| 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 | H | 51.9 | Low | 48.7 | Very low | 253 Ų | 253 | 150.5 Ų | 150.5 | 100% | 1.171 | 85% | 0.847 | S | S | * | * | 0 | 99.1 | 0 | -159.3 | -120.8 | 0 | 0 | 0 | 107.6 | |||||
| 2 | Q | 45.3 | Very low | 48.5 | Very low | 192 Ų | 192 | 149.6 Ų | 149.6 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | trans | -133.2 | 128 | 174.8 | -84 | -176.5 | -100.8 | 0 | 0 | 107.6 | ||||
| 3 | S | 53.9 | Low | 48.1 | Very low | 113 Ų | 113 | 147.9 Ų | 147.9 | 79% | 0.79 | 83% | 0.83 | S | S | * | * | trans | -65.6 | 128.7 | -175.5 | -167 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 4 | L | 51.1 | Low | 48 | Very low | 176 Ų | 176 | 144.5 Ų | 144.5 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | trans | -112.6 | 96.2 | 164.8 | -69.5 | 177 | 0 | 0 | 0 | 108.1 | ||||
| 5 | F | 53.5 | Low | 47.6 | Very low | 189 Ų | 189 | 146.1 Ų | 146.1 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | trans | -63.4 | 143.7 | 170.6 | -150.3 | -102.6 | 0 | 0 | 0 | 109.6 | S7 | F5-S7 PolarHBondContact O-N 2.72Š| ||
| 6 | M | 58.4 | Low | 47.7 | Very low | 163 Ų | 163 | 144.9 Ų | 144.9 | 80% | 0.803 | 80% | 0.803 | S | S | * | * | trans | -41.7 | 130.8 | 176.6 | -66.9 | 155.5 | 55.6 | 0 | 0 | 113.7 | ||||
| 7 | S | 42.3 | Very low | 47.4 | Very low | 123 Ų | 123 | 142.6 Ų | 142.6 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | 173.9 | 89.4 | 133.8 | -78.4 | 0 | 0 | 0 | 0 | 109.4 | F5 | F5-S7 PolarHBondContact O-N 2.72Š| ||
| 8 | A | 47.2 | Very low | 47.4 | Very low | 93 Ų | 93 | 139.9 Ų | 139.9 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -176 | 73.1 | 147.1 | 0 | 0 | 0 | 0 | 0 | 106 | S10 | A8-S10 PolarHBondContact O-N 3.12Š| ||
| 9 | L | 51.7 | Low | 47.3 | Very low | 182 Ų | 182 | 136.5 Ų | 136.5 | 95% | 0.953 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -58.7 | 89.8 | 143.7 | -81 | 162.6 | 0 | 0 | 0 | 104.5 | A11 | L9-A11 PolarHBondContact O-N 2.67Š|
| 10 | S | 39.7 | Very low | 47.4 | Very low | 73 Ų | 73 | 133.7 Ų | 133.7 | 51% | 0.51 | 75% | 0.753 | S | S | . | * | trans | 21.9 | 99.8 | 153.4 | -176.1 | 0 | 0 | 0 | 0 | 112.4 | A8 H12 | A8-S10 PolarHBondContact O-N 3.12Å; S10-H12 PolarHBondContact O-N 3.49Å; S10-H12 WeakPolarHBondContact OG-CB 3.38Å; S10-H12 PolarHBondContact OG-CD2 2.99Å; S10-H12 VanDerWaalsContact OG-CG 3.26Å | ||
| 11 | A | 40.4 | Very low | 47.4 | Very low | 98 Ų | 98 | 131.9 Ų | 131.9 | 81% | 0.81 | 73% | 0.734 | S | S | * | * | trans | -65.4 | 47.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 111 | L9 P13 | L9-A11 PolarHBondContact O-N 2.67Å; A11-P13 VanDerWaalsContact C-CD 3.49Å; A11-P13 WeakPolarHBondContact O-CD 3.32Å | ||
| 12 | H | 46.4 | Very low | 47.1 | Very low | 140 Ų | 140 | 127.1 Ų | 127.1 | 65% | 0.648 | 71% | 0.713 | S | S | * | * | trans | -98.9 | 99.7 | 165.7 | -73.6 | -124.7 | 0 | 0 | 0 | 105.6 | S10 D14 | S10-H12 PolarHBondContact O-N 3.49Å; S10-H12 WeakPolarHBondContact OG-CB 3.38Å; S10-H12 PolarHBondContact OG-CD2 2.99Å; S10-H12 VanDerWaalsContact OG-CG 3.26Å; H12-D14 HydrophobicContact CB-CB 3.83Å; H12-D14 PolarHBondContact O-N 2.98Å | ||
| 13 | P | 43.2 | Very low | 47.1 | Very low | 128 Ų | 128 | 124 Ų | 124 | 83% | 0.831 | 70% | 0.698 | S | S | * | * | trans | -66.5 | 42.4 | 147.7 | 32.8 | -32.9 | 0 | 0 | 0 | 109.5 | A11 R15 | A11-P13 VanDerWaalsContact C-CD 3.49Å; A11-P13 WeakPolarHBondContact O-CD 3.32Å; P13-R15 PolarHBondContact O-N 3.03Å | ||
| 14 | D | 46.5 | Very low | 47 | Very low | 100 Ų | 100 | 122.9 Ų | 122.9 | 54% | 0.535 | 68% | 0.68 | S | S | . | * | trans | -73.4 | 81.3 | 167.2 | -179.9 | -109.1 | 0 | 0 | 0 | 106.2 | H12 | H12-D14 HydrophobicContact CB-CB 3.83Å; H12-D14 PolarHBondContact O-N 2.98Å | ||
| 15 | R | 42.4 | Very low | 46.4 | Very low | 169 Ų | 169 | 115.9 Ų | 115.9 | 64% | 0.638 | 65% | 0.645 | S | S | * | * | trans | 142.7 | 100 | 146.7 | -84.2 | 165 | -124.6 | -132.5 | -4.2 | 108.2 | P13 L17 | P13-R15 PolarHBondContact O-N 3.03Å; R15-L17 HydrophobicContact CB-CB 3.99Å; R15-L17 HydrophobicContact CB-CD1 3.82Å; R15-L17 HydrophobicContact CB-CG 3.55Å; R15-L17 HydrophobicContact CG-CD1 4.2Å; R15-L17 HydrophobicContact CG-CG 3.85Å; R15-L17 PolarHBondContact O-N 2.75Å | ||
| 16 | S | 49.1 | Very low | 46 | Very low | 126 Ų | 126 | 116 Ų | 116 | 88% | 0.881 | 65% | 0.646 | S | S | * | * | -53.4 | 71.3 | 125.6 | -174.3 | 0 | 0 | 0 | 0 | 108.2 | S18 | S16-S18 PolarHBondContact O-N 2.92Š| |||
| 17 | L | 43 | Very low | 45.4 | Very low | 106 Ų | 106 | 114.8 Ų | 114.8 | 56% | 0.555 | 64% | 0.642 | S | S | * | * | trans | -70.6 | 100.4 | 159.2 | -94.5 | 156.7 | 0 | 0 | 0 | 99.8 | R15 V19 | R15-L17 HydrophobicContact CB-CB 3.99Å; R15-L17 HydrophobicContact CB-CD1 3.82Å; R15-L17 HydrophobicContact CB-CG 3.55Å; R15-L17 HydrophobicContact CG-CD1 4.2Å; R15-L17 HydrophobicContact CG-CG 3.85Å; R15-L17 PolarHBondContact O-N 2.75Å; L17-V19 HydrophobicContact CB-CG2 4.23Å; L17-V19 PolarHBondContact O-N 3.37Å | ||
| 18 | S | 46.8 | Very low | 45.9 | Very low | 94 Ų | 94 | 110.3 Ų | 110.3 | 66% | 0.657 | 61% | 0.608 | S | S | * | * | trans | -50.2 | 96.8 | 150.9 | 59.7 | 0 | 0 | 0 | 0 | 104 | S16 C20 | S16-S18 PolarHBondContact O-N 2.92Å; S18-C20 PolarHBondContact O-N 3.27Å | ||
| 19 | V | 45.3 | Very low | 46.2 | Very low | 75 Ų | 75 | 112.3 Ų | 112.3 | 46% | 0.455 | 61% | 0.613 | S | S | . | * | trans | -72.5 | 72 | 171.9 | -177.6 | 0 | 0 | 0 | 0 | 103.8 | L17 W21 Q23 H24 | L17-V19 HydrophobicContact CB-CG2 4.23Å; L17-V19 PolarHBondContact O-N 3.37Å; V19-W21 PolarHBondContact O-N 3.48Å; V19-Q23 HydrophobicContact CG1-CB 3.95Å; V19-H24 VanDerWaalsContact CG1-CE1 3.49Å; V19-H24 WeakPolarHBondContact CG1-CE1 3.15Å; V19-H24 WeakPolarHBondContact CG1-ND1 3.38Å | ||
| 20 | C | 49.9 | Very low | 46.2 | Very low | 81 Ų | 81 | 106.7 Ų | 106.7 | 55% | 0.547 | 60% | 0.599 | S | S | . | * | trans | -61.3 | 109.5 | 176.7 | -161.9 | 0 | 0 | 0 | 0 | 103.5 | S18 E22 Q23 | S18-C20 PolarHBondContact O-N 3.27Å; C20-E22 WeakPolarHBondContact O-CA 3.21Å; C20-E22 PolarHBondContact O-N 2.93Å; C20-Q23 PolarHBondContact O-N 3.12Å; C20-Q23 VanDerWaalsContact O-N 3.1Å | ||
| 21 | W | 48.3 | Very low | 46.9 | Very low | 95 Ų | 95 | 103.5 Ų | 103.5 | 36% | 0.36 | 58% | 0.576 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 18.9 | -56.7 | 160.5 | -177.4 | -107 | 0 | 0 | 0 | 118.4 | V19 Q23 H24 C25 I34 V39 W42 F50 | V19-W21 PolarHBondContact O-N 3.48Å; W21-Q23 VanDerWaalsContact C-N 3.3Å; W21-Q23 PolarHBondContact O-N 3Å; W21-H24 CarbonylContact O-C 3.6Å; W21-H24 WeakPolarHBondContact O-CA 3.44Å; W21-H24 PolarHBondContact O-N 3.49Å; W21-C25 PolarHBondContact NE1-SG 3Å; W21-C25 VanDerWaalsContact NE1-SG 3.39Å; W21-C25 PolarHBondContact O-N 2.9Å; W21-I34 HydrophobicContact CZ2-CG2 4.46Å; W21-V39 HydrophobicContact CH2-CG2 4.37Å; W21-V39 HydrophobicContact CZ2-CG2 4.06Å; W21-W42 HydrophobicContact CH2-CH2 4.42Å; W21-F50 HydrophobicContact CE3-CZ 4.45Å; W21-F50 AromaticContact CH2-CE1 3.59Å; W21-F50 HydrophobicContact CH2-CE1 3.59Å; W21-F50 AromaticContact CH2-CE2 3.72Å; W21-F50 HydrophobicContact CH2-CE2 3.72Å; W21-F50 AromaticContact CH2-CZ 3.06Å; W21-F50 HydrophobicContact CH2-CZ 3.06Å; W21-F50 HydrophobicContact CZ2-CZ 4.3Å; W21-F50 AromaticContact CZ3-CE1 3.51Å; W21-F50 HydrophobicContact CZ3-CE1 3.51Å; W21-F50 HydrophobicContact CZ3-CE2 4.22Å; W21-F50 AromaticContact CZ3-CZ 3.16Å; W21-F50 HydrophobicContact CZ3-CZ 3.16Å |
| 22 | E | 44 | Very low | 47.5 | Very low | 153 Ų | 153 | 103.2 Ų | 103.2 | 72% | 0.715 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -48.1 | -39.3 | 174.6 | -94.1 | 175.2 | 69.6 | 0 | 0 | 115.6 | C20 | C20-E22 WeakPolarHBondContact O-CA 3.21Å; C20-E22 PolarHBondContact O-N 2.93Å |
| 23 | Q | 46.2 | Very low | 47.9 | Very low | 128 Ų | 128 | 100.1 Ų | 100.1 | 60% | 0.598 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -71.7 | -36 | 175.4 | -110.8 | 89.2 | 23 | 0 | 0 | 112 | V19 C20 W21 | V19-Q23 HydrophobicContact CG1-CB 3.95Å; C20-Q23 PolarHBondContact O-N 3.12Å; C20-Q23 VanDerWaalsContact O-N 3.1Å; W21-Q23 VanDerWaalsContact C-N 3.3Å; W21-Q23 PolarHBondContact O-N 3Å |
| 24 | H | 50.9 | Low | 48.7 | Very low | 89 Ų | 89 | 95.9 Ų | 95.9 | 41% | 0.412 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -74.4 | -34 | 179.1 | -95.7 | 115.1 | 0 | 0 | 0 | 112.6 | V19 W21 K26 L27 L28 | V19-H24 VanDerWaalsContact CG1-CE1 3.49Å; V19-H24 WeakPolarHBondContact CG1-CE1 3.15Å; V19-H24 WeakPolarHBondContact CG1-ND1 3.38Å; W21-H24 CarbonylContact O-C 3.6Å; W21-H24 WeakPolarHBondContact O-CA 3.44Å; W21-H24 PolarHBondContact O-N 3.49Å; H24-K26 PolarHBondContact O-N 3.3Å; H24-L27 PolarHBondContact O-N 2.89Å; H24-L28 PolarHBondContact O-N 3.14Å |
| 25 | C | 40.1 | Very low | 49.2 | Very low | 28 Ų | 28 | 94.1 Ų | 94.1 | 19% | 0.189 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -57.7 | -28.6 | 175.5 | -85.3 | 0 | 0 | 0 | 0 | 113.8 | W21 L27 V31 | W21-C25 PolarHBondContact NE1-SG 3Å; W21-C25 VanDerWaalsContact NE1-SG 3.39Å; W21-C25 PolarHBondContact O-N 2.9Å; C25-L27 VanDerWaalsContact C-N 3.34Å; C25-V31 HydrophobicContact CB-CG1 4.28Å; C25-V31 VanDerWaalsContact SG-CG1 3.57Å |
| 26 | K | 44.4 | Very low | 49.8 | Very low | 192 Ų | 192 | 89.6 Ų | 89.6 | 84% | 0.835 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -17.7 | 178.1 | -71.7 | -171.3 | 179.2 | -168.9 | 0 | 114 | H24 | H24-K26 PolarHBondContact O-N 3.3Š|
| 27 | L | 45.1 | Very low | 50.4 | Low | 138 Ų | 138 | 87.1 Ų | 87.1 | 72% | 0.723 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.8 | -9.6 | -172.7 | -72.8 | 167.8 | 0 | 0 | 0 | 113.7 | H24 C25 P29 | H24-L27 PolarHBondContact O-N 2.89Å; C25-L27 VanDerWaalsContact C-N 3.34Å; L27-P29 WeakPolarHBondContact O-CD 3.5Å |
| 28 | L | 53.1 | Low | 51.2 | Low | 29 Ų | 29 | 85 Ų | 85 | 15% | 0.152 | 52% | 0.518 | C | S | . | . | trans | -100.9 | 106.6 | -178.3 | -70.1 | 167.8 | 0 | 0 | 0 | 110 | H24 G30 V31 L54 | H24-L28 PolarHBondContact O-N 3.14Å; L28-G30 PolarHBondContact O-N 2.87Å; L28-V31 HydrophobicContact CB-CB 3.57Å; L28-V31 HydrophobicContact CB-CG1 4.41Å; L28-V31 HydrophobicContact CB-CG2 3.52Å; L28-V31 HydrophobicContact CD1-CB 4.15Å; L28-V31 HydrophobicContact CD1-CG1 4.32Å; L28-V31 HydrophobicContact CD1-CG2 3.68Å; L28-V31 HydrophobicContact CG-CG2 4.21Å; L28-V31 PolarHBondContact O-N 3.18Å; L28-L54 HydrophobicContact CD1-CD2 3.26Å; L28-L54 HydrophobicContact CD1-CG 4.19Å; L28-L54 HydrophobicContact CD2-CD2 4.27Å; L28-L54 HydrophobicContact CG-CD2 4.36Å | ||
| 29 | P | 52.9 | Low | 51.9 | Low | 135 Ų | 135 | 83 Ų | 83 | 88% | 0.877 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -13.4 | -178.3 | 21.9 | -31 | 0 | 0 | 0 | 114.1 | L27 | L27-P29 WeakPolarHBondContact O-CD 3.5Š|
| 30 | G | 51.5 | Low | 52.6 | Low | 63 Ų | 63 | 83.6 Ų | 83.6 | 65% | 0.649 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.5 | -0.8 | 174 | 0 | 0 | 0 | 0 | 0 | 115.6 | L28 | L28-G30 PolarHBondContact O-N 2.87Š|
| 31 | V | 55.2 | Low | 53.5 | Low | 6 Ų | 6 | 87.9 Ų | 87.9 | 4% | 0.036 | 52% | 0.524 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -117.1 | -6.2 | -169.9 | 172 | 0 | 0 | 0 | 0 | 113 | C25 L28 G33 I34 F50 | C25-V31 HydrophobicContact CB-CG1 4.28Å; C25-V31 VanDerWaalsContact SG-CG1 3.57Å; L28-V31 HydrophobicContact CB-CB 3.57Å; L28-V31 HydrophobicContact CB-CG1 4.41Å; L28-V31 HydrophobicContact CB-CG2 3.52Å; L28-V31 HydrophobicContact CD1-CB 4.15Å; L28-V31 HydrophobicContact CD1-CG1 4.32Å; L28-V31 HydrophobicContact CD1-CG2 3.68Å; L28-V31 HydrophobicContact CG-CG2 4.21Å; L28-V31 PolarHBondContact O-N 3.18Å; V31-G33 PolarHBondContact O-N 3.34Å; V31-I34 HydrophobicContact CB-CD1 4.08Å; V31-I34 HydrophobicContact CG1-CD1 4.1Å; V31-I34 HydrophobicContact CG2-CD1 3.92Å; V31-I34 PolarHBondContact O-N 2.88Å; V31-I34 VanDerWaalsContact O-N 3.14Å; V31-F50 HydrophobicContact CG1-CE2 4.26Å; V31-F50 HydrophobicContact CG2-CD2 4.06Å; V31-F50 HydrophobicContact CG2-CE2 3.48Å; V31-F50 VanDerWaalsContact CG2-CE2 3.48Å |
| 32 | A | 52.8 | Low | 54.5 | Low | 93 Ų | 93 | 85.5 Ų | 85.5 | 77% | 0.769 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63 | 81 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 33 | G | 54.5 | Low | 55.6 | Low | 74 Ų | 74 | 82 Ų | 82 | 76% | 0.763 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 141.7 | -6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | V31 S35 | V31-G33 PolarHBondContact O-N 3.34Å; G33-S35 PolarHBondContact O-N 3.43Å |
| 34 | I | 60.8 | Low | 56.3 | Low | 40 Ų | 40 | 83 Ų | 83 | 21% | 0.205 | 51% | 0.512 | C | S | . | . | trans | -78.4 | 111.5 | 178.6 | -62.4 | 167.8 | 0 | 0 | 0 | 109 | W21 V31 V39 W42 F50 | W21-I34 HydrophobicContact CZ2-CG2 4.46Å; V31-I34 HydrophobicContact CB-CD1 4.08Å; V31-I34 HydrophobicContact CG1-CD1 4.1Å; V31-I34 HydrophobicContact CG2-CD1 3.92Å; V31-I34 PolarHBondContact O-N 2.88Å; V31-I34 VanDerWaalsContact O-N 3.14Å; I34-V39 HydrophobicContact CG2-CG2 3.52Å; I34-W42 HydrophobicContact CB-CZ2 4.48Å; I34-W42 HydrophobicContact CD1-CH2 4.24Å; I34-W42 HydrophobicContact CD1-CZ2 3.86Å; I34-W42 HydrophobicContact CG1-CZ2 4.32Å; I34-W42 HydrophobicContact CG2-CH2 3.97Å; I34-W42 HydrophobicContact CG2-CZ2 3.4Å; I34-W42 VanDerWaalsContact CG2-CZ2 3.4Å; I34-F50 HydrophobicContact CD1-CD2 4.14Å; I34-F50 HydrophobicContact CD1-CE2 4.23Å | ||
| 35 | S | 57 | Low | 56.7 | Low | 62 Ų | 62 | 85.1 Ų | 85.1 | 43% | 0.434 | 53% | 0.527 | S | S | . | . | trans | -84 | 152.9 | 175.5 | -166.1 | 0 | 0 | 0 | 0 | 111 | G33 S37 T38 V39 | G33-S35 PolarHBondContact O-N 3.43Å; S35-S37 PolarHBondContact O-N 2.88Å; S35-S37 VanDerWaalsContact O-N 3.15Å; S35-S37 PolarHBondContact OG-OG 3.27Å; S35-T38 WeakPolarHBondContact O-CA 3.3Å; S35-T38 WeakPolarHBondContact O-CB 3.48Å; S35-T38 PolarHBondContact O-N 3.47Å; S35-V39 PolarHBondContact O-N 2.87Å; S35-V39 VanDerWaalsContact O-N 3.11Å | ||
| 36 | A | 55.8 | Low | 57.9 | Low | 74 Ų | 74 | 88.1 Ų | 88.1 | 61% | 0.612 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -57 | -30.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | T38 V39 A40 | A36-T38 VanDerWaalsContact C-N 3.3Å; A36-T38 PolarHBondContact O-N 3.17Å; A36-V39 PolarHBondContact O-N 2.99Å; A36-A40 WeakPolarHBondContact O-CB 3.43Å; A36-A40 PolarHBondContact O-N 3.31Å |
| 37 | S | 60.1 | Low | 59.1 | Low | 75 Ų | 75 | 81.9 Ų | 81.9 | 52% | 0.524 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -70.9 | -23.5 | 173.8 | 49.1 | 0 | 0 | 0 | 0 | 113.7 | S35 | S35-S37 PolarHBondContact O-N 2.88Å; S35-S37 VanDerWaalsContact O-N 3.15Å; S35-S37 PolarHBondContact OG-OG 3.27Å |
| 38 | T | 60.7 | Low | 59.7 | Low | 61 Ų | 61 | 81 Ų | 81 | 37% | 0.374 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -76.4 | -45.8 | 171.7 | -49.5 | 0 | 0 | 0 | 0 | 110 | S35 A36 A40 K41 W42 | S35-T38 WeakPolarHBondContact O-CA 3.3Å; S35-T38 WeakPolarHBondContact O-CB 3.48Å; S35-T38 PolarHBondContact O-N 3.47Å; A36-T38 VanDerWaalsContact C-N 3.3Å; A36-T38 PolarHBondContact O-N 3.17Å; T38-A40 VanDerWaalsContact C-N 3.28Å; T38-A40 PolarHBondContact O-N 3.44Å; T38-K41 CarbonylContact O-C 3.58Å; T38-K41 PolarHBondContact O-N 3.4Å; T38-W42 PolarHBondContact O-N 2.99Å |
| 39 | V | 61 | Low | 60.2 | Low | 52 Ų | 52 | 81 Ų | 81 | 32% | 0.315 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.2 | -40.4 | 176.3 | -178.2 | 0 | 0 | 0 | 0 | 111.5 | W21 I34 S35 A36 K41 W42 | W21-V39 HydrophobicContact CH2-CG2 4.37Å; W21-V39 HydrophobicContact CZ2-CG2 4.06Å; I34-V39 HydrophobicContact CG2-CG2 3.52Å; S35-V39 PolarHBondContact O-N 2.87Å; S35-V39 VanDerWaalsContact O-N 3.11Å; A36-V39 PolarHBondContact O-N 2.99Å; V39-K41 PolarHBondContact O-N 3.05Å; V39-K41 VanDerWaalsContact O-N 3.13Å; V39-W42 HydrophobicContact CB-CD2 4.35Å; V39-W42 HydrophobicContact CB-CE3 4.34Å; V39-W42 HydrophobicContact CG1-CD2 4.32Å; V39-W42 HydrophobicContact CG1-CE3 3.87Å; V39-W42 HydrophobicContact CG1-CZ3 4.04Å; V39-W42 HydrophobicContact CG2-CD2 4.42Å; V39-W42 HydrophobicContact CG2-CE3 4.38Å; V39-W42 HydrophobicContact CG2-CH2 3.92Å; V39-W42 HydrophobicContact CG2-CZ2 3.98Å; V39-W42 HydrophobicContact CG2-CZ3 4.13Å; V39-W42 WeakPolarHBondContact O-CB 3.39Å; V39-W42 PolarHBondContact O-N 3.3Å; V39-W42 VanDerWaalsContact O-N 3.16Å |
| 40 | A | 60.8 | Low | 60.9 | Low | 87 Ų | 87 | 75.5 Ų | 75.5 | 72% | 0.719 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -17.4 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | A36 T38 | A36-A40 WeakPolarHBondContact O-CB 3.43Å; A36-A40 PolarHBondContact O-N 3.31Å; T38-A40 VanDerWaalsContact C-N 3.28Å; T38-A40 PolarHBondContact O-N 3.44Å |
| 41 | K | 69.4 | Low | 61.5 | Low | 172 Ų | 172 | 74.7 Ų | 74.7 | 75% | 0.748 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.3 | 5.3 | -179.8 | -67.7 | -179.3 | -179.5 | 179.4 | 0 | 113.1 | T38 V39 T43 | T38-K41 CarbonylContact O-C 3.58Å; T38-K41 PolarHBondContact O-N 3.4Å; V39-K41 PolarHBondContact O-N 3.05Å; V39-K41 VanDerWaalsContact O-N 3.13Å; K41-T43 PolarHBondContact O-N 3.16Å |
| 42 | W | 69.4 | Low | 61.6 | Low | 45 Ų | 45 | 80.3 Ų | 80.3 | 17% | 0.17 | 48% | 0.484 | C | S | . | . | trans | -63.7 | 132.3 | -176.3 | -79.7 | -10 | 0 | 0 | 0 | 112.3 | W21 I34 T38 V39 E46 V47 F50 | W21-W42 HydrophobicContact CH2-CH2 4.42Å; I34-W42 HydrophobicContact CB-CZ2 4.48Å; I34-W42 HydrophobicContact CD1-CH2 4.24Å; I34-W42 HydrophobicContact CD1-CZ2 3.86Å; I34-W42 HydrophobicContact CG1-CZ2 4.32Å; I34-W42 HydrophobicContact CG2-CH2 3.97Å; I34-W42 HydrophobicContact CG2-CZ2 3.4Å; I34-W42 VanDerWaalsContact CG2-CZ2 3.4Å; T38-W42 PolarHBondContact O-N 2.99Å; V39-W42 HydrophobicContact CB-CD2 4.35Å; V39-W42 HydrophobicContact CB-CE3 4.34Å; V39-W42 HydrophobicContact CG1-CD2 4.32Å; V39-W42 HydrophobicContact CG1-CE3 3.87Å; V39-W42 HydrophobicContact CG1-CZ3 4.04Å; V39-W42 HydrophobicContact CG2-CD2 4.42Å; V39-W42 HydrophobicContact CG2-CE3 4.38Å; V39-W42 HydrophobicContact CG2-CH2 3.92Å; V39-W42 HydrophobicContact CG2-CZ2 3.98Å; V39-W42 HydrophobicContact CG2-CZ3 4.13Å; V39-W42 WeakPolarHBondContact O-CB 3.39Å; V39-W42 PolarHBondContact O-N 3.3Å; V39-W42 VanDerWaalsContact O-N 3.16Å; W42-E46 HydrophobicContact CB-CB 4.16Å; W42-E46 HydrophobicContact CD2-CB 4.47Å; W42-E46 HydrophobicContact CG-CB 3.99Å; W42-V47 HydrophobicContact CB-CG2 3.67Å; W42-V47 HydrophobicContact CE3-CG2 4Å; W42-V47 HydrophobicContact CG-CG2 4.49Å; W42-F50 HydrophobicContact CE3-CD1 4.46Å; W42-F50 HydrophobicContact CH2-CB 3.77Å; W42-F50 AromaticContact CH2-CD1 3.54Å; W42-F50 HydrophobicContact CH2-CD1 3.54Å; W42-F50 AromaticContact CH2-CD2 3.36Å; W42-F50 HydrophobicContact CH2-CD2 3.36Å; W42-F50 AromaticContact CH2-CE1 3.93Å; W42-F50 HydrophobicContact CH2-CE1 3.93Å; W42-F50 AromaticContact CH2-CE2 3.79Å; W42-F50 HydrophobicContact CH2-CE2 3.79Å; W42-F50 AromaticContact CH2-CG 3.25Å; W42-F50 HydrophobicContact CH2-CG 3.25Å; W42-F50 HydrophobicContact CH2-CZ 4.13Å; W42-F50 HydrophobicContact CZ2-CD2 4.23Å; W42-F50 HydrophobicContact CZ2-CG 4.29Å; W42-F50 HydrophobicContact CZ3-CB 3.81Å; W42-F50 AromaticContact CZ3-CD1 3.29Å; W42-F50 HydrophobicContact CZ3-CD1 3.29Å; W42-F50 HydrophobicContact CZ3-CD2 4.03Å; W42-F50 AromaticContact CZ3-CE1 3.82Å; W42-F50 HydrophobicContact CZ3-CE1 3.82Å; W42-F50 HydrophobicContact CZ3-CE2 4.49Å; W42-F50 AromaticContact CZ3-CG 3.43Å; W42-F50 HydrophobicContact CZ3-CG 3.43Å; W42-F50 VanDerWaalsContact CZ3-CG 3.43Å; W42-F50 HydrophobicContact CZ3-CZ 4.46Å | ||
| 43 | T | 65.1 | Low | 61.7 | Low | 80 Ų | 80 | 80.5 Ų | 80.5 | 49% | 0.491 | 48% | 0.476 | S | S | . | . | trans | -76.2 | 157.6 | 164.7 | 56.1 | 0 | 0 | 0 | 0 | 109.9 | K41 D45 E46 V47 | K41-T43 PolarHBondContact O-N 3.16Å; T43-D45 PolarHBondContact O-N 3.13Å; T43-D45 VanDerWaalsContact O-N 3.12Å; T43-E46 PolarHBondContact N-OE2 3.5Å; T43-E46 WeakPolarHBondContact O-CB 3.29Å; T43-E46 PolarHBondContact O-N 3.02Å; T43-E46 WeakPolarHBondContact OG1-CG 3.47Å; T43-E46 PolarHBondContact OG1-OE2 2.85Å; T43-V47 WeakPolarHBondContact O-CG2 3.19Å; T43-V47 PolarHBondContact O-N 3.15Å | ||
| 44 | I | 61.6 | Low | 61.7 | Low | 149 Ų | 149 | 79.7 Ų | 79.7 | 76% | 0.764 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -51.2 | -38.2 | -179.4 | -63 | -77.7 | 0 | 0 | 0 | 111.7 | V47 F48 | I44-V47 PolarHBondContact O-N 3.39Å; I44-F48 VanDerWaalsContact O-CB 3.3Å; I44-F48 WeakPolarHBondContact O-CB 3.33Å; I44-F48 PolarHBondContact O-N 3.28Å |
| 45 | D | 59.7 | Low | 61.3 | Low | 133 Ų | 133 | 80.5 Ų | 80.5 | 71% | 0.711 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -64.9 | -40.2 | 176.2 | -101.7 | -92 | 0 | 0 | 0 | 113.2 | T43 F48 G49 | T43-D45 PolarHBondContact O-N 3.13Å; T43-D45 VanDerWaalsContact O-N 3.12Å; D45-F48 PolarHBondContact O-N 3.01Å; D45-G49 PolarHBondContact O-N 3.36Å |
| 46 | E | 64.7 | Low | 60.9 | Low | 91 Ų | 91 | 81.9 Ų | 81.9 | 43% | 0.425 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -70.4 | -39.2 | 177.5 | -68.7 | 171.1 | 112.3 | 0 | 0 | 111.3 | W42 T43 F48 F50 | W42-E46 HydrophobicContact CB-CB 4.16Å; W42-E46 HydrophobicContact CD2-CB 4.47Å; W42-E46 HydrophobicContact CG-CB 3.99Å; T43-E46 PolarHBondContact N-OE2 3.5Å; T43-E46 WeakPolarHBondContact O-CB 3.29Å; T43-E46 PolarHBondContact O-N 3.02Å; T43-E46 WeakPolarHBondContact OG1-CG 3.47Å; T43-E46 PolarHBondContact OG1-OE2 2.85Å; E46-F48 VanDerWaalsContact C-N 3.3Å; E46-F48 PolarHBondContact O-N 3.43Å; E46-F50 WeakPolarHBondContact O-CB 3.46Å; E46-F50 PolarHBondContact O-N 3.11Å |
| 47 | V | 69.1 | Low | 60.7 | Low | 61 Ų | 61 | 81.5 Ų | 81.5 | 37% | 0.37 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.1 | -41.1 | 171.2 | -176 | 0 | 0 | 0 | 0 | 110.2 | W42 T43 I44 F50 V51 | W42-V47 HydrophobicContact CB-CG2 3.67Å; W42-V47 HydrophobicContact CE3-CG2 4Å; W42-V47 HydrophobicContact CG-CG2 4.49Å; T43-V47 WeakPolarHBondContact O-CG2 3.19Å; T43-V47 PolarHBondContact O-N 3.15Å; I44-V47 PolarHBondContact O-N 3.39Å; V47-F50 PolarHBondContact O-N 2.65Å; V47-V51 HydrophobicContact CG1-CG2 4.31Å; V47-V51 WeakPolarHBondContact O-CB 3.18Å; V47-V51 WeakPolarHBondContact O-CG2 3.47Å; V47-V51 PolarHBondContact O-N 2.97Å |
| 48 | F | 58.7 | Low | 60.4 | Low | 118 Ų | 118 | 86.2 Ų | 86.2 | 52% | 0.518 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.2 | -50.1 | -179.7 | -175.7 | -99.4 | 0 | 0 | 0 | 112.3 | I44 D45 E46 F50 V51 Q52 | I44-F48 VanDerWaalsContact O-CB 3.3Å; I44-F48 WeakPolarHBondContact O-CB 3.33Å; I44-F48 PolarHBondContact O-N 3.28Å; D45-F48 PolarHBondContact O-N 3.01Å; E46-F48 VanDerWaalsContact C-N 3.3Å; E46-F48 PolarHBondContact O-N 3.43Å; F48-F50 PolarHBondContact O-N 3.25Å; F48-V51 PolarHBondContact O-N 3.47Å; F48-Q52 HydrophobicContact CD1-CG 4.22Å; F48-Q52 HydrophobicContact CE1-CG 3.92Å; F48-Q52 HydrophobicContact CZ-CG 4.15Å; F48-Q52 WeakPolarHBondContact O-CG 3.48Å; F48-Q52 PolarHBondContact O-N 3.42Å |
| 49 | G | 63.8 | Low | 59.8 | Low | 30 Ų | 30 | 88.9 Ų | 88.9 | 31% | 0.309 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.6 | -34.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | D45 Q52 T53 | D45-G49 PolarHBondContact O-N 3.36Å; G49-Q52 PolarHBondContact O-N 3.43Å; G49-T53 PolarHBondContact O-N 3.46Å; G49-T53 PolarHBondContact O-OG1 2.91Å |
| 50 | F | 66.7 | Low | 59.3 | Low | 20 Ų | 20 | 92.5 Ų | 92.5 | 9% | 0.088 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -66.8 | -44.5 | 173.3 | 179 | -106.7 | 0 | 0 | 0 | 112.7 | W21 V31 I34 W42 E46 V47 F48 Q52 T53 L54 | W21-F50 HydrophobicContact CE3-CZ 4.45Å; W21-F50 AromaticContact CH2-CE1 3.59Å; W21-F50 HydrophobicContact CH2-CE1 3.59Å; W21-F50 AromaticContact CH2-CE2 3.72Å; W21-F50 HydrophobicContact CH2-CE2 3.72Å; W21-F50 AromaticContact CH2-CZ 3.06Å; W21-F50 HydrophobicContact CH2-CZ 3.06Å; W21-F50 HydrophobicContact CZ2-CZ 4.3Å; W21-F50 AromaticContact CZ3-CE1 3.51Å; W21-F50 HydrophobicContact CZ3-CE1 3.51Å; W21-F50 HydrophobicContact CZ3-CE2 4.22Å; W21-F50 AromaticContact CZ3-CZ 3.16Å; W21-F50 HydrophobicContact CZ3-CZ 3.16Å; V31-F50 HydrophobicContact CG1-CE2 4.26Å; V31-F50 HydrophobicContact CG2-CD2 4.06Å; V31-F50 HydrophobicContact CG2-CE2 3.48Å; V31-F50 VanDerWaalsContact CG2-CE2 3.48Å; I34-F50 HydrophobicContact CD1-CD2 4.14Å; I34-F50 HydrophobicContact CD1-CE2 4.23Å; W42-F50 HydrophobicContact CE3-CD1 4.46Å; W42-F50 HydrophobicContact CH2-CB 3.77Å; W42-F50 AromaticContact CH2-CD1 3.54Å; W42-F50 HydrophobicContact CH2-CD1 3.54Å; W42-F50 AromaticContact CH2-CD2 3.36Å; W42-F50 HydrophobicContact CH2-CD2 3.36Å; W42-F50 AromaticContact CH2-CE1 3.93Å; W42-F50 HydrophobicContact CH2-CE1 3.93Å; W42-F50 AromaticContact CH2-CE2 3.79Å; W42-F50 HydrophobicContact CH2-CE2 3.79Å; W42-F50 AromaticContact CH2-CG 3.25Å; W42-F50 HydrophobicContact CH2-CG 3.25Å; W42-F50 HydrophobicContact CH2-CZ 4.13Å; W42-F50 HydrophobicContact CZ2-CD2 4.23Å; W42-F50 HydrophobicContact CZ2-CG 4.29Å; W42-F50 HydrophobicContact CZ3-CB 3.81Å; W42-F50 AromaticContact CZ3-CD1 3.29Å; W42-F50 HydrophobicContact CZ3-CD1 3.29Å; W42-F50 HydrophobicContact CZ3-CD2 4.03Å; W42-F50 AromaticContact CZ3-CE1 3.82Å; W42-F50 HydrophobicContact CZ3-CE1 3.82Å; W42-F50 HydrophobicContact CZ3-CE2 4.49Å; W42-F50 AromaticContact CZ3-CG 3.43Å; W42-F50 HydrophobicContact CZ3-CG 3.43Å; W42-F50 VanDerWaalsContact CZ3-CG 3.43Å; W42-F50 HydrophobicContact CZ3-CZ 4.46Å; E46-F50 WeakPolarHBondContact O-CB 3.46Å; E46-F50 PolarHBondContact O-N 3.11Å; V47-F50 PolarHBondContact O-N 2.65Å; F48-F50 PolarHBondContact O-N 3.25Å; F50-Q52 VanDerWaalsContact C-N 3.32Å; F50-Q52 PolarHBondContact O-N 3.46Å; F50-T53 WeakPolarHBondContact CA-OG1 3.46Å; F50-T53 PolarHBondContact O-N 3.2Å; F50-T53 PolarHBondContact O-OG1 3Å; F50-T53 VanDerWaalsContact O-OG1 3.12Å; F50-L54 HydrophobicContact CD1-CD1 3.49Å; F50-L54 VanDerWaalsContact CD1-CD1 3.49Å; F50-L54 HydrophobicContact CD1-CG 4.26Å; F50-L54 HydrophobicContact CE1-CD1 2.99Å; F50-L54 HydrophobicContact CE1-CD2 4.46Å; F50-L54 HydrophobicContact CE1-CG 3.81Å; F50-L54 HydrophobicContact CE2-CD1 4.2Å; F50-L54 HydrophobicContact CE2-CG 4.12Å; F50-L54 HydrophobicContact CG-CD1 4.26Å; F50-L54 HydrophobicContact CZ-CD1 3.33Å; F50-L54 HydrophobicContact CZ-CD2 3.97Å; F50-L54 HydrophobicContact CZ-CG 3.63Å; F50-L54 VanDerWaalsContact O-CB 3.29Å; F50-L54 WeakPolarHBondContact O-CB 3.49Å; F50-L54 WeakPolarHBondContact O-CG 3.1Å; F50-L54 PolarHBondContact O-N 3.49Å |
| 51 | V | 65.4 | Low | 58.6 | Low | 46 Ų | 46 | 90.5 Ų | 90.5 | 28% | 0.279 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.1 | -35.9 | 175.1 | 170.6 | 0 | 0 | 0 | 0 | 111.7 | V47 F48 L54 T55 A61 | V47-V51 HydrophobicContact CG1-CG2 4.31Å; V47-V51 WeakPolarHBondContact O-CB 3.18Å; V47-V51 WeakPolarHBondContact O-CG2 3.47Å; V47-V51 PolarHBondContact O-N 2.97Å; F48-V51 PolarHBondContact O-N 3.47Å; V51-L54 PolarHBondContact O-N 2.99Å; V51-T55 PolarHBondContact O-N 3.1Å; V51-T55 PolarHBondContact O-OG1 3.26Å; V51-A61 HydrophobicContact CG1-CB 4.02Å |
| 52 | Q | 56.3 | Low | 57.6 | Low | 124 Ų | 124 | 91.6 Ų | 91.6 | 58% | 0.579 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -68.1 | -34.9 | 174.2 | -75 | -171.6 | -59 | 0 | 0 | 113 | F48 G49 F50 | F48-Q52 HydrophobicContact CD1-CG 4.22Å; F48-Q52 HydrophobicContact CE1-CG 3.92Å; F48-Q52 HydrophobicContact CZ-CG 4.15Å; F48-Q52 WeakPolarHBondContact O-CG 3.48Å; F48-Q52 PolarHBondContact O-N 3.42Å; G49-Q52 PolarHBondContact O-N 3.43Å; F50-Q52 VanDerWaalsContact C-N 3.32Å; F50-Q52 PolarHBondContact O-N 3.46Å |
| 53 | T | 54.6 | Low | 56.6 | Low | 96 Ų | 96 | 94.5 Ų | 94.5 | 59% | 0.589 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -80 | -25.7 | 175.3 | 30.6 | 0 | 0 | 0 | 0 | 113 | G49 F50 | G49-T53 PolarHBondContact O-N 3.46Å; G49-T53 PolarHBondContact O-OG1 2.91Å; F50-T53 WeakPolarHBondContact CA-OG1 3.46Å; F50-T53 PolarHBondContact O-N 3.2Å; F50-T53 PolarHBondContact O-OG1 3Å; F50-T53 VanDerWaalsContact O-OG1 3.12Å |
| 54 | L | 55.7 | Low | 55.9 | Low | 57 Ų | 57 | 98 Ų | 98 | 30% | 0.298 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -72.2 | -29.4 | 177 | -91.6 | 172.2 | 0 | 0 | 0 | 114 | L28 F50 V51 | L28-L54 HydrophobicContact CD1-CD2 3.26Å; L28-L54 HydrophobicContact CD1-CG 4.19Å; L28-L54 HydrophobicContact CD2-CD2 4.27Å; L28-L54 HydrophobicContact CG-CD2 4.36Å; F50-L54 HydrophobicContact CD1-CD1 3.49Å; F50-L54 VanDerWaalsContact CD1-CD1 3.49Å; F50-L54 HydrophobicContact CD1-CG 4.26Å; F50-L54 HydrophobicContact CE1-CD1 2.99Å; F50-L54 HydrophobicContact CE1-CD2 4.46Å; F50-L54 HydrophobicContact CE1-CG 3.81Å; F50-L54 HydrophobicContact CE2-CD1 4.2Å; F50-L54 HydrophobicContact CE2-CG 4.12Å; F50-L54 HydrophobicContact CG-CD1 4.26Å; F50-L54 HydrophobicContact CZ-CD1 3.33Å; F50-L54 HydrophobicContact CZ-CD2 3.97Å; F50-L54 HydrophobicContact CZ-CG 3.63Å; F50-L54 VanDerWaalsContact O-CB 3.29Å; F50-L54 WeakPolarHBondContact O-CB 3.49Å; F50-L54 WeakPolarHBondContact O-CG 3.1Å; F50-L54 PolarHBondContact O-N 3.49Å; V51-L54 PolarHBondContact O-N 2.99Å |
| 55 | T | 50.9 | Low | 55.2 | Low | 57 Ų | 57 | 99 Ų | 99 | 35% | 0.35 | 53% | 0.525 | S | S | . | . | trans | -154.8 | 122 | -162.4 | 14.1 | 0 | 0 | 0 | 0 | 113.2 | V51 C57 | V51-T55 PolarHBondContact O-N 3.1Å; V51-T55 PolarHBondContact O-OG1 3.26Å; T55-C57 HydrophobicContact CG2-CB 3.54Å; T55-C57 PolarHBondContact O-N 3.03Å | ||
| 56 | G | 49.4 | Very low | 54.8 | Low | 92 Ų | 92 | 98.2 Ų | 98.2 | 95% | 0.948 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -69.6 | 40.4 | 146.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 57 | C | 52.8 | Low | 53.8 | Low | 65 Ų | 65 | 100.5 Ų | 100.5 | 44% | 0.439 | 53% | 0.531 | S | S | . | . | trans | -133.2 | 77 | 179.7 | -66.9 | 0 | 0 | 0 | 0 | 109 | T55 D59 Q60 | T55-C57 HydrophobicContact CG2-CB 3.54Å; T55-C57 PolarHBondContact O-N 3.03Å; C57-D59 PolarHBondContact O-N 3.41Å; C57-Q60 PolarHBondContact O-N 3.11Å | ||
| 58 | E | 52.6 | Low | 52.5 | Low | 175 Ų | 175 | 100 Ų | 100 | 82% | 0.818 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -56.7 | -23.4 | 171.7 | -82.6 | 168.7 | 58.7 | 0 | 0 | 112.9 | Q60 R62 | E58-Q60 PolarHBondContact O-N 3.39Å; E58-R62 PolarHBondContact O-N 3.07Å |
| 59 | D | 48.3 | Very low | 51.7 | Low | 116 Ų | 116 | 98 Ų | 98 | 62% | 0.62 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -69.5 | -29.9 | -177.1 | -68.8 | -74 | 0 | 0 | 0 | 114.5 | C57 R62 L63 | C57-D59 PolarHBondContact O-N 3.41Å; D59-R62 PolarHBondContact O-N 3.41Å; D59-L63 WeakPolarHBondContact O-CG 3.46Å; D59-L63 PolarHBondContact O-N 2.71Å; D59-L63 VanDerWaalsContact O-N 3.15Å |
| 60 | Q | 49.8 | Very low | 50.8 | Low | 128 Ų | 128 | 102.6 Ų | 102.6 | 60% | 0.598 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -74.4 | -36.8 | -179.2 | -81 | -71.6 | -16.8 | 0 | 0 | 112.7 | C57 E58 R62 L63 F64 | C57-Q60 PolarHBondContact O-N 3.11Å; E58-Q60 PolarHBondContact O-N 3.39Å; Q60-R62 VanDerWaalsContact C-N 3.25Å; Q60-R62 PolarHBondContact O-N 2.69Å; Q60-L63 PolarHBondContact O-N 2.91Å; Q60-F64 PolarHBondContact O-N 2.75Å; Q60-F64 VanDerWaalsContact O-N 3.07Å |
| 61 | A | 45.9 | Very low | 49.8 | Very low | 46 Ų | 46 | 106.9 Ų | 106.9 | 38% | 0.38 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.6 | -33.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | V51 K65 | V51-A61 HydrophobicContact CG1-CB 4.02Å; A61-K65 WeakPolarHBondContact O-CB 3.42Å; A61-K65 PolarHBondContact O-N 3.03Å; A61-K65 VanDerWaalsContact O-N 3.11Å |
| 62 | R | 48.3 | Very low | 48.8 | Very low | 195 Ų | 195 | 110.8 Ų | 110.8 | 74% | 0.736 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -69.4 | -42.1 | 178.5 | -158.7 | 173.8 | 179.5 | 168.9 | -0.3 | 111.6 | E58 D59 Q60 K65 D66 | E58-R62 PolarHBondContact O-N 3.07Å; D59-R62 PolarHBondContact O-N 3.41Å; Q60-R62 VanDerWaalsContact C-N 3.25Å; Q60-R62 PolarHBondContact O-N 2.69Å; R62-K65 PolarHBondContact O-N 3.4Å; R62-D66 WeakPolarHBondContact O-CB 3.41Å; R62-D66 PolarHBondContact O-N 3.22Å |
| 63 | L | 48.3 | Very low | 48.1 | Very low | 105 Ų | 105 | 108.9 Ų | 108.9 | 55% | 0.55 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.5 | -41.9 | 173.5 | -73.3 | 166.9 | 0 | 0 | 0 | 112.3 | D59 Q60 K65 D66 E67 | D59-L63 WeakPolarHBondContact O-CG 3.46Å; D59-L63 PolarHBondContact O-N 2.71Å; D59-L63 VanDerWaalsContact O-N 3.15Å; Q60-L63 PolarHBondContact O-N 2.91Å; L63-K65 VanDerWaalsContact C-N 3.3Å; L63-K65 PolarHBondContact O-N 3.44Å; L63-D66 PolarHBondContact O-N 3.47Å; L63-E67 WeakPolarHBondContact O-CB 3.46Å; L63-E67 PolarHBondContact O-N 3.15Å |
| 64 | F | 50.4 | Low | 47.7 | Very low | 153 Ų | 153 | 109.9 Ų | 109.9 | 67% | 0.671 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.1 | -37 | 178.4 | -154.6 | -91.1 | 0 | 0 | 0 | 112.6 | Q60 S68 | Q60-F64 PolarHBondContact O-N 2.75Å; Q60-F64 VanDerWaalsContact O-N 3.07Å; F64-S68 WeakPolarHBondContact O-CB 2.9Å; F64-S68 PolarHBondContact O-N 3.38Å; F64-S68 PolarHBondContact O-OG 2.87Å |
| 65 | K | 48.9 | Very low | 47 | Very low | 170 Ų | 170 | 118.3 Ų | 118.3 | 74% | 0.739 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -72.1 | -35.6 | 177 | -156.9 | 176.1 | -177.5 | -179 | 0 | 112 | A61 R62 L63 C69 | A61-K65 WeakPolarHBondContact O-CB 3.42Å; A61-K65 PolarHBondContact O-N 3.03Å; A61-K65 VanDerWaalsContact O-N 3.11Å; R62-K65 PolarHBondContact O-N 3.4Å; L63-K65 VanDerWaalsContact C-N 3.3Å; L63-K65 PolarHBondContact O-N 3.44Å; K65-C69 WeakPolarHBondContact O-CB 3.41Å; K65-C69 PolarHBondContact O-N 3.21Å |
| 66 | D | 49.5 | Very low | 46.8 | Very low | 117 Ų | 117 | 121.4 Ų | 121.4 | 63% | 0.626 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -71.7 | -45.6 | 177.7 | -154.4 | -105.4 | 0 | 0 | 0 | 111.6 | R62 L63 C69 L70 | R62-D66 WeakPolarHBondContact O-CB 3.41Å; R62-D66 PolarHBondContact O-N 3.22Å; L63-D66 PolarHBondContact O-N 3.47Å; D66-C69 PolarHBondContact O-N 3.3Å; D66-L70 PolarHBondContact O-N 2.86Å |
| 67 | E | 45.5 | Very low | 46.6 | Very low | 140 Ų | 140 | 122.9 Ų | 122.9 | 65% | 0.654 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -70.3 | -41.1 | 179.6 | -164.1 | 170.6 | 98.2 | 0 | 0 | 111.8 | L63 L70 I71 | L63-E67 WeakPolarHBondContact O-CB 3.46Å; L63-E67 PolarHBondContact O-N 3.15Å; E67-L70 PolarHBondContact O-N 2.84Å; E67-I71 HydrophobicContact CG-CD1 4.38Å; E67-I71 WeakPolarHBondContact O-CD1 3.26Å; E67-I71 VanDerWaalsContact O-CG1 3.26Å; E67-I71 WeakPolarHBondContact O-CG1 3.07Å; E67-I71 PolarHBondContact O-N 3.34Å |
| 68 | S | 39.8 | Very low | 46.3 | Very low | 50 Ų | 50 | 126.2 Ų | 126.2 | 35% | 0.35 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -64.3 | -42 | 172.4 | -63.7 | 0 | 0 | 0 | 0 | 111.4 | F64 L70 I71 I72 | F64-S68 WeakPolarHBondContact O-CB 2.9Å; F64-S68 PolarHBondContact O-N 3.38Å; F64-S68 PolarHBondContact O-OG 2.87Å; S68-L70 VanDerWaalsContact C-N 3.32Å; S68-L70 PolarHBondContact O-N 2.72Å; S68-I71 PolarHBondContact O-N 3.03Å; S68-I72 WeakPolarHBondContact O-CG1 3.43Å; S68-I72 PolarHBondContact O-N 3.21Å |
| 69 | C | 42.6 | Very low | 45.9 | Very low | 77 Ų | 77 | 123.3 Ų | 123.3 | 52% | 0.52 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -62.6 | -37.1 | 179.2 | -168.3 | 0 | 0 | 0 | 0 | 112.6 | K65 D66 I71 A73 | K65-C69 WeakPolarHBondContact O-CB 3.41Å; K65-C69 PolarHBondContact O-N 3.21Å; D66-C69 PolarHBondContact O-N 3.3Å; C69-I71 VanDerWaalsContact C-N 3.32Å; C69-I71 PolarHBondContact O-N 3.06Å; C69-A73 WeakPolarHBondContact O-CB 3.15Å; C69-A73 PolarHBondContact O-N 2.75Å |
| 70 | L | 44.2 | Very low | 45.8 | Very low | 125 Ų | 125 | 123.8 Ų | 123.8 | 65% | 0.654 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -66 | -35.2 | 177 | -151.7 | 85.1 | 0 | 0 | 0 | 112.2 | D66 E67 S68 T74 | D66-L70 PolarHBondContact O-N 2.86Å; E67-L70 PolarHBondContact O-N 2.84Å; S68-L70 VanDerWaalsContact C-N 3.32Å; S68-L70 PolarHBondContact O-N 2.72Å; L70-T74 PolarHBondContact O-OG1 2.97Å |
| 71 | I | 45.8 | Very low | 45.5 | Very low | 110 Ų | 110 | 123.5 Ų | 123.5 | 56% | 0.564 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -75.1 | -37.3 | -177.6 | -62.7 | 166 | 0 | 0 | 0 | 111.4 | E67 S68 C69 | E67-I71 HydrophobicContact CG-CD1 4.38Å; E67-I71 WeakPolarHBondContact O-CD1 3.26Å; E67-I71 VanDerWaalsContact O-CG1 3.26Å; E67-I71 WeakPolarHBondContact O-CG1 3.07Å; E67-I71 PolarHBondContact O-N 3.34Å; S68-I71 PolarHBondContact O-N 3.03Å; C69-I71 VanDerWaalsContact C-N 3.32Å; C69-I71 PolarHBondContact O-N 3.06Å |
| 72 | I | 46.2 | Very low | 45.5 | Very low | 129 Ų | 129 | 129 Ų | 129 | 66% | 0.662 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -78.5 | -16.2 | 175.7 | 19.1 | 167.2 | 0 | 0 | 0 | 114.5 | S68 T74 | S68-I72 WeakPolarHBondContact O-CG1 3.43Å; S68-I72 PolarHBondContact O-N 3.21Å; I72-T74 VanDerWaalsContact C-N 3.33Å |
| 73 | A | 40.5 | Very low | 45.2 | Very low | 83 Ų | 83 | 123.9 Ų | 123.9 | 69% | 0.686 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -3.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | C69 | C69-A73 WeakPolarHBondContact O-CB 3.15Å; C69-A73 PolarHBondContact O-N 2.75Å |
| 74 | T | 45.8 | Very low | 45 | Very low | 117 Ų | 117 | 125.5 Ų | 125.5 | 72% | 0.718 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | 8.9 | -176.9 | -40.2 | 0 | 0 | 0 | 0 | 113 | L70 I72 | L70-T74 PolarHBondContact O-OG1 2.97Å; I72-T74 VanDerWaalsContact C-N 3.33Å |
| 75 | E | 40.6 | Very low | 44.5 | Very low | 235 Ų | 235 | 123 Ų | 123 | 100% | 1.098 | 66% | 0.661 | S | S | * | * | trans | -109.6 | 0 | 171.7 | -70 | -165.9 | 94.6 | 0 | 0 | 112.7 |
Retrieved 75 of 75 residues in 60.4 ms
(Link to these results)