | 122.1 Ų | 122.1 | 71% | 0.706 | 74% | 0.737 | S | S | * | * | trans | -130.1 | 132.2 | 172.9 | 41.8 | 0 | 0 | 0 | 0 | 113.2 | D115 | D115-T117 PolarHBondContact O-N 3.21Š| ||
| 118 | P | 47 | Very low | 47.3 | Very low | 123 Ų | 123 | 118.4 Ų | 118.4 | 80% | 0.799 | 72% | 0.718 | S | S | * | * | trans | -66.9 | 133.2 | 172 | -19.6 | 32.3 | 0 | 0 | 0 | 111.5 | H120 | P118-H120 VanDerWaalsContact C-N 3.3Å; P118-H120 PolarHBondContact O-N 2.89Å | ||
| 119 | S | 55.9 | Low | 48.4 | Very low | 120 Ų | 120 | 116.2 Ų | 116.2 | 84% | 0.839 | 72% | 0.721 | S | S | * | * | trans | -70.5 | 80.6 | 172.8 | 40.9 | 0 | 0 | 0 | 0 | 111.1 | H121 | S119-H121 PolarHBondContact O-N 2.82Š| ||
| 120 | H | 57.4 | Low | 49.5 | Very low | 103 Ų | 103 | 116 Ų | 116 | 48% | 0.477 | 72% | 0.719 | S | S | . | * | trans | -65.9 | 121.6 | 175.2 | 117.2 | -71.1 | 0 | 0 | 0 | 109.9 | P118 H122 C135 | P118-H120 VanDerWaalsContact C-N 3.3Å; P118-H120 PolarHBondContact O-N 2.89Å; H120-H122 AromaticContact CD2-ND1 3.79Å; H120-H122 AromaticContact CE1-CE1 3.3Å; H120-H122 PolarHBondContact CE1-CE1 2.81Å; H120-H122 AromaticContact CE1-ND1 3.15Å; H120-H122 PolarHBondContact CE1-ND1 2.84Å; H120-H122 AromaticContact ND1-ND1 3.99Å; H120-H122 AromaticContact NE2-CE1 3.62Å; H120-H122 AromaticContact NE2-ND1 2.97Å; H120-H122 PolarHBondContact NE2-ND1 3.13Å; H120-C135 PolarHBondContact CE1-SG 2.92Å; H120-C135 PolarHBondContact NE2-SG 3.19Å; H120-C135 VanDerWaalsContact NE2-SG 3.44Å | ||
| 121 | H | 51.6 | Low | 50.5 | Low | 171 Ų | 171 | 114.6 Ų | 114.6 | 79% | 0.792 | 71% | 0.712 | S | S | * | * | trans | -113 | 141.3 | -179.3 | -138.1 | 21.8 | 0 | 0 | 0 | 108.8 | S119 | S119-H121 PolarHBondContact O-N 2.82Š| ||
| 122 | H | 57.1 | Low | 52.1 | Low | 51 Ų | 51 | 110.4 Ų | 110.4 | 24% | 0.236 | 68% | 0.682 | C | S | . | * | trans | -139.1 | 138.7 | -179.2 | 40.7 | -106.3 | 0 | 0 | 0 | 109.1 | H120 V124 H125 | H120-H122 AromaticContact CD2-ND1 3.79Å; H120-H122 AromaticContact CE1-CE1 3.3Å; H120-H122 PolarHBondContact CE1-CE1 2.81Å; H120-H122 AromaticContact CE1-ND1 3.15Å; H120-H122 PolarHBondContact CE1-ND1 2.84Å; H120-H122 AromaticContact ND1-ND1 3.99Å; H120-H122 AromaticContact NE2-CE1 3.62Å; H120-H122 AromaticContact NE2-ND1 2.97Å; H120-H122 PolarHBondContact NE2-ND1 3.13Å; H122-V124 PolarHBondContact O-N 3.23Å; H122-H125 AromaticContact CD2-CD2 3.35Å; H122-H125 PolarHBondContact CD2-CD2 3.15Å; H122-H125 AromaticContact CD2-CG 3.71Å; H122-H125 WeakPolarHBondContact NE2-CB 3.41Å; H122-H125 AromaticContact NE2-CD2 3.23Å; H122-H125 PolarHBondContact NE2-CD2 3.32Å; H122-H125 AromaticContact NE2-CG 3.34Å; H122-H125 VanDerWaalsContact NE2-CG 3.34Å; H122-H125 PolarHBondContact O-N 3.35Å | ||
| 123 | T | 59.6 | Low | 53.4 | Low | 145 Ų | 145 | 111.8 Ų | 111.8 | 89% | 0.89 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.8 | -16.7 | -168.5 | -31.6 | 0 | 0 | 0 | 0 | 114.5 | ||
| 124 | V | 54.6 | Low | 53.8 | Low | 126 Ų | 126 | 112 Ų | 112 | 76% | 0.764 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | 0.4 | -176.5 | -77.1 | 0 | 0 | 0 | 0 | 115.5 | H122 | H122-V124 PolarHBondContact O-N 3.23Š|
| 125 | H | 55.1 | Low | 54.6 | Low | 70 Ų | 70 | 106.2 Ų | 106.2 | 32% | 0.324 | 66% | 0.655 | S | S | . | * | trans | -128.6 | 72.6 | 172.6 | -69.6 | -118.8 | 0 | 0 | 0 | 111.8 | H122 G127 | H122-H125 AromaticContact CD2-CD2 3.35Å; H122-H125 PolarHBondContact CD2-CD2 3.15Å; H122-H125 AromaticContact CD2-CG 3.71Å; H122-H125 WeakPolarHBondContact NE2-CB 3.41Å; H122-H125 AromaticContact NE2-CD2 3.23Å; H122-H125 PolarHBondContact NE2-CD2 3.32Å; H122-H125 AromaticContact NE2-CG 3.34Å; H122-H125 VanDerWaalsContact NE2-CG 3.34Å; H122-H125 PolarHBondContact O-N 3.35Å; H125-G127 PolarHBondContact O-N 3.1Å; H125-G127 VanDerWaalsContact O-N 3.13Å | ||
| 126 | L | 52.9 | Low | 55.8 | Low | 169 Ų | 169 | 103 Ų | 103 | 89% | 0.885 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -68 | 104.8 | 161.3 | -124.7 | 67.4 | 0 | 0 | 0 | 108.7 | ||
| 127 | G | 52 | Low | 56.2 | Low | 84 Ų | 84 | 108.3 Ų | 108.3 | 87% | 0.866 | 64% | 0.639 | S | S | * | * | S | Bend | trans | 89.5 | 7.9 | 165 | 0 | 0 | 0 | 0 | 0 | 118.9 | H125 | H125-G127 PolarHBondContact O-N 3.1Å; H125-G127 VanDerWaalsContact O-N 3.13Å |
| 128 | S | 51.7 | Low | 56.5 | Low | 71 Ų | 71 | 107.2 Ų | 107.2 | 50% | 0.497 | 64% | 0.636 | S | S | . | * | trans | -103.4 | 119.3 | 177.1 | -170.3 | 0 | 0 | 0 | 0 | 113 | A130 | S128-A130 PolarHBondContact O-N 3.25Å; S128-A130 VanDerWaalsContact O-N 3.1Å | ||
| 129 | A | 58 | Low | 56.7 | Low | 107 Ų | 107 | 110.1 Ų | 110.1 | 88% | 0.884 | 64% | 0.636 | S | S | * | * | trans | -75.2 | 13.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | P131 | A129-P131 WeakPolarHBondContact O-CD 3.25Š| ||
| 130 | A | 57.8 | Low | 56.8 | Low | 56 Ų | 56 | 113.6 Ų | 113.6 | 46% | 0.463 | 63% | 0.631 | S | S | . | * | P | Polyproline II helix | trans | -79.3 | 123.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | S128 C132 | S128-A130 PolarHBondContact O-N 3.25Å; S128-A130 VanDerWaalsContact O-N 3.1Å; A130-C132 PolarHBondContact O-N 3.01Å |
| 131 | P | 60.5 | Low | 56.5 | Low | 105 Ų | 105 | 113.9 Ų | 113.9 | 68% | 0.682 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 125.1 | 178.5 | -23.7 | 34.4 | 0 | 0 | 0 | 112.6 | A129 I133 | A129-P131 WeakPolarHBondContact O-CD 3.25Å; P131-I133 PolarHBondContact O-N 2.78Å |
| 132 | C | 64.1 | Low | 56.5 | Low | 32 Ų | 32 | 112 Ų | 112 | 22% | 0.216 | 65% | 0.645 | C | S | . | * | P | Polyproline II helix | trans | -53.6 | 129.8 | 179.3 | -179.2 | 0 | 0 | 0 | 0 | 112 | A130 H134 C135 S136 | A130-C132 PolarHBondContact O-N 3.01Å; C132-H134 PolarHBondContact O-N 2.88Å; C132-H134 VanDerWaalsContact O-N 3.15Å; C132-C135 HydrophobicContact CB-CB 4.28Å; C132-C135 PolarHBondContact O-N 2.86Å; C132-S136 PolarHBondContact O-N 3.29Å; C132-S136 PolarHBondContact O-OG 2.75Å |
| 133 | I | 60.9 | Low | 56.2 | Low | 136 Ų | 136 | 117.5 Ų | 117.5 | 70% | 0.697 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -58.8 | -28.6 | -176.3 | -65 | 176.1 | 0 | 0 | 0 | 112.6 | P131 | P131-I133 PolarHBondContact O-N 2.78Å |
| 134 | H | 56.1 | Low | 55.7 | Low | 168 Ų | 168 | 117.2 Ų | 117.2 | 78% | 0.778 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -75.8 | -33.1 | 175.3 | -77.8 | -96.9 | 0 | 0 | 0 | 113 | C132 | C132-H134 PolarHBondContact O-N 2.88Å; C132-H134 VanDerWaalsContact O-N 3.15Å |
| 135 | C | 61.6 | Low | 55.4 | Low | 55 Ų | 55 | 123 Ų | 123 | 37% | 0.372 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -86 | -40.6 | -175 | -57.9 | 0 | 0 | 0 | 0 | 112.2 | H120 C132 R137 S138 | H120-C135 PolarHBondContact CE1-SG 2.92Å; H120-C135 PolarHBondContact NE2-SG 3.19Å; H120-C135 VanDerWaalsContact NE2-SG 3.44Å; C132-C135 HydrophobicContact CB-CB 4.28Å; C132-C135 PolarHBondContact O-N 2.86Å; C135-R137 PolarHBondContact O-N 3.39Å; C135-S138 WeakPolarHBondContact O-CB 3.46Å; C135-S138 PolarHBondContact O-N 3.24Å; C135-S138 PolarHBondContact O-OG 3.46Å |
| 136 | S | 62.8 | Low | 55 | Low | 77 Ų | 77 | 128.4 Ų | 128.4 | 54% | 0.538 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -64 | -21.9 | -178.9 | 59.7 | 0 | 0 | 0 | 0 | 113.8 | C132 S138 | C132-S136 PolarHBondContact O-N 3.29Å; C132-S136 PolarHBondContact O-OG 2.75Å; S136-S138 VanDerWaalsContact C-N 3.29Å; S136-S138 PolarHBondContact O-N 2.92Å |
| 137 | R | 57 | Low | 55.1 | Low | 191 Ų | 191 | 123.8 Ų | 123.8 | 72% | 0.721 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -2.1 | -176.2 | -134.3 | 172.3 | -167.6 | -102.8 | 6.1 | 115.1 | C135 | C135-R137 PolarHBondContact O-N 3.39Š|
| 138 | S | 52.7 | Low | 54.8 | Low | 91 Ų | 91 | 131.4 Ų | 131.4 | 64% | 0.636 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -26.8 | -172.3 | 55.9 | 0 | 0 | 0 | 0 | 115.2 | C135 S136 R140 | C135-S138 WeakPolarHBondContact O-CB 3.46Å; C135-S138 PolarHBondContact O-N 3.24Å; C135-S138 PolarHBondContact O-OG 3.46Å; S136-S138 VanDerWaalsContact C-N 3.29Å; S136-S138 PolarHBondContact O-N 2.92Å; S138-R140 VanDerWaalsContact C-N 3.34Å; S138-R140 PolarHBondContact O-N 3.37Å |
| 139 | K | 52.1 | Low | 54.5 | Low | 184 Ų | 184 | 132.9 Ų | 132.9 | 80% | 0.8 | 71% | 0.713 | S | S | * | * | trans | -82 | 68.2 | -176.8 | -68.5 | -170.8 | 176.4 | -175.5 | 0 | 113.1 | ||||
| 140 | R | 56.2 | Low | 54.3 | Low | 193 Ų | 193 | 137.9 Ų | 137.9 | 73% | 0.728 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -136.2 | 136 | 163.2 | -69.8 | -172.4 | -178.3 | 161.1 | 1.4 | 110.8 | S138 | S138-R140 VanDerWaalsContact C-N 3.34Å; S138-R140 PolarHBondContact O-N 3.37Å |
| 141 | P | 52.5 | Low | 53.8 | Low | 109 Ų | 109 | 142.3 Ų | 142.3 | 71% | 0.708 | 73% | 0.726 | S | S | * | * | trans | -58.8 | 152.6 | 173.6 | -23.8 | 34.3 | 0 | 0 | 0 | 112.1 | L143 | P141-L143 PolarHBondContact O-N 2.94Š| ||
| 142 | P | 50.1 | Low | 53.2 | Low | 133 Ų | 133 | 140.4 Ų | 140.4 | 86% | 0.864 | 73% | 0.725 | S | S | * | * | trans | -67.5 | 94.7 | 178.4 | -18 | 32.2 | 0 | 0 | 0 | 111.4 | V144 | P142-V144 PolarHBondContact O-N 3.18Š| ||
| 143 | L | 51.8 | Low | 52.5 | Low | 166 Ų | 166 | 147.8 Ų | 147.8 | 87% | 0.869 | 75% | 0.753 | S | S | * | * | trans | -63.7 | 135.1 | 171.1 | -70.1 | 177.9 | 0 | 0 | 0 | 109.7 | P141 | P141-L143 PolarHBondContact O-N 2.94Š| ||
| 144 | V | 48.5 | Very low | 51.9 | Low | 139 Ų | 139 | 145.3 Ų | 145.3 | 84% | 0.842 | 75% | 0.748 | S | S | * | * | trans | -54.2 | 142.8 | -172.8 | 177.1 | 0 | 0 | 0 | 0 | 111.2 | P142 Q146 | P142-V144 PolarHBondContact O-N 3.18Å; V144-Q146 VanDerWaalsContact C-N 3.28Å; V144-Q146 PolarHBondContact O-N 2.87Å | ||
| 145 | R | 49.5 | Very low | 52 | Low | 247 Ų | 247 | 146.9 Ų | 146.9 | 93% | 0.932 | 75% | 0.747 | S | S | * | * | trans | -63.7 | 74.7 | -172.1 | -171.2 | -178.1 | -179.4 | 146.6 | -2.2 | 113.3 | G147 | R145-G147 PolarHBondContact O-N 3.3Š| ||
| 146 | Q | 46.3 | Very low | 51.6 | Low | 184 Ų | 184 | 147.4 Ų | 147.4 | 86% | 0.86 | 75% | 0.75 | S | S | * | * | trans | -68.7 | 98 | 170.1 | -172.9 | 175.6 | -0.8 | 0 | 0 | 109.3 | V144 R148 | V144-Q146 VanDerWaalsContact C-N 3.28Å; V144-Q146 PolarHBondContact O-N 2.87Å; Q146-R148 PolarHBondContact O-N 3.1Å | ||
| 147 | G | 55.2 | Low | 51.4 | Low | 72 Ų | 72 | 152.8 Ų | 152.8 | 74% | 0.742 | 76% | 0.759 | S | S | * | * | trans | -62 | 130 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | R145 | R145-G147 PolarHBondContact O-N 3.3Š| ||
| 148 | R | 44.8 | Very low | 51.5 | Low | 243 Ų | 243 | 150 Ų | 150 | 92% | 0.917 | 76% | 0.763 | S | S | * | * | trans | -123.6 | 113.9 | 179.3 | -165.1 | 171.6 | -172.2 | 152.3 | 3.8 | 111 | Q146 | Q146-R148 PolarHBondContact O-N 3.1Š| ||
| 149 | S | 46.7 | Very low | 52.1 | Low | 103 Ų | 103 | 146.9 Ų | 146.9 | 72% | 0.72 | 75% | 0.745 | S | S | * | * | trans | 44 | 121.5 | 168.1 | -116.2 | 0 | 0 | 0 | 0 | 119.8 | E151 | S149-E151 PolarHBondContact O-N 2.89Š| ||
| 150 | K | 52.5 | Low | 53.2 | Low | 211 Ų | 211 | 141 Ų | 141 | 92% | 0.917 | 72% | 0.72 | S | S | * | * | S | Bend | -58.7 | 109.1 | 125.3 | -72.5 | 178.1 | 176.8 | 177.6 | 0 | 107.1 | |||
| 151 | E | 48 | Very low | 54.3 | Low | 150 Ų | 150 | 136 Ų | 136 | 70% | 0.701 | 71% | 0.711 | S | S | * | * | 177.9 | 125.8 | 127.6 | -173.7 | 48.6 | -95.7 | 0 | 0 | 106.6 | S149 K153 | S149-E151 PolarHBondContact O-N 2.89Å; E151-K153 WeakPolarHBondContact OE1-CB 3.25Å; E151-K153 PolarHBondContact OE1-N 2.86Å | |||
| 152 | G | 47 | Very low | 55.6 | Low | 65 Ų | 65 | 133.1 Ų | 133.1 | 67% | 0.67 | 69% | 0.692 | S | S | * | * | trans | -177.9 | 24.8 | -165.5 | 0 | 0 | 0 | 0 | 0 | 111 | S154 | G152-S154 PolarHBondContact O-N 3.48Š| ||
| 153 | K | 49.2 | Very low | 57.3 | Low | 186 Ų | 186 | 131.2 Ų | 131.2 | 81% | 0.809 | 68% | 0.678 | S | S | * | * | trans | -69 | 78.5 | 175.4 | -168.4 | 169.4 | -175.6 | 174 | 0 | 109 | E151 R155 | E151-K153 WeakPolarHBondContact OE1-CB 3.25Å; E151-K153 PolarHBondContact OE1-N 2.86Å; K153-R155 PolarHBondContact O-N 2.81Å | ||
| 154 | S | 49 | Very low | 58.3 | Low | 84 Ų | 84 | 129.1 Ų | 129.1 | 59% | 0.587 | 66% | 0.662 | S | S | * | * | trans | -60.3 | 84.7 | 164.6 | 43.4 | 0 | 0 | 0 | 0 | 108.3 | G152 P156 | G152-S154 PolarHBondContact O-N 3.48Å; S154-P156 VanDerWaalsContact O-CD 3.31Å; S154-P156 WeakPolarHBondContact O-CD 3.27Å; S154-P156 VanDerWaalsContact O-N 3.1Å | ||
| 155 | R | 57.6 | Low | 60.1 | Low | 202 Ų | 202 | 126.2 Ų | 126.2 | 76% | 0.762 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -51 | 116.4 | 168.6 | -177 | 177.4 | -171.7 | -110.6 | 3.9 | 106 | K153 R157 | K153-R155 PolarHBondContact O-N 2.81Å; R155-R157 PolarHBondContact O-N 3.39Å |
| 156 | P | 53.6 | Low | 61.6 | Low | 66 Ų | 66 | 118.6 Ų | 118.6 | 43% | 0.429 | 63% | 0.628 | S | S | . | * | P | Polyproline II helix | trans | -51.8 | 139.2 | 177.3 | -25.1 | 33.9 | 0 | 0 | 0 | 108.9 | S154 T158 E160 | S154-P156 VanDerWaalsContact O-CD 3.31Å; S154-P156 WeakPolarHBondContact O-CD 3.27Å; S154-P156 VanDerWaalsContact O-N 3.1Å; P156-T158 PolarHBondContact O-N 3.3Å; P156-E160 HydrophobicContact CB-CB 4.37Å |
| 157 | R | 60.1 | Low | 63.5 | Low | 190 Ų | 190 | 114 Ų | 114 | 72% | 0.717 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 142.3 | 169.7 | -54 | -64.6 | -170.7 | 157.6 | 2.3 | 107.2 | R155 G159 E160 | R155-R157 PolarHBondContact O-N 3.39Å; R157-G159 PolarHBondContact O-N 2.86Å; R157-E160 HydrophobicContact CB-CG 3.89Å; R157-E160 WeakPolarHBondContact CB-OE1 3.44Å; R157-E160 VanDerWaalsContact CG-CD 3.47Å; R157-E160 HydrophobicContact CG-CG 4.47Å; R157-E160 WeakPolarHBondContact CG-OE1 3.14Å; R157-E160 PolarHBondContact N-OE2 2.91Å; R157-E160 WeakPolarHBondContact O-CB 3.48Å; R157-E160 PolarHBondContact O-N 3.2Å |
| 158 | T | 58.4 | Low | 64.9 | Low | 132 Ų | 132 | 122.8 Ų | 122.8 | 81% | 0.81 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | 100.2 | -177.3 | -48.9 | 0 | 0 | 0 | 0 | 109.5 | P156 | P156-T158 PolarHBondContact O-N 3.3Š|
| 159 | G | 65.9 | Low | 66.3 | Low | 26 Ų | 26 | 117.6 Ų | 117.6 | 27% | 0.268 | 63% | 0.626 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 125.4 | -7.2 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | R157 E175 | R157-G159 PolarHBondContact O-N 2.86Å; G159-E175 PolarHBondContact O-N 3.2Å; G159-E175 VanDerWaalsContact O-N 3.1Å |
| 160 | E | 74.8 | Confident | 68.1 | Low | 59 Ų | 59 | 118.4 Ų | 118.4 | 28% | 0.276 | 61% | 0.613 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.1 | 101.1 | 175.6 | -69.1 | 173.5 | 172 | 0 | 0 | 111.7 | P156 R157 I174 | P156-E160 HydrophobicContact CB-CB 4.37Å; R157-E160 HydrophobicContact CB-CG 3.89Å; R157-E160 WeakPolarHBondContact CB-OE1 3.44Å; R157-E160 VanDerWaalsContact CG-CD 3.47Å; R157-E160 HydrophobicContact CG-CG 4.47Å; R157-E160 WeakPolarHBondContact CG-OE1 3.14Å; R157-E160 PolarHBondContact N-OE2 2.91Å; R157-E160 WeakPolarHBondContact O-CB 3.48Å; R157-E160 PolarHBondContact O-N 3.2Å; E160-I174 HydrophobicContact CG-CD1 4.48Å; E160-I174 HydrophobicContact CG-CG1 4.2Å; E160-I174 HydrophobicContact CG-CG2 4.34Å |
| 161 | T | 79.8 | Confident | 69.7 | Low | 88 Ų | 88 | 111.1 Ų | 111.1 | 54% | 0.54 | 59% | 0.586 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.5 | 119.2 | 174.1 | -58.7 | 0 | 0 | 0 | 0 | 109.5 | V163 T172 H173 | T161-V163 HydrophobicContact CG2-CG1 4.29Å; T161-V163 PolarHBondContact O-N 3.17Å; T161-T172 CarbonylContact O-C 3.52Å; T161-T172 WeakPolarHBondContact O-CA 3.43Å; T161-H173 PolarHBondContact N-O 2.98Å; T161-H173 PolarHBondContact O-N 3.05Å |
| 162 | T | 79.9 | Confident | 71.6 | Confident | 50 Ų | 50 | 106.7 Ų | 106.7 | 31% | 0.307 | 57% | 0.569 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -75.3 | 107.2 | 171.6 | -54.3 | 0 | 0 | 0 | 0 | 108.6 | F164 R170 V171 | T162-F164 WeakPolarHBondContact CG2-O 3.3Å; T162-R170 HydrophobicContact CG2-CB 4.44Å; T162-R170 PolarHBondContact OG1-NH2 3.24Å; T162-V171 CarbonylContact C-O 3.59Å; T162-V171 WeakPolarHBondContact CA-O 3.41Å |
| 163 | V | 85.1 | Confident | 73.2 | Confident | 92 Ų | 92 | 109 Ų | 109 | 56% | 0.558 | 56% | 0.562 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -88 | -21 | -178.2 | -65.4 | 0 | 0 | 0 | 0 | 112.6 | T161 V171 H173 | T161-V163 HydrophobicContact CG2-CG1 4.29Å; T161-V163 PolarHBondContact O-N 3.17Å; V163-V171 HydrophobicContact CG2-CB 4.07Å; V163-V171 HydrophobicContact CG2-CG1 3.76Å; V163-V171 WeakPolarHBondContact CG2-O 3.45Å; V163-V171 PolarHBondContact N-O 2.84Å; V163-H173 HydrophobicContact CG1-CB 3.81Å |
| 164 | F | 73.6 | Confident | 74.6 | Confident | 122 Ų | 122 | 105 Ų | 105 | 54% | 0.535 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.4 | 146 | 175.1 | -168.7 | -113.6 | 0 | 0 | 0 | 111.4 | T162 V166 R170 V171 | T162-F164 WeakPolarHBondContact CG2-O 3.3Å; F164-V166 HydrophobicContact CD1-CG2 4.35Å; F164-V166 HydrophobicContact CE1-CB 4.41Å; F164-V166 HydrophobicContact CE1-CG2 3.47Å; F164-V166 VanDerWaalsContact CE1-CG2 3.47Å; F164-V166 HydrophobicContact CE2-CG2 4.27Å; F164-V166 HydrophobicContact CZ-CG2 3.42Å; F164-V166 VanDerWaalsContact CZ-CG2 3.42Å; F164-R170 WeakPolarHBondContact O-CA 3.4Å; F164-V171 HydrophobicContact CB-CB 4.14Å; F164-V171 HydrophobicContact CB-CG2 4.21Å; F164-V171 HydrophobicContact CD1-CG2 4.48Å; F164-V171 PolarHBondContact N-O 3.43Å; F164-V171 PolarHBondContact O-N 3.21Å |
| 165 | S | 85.7 | Confident | 75.2 | Confident | 78 Ų | 78 | 105.8 Ų | 105.8 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.5 | 127.4 | 174.6 | 58.7 | 0 | 0 | 0 | 0 | 112.8 | F169 | S165-F169 CarbonylContact C-O 3.55Å; S165-F169 VanDerWaalsContact CA-O 3.3Å; S165-F169 WeakPolarHBondContact CA-O 3.26Å |
| 166 | V | 80.8 | Confident | 75.2 | Confident | 87 Ų | 87 | 103 Ų | 103 | 53% | 0.527 | 54% | 0.537 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 111.4 | 176.7 | 174.5 | 0 | 0 | 0 | 0 | 109.1 | F164 R168 F169 | F164-V166 HydrophobicContact CD1-CG2 4.35Å; F164-V166 HydrophobicContact CE1-CB 4.41Å; F164-V166 HydrophobicContact CE1-CG2 3.47Å; F164-V166 VanDerWaalsContact CE1-CG2 3.47Å; F164-V166 HydrophobicContact CE2-CG2 4.27Å; F164-V166 HydrophobicContact CZ-CG2 3.42Å; F164-V166 VanDerWaalsContact CZ-CG2 3.42Å; V166-R168 PolarHBondContact O-N 3.04Å; V166-F169 PolarHBondContact N-O 3.47Å; V166-F169 PolarHBondContact O-N 3.42Å |
| 167 | G | 85.5 | Confident | 75 | Confident | 87 Ų | 87 | 109.2 Ų | 109.2 | 90% | 0.897 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 58.1 | -107.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 168 | R | 84.9 | Confident | 74.3 | Confident | 257 Ų | 257 | 109 Ų | 109 | 97% | 0.97 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -7 | 176.9 | 68.4 | 178.7 | 177.3 | -171.7 | -1.6 | 114.5 | V166 | V166-R168 PolarHBondContact O-N 3.04Š|
| 169 | F | 73.5 | Confident | 73.5 | Confident | 135 Ų | 135 | 106.1 Ų | 106.1 | 59% | 0.592 | 55% | 0.549 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.6 | 133.2 | 178.1 | -170.7 | -107.1 | 0 | 0 | 0 | 109.8 | S165 V166 V171 | S165-F169 CarbonylContact C-O 3.55Å; S165-F169 VanDerWaalsContact CA-O 3.3Å; S165-F169 WeakPolarHBondContact CA-O 3.26Å; V166-F169 PolarHBondContact N-O 3.47Å; V166-F169 PolarHBondContact O-N 3.42Å; F169-V171 HydrophobicContact CD1-CG2 4.26Å; F169-V171 HydrophobicContact CE1-CG2 3.5Å; F169-V171 VanDerWaalsContact CE1-CG2 3.5Å; F169-V171 HydrophobicContact CZ-CG2 4.06Å |
| 170 | R | 85.9 | Confident | 72.2 | Confident | 119 Ų | 119 | 113 Ų | 113 | 45% | 0.449 | 58% | 0.578 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -139.5 | 129.3 | 179.5 | -67.7 | 179.8 | 63.4 | -163.6 | -2.1 | 109.1 | T162 F164 | T162-R170 HydrophobicContact CG2-CB 4.44Å; T162-R170 PolarHBondContact OG1-NH2 3.24Å; F164-R170 WeakPolarHBondContact O-CA 3.4Å |
| 171 | V | 85.9 | Confident | 70.3 | Confident | 59 Ų | 59 | 118.2 Ų | 118.2 | 36% | 0.358 | 60% | 0.602 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103 | 115.1 | 171.9 | -173.6 | 0 | 0 | 0 | 0 | 107.6 | T162 V163 F164 F169 | T162-V171 CarbonylContact C-O 3.59Å; T162-V171 WeakPolarHBondContact CA-O 3.41Å; V163-V171 HydrophobicContact CG2-CB 4.07Å; V163-V171 HydrophobicContact CG2-CG1 3.76Å; V163-V171 WeakPolarHBondContact CG2-O 3.45Å; V163-V171 PolarHBondContact N-O 2.84Å; F164-V171 HydrophobicContact CB-CB 4.14Å; F164-V171 HydrophobicContact CB-CG2 4.21Å; F164-V171 HydrophobicContact CD1-CG2 4.48Å; F164-V171 PolarHBondContact N-O 3.43Å; F164-V171 PolarHBondContact O-N 3.21Å; F169-V171 HydrophobicContact CD1-CG2 4.26Å; F169-V171 HydrophobicContact CE1-CG2 3.5Å; F169-V171 VanDerWaalsContact CE1-CG2 3.5Å; F169-V171 HydrophobicContact CZ-CG2 4.06Å |
| 172 | T | 87.9 | Confident | 68.4 | Low | 56 Ų | 56 | 123.2 Ų | 123.2 | 34% | 0.344 | 62% | 0.62 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -108.5 | 116.8 | 176.9 | 44.8 | 0 | 0 | 0 | 0 | 110.1 | T161 | T161-T172 CarbonylContact O-C 3.52Å; T161-T172 WeakPolarHBondContact O-CA 3.43Å |
| 173 | H | 81 | Confident | 66.4 | Low | 115 Ų | 115 | 126.3 Ų | 126.3 | 53% | 0.532 | 63% | 0.63 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -75.3 | 121.7 | 164.4 | -176.6 | -93.1 | 0 | 0 | 0 | 108.5 | T161 V163 | T161-H173 PolarHBondContact N-O 2.98Å; T161-H173 PolarHBondContact O-N 3.05Å; V163-H173 HydrophobicContact CG1-CB 3.81Å |
| 174 | I | 76.9 | Confident | 63.9 | Low | 102 Ų | 102 | 130.9 Ų | 130.9 | 52% | 0.523 | 64% | 0.638 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102 | 114.6 | 178.3 | -46.2 | -171 | 0 | 0 | 0 | 107.6 | E160 K176 | E160-I174 HydrophobicContact CG-CD1 4.48Å; E160-I174 HydrophobicContact CG-CG1 4.2Å; E160-I174 HydrophobicContact CG-CG2 4.34Å; I174-K176 PolarHBondContact O-N 3.38Å |
| 175 | E | 62.9 | Low | 62.2 | Low | 99 Ų | 99 | 132.3 Ų | 132.3 | 46% | 0.463 | 65% | 0.651 | S | S | . | * | trans | -65.4 | 106.3 | 176 | -176.2 | -171.4 | -141.9 | 0 | 0 | 110.1 | G159 R177 | G159-E175 PolarHBondContact O-N 3.2Å; G159-E175 VanDerWaalsContact O-N 3.1Å; E175-R177 VanDerWaalsContact C-N 3.35Å; E175-R177 HydrophobicContact CG-CG 4.24Å; E175-R177 PolarHBondContact O-N 3.15Å; E175-R177 IonicContact OE2-CZ 2.68Å; E175-R177 VanDerWaalsContact OE2-CZ 3.29Å; E175-R177 IonicContact OE2-NE 2.7Å; E175-R177 PolarHBondContact OE2-NE 2.93Å; E175-R177 IonicContact OE2-NH2 3.27Å; E175-R177 PolarHBondContact OE2-NH2 3.11Å | ||
| 176 | K | 56.3 | Low | 59.6 | Low | 145 Ų | 145 | 132.4 Ų | 132.4 | 63% | 0.63 | 66% | 0.664 | S | S | * | * | trans | -73 | 89.3 | 174.2 | -174.4 | 177.8 | 170.9 | -163.2 | 0 | 109.7 | I174 Y178 | I174-K176 PolarHBondContact O-N 3.38Å; K176-Y178 HydrophobicContact CB-CE2 4.35Å; K176-Y178 HydrophobicContact CD-CE1 4.15Å; K176-Y178 HydrophobicContact CD-CE2 4.09Å; K176-Y178 WeakPolarHBondContact CD-OH 3.38Å; K176-Y178 VanDerWaalsContact CE-CE1 3.49Å; K176-Y178 VanDerWaalsContact CE-CZ 3.49Å; K176-Y178 WeakPolarHBondContact CE-OH 3.42Å; K176-Y178 HydrophobicContact CG-CE2 4.07Å; K176-Y178 PolarHBondContact NZ-OH 3.04Å; K176-Y178 WeakPolarHBondContact O-CD2 3.14Å; K176-Y178 WeakPolarHBondContact O-CE2 3.42Å; K176-Y178 PolarHBondContact O-N 3.09Å; K176-Y178 VanDerWaalsContact O-N 3.11Å | ||
| 177 | R | 50.9 | Low | 57.4 | Low | 196 Ų | 196 | 133.4 Ų | 133.4 | 74% | 0.74 | 67% | 0.674 | S | S | * | * | trans | -65.9 | 106.7 | 176.3 | -68.4 | -168.3 | 171.6 | -134.4 | -14.3 | 111.4 | E175 G179 | E175-R177 VanDerWaalsContact C-N 3.35Å; E175-R177 HydrophobicContact CG-CG 4.24Å; E175-R177 PolarHBondContact O-N 3.15Å; E175-R177 IonicContact OE2-CZ 2.68Å; E175-R177 VanDerWaalsContact OE2-CZ 3.29Å; E175-R177 IonicContact OE2-NE 2.7Å; E175-R177 PolarHBondContact OE2-NE 2.93Å; E175-R177 IonicContact OE2-NH2 3.27Å; E175-R177 PolarHBondContact OE2-NH2 3.11Å; R177-G179 PolarHBondContact O-N 2.84Å | ||
| 178 | Y | 45 | Very low | 55.8 | Low | 185 Ų | 185 | 135 Ų | 135 | 73% | 0.725 | 67% | 0.67 | S | S | * | * | trans | -80.1 | 100.1 | 167.8 | -63.6 | -86.4 | 0 | 0 | 0 | 109.2 | K176 | K176-Y178 HydrophobicContact CB-CE2 4.35Å; K176-Y178 HydrophobicContact CD-CE1 4.15Å; K176-Y178 HydrophobicContact CD-CE2 4.09Å; K176-Y178 WeakPolarHBondContact CD-OH 3.38Å; K176-Y178 VanDerWaalsContact CE-CE1 3.49Å; K176-Y178 VanDerWaalsContact CE-CZ 3.49Å; K176-Y178 WeakPolarHBondContact CE-OH 3.42Å; K176-Y178 HydrophobicContact CG-CE2 4.07Å; K176-Y178 PolarHBondContact NZ-OH 3.04Å; K176-Y178 WeakPolarHBondContact O-CD2 3.14Å; K176-Y178 WeakPolarHBondContact O-CE2 3.42Å; K176-Y178 PolarHBondContact O-N 3.09Å; K176-Y178 VanDerWaalsContact O-N 3.11Å | ||
| 179 | G | 40.2 | Very low | 53.5 | Low | 72 Ų | 72 | 129.4 Ų | 129.4 | 74% | 0.742 | 66% | 0.664 | S | S | * | * | trans | 26.8 | 116.3 | 164.7 | 0 | 0 | 0 | 0 | 0 | 121.4 | R177 | R177-G179 PolarHBondContact O-N 2.84Š| ||
| 180 | L | 39.3 | Very low | 51.6 | Low | 171 Ų | 171 | 128.3 Ų | 128.3 | 90% | 0.895 | 66% | 0.664 | S | S | * | * | -165.6 | 96.3 | 119.7 | -167.8 | 77 | 0 | 0 | 0 | 111.4 | |||||
| 181 | H | 35.9 | Very low | 49.4 | Very low | 168 Ų | 168 | 133 Ų | 133 | 78% | 0.778 | 68% | 0.682 | S | S | * | * | trans | -157.8 | 79.3 | 151.8 | -165.3 | -92.4 | 0 | 0 | 0 | 110.5 | H183 | H181-H183 PolarHBondContact O-N 2.87Å; H181-H183 VanDerWaalsContact O-N 3.1Å | ||
| 182 | E | 39.1 | Very low | 46.7 | Very low | 193 Ų | 193 | 135.6 Ų | 135.6 | 90% | 0.902 | 70% | 0.703 | S | S | * | * | trans | -73.7 | 93.1 | 171.6 | -175.5 | -171.4 | 123.4 | 0 | 0 | 109.7 | ||||
| 183 | H | 38.2 | Very low | 44.3 | Very low | 115 Ų | 115 | 145.1 Ų | 145.1 | 53% | 0.532 | 73% | 0.732 | S | S | . | * | trans | -156.1 | 96.1 | 160.7 | -165.7 | -98.7 | 0 | 0 | 0 | 114.2 | H181 | H181-H183 PolarHBondContact O-N 2.87Å; H181-H183 VanDerWaalsContact O-N 3.1Å | ||
| 184 | R | 33.3 | Very low | 41.9 | Very low | 188 Ų | 188 | 142.6 Ų | 142.6 | 71% | 0.709 | 74% | 0.737 | S | S | * | * | trans | 78.7 | 115.8 | 137 | -151.4 | 153.4 | 86.3 | -161.2 | 16.9 | 121 | ||||
| 185 | D | 36.2 | Very low | 39.7 | Very low | 152 Ų | 152 | 144.2 Ų | 144.2 | 81% | 0.813 | 76% | 0.758 | S | S | * | * | trans | 56.9 | 121.6 | 145.6 | -51.1 | -15 | 0 | 0 | 0 | 121.7 | ||||
| 186 | G | 31.5 | Very low | 38.2 | Very low | 79 Ų | 79 | 143.3 Ų | 143.3 | 81% | 0.814 | 78% | 0.775 | S | S | * | * | trans | 163.5 | 99 | 164.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 187 | S | 35.6 | Very low | 37.1 | Very low | 108 Ų | 108 | 140.6 Ų | 140.6 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | -65.8 | 145.3 | 175.6 | -177.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 188 | P | 50.8 | Low | 36.3 | Very low | 122 Ų | 122 | 135.1 Ų | 135.1 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | trans | -70.6 | 145.9 | 170.5 | 30.6 | -35.7 | 0 | 0 | 0 | 111.7 | ||||
| 189 | T | 37.6 | Very low | 35.9 | Very low | 138 Ų | 138 | 135.8 Ų | 135.8 | 85% | 0.847 | 80% | 0.803 | S | S | * | * | trans | -138.7 | 140.5 | 170.9 | -37.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 190 | D | 33.9 | Very low | 35.7 | Very low | 112 Ų | 112 | 139.6 Ų | 139.6 | 60% | 0.599 | 81% | 0.806 | S | S | * | * | trans | -82.8 | 164.8 | 179.3 | 176.4 | 27.2 | 0 | 0 | 0 | 112.1 | ||||
| 191 | R | 38 | Very low | 36.2 | Very low | 217 Ų | 217 | 137.7 Ų | 137.7 | 82% | 0.819 | 80% | 0.804 | S | S | * | * | trans | 71.9 | 156.1 | 170.6 | -38.2 | -174.7 | -174.8 | 148.5 | 16.7 | 114.5 | ||||
| 192 | S | 30.2 | Very low | 36.1 | Very low | 114 Ų | 114 | 133.3 Ų | 133.3 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | cis | -151.9 | 167.5 | 15.6 | -173.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 193 | W | 36.6 | Very low | 35.7 | Very low | 256 Ų | 256 | 128.1 Ų | 128.1 | 97% | 0.97 | 80% | 0.802 | S | S | * | * | trans | -71.6 | 152.2 | 160.7 | -123.8 | -41 | 0 | 0 | 0 | 111.2 | ||||
| 194 | G | 31.1 | Very low | 35.5 | Very low | 62 Ų | 62 | 125.8 Ų | 125.8 | 64% | 0.639 | 81% | 0.81 | S | S | * | * | trans | 117.9 | 125.9 | 144.4 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 195 | S | 31.9 | Very low | 35.6 | Very low | 136 Ų | 136 | 127 Ų | 127 | 95% | 0.951 | 82% | 0.824 | S | S | * | * | trans | 54.4 | 140.3 | 153.7 | -58 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 196 | G | 31.1 | Very low | 35.4 | Very low | 80 Ų | 80 | 123.6 Ų | 123.6 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | cis | 159.1 | 174.8 | -3.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 197 | G | 32.9 | Very low | 35.7 | Very low | 88 Ų | 88 | 126.4 Ų | 126.4 | 91% | 0.907 | 83% | 0.831 | S | S | * | * | trans | 96.6 | 143.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 198 | G | 33 | Very low | 35.5 | Very low | 81 Ų | 81 | 124.8 Ų | 124.8 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | trans | 137 | 93.4 | -177 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 199 | Q | 36.6 | Very low | 34.7 | Very low | 200 Ų | 200 | 123.1 Ų | 123.1 | 94% | 0.935 | 84% | 0.837 | S | S | * | * | trans | -97.6 | 148.8 | 176.6 | -73.4 | 173.3 | 91.9 | 0 | 0 | 110.7 | ||||
| 200 | D | 37.1 | Very low | 34.5 | Very low | 152 Ų | 152 | 120.4 Ų | 120.4 | 81% | 0.813 | 84% | 0.836 | S | S | * | * | trans | -53.9 | 165.4 | 164.1 | -92.3 | -58.4 | 0 | 0 | 0 | 112.8 | ||||
| 201 | P | 49.5 | Very low | 34.7 | Very low | 130 Ų | 130 | 124.1 Ų | 124.1 | 84% | 0.844 | 85% | 0.85 | S | S | * | * | cis | -138.6 | 165.1 | 29.9 | 40.5 | -22.6 | 0 | 0 | 0 | 118.3 | ||||
| 202 | G | 33.3 | Very low | 35.2 | Very low | 77 Ų | 77 | 118.8 Ų | 118.8 | 79% | 0.794 | 84% | 0.843 | S | S | * | * | trans | -137.8 | 104.7 | 169.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 203 | G | 31 | Very low | 35.7 | Very low | 83 Ų | 83 | 122.4 Ų | 122.4 | 86% | 0.856 | 85% | 0.845 | S | S | * | * | trans | -173.3 | 151.6 | 168 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 204 | G | 35.2 | Very low | 35.5 | Very low | 67 Ų | 67 | 115 Ų | 115 | 69% | 0.691 | 84% | 0.838 | S | S | * | * | cis | 172.4 | 161.2 | -5.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 205 | Q | 34.8 | Very low | 35.5 | Very low | 214 Ų | 214 | 115.5 Ų | 115.5 | 100% | 1 | 84% | 0.843 | S | S | * | * | trans | 70 | 149.4 | -177.7 | -52.8 | 179.5 | 92.3 | 0 | 0 | 116.4 | ||||
| 206 | G | 31.3 | Very low | 35.7 | Very low | 80 Ų | 80 | 117.5 Ų | 117.5 | 83% | 0.825 | 84% | 0.84 | S | S | * | * | trans | 173.3 | 113.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 207 | S | 37.9 | Very low | 36.3 | Very low | 138 Ų | 138 | 119.4 Ų | 119.4 | 97% | 0.965 | 84% | 0.837 | S | S | * | * | trans | -89 | 155.4 | -175.5 | -171.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 208 | G | 32.2 | Very low | 36.2 | Very low | 74 Ų | 74 | 118.9 Ų | 118.9 | 76% | 0.763 | 83% | 0.825 | S | S | * | * | trans | 166.8 | 123.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 209 | G | 34.4 | Very low | 36.2 | Very low | 87 Ų | 87 | 123.6 Ų | 123.6 | 90% | 0.897 | 83% | 0.827 | S | S | * | * | trans | -103.4 | 154.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 210 | G | 32.8 | Very low | 36 | Very low | 81 Ų | 81 | 123.8 Ų | 123.8 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | trans | -173.1 | 120 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 211 | Q | 37.1 | Very low | 35.7 | Very low | 189 Ų | 189 | 127.6 Ų | 127.6 | 88% | 0.883 | 83% | 0.831 | S | S | * | * | trans | -119.2 | 171.1 | 157.4 | -113 | -156.2 | -23.4 | 0 | 0 | 106.9 | ||||
| 212 | P | 50.3 | Low | 34.9 | Very low | 106 Ų | 106 | 128.4 Ų | 128.4 | 69% | 0.688 | 83% | 0.828 | S | S | * | * | cis | -136.4 | -174.9 | 13.5 | 34.5 | -12.7 | 0 | 0 | 0 | 115.4 | ||||
| 213 | K | 39.8 | Very low | 35.1 | Very low | 189 Ų | 189 | 130.4 Ų | 130.4 | 82% | 0.822 | 83% | 0.827 | S | S | * | * | 135.5 | 116 | 115.6 | -165.3 | 171.2 | -178.2 | -178.4 | 0 | 117 | |||||
| 214 | A | 32.3 | Very low | 35 | Very low | 101 Ų | 101 | 130.9 Ų | 130.9 | 84% | 0.835 | 82% | 0.816 | S | S | * | * | trans | 57.7 | 133.5 | 147.8 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 215 | G | 30.1 | Very low | 34.7 | Very low | 72 Ų | 72 | 136.4 Ų | 136.4 | 74% | 0.742 | 82% | 0.824 | S | S | * | * | trans | 170.5 | 77 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 216 | M | 36.4 | Very low | 35 | Very low | 179 Ų | 179 | 136.9 Ų | 136.9 | 88% | 0.882 | 82% | 0.817 | S | S | * | * | trans | -106.5 | 154.6 | 168.3 | -58.2 | -91.9 | 81.4 | 0 | 0 | 108.2 | ||||
| 217 | P | 45.4 | Very low | 35 | Very low | 119 Ų | 119 | 139.1 Ų | 139.1 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | -148.2 | 176.4 | 92.5 | 41 | -25.9 | 0 | 0 | 0 | 115.5 | |||||
| 218 | A | 30.8 | Very low | 34.9 | Very low | 78 Ų | 78 | 140.7 Ų | 140.7 | 65% | 0.645 | 81% | 0.809 | S | S | * | * | trans | 51.2 | 103.8 | 149.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 219 | M | 31.8 | Very low | 35.1 | Very low | 180 Ų | 180 | 142.6 Ų | 142.6 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | 76.8 | 108.3 | 53.3 | 93.2 | -156 | -161.2 | 0 | 0 | 115 | |||||
| 220 | E | 32.5 | Very low | 34.9 | Very low | 203 Ų | 203 | 147.3 Ų | 147.3 | 95% | 0.949 | 81% | 0.807 | S | S | * | * | -150.2 | 173.8 | 127.3 | -125.7 | -175.4 | 102.4 | 0 | 0 | 110.6 | |||||
| 221 | R | 31.3 | Very low | 35.2 | Very low | 232 Ų | 232 | 150.4 Ų | 150.4 | 88% | 0.875 | 81% | 0.809 | S | S | * | * | trans | -100.4 | 151.9 | -162.4 | -68.4 | -175.6 | 173.3 | 103 | -4.8 | 113.6 | ||||
| 222 | L | 32.3 | Very low | 35 | Very low | 148 Ų | 148 | 149 Ų | 149 | 78% | 0.775 | 81% | 0.807 | S | S | * | * | trans | -59.3 | 152.5 | 157.6 | -141.7 | 77.2 | 0 | 0 | 0 | 109.9 | ||||
| 223 | P | 36.5 | Very low | 34.2 | Very low | 119 Ų | 119 | 148.2 Ų | 148.2 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | -122.4 | 152.8 | 105.4 | 35.3 | -34 | 0 | 0 | 0 | 112.7 | |||||
| 224 | S | 29.8 | Very low | 34.3 | Very low | 92 Ų | 92 | 144.7 Ų | 144.7 | 64% | 0.643 | 81% | 0.808 | S | S | * | * | trans | -96.4 | 122.7 | 174.3 | -178.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 225 | E | 28.7 | Very low | 35.3 | Very low | 183 Ų | 183 | 145.6 Ų | 145.6 | 86% | 0.855 | 81% | 0.805 | S | S | * | * | trans | -121.1 | 132.7 | 161.1 | -72.8 | -154.8 | 79.3 | 0 | 0 | 110.4 | ||||
| 226 | R | 41.2 | Very low | 35.8 | Very low | 224 Ų | 224 | 148.1 Ų | 148.1 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 127.2 | 163.2 | -71 | -178.8 | 175.6 | 90.3 | -6.7 | 108.1 | ||
| 227 | P | 31.9 | Very low | 35.8 | Very low | 127 Ų | 127 | 145.1 Ų | 145.1 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 132.9 | 148.4 | -22.4 | 35.9 | 0 | 0 | 0 | 110 | ||
| 228 | Q | 34.8 | Very low | 35.4 | Very low | 172 Ų | 172 | 148.7 Ų | 148.7 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 158.2 | 177.3 | -167.4 | 168.5 | 16.7 | 0 | 0 | 110.5 | Q230 | Q228-Q230 PolarHBondContact O-N 2.94Š|
| 229 | P | 36.1 | Very low | 35.9 | Very low | 114 Ų | 114 | 152 Ų | 152 | 74% | 0.74 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -57 | 131.3 | 177 | -26.7 | 36 | 0 | 0 | 0 | 112.2 | V231 | P229-V231 PolarHBondContact O-N 3.16Š|
| 230 | Q | 30.8 | Very low | 36.1 | Very low | 186 Ų | 186 | 147.1 Ų | 147.1 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | trans | -76.4 | 90.6 | -178.4 | -66.2 | -170.7 | 58.5 | 0 | 0 | 110.9 | Q228 L232 | Q228-Q230 PolarHBondContact O-N 2.94Å; Q230-L232 PolarHBondContact O-N 3.42Å; Q230-L232 VanDerWaalsContact O-N 3.11Å | ||
| 231 | V | 39.4 | Very low | 36.1 | Very low | 145 Ų | 145 | 140.4 Ų | 140.4 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | trans | -69.5 | 97.6 | 162.1 | 176.3 | 0 | 0 | 0 | 0 | 107.6 | P229 | P229-V231 PolarHBondContact O-N 3.16Š| ||
| 232 | L | 33 | Very low | 36.5 | Very low | 161 Ų | 161 | 137.4 Ų | 137.4 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 132 | 173 | -164.5 | 63.8 | 0 | 0 | 0 | 110.1 | Q230 | Q230-L232 PolarHBondContact O-N 3.42Å; Q230-L232 VanDerWaalsContact O-N 3.11Å |
| 233 | A | 33.6 | Very low | 37 | Very low | 89 Ų | 89 | 140.8 Ų | 140.8 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 146.5 | -163.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 234 | S | 41 | Very low | 36.9 | Very low | 114 Ų | 114 | 141.7 Ų | 141.7 | 80% | 0.797 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 137 | 165.9 | -46.1 | 0 | 0 | 0 | 0 | 111 | ||
| 235 | P | 53.3 | Low | 37.2 | Very low | 120 Ų | 120 | 143.4 Ų | 143.4 | 78% | 0.779 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 147.6 | 168.6 | 31.1 | -33.9 | 0 | 0 | 0 | 111.1 | ||
| 236 | P | 40.3 | Very low | 37.5 | Very low | 125 Ų | 125 | 139.4 Ų | 139.4 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 136 | -174 | 31.9 | -34.8 | 0 | 0 | 0 | 114.4 | ||
| 237 | V | 37.6 | Very low | 37.3 | Very low | 117 Ų | 117 | 136.6 Ų | 136.6 | 71% | 0.709 | 80% | 0.801 | S | S | * | * | trans | 7.6 | 129.3 | 150.6 | -172.6 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 238 | Q | 36.6 | Very low | 37.4 | Very low | 194 Ų | 194 | 135 Ų | 135 | 91% | 0.907 | 80% | 0.798 | S | S | * | * | trans | -129.6 | 117.6 | 137.1 | -172.2 | 161.2 | 75.2 | 0 | 0 | 110.4 | G240 | Q238-G240 PolarHBondContact O-N 2.9Š| ||
| 239 | N | 41.4 | Very low | 37.9 | Very low | 148 Ų | 148 | 132.1 Ų | 132.1 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -78.4 | 103.3 | 178.3 | -80.5 | -41.5 | 0 | 0 | 0 | 110.6 | G241 | N239-G241 PolarHBondContact O-N 2.96Š| ||
| 240 | G | 36.1 | Very low | 37.7 | Very low | 77 Ų | 77 | 132.5 Ų | 132.5 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | trans | -75.5 | 110.4 | 163.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q238 L242 | Q238-G240 PolarHBondContact O-N 2.9Å; G240-L242 PolarHBondContact O-N 3.29Å | ||
| 241 | G | 32.7 | Very low | 37.7 | Very low | 62 Ų | 62 | 128 Ų | 128 | 64% | 0.639 | 79% | 0.793 | S | S | * | * | trans | -66.4 | 130.9 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | N239 R243 | N239-G241 PolarHBondContact O-N 2.96Å; G241-R243 WeakPolarHBondContact O-CG 3.47Å; G241-R243 PolarHBondContact O-N 3.1Å | ||
| 242 | L | 39.2 | Very low | 37.4 | Very low | 168 Ų | 168 | 128.8 Ų | 128.8 | 88% | 0.88 | 79% | 0.791 | S | S | * | * | trans | -51.1 | 130.3 | 158.5 | 179.5 | 67.8 | 0 | 0 | 0 | 108.9 | G240 | G240-L242 PolarHBondContact O-N 3.29Š| ||
| 243 | R | 42.2 | Very low | 37.5 | Very low | 220 Ų | 220 | 130.5 Ų | 130.5 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | trans | -126.6 | 126 | 175.1 | -46 | -142.6 | 82.3 | -126.7 | -1.3 | 109 | G241 | G241-R243 WeakPolarHBondContact O-CG 3.47Å; G241-R243 PolarHBondContact O-N 3.1Å | ||
| 244 | D | 35 | Very low | 37.4 | Very low | 138 Ų | 138 | 129.7 Ų | 129.7 | 74% | 0.738 | 80% | 0.795 | S | S | * | * | trans | -61.2 | 156.8 | -178.5 | -61.2 | -85.7 | 0 | 0 | 0 | 113.2 | ||||
| 245 | S | 35.9 | Very low | 37.4 | Very low | 127 Ų | 127 | 131.5 Ų | 131.5 | 89% | 0.888 | 80% | 0.796 | S | S | * | * | trans | -148 | 61.8 | 168.9 | -72.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 246 | S | 36.5 | Very low | 37.3 | Very low | 100 Ų | 100 | 131.2 Ų | 131.2 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | trans | -104.8 | 115.2 | 177.7 | -70.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 247 | L | 35.7 | Very low | 37.1 | Very low | 164 Ų | 164 | 136.9 Ų | 136.9 | 86% | 0.859 | 80% | 0.8 | S | S | * | * | trans | 69.4 | 107.4 | 148.5 | -54.2 | 173.4 | 0 | 0 | 0 | 120.8 | ||||
| 248 | A | 34.7 | Very low | 36.9 | Very low | 93 Ų | 93 | 135.8 Ų | 135.8 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | 71.2 | 171.7 | 127.3 | 0 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 249 | P | 45.8 | Very low | 36.8 | Very low | 112 Ų | 112 | 131.9 Ų | 131.9 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | cis | -132.7 | -171.9 | -40.1 | 32.7 | -13.8 | 0 | 0 | 0 | 113.9 | ||||
| 250 | C | 31.6 | Very low | 36.4 | Very low | 123 Ų | 123 | 129.3 Ų | 129.3 | 83% | 0.831 | 80% | 0.796 | S | S | * | * | trans | 73.9 | 152.7 | 161 | -64.1 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 251 | A | 31.3 | Very low | 36.5 | Very low | 90 Ų | 90 | 133.9 Ų | 133.9 | 74% | 0.744 | 80% | 0.797 | S | S | * | * | cis | -162.6 | 156.2 | -17.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 252 | L | 33.1 | Very low | 37.4 | Very low | 162 Ų | 162 | 135.7 Ų | 135.7 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | trans | 45.5 | 110 | 139.7 | -168.2 | 77.4 | 0 | 0 | 0 | 122.3 | ||||
| 253 | E | 33.7 | Very low | 37.3 | Very low | 197 Ų | 197 | 133.2 Ų | 133.2 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | -177.6 | 145.7 | 129 | -106.1 | -176.1 | 70 | 0 | 0 | 108.8 | |||||
| 254 | G | 31.6 | Very low | 37 | Very low | 72 Ų | 72 | 130 Ų | 130 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | cis | -167.8 | 157 | -9.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 255 | N | 40.6 | Very low | 37.1 | Very low | 153 Ų | 153 | 134.2 Ų | 134.2 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -157.9 | 136.6 | -177.1 | -177.3 | 13.7 | 0 | 0 | 0 | 113.2 | ||||
| 256 | P | 52.1 | Low | 37.2 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | trans | -124.8 | 110.3 | 171.8 | 36.6 | -20.9 | 0 | 0 | 0 | 116.4 | ||||
| 257 | R | 36.1 | Very low | 37.2 | Very low | 245 Ų | 245 | 139.5 Ų | 139.5 | 93% | 0.925 | 79% | 0.787 | S | S | * | * | trans | 65.6 | 155.2 | 155 | -80.1 | 176.4 | 168.1 | 172.3 | -4.1 | 118.2 | ||||
| 258 | A | 33.8 | Very low | 37.4 | Very low | 94 Ų | 94 | 135 Ų | 135 | 78% | 0.777 | 78% | 0.78 | S | S | * | * | cis | -139.3 | 176.1 | -3.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 259 | S | 34.1 | Very low | 37.5 | Very low | 111 Ų | 111 | 142.3 Ų | 142.3 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | cis | -159.3 | 151.4 | 22 | -167 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 260 | A | 33.5 | Very low | 36.9 | Very low | 94 Ų | 94 | 140.1 Ų | 140.1 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | trans | 38.2 | 106.6 | 154.7 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 261 | E | 38.1 | Very low | 37.6 | Very low | 174 Ų | 174 | 140.6 Ų | 140.6 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | trans | -84 | -163.9 | 141.1 | -124.9 | -155.2 | 93.6 | 0 | 0 | 109.1 | ||||
| 262 | P | 51.6 | Low | 38 | Very low | 99 Ų | 99 | 141.6 Ų | 141.6 | 64% | 0.643 | 79% | 0.789 | S | S | * | * | cis | -120.2 | -159.6 | -1.5 | 37.1 | -15.2 | 0 | 0 | 0 | 111.6 | ||||
| 263 | T | 37.6 | Very low | 38.8 | Very low | 116 Ų | 116 | 140.2 Ų | 140.2 | 71% | 0.712 | 79% | 0.789 | S | S | * | * | cis | -149.6 | -166.7 | 11.1 | -11.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 264 | L | 35.9 | Very low | 38.6 | Very low | 154 Ų | 154 | 134.5 Ų | 134.5 | 81% | 0.806 | 78% | 0.784 | S | S | * | * | cis | -150.5 | 169.2 | 20.4 | -172.9 | 56.6 | 0 | 0 | 0 | 110.8 | ||||
| 265 | R | 35.9 | Very low | 39 | Very low | 225 Ų | 225 | 138.9 Ų | 138.9 | 85% | 0.849 | 79% | 0.789 | S | S | * | * | trans | -137.6 | 155.2 | 168.9 | -80.1 | -175.7 | 165.5 | -144.6 | 0.6 | 110.4 | ||||
| 266 | D | 39.1 | Very low | 39.2 | Very low | 117 Ų | 117 | 137.7 Ų | 137.7 | 63% | 0.626 | 79% | 0.79 | S | S | * | * | 167 | 162.1 | 98.9 | -164.6 | 30.5 | 0 | 0 | 0 | 113.3 | |||||
| 267 | R | 35.9 | Very low | 38.4 | Very low | 221 Ų | 221 | 137.9 Ų | 137.9 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | 32.2 | 144 | 161.2 | -77.9 | 168 | -177.7 | 166.8 | -2.4 | 122 | ||||
| 268 | G | 40.3 | Very low | 38.6 | Very low | 69 Ų | 69 | 135.1 Ų | 135.1 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | cis | 113.8 | 92.3 | -3.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 269 | R | 35.6 | Very low | 38.7 | Very low | 247 Ų | 247 | 138.6 Ų | 138.6 | 93% | 0.932 | 79% | 0.787 | S | S | * | * | trans | -166.3 | 149.9 | 164.1 | -160.9 | 166 | -77.7 | -105.4 | -1.9 | 111.6 | ||||
| 270 | G | 32.9 | Very low | 38.7 | Very low | 66 Ų | 66 | 137.9 Ų | 137.9 | 68% | 0.68 | 79% | 0.787 | S | S | * | * | trans | -99.2 | -160.4 | 166.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 271 | P | 47.6 | Very low | 38.8 | Very low | 134 Ų | 134 | 140.5 Ų | 140.5 | 87% | 0.87 | 79% | 0.789 | S | S | * | * | cis | -130.7 | -171.8 | 7.3 | 42.6 | -25.6 | 0 | 0 | 0 | 114.9 | ||||
| 272 | S | 39.3 | Very low | 38.5 | Very low | 111 Ų | 111 | 136 Ų | 136 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | trans | -75.5 | 178.4 | 163.9 | -42.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 273 | P | 50.2 | Low | 37.9 | Very low | 132 Ų | 132 | 139.5 Ų | 139.5 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | cis | -134.1 | -177.9 | 0.7 | 43.3 | -26.7 | 0 | 0 | 0 | 115.4 | ||||
| 274 | G | 29 | Very low | 37.7 | Very low | 78 Ų | 78 | 142.6 Ų | 142.6 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | 167 | 130.4 | 162.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 275 | L | 39.7 | Very low | 37.7 | Very low | 163 Ų | 163 | 140.3 Ų | 140.3 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | -99.4 | 163.3 | 161 | -84.9 | 168.4 | 0 | 0 | 0 | 109.6 | ||||
| 276 | P | 46.3 | Very low | 38 | Very low | 128 Ų | 128 | 138.8 Ų | 138.8 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | -139.9 | 171.9 | 118.2 | 38.8 | -27.8 | 0 | 0 | 0 | 114.9 | |||||
| 277 | T | 34.6 | Very low | 38.5 | Very low | 117 Ų | 117 | 137.9 Ų | 137.9 | 72% | 0.718 | 80% | 0.8 | S | S | * | * | trans | -110.4 | 140.2 | -171.6 | -50.6 | 0 | 0 | 0 | 0 | 112.9 | E279 | T277-E279 HydrophobicContact CG2-CG 4.22Š| ||
| 278 | Q | 39.3 | Very low | 38.5 | Very low | 187 Ų | 187 | 134.5 Ų | 134.5 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -163.8 | 131.6 | 150.5 | -139 | 162.6 | 88.9 | 0 | 0 | 108.2 | ||||
| 279 | E | 36.8 | Very low | 38.6 | Very low | 168 Ų | 168 | 136.9 Ų | 136.9 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | cis | 87.2 | 89 | 28.1 | -68.9 | -113.3 | 82.2 | 0 | 0 | 116.5 | T277 | T277-E279 HydrophobicContact CG2-CG 4.22Š| ||
| 280 | A | 34.4 | Very low | 38.9 | Very low | 95 Ų | 95 | 130.1 Ų | 130.1 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | trans | -171.7 | 92.9 | 151.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 281 | N | 34.9 | Very low | 39.3 | Very low | 150 Ų | 150 | 132.9 Ų | 132.9 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | 68.8 | 121.9 | 79.1 | -162.2 | -2.2 | 0 | 0 | 0 | 114.2 | |||||
| 282 | G | 32.3 | Very low | 39 | Very low | 79 Ų | 79 | 135.5 Ų | 135.5 | 81% | 0.814 | 79% | 0.789 | S | S | * | * | trans | 175.6 | 94 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 283 | Q | 38.2 | Very low | 39 | Very low | 172 Ų | 172 | 138.6 Ų | 138.6 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -127 | 129.7 | -157.6 | 175.1 | -175 | -70.9 | 0 | 0 | 112.7 | ||||
| 284 | Q | 34.6 | Very low | 38.3 | Very low | 182 Ų | 182 | 137.7 Ų | 137.7 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | trans | -151.9 | 105.2 | 161.7 | -153.1 | 158.8 | 0.6 | 0 | 0 | 115.7 | ||||
| 285 | S | 35.7 | Very low | 38.8 | Very low | 105 Ų | 105 | 139.5 Ų | 139.5 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | 47.1 | 117 | 136.1 | -48.2 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 286 | K | 42.1 | Very low | 39 | Very low | 194 Ų | 194 | 139.7 Ų | 139.7 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | -79.6 | 178.9 | 133.9 | -114.2 | -156.2 | 173.7 | -169.6 | 0 | 109.5 | ||||
| 287 | P | 50 | Low | 39.5 | Very low | 98 Ų | 98 | 139.6 Ų | 139.6 | 64% | 0.636 | 78% | 0.784 | S | S | * | * | cis | -113.7 | -162.3 | 5.4 | 44.1 | -29.3 | 0 | 0 | 0 | 112 | ||||
| 288 | D | 34.6 | Very low | 39.9 | Very low | 149 Ų | 149 | 145.8 Ų | 145.8 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | -151.4 | 176.8 | 72.2 | -126.4 | -40.1 | 0 | 0 | 0 | 115.5 | |||||
| 289 | T | 42 | Very low | 40 | Very low | 119 Ų | 119 | 140.6 Ų | 140.6 | 73% | 0.73 | 79% | 0.791 | S | S | * | * | trans | -122.9 | 138.3 | -175.4 | -61.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 290 | S | 42.4 | Very low | 40.3 | Very low | 106 Ų | 106 | 137.7 Ų | 137.7 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -158.2 | 133.7 | 150.3 | -168.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 291 | D | 42 | Very low | 40.6 | Very low | 124 Ų | 124 | 137.1 Ų | 137.1 | 66% | 0.663 | 80% | 0.799 | S | S | * | * | trans | -67 | 162 | 158.4 | -66.1 | -95.3 | 0 | 0 | 0 | 111 | ||||
| 292 | H | 40 | Very low | 41 | Very low | 189 Ų | 189 | 133.7 Ų | 133.7 | 88% | 0.875 | 80% | 0.799 | S | S | * | * | -174.8 | 171.5 | 107.5 | -88.8 | -41.5 | 0 | 0 | 0 | 112.8 | |||||
| 293 | Q | 40.3 | Very low | 41.7 | Very low | 176 Ų | 176 | 142.9 Ų | 142.9 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | trans | -122.6 | 165.8 | -161 | -151.5 | -168.2 | 102.9 | 0 | 0 | 111.1 | ||||
| 294 | V | 35.3 | Very low | 41.8 | Very low | 112 Ų | 112 | 141.4 Ų | 141.4 | 68% | 0.679 | 83% | 0.825 | S | S | * | * | trans | 67.1 | 117 | 161.4 | -180 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 295 | S | 39.2 | Very low | 42.2 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 81% | 0.811 | 82% | 0.824 | S | S | * | * | -172.3 | 137.1 | 117.2 | -81.9 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 296 | L | 44.9 | Very low | 42.6 | Very low | 168 Ų | 168 | 141.2 Ų | 141.2 | 88% | 0.88 | 83% | 0.829 | S | S | * | * | trans | -96.5 | 143.5 | 164.2 | -81.7 | 159.9 | 0 | 0 | 0 | 109.6 | ||||
| 297 | P | 56.4 | Low | 42.6 | Very low | 125 Ų | 125 | 138.1 Ų | 138.1 | 81% | 0.812 | 83% | 0.828 | S | S | * | * | trans | -87.5 | 149.4 | 151.6 | 33.4 | -28.9 | 0 | 0 | 0 | 110.8 | ||||
| 298 | R | 42.1 | Very low | 42.2 | Very low | 247 Ų | 247 | 140.6 Ų | 140.6 | 93% | 0.932 | 84% | 0.84 | S | S | * | * | trans | -128.8 | 115.7 | -174.1 | 170.9 | -176 | 168.7 | 170.8 | -2.3 | 111.4 | ||||
| 299 | G | 41.7 | Very low | 42.7 | Very low | 78 Ų | 78 | 140 Ų | 140 | 80% | 0.804 | 84% | 0.843 | S | S | * | * | trans | 72.4 | 179.9 | 168.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 300 | A | 42.3 | Very low | 42.7 | Very low | 107 Ų | 107 | 141.5 Ų | 141.5 | 88% | 0.884 | 85% | 0.851 | S | S | * | * | cis | -159.4 | 157.7 | -7.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 301 | G | 40.6 | Very low | 42.7 | Very low | 84 Ų | 84 | 144.2 Ų | 144.2 | 87% | 0.866 | 86% | 0.859 | S | S | * | * | trans | 84.2 | 152.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 302 | G | 44.5 | Very low | 42.8 | Very low | 78 Ų | 78 | 145.9 Ų | 145.9 | 80% | 0.804 | 88% | 0.875 | S | S | * | * | cis | 136.8 | 85.4 | -9.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 303 | M | 46.3 | Very low | 43.1 | Very low | 271 Ų | 271 | 142 Ų | 142 | 100% | 1.335 | 88% | 0.875 | S | S | * | * | trans | -162.6 | 0 | 157.7 | -108 | 177.1 | 172.4 | 0 | 0 | 108.8 |
Retrieved 303 of 303 residues in 56.5 ms
(Link to these results)