| 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 | 59.6 | Low | 67.9 | Low | 227 Ų | 227 | 104.1 Ų | 104.1 | 100% | 1.118 | 51% | 0.512 | S | S | * | . | 0 | 56.1 | 0 | -68.5 | 175.6 | 138.4 | 0 | 0 | 110.4 | |||||
| 2 | Y | 68.3 | Low | 68 | Low | 162 Ų | 162 | 106.7 Ų | 106.7 | 64% | 0.635 | 53% | 0.528 | S | S | * | . | trans | -115.1 | 7 | -171.1 | -66.8 | -73.9 | 0 | 0 | 0 | 113.6 | L4 Q5 W6 | Y2-L4 VanDerWaalsContact C-N 3.34Å; Y2-L4 PolarHBondContact O-N 3.11Å; Y2-Q5 PolarHBondContact O-N 3.28Å; Y2-Q5 VanDerWaalsContact O-N 3.1Å; Y2-W6 VanDerWaalsContact O-CD1 3.3Å | ||
| 3 | C | 67.7 | Low | 67.8 | Low | 55 Ų | 55 | 102.7 Ų | 102.7 | 37% | 0.372 | 51% | 0.508 | S | S | . | . | G | 310 helix | trans | -63.3 | -38.9 | -172 | -67.2 | 0 | 0 | 0 | 0 | 113.1 | Q5 C47 | C3-Q5 VanDerWaalsContact C-N 3.31Å; C3-Q5 PolarHBondContact O-N 3.28Å; C3-C47 HydrophobicContact CB-CB 3.42Å; C3-C47 VanDerWaalsContact CB-CB 3.42Å; C3-C47 WeakPolarHBondContact CB-SG 3.43Å; C3-C47 WeakPolarHBondContact SG-CB 3.28Å; C3-C47 CovalentContact SG-SG 2.01Å; C3-C47 PolarHBondContact SG-SG 2.98Å |
| 4 | L | 65.6 | Low | 67 | Low | 128 Ų | 128 | 102.9 Ų | 102.9 | 67% | 0.67 | 52% | 0.521 | S | S | * | . | G | 310 helix | trans | -71.8 | -23.4 | 176.1 | -84.3 | 94.7 | 0 | 0 | 0 | 113.4 | Y2 W6 L7 I8 | Y2-L4 VanDerWaalsContact C-N 3.34Å; Y2-L4 PolarHBondContact O-N 3.11Å; L4-W6 PolarHBondContact O-N 3.39Å; L4-L7 VanDerWaalsContact O-CB 3.27Å; L4-L7 WeakPolarHBondContact O-CB 3.23Å; L4-L7 PolarHBondContact O-N 3Å; L4-I8 PolarHBondContact O-N 2.97Å |
| 5 | Q | 72.1 | Confident | 66.3 | Low | 122 Ų | 122 | 101.1 Ų | 101.1 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | G | 310 helix | trans | -67.2 | -25.6 | -173 | -154 | 166.9 | -38.2 | 0 | 0 | 112.1 | Y2 C3 I8 | Y2-Q5 PolarHBondContact O-N 3.28Å; Y2-Q5 VanDerWaalsContact O-N 3.1Å; C3-Q5 VanDerWaalsContact C-N 3.31Å; C3-Q5 PolarHBondContact O-N 3.28Å; Q5-I8 HydrophobicContact CG-CD1 4.39Å |
| 6 | W | 67 | Low | 65.9 | Low | 115 Ų | 115 | 97.6 Ų | 97.6 | 44% | 0.436 | 50% | 0.495 | S | S | . | . | G | 310 helix | trans | -85.9 | -11.9 | 174.2 | -57.6 | 100.2 | 0 | 0 | 0 | 113.9 | Y2 L4 P9 F37 | Y2-W6 VanDerWaalsContact O-CD1 3.3Å; L4-W6 PolarHBondContact O-N 3.39Å; W6-P9 WeakPolarHBondContact O-CD 3.35Å; W6-F37 HydrophobicContact CB-CE1 3.85Å; W6-F37 HydrophobicContact CB-CE2 4.31Å; W6-F37 HydrophobicContact CB-CZ 3.55Å; W6-F37 AromaticContact CD1-CZ 3.94Å; W6-F37 HydrophobicContact CD2-CE1 4.36Å; W6-F37 AromaticContact CD2-CE2 3.59Å; W6-F37 HydrophobicContact CD2-CE2 3.59Å; W6-F37 AromaticContact CD2-CZ 3.25Å; W6-F37 HydrophobicContact CD2-CZ 3.25Å; W6-F37 AromaticContact CE2-CZ 3.89Å; W6-F37 HydrophobicContact CE3-CD2 4.38Å; W6-F37 AromaticContact CE3-CE2 3.24Å; W6-F37 HydrophobicContact CE3-CE2 3.24Å; W6-F37 AromaticContact CE3-CZ 3.47Å; W6-F37 HydrophobicContact CE3-CZ 3.47Å; W6-F37 VanDerWaalsContact CE3-CZ 3.47Å; W6-F37 HydrophobicContact CG-CE1 4Å; W6-F37 HydrophobicContact CG-CE2 4.07Å; W6-F37 AromaticContact CG-CZ 3.29Å; W6-F37 HydrophobicContact CG-CZ 3.29Å; W6-F37 HydrophobicContact CH2-CE2 4.41Å; W6-F37 AromaticContact CZ3-CE2 3.7Å; W6-F37 HydrophobicContact CZ3-CE2 3.7Å; W6-F37 HydrophobicContact CZ3-CZ 4.24Å |
| 7 | L | 66.9 | Low | 65.1 | Low | 44 Ų | 44 | 97.2 Ų | 97.2 | 23% | 0.23 | 49% | 0.492 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -28.5 | 173.5 | -171.6 | 57.7 | 0 | 0 | 0 | 111.7 | L4 V10 L11 F51 | L4-L7 VanDerWaalsContact O-CB 3.27Å; L4-L7 WeakPolarHBondContact O-CB 3.23Å; L4-L7 PolarHBondContact O-N 3Å; L7-V10 WeakPolarHBondContact O-CB 3.45Å; L7-V10 PolarHBondContact O-N 3.36Å; L7-V10 VanDerWaalsContact O-N 3.11Å; L7-L11 PolarHBondContact O-N 2.91Å; L7-F51 HydrophobicContact CD1-CD2 3.13Å; L7-F51 HydrophobicContact CD1-CE2 3.11Å; L7-F51 HydrophobicContact CD1-CG 4.43Å; L7-F51 HydrophobicContact CD1-CZ 4.41Å; L7-F51 HydrophobicContact CG-CD2 4.4Å |
| 8 | I | 75.6 | Confident | 64.7 | Low | 100 Ų | 100 | 96.2 Ų | 96.2 | 51% | 0.513 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -56.6 | -47.9 | -175.8 | -64.4 | 165.8 | 0 | 0 | 0 | 112.2 | L4 Q5 V10 L11 L12 | L4-I8 PolarHBondContact O-N 2.97Å; Q5-I8 HydrophobicContact CG-CD1 4.39Å; I8-V10 PolarHBondContact O-N 3.18Å; I8-L11 PolarHBondContact O-N 3.36Å; I8-L12 WeakPolarHBondContact O-CB 3.33Å; I8-L12 PolarHBondContact O-N 2.83Å |
| 9 | P | 69.8 | Low | 64 | Low | 59 Ų | 59 | 95.9 Ų | 95.9 | 38% | 0.383 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.4 | -33.6 | 178.7 | -22.9 | 34.2 | 0 | 0 | 0 | 113.1 | W6 M13 | W6-P9 WeakPolarHBondContact O-CD 3.35Å; P9-M13 WeakPolarHBondContact O-CG 3.47Å; P9-M13 PolarHBondContact O-N 3.47Å |
| 10 | V | 67.8 | Low | 63.6 | Low | 5 Ų | 5 | 94.3 Ų | 94.3 | 3% | 0.03 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -74.1 | -40.7 | -179 | 178.2 | 0 | 0 | 0 | 0 | 110.9 | L7 I8 L12 M13 M30 Y33 L34 | L7-V10 WeakPolarHBondContact O-CB 3.45Å; L7-V10 PolarHBondContact O-N 3.36Å; L7-V10 VanDerWaalsContact O-N 3.11Å; I8-V10 PolarHBondContact O-N 3.18Å; V10-L12 VanDerWaalsContact C-N 3.34Å; V10-M13 HydrophobicContact CB-CE 4.44Å; V10-M13 HydrophobicContact CG2-CE 4.31Å; V10-M30 HydrophobicContact CG1-CE 3.22Å; V10-M30 HydrophobicContact CG1-CG 4.38Å; V10-M30 HydrophobicContact CG1-SD 4.1Å; V10-Y33 HydrophobicContact CG2-CD1 4.39Å; V10-Y33 HydrophobicContact CG2-CE1 4.18Å; V10-L34 HydrophobicContact CG1-CD2 4.27Å; V10-L34 HydrophobicContact CG2-CD2 3.77Å |
| 11 | L | 66.4 | Low | 63.5 | Low | 128 Ų | 128 | 94.1 Ų | 94.1 | 67% | 0.67 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -73.3 | -28.1 | 176.4 | -165.9 | 69.2 | 0 | 0 | 0 | 112.5 | L7 I8 | L7-L11 PolarHBondContact O-N 2.91Å; I8-L11 PolarHBondContact O-N 3.36Å |
| 12 | L | 69 | Low | 63.5 | Low | 135 Ų | 135 | 88.6 Ų | 88.6 | 71% | 0.707 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -81.5 | -16 | 178.6 | -161.7 | 71.6 | 0 | 0 | 0 | 112.8 | I8 V10 P14 | I8-L12 WeakPolarHBondContact O-CB 3.33Å; I8-L12 PolarHBondContact O-N 2.83Å; V10-L12 VanDerWaalsContact C-N 3.34Å; L12-P14 VanDerWaalsContact O-CD 3.23Å; L12-P14 WeakPolarHBondContact O-CD 3.4Å; L12-P14 VanDerWaalsContact O-N 3.09Å |
| 13 | M | 66 | Low | 63.1 | Low | 55 Ų | 55 | 81.9 Ų | 81.9 | 27% | 0.271 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -60.9 | 114.4 | 175 | -88.2 | -171.5 | -81.6 | 0 | 0 | 109.3 | P9 V10 M30 | P9-M13 WeakPolarHBondContact O-CG 3.47Å; P9-M13 PolarHBondContact O-N 3.47Å; V10-M13 HydrophobicContact CB-CE 4.44Å; V10-M13 HydrophobicContact CG2-CE 4.31Å; M13-M30 HydrophobicContact CE-CG 4.39Å |
| 14 | P | 55.7 | Low | 63.1 | Low | 106 Ų | 106 | 85.4 Ų | 85.4 | 69% | 0.688 | 45% | 0.448 | S | S | * | . | trans | -66.1 | 142.9 | -173.4 | 25.7 | -32.6 | 0 | 0 | 0 | 110.7 | L12 | L12-P14 VanDerWaalsContact O-CD 3.23Å; L12-P14 WeakPolarHBondContact O-CD 3.4Å; L12-P14 VanDerWaalsContact O-N 3.09Å | ||
| 15 | K | 57.7 | Low | 63.2 | Low | 75 Ų | 75 | 82.5 Ų | 82.5 | 33% | 0.326 | 44% | 0.438 | S | S | . | . | trans | -53.4 | 124.3 | 175.4 | -66.3 | -165.2 | -175.2 | 169.8 | 0 | 108.8 | M17 S65 W86 | K15-M17 VanDerWaalsContact C-N 3.28Å; K15-M17 HydrophobicContact CB-CG 3.91Å; K15-M17 WeakPolarHBondContact O-CG 3.41Å; K15-M17 PolarHBondContact O-N 2.95Å; K15-S65 PolarHBondContact NZ-OG 3.45Å; K15-W86 HydrophobicContact CD-CH2 3.93Å; K15-W86 HydrophobicContact CD-CZ2 3.26Å; K15-W86 HydrophobicContact CG-CZ2 4.05Å; K15-W86 VanDerWaalsContact NZ-CZ3 3.31Å | ||
| 16 | P | 58.8 | Low | 63.1 | Low | 46 Ų | 46 | 79.6 Ų | 79.6 | 30% | 0.299 | 43% | 0.425 | S | S | . | . | trans | -71.4 | 86.2 | 178.4 | 28.3 | -33.5 | 0 | 0 | 0 | 109.4 | V18 H26 | P16-V18 VanDerWaalsContact C-N 3.35Å; P16-V18 PolarHBondContact O-N 3.46Å; P16-H26 HydrophobicContact CG-CB 4.08Å | ||
| 17 | M | 53.6 | Low | 63.2 | Low | 90 Ų | 90 | 75.1 Ų | 75.1 | 44% | 0.443 | 41% | 0.41 | S | S | . | . | trans | -94.1 | 45.4 | -175.6 | -64.7 | -147.9 | -96.7 | 0 | 0 | 112.7 | K15 W86 | K15-M17 VanDerWaalsContact C-N 3.28Å; K15-M17 HydrophobicContact CB-CG 3.91Å; K15-M17 WeakPolarHBondContact O-CG 3.41Å; K15-M17 PolarHBondContact O-N 2.95Å; M17-W86 VanDerWaalsContact CE-NE1 3.3Å | ||
| 18 | V | 56.4 | Low | 63.6 | Low | 80 Ų | 80 | 76.2 Ų | 76.2 | 49% | 0.485 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -138.4 | -30.8 | -177.9 | -154.8 | 0 | 0 | 0 | 0 | 114.8 | P16 | P16-V18 VanDerWaalsContact C-N 3.35Å; P16-V18 PolarHBondContact O-N 3.46Å |
| 19 | H | 53 | Low | 63.7 | Low | 90 Ų | 90 | 76.6 Ų | 76.6 | 42% | 0.417 | 42% | 0.418 | S | S | . | . | trans | -150.7 | 132.3 | -177.6 | -33.3 | -83.4 | 0 | 0 | 0 | 113.3 | S21 M22 M23 | H19-S21 VanDerWaalsContact C-N 3.3Å; H19-S21 PolarHBondContact O-N 3.28Å; H19-M22 HydrophobicContact CB-CB 4.17Å; H19-M22 HydrophobicContact CB-CG 4.12Å; H19-M22 PolarHBondContact O-N 3Å; H19-M22 VanDerWaalsContact O-N 3.14Å; H19-M23 PolarHBondContact O-N 3.36Å | ||
| 20 | P | 55.2 | Low | 64 | Low | 64 Ų | 64 | 74.2 Ų | 74.2 | 42% | 0.416 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.3 | -34.1 | 179.7 | 23.9 | -33 | 0 | 0 | 0 | 113 | M22 M23 | P20-M22 VanDerWaalsContact C-N 3.32Å; P20-M22 PolarHBondContact O-N 3.44Å; P20-M23 PolarHBondContact O-N 3.3Å |
| 21 | S | 61.8 | Low | 64.4 | Low | 90 Ų | 90 | 78.8 Ų | 78.8 | 63% | 0.629 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -68.1 | -30.3 | 176.7 | 57.4 | 0 | 0 | 0 | 0 | 113.3 | H19 | H19-S21 VanDerWaalsContact C-N 3.3Å; H19-S21 PolarHBondContact O-N 3.28Å |
| 22 | M | 59.9 | Low | 65.1 | Low | 112 Ų | 112 | 78.3 Ų | 78.3 | 55% | 0.552 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -80.1 | -21.9 | 178.1 | -73.1 | -69.7 | -174.9 | 0 | 0 | 112.4 | H19 P20 H26 | H19-M22 HydrophobicContact CB-CB 4.17Å; H19-M22 HydrophobicContact CB-CG 4.12Å; H19-M22 PolarHBondContact O-N 3Å; H19-M22 VanDerWaalsContact O-N 3.14Å; P20-M22 VanDerWaalsContact C-N 3.32Å; P20-M22 PolarHBondContact O-N 3.44Å; M22-H26 WeakPolarHBondContact O-CB 2.96Å; M22-H26 PolarHBondContact O-N 3.36Å |
| 23 | M | 59.9 | Low | 65.5 | Low | 20 Ų | 20 | 76.8 Ų | 76.8 | 10% | 0.099 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -61.4 | -52.8 | 179.7 | -66.1 | -162.2 | -176 | 0 | 0 | 111.8 | H19 P20 S25 H26 V27 P70 C72 C82 | H19-M23 PolarHBondContact O-N 3.36Å; P20-M23 PolarHBondContact O-N 3.3Å; M23-S25 VanDerWaalsContact C-N 3.29Å; M23-S25 PolarHBondContact O-N 3.26Å; M23-H26 WeakPolarHBondContact O-CB 3.48Å; M23-H26 PolarHBondContact O-N 3.12Å; M23-V27 WeakPolarHBondContact O-CG2 3.34Å; M23-V27 PolarHBondContact O-N 2.99Å; M23-P70 HydrophobicContact CB-CG 4.24Å; M23-P70 HydrophobicContact CG-CG 4.41Å; M23-P70 HydrophobicContact SD-CB 3.88Å; M23-P70 HydrophobicContact SD-CG 3.52Å; M23-P70 VanDerWaalsContact SD-CG 3.52Å; M23-C72 HydrophobicContact CE-CB 4.11Å; M23-C72 HydrophobicContact SD-CB 4.31Å; M23-C82 HydrophobicContact CE-CB 3.12Å; M23-C82 WeakPolarHBondContact CE-SG 3.46Å |
| 24 | F | 66.5 | Low | 66 | Low | 129 Ų | 129 | 75.1 Ų | 75.1 | 57% | 0.566 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -60 | -42.7 | -177.2 | -173.1 | -103.4 | 0 | 0 | 0 | 111.7 | H26 V27 L28 | F24-H26 VanDerWaalsContact C-N 3.33Å; F24-H26 PolarHBondContact O-N 2.01Å; F24-V27 PolarHBondContact O-N 2.84Å; F24-L28 HydrophobicContact CD1-CD1 3.82Å; F24-L28 HydrophobicContact CD1-CG 4.39Å; F24-L28 HydrophobicContact CE1-CD1 3.27Å; F24-L28 HydrophobicContact CE1-CG 4.02Å; F24-L28 HydrophobicContact CZ-CD1 3.76Å; F24-L28 HydrophobicContact CZ-CG 4.16Å; F24-L28 PolarHBondContact O-N 3.27Å |
| 25 | S | 67.7 | Low | 67.1 | Low | 68 Ų | 68 | 73.2 Ų | 73.2 | 48% | 0.476 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.1 | -41.4 | 175.3 | -58.6 | 0 | 0 | 0 | 0 | 112 | M23 L29 | M23-S25 VanDerWaalsContact C-N 3.29Å; M23-S25 PolarHBondContact O-N 3.26Å; S25-L29 VanDerWaalsContact O-CB 3.25Å; S25-L29 WeakPolarHBondContact O-CB 3.03Å; S25-L29 PolarHBondContact O-N 3.44Å |
| 26 | H | 70.3 | Confident | 68.2 | Low | 61 Ų | 61 | 72.7 Ų | 72.7 | 28% | 0.282 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -68.4 | -40.1 | 178.9 | -157 | -78.3 | 0 | 0 | 0 | 112.3 | P16 M22 M23 F24 L29 M30 | P16-H26 HydrophobicContact CG-CB 4.08Å; M22-H26 WeakPolarHBondContact O-CB 2.96Å; M22-H26 PolarHBondContact O-N 3.36Å; M23-H26 WeakPolarHBondContact O-CB 3.48Å; M23-H26 PolarHBondContact O-N 3.12Å; F24-H26 VanDerWaalsContact C-N 3.33Å; F24-H26 PolarHBondContact O-N 2.01Å; H26-L29 PolarHBondContact O-N 3.11Å; H26-M30 WeakPolarHBondContact O-CB 3.38Å; H26-M30 PolarHBondContact O-N 3.03Å |
| 27 | V | 69.7 | Low | 68.9 | Low | 20 Ų | 20 | 72.3 Ų | 72.3 | 12% | 0.121 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.1 | -49.4 | 174.8 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | M23 F24 L29 M30 F31 L67 L68 | M23-V27 WeakPolarHBondContact O-CG2 3.34Å; M23-V27 PolarHBondContact O-N 2.99Å; F24-V27 PolarHBondContact O-N 2.84Å; V27-L29 PolarHBondContact O-N 2.89Å; V27-M30 PolarHBondContact O-N 2.87Å; V27-F31 WeakPolarHBondContact O-CB 3.45Å; V27-F31 PolarHBondContact O-N 3.07Å; V27-L67 WeakPolarHBondContact CG2-O 3.35Å; V27-L68 HydrophobicContact CG1-CD2 4.09Å |
| 28 | L | 75.2 | Confident | 69.8 | Low | 68 Ų | 68 | 70.4 Ų | 70.4 | 36% | 0.356 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 177.9 | -77.8 | -179 | 0 | 0 | 0 | 111.3 | F24 M30 F31 F32 | F24-L28 HydrophobicContact CD1-CD1 3.82Å; F24-L28 HydrophobicContact CD1-CG 4.39Å; F24-L28 HydrophobicContact CE1-CD1 3.27Å; F24-L28 HydrophobicContact CE1-CG 4.02Å; F24-L28 HydrophobicContact CZ-CD1 3.76Å; F24-L28 HydrophobicContact CZ-CG 4.16Å; F24-L28 PolarHBondContact O-N 3.27Å; L28-M30 VanDerWaalsContact C-N 3.34Å; L28-M30 PolarHBondContact O-N 2.98Å; L28-F31 PolarHBondContact O-N 3.23Å; L28-F32 HydrophobicContact CB-CD2 4.3Å; L28-F32 HydrophobicContact CB-CE2 4.37Å; L28-F32 HydrophobicContact CD2-CE2 4.16Å; L28-F32 WeakPolarHBondContact O-CB 3.39Å; L28-F32 WeakPolarHBondContact O-CD2 3.06Å; L28-F32 PolarHBondContact O-N 3.29Å |
| 29 | L | 78.5 | Confident | 70.9 | Confident | 107 Ų | 107 | 74.2 Ų | 74.2 | 56% | 0.56 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -58.8 | -47.3 | 177.3 | -168.4 | 161.6 | 0 | 0 | 0 | 110.7 | S25 H26 V27 F31 F32 Y33 | S25-L29 VanDerWaalsContact O-CB 3.25Å; S25-L29 WeakPolarHBondContact O-CB 3.03Å; S25-L29 PolarHBondContact O-N 3.44Å; H26-L29 PolarHBondContact O-N 3.11Å; V27-L29 PolarHBondContact O-N 2.89Å; L29-F31 PolarHBondContact O-N 3.19Å; L29-F32 PolarHBondContact O-N 3.1Å; L29-Y33 WeakPolarHBondContact O-CB 3.45Å; L29-Y33 PolarHBondContact O-N 3.3Å |
| 30 | M | 75.1 | Confident | 72 | Confident | 10 Ų | 10 | 78 Ų | 78 | 5% | 0.049 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.7 | -42.8 | 176.9 | -179.7 | 176.1 | 155.3 | 0 | 0 | 111.9 | V10 M13 H26 V27 L28 Y33 L34 L55 L67 | V10-M30 HydrophobicContact CG1-CE 3.22Å; V10-M30 HydrophobicContact CG1-CG 4.38Å; V10-M30 HydrophobicContact CG1-SD 4.1Å; M13-M30 HydrophobicContact CE-CG 4.39Å; H26-M30 WeakPolarHBondContact O-CB 3.38Å; H26-M30 PolarHBondContact O-N 3.03Å; V27-M30 PolarHBondContact O-N 2.87Å; L28-M30 VanDerWaalsContact C-N 3.34Å; L28-M30 PolarHBondContact O-N 2.98Å; M30-Y33 PolarHBondContact O-N 2.99Å; M30-L34 HydrophobicContact CE-CD1 4.01Å; M30-L34 HydrophobicContact CG-CD1 4.08Å; M30-L34 WeakPolarHBondContact O-CB 2.84Å; M30-L34 WeakPolarHBondContact O-CD1 3.35Å; M30-L34 VanDerWaalsContact O-CG 3.22Å; M30-L34 WeakPolarHBondContact O-CG 3.39Å; M30-L34 PolarHBondContact O-N 3.49Å; M30-L55 HydrophobicContact CE-CD2 4.4Å; M30-L67 HydrophobicContact CE-CB 4.15Å; M30-L67 HydrophobicContact CE-CD1 3.86Å; M30-L67 HydrophobicContact CE-CD2 3.89Å; M30-L67 HydrophobicContact CE-CG 4.18Å; M30-L67 HydrophobicContact SD-CD2 3.64Å; M30-L67 HydrophobicContact SD-CG 4.49Å |
| 31 | F | 76 | Confident | 72.8 | Confident | 101 Ų | 101 | 82.3 Ų | 82.3 | 44% | 0.443 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.3 | -49 | 177.2 | -179.4 | -96.8 | 0 | 0 | 0 | 111.7 | V27 L28 L29 Y33 L34 L35 L68 | V27-F31 WeakPolarHBondContact O-CB 3.45Å; V27-F31 PolarHBondContact O-N 3.07Å; L28-F31 PolarHBondContact O-N 3.23Å; L29-F31 PolarHBondContact O-N 3.19Å; F31-Y33 VanDerWaalsContact C-N 3.32Å; F31-Y33 PolarHBondContact O-N 3.48Å; F31-L34 PolarHBondContact O-N 2.82Å; F31-L35 HydrophobicContact CE1-CD2 4.32Å; F31-L35 WeakPolarHBondContact O-CB 3.24Å; F31-L35 PolarHBondContact O-N 3.4Å; F31-L68 HydrophobicContact CD2-CD2 4.3Å |
| 32 | F | 80.8 | Confident | 73.2 | Confident | 118 Ų | 118 | 88.4 Ų | 88.4 | 52% | 0.518 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.1 | -35.7 | 176.9 | -78.7 | -64.9 | 0 | 0 | 0 | 112.2 | L28 L29 L35 S36 | L28-F32 HydrophobicContact CB-CD2 4.3Å; L28-F32 HydrophobicContact CB-CE2 4.37Å; L28-F32 HydrophobicContact CD2-CE2 4.16Å; L28-F32 WeakPolarHBondContact O-CB 3.39Å; L28-F32 WeakPolarHBondContact O-CD2 3.06Å; L28-F32 PolarHBondContact O-N 3.29Å; L29-F32 PolarHBondContact O-N 3.1Å; F32-L35 PolarHBondContact O-N 3.36Å; F32-S36 VanDerWaalsContact O-CB 3.25Å; F32-S36 WeakPolarHBondContact O-CB 2.98Å; F32-S36 PolarHBondContact O-N 2.89Å; F32-S36 PolarHBondContact O-OG 2.03Å |
| 33 | Y | 76.9 | Confident | 73.7 | Confident | 103 Ų | 103 | 85 Ų | 85 | 40% | 0.404 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.3 | -48.5 | 174.6 | 177.9 | -96.2 | 0 | 0 | 0 | 111.3 | V10 L29 M30 F31 S36 F37 | V10-Y33 HydrophobicContact CG2-CD1 4.39Å; V10-Y33 HydrophobicContact CG2-CE1 4.18Å; L29-Y33 WeakPolarHBondContact O-CB 3.45Å; L29-Y33 PolarHBondContact O-N 3.3Å; M30-Y33 PolarHBondContact O-N 2.99Å; F31-Y33 VanDerWaalsContact C-N 3.32Å; F31-Y33 PolarHBondContact O-N 3.48Å; Y33-S36 PolarHBondContact O-N 3.42Å; Y33-F37 VanDerWaalsContact O-CB 3.28Å; Y33-F37 WeakPolarHBondContact O-CB 3.06Å; Y33-F37 PolarHBondContact O-N 3.48Å |
| 34 | L | 76.5 | Confident | 74.6 | Confident | 19 Ų | 19 | 88 Ų | 88 | 10% | 0.099 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 175.4 | -71.8 | 166.6 | 0 | 0 | 0 | 111.1 | V10 M30 F31 S36 F37 F38 F51 | V10-L34 HydrophobicContact CG1-CD2 4.27Å; V10-L34 HydrophobicContact CG2-CD2 3.77Å; M30-L34 HydrophobicContact CE-CD1 4.01Å; M30-L34 HydrophobicContact CG-CD1 4.08Å; M30-L34 WeakPolarHBondContact O-CB 2.84Å; M30-L34 WeakPolarHBondContact O-CD1 3.35Å; M30-L34 VanDerWaalsContact O-CG 3.22Å; M30-L34 WeakPolarHBondContact O-CG 3.39Å; M30-L34 PolarHBondContact O-N 3.49Å; F31-L34 PolarHBondContact O-N 2.82Å; L34-S36 PolarHBondContact O-N 3.22Å; L34-F37 WeakPolarHBondContact O-CB 3.48Å; L34-F37 PolarHBondContact O-N 3.02Å; L34-F38 HydrophobicContact CB-CE2 4.4Å; L34-F38 WeakPolarHBondContact O-CD2 3.25Å; L34-F38 PolarHBondContact O-N 3.28Å; L34-F51 HydrophobicContact CD1-CE1 3.72Å; L34-F51 HydrophobicContact CD1-CZ 3.43Å; L34-F51 VanDerWaalsContact CD1-CZ 3.43Å; L34-F51 HydrophobicContact CD2-CE1 3.6Å; L34-F51 HydrophobicContact CD2-CE2 4.07Å; L34-F51 HydrophobicContact CD2-CZ 3.24Å; L34-F51 HydrophobicContact CG-CE1 4.13Å; L34-F51 HydrophobicContact CG-CZ 3.91Å |
| 35 | L | 79.9 | Confident | 75.2 | Confident | 66 Ų | 66 | 87.8 Ų | 87.8 | 35% | 0.346 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.5 | -48.8 | 179.5 | -167.8 | 68.3 | 0 | 0 | 0 | 110.9 | F31 F32 F37 F38 F39 | F31-L35 HydrophobicContact CE1-CD2 4.32Å; F31-L35 WeakPolarHBondContact O-CB 3.24Å; F31-L35 PolarHBondContact O-N 3.4Å; F32-L35 PolarHBondContact O-N 3.36Å; L35-F37 VanDerWaalsContact C-N 3.27Å; L35-F37 PolarHBondContact O-N 3.38Å; L35-F38 WeakPolarHBondContact O-CB 3.34Å; L35-F38 PolarHBondContact O-N 2.82Å; L35-F38 VanDerWaalsContact O-N 3.11Å; L35-F39 HydrophobicContact CD1-CD2 4.2Å; L35-F39 HydrophobicContact CD1-CE2 3.89Å; L35-F39 HydrophobicContact CG-CD2 4.04Å; L35-F39 HydrophobicContact CG-CE2 4.01Å; L35-F39 WeakPolarHBondContact O-CD2 3.27Å; L35-F39 PolarHBondContact O-N 3.43Å |
| 36 | S | 79.7 | Confident | 75.8 | Confident | 65 Ų | 65 | 90.8 Ų | 90.8 | 46% | 0.455 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58.3 | -42.5 | 176.5 | -57.6 | 0 | 0 | 0 | 0 | 110.9 | F32 Y33 L34 F38 F39 E40 | F32-S36 VanDerWaalsContact O-CB 3.25Å; F32-S36 WeakPolarHBondContact O-CB 2.98Å; F32-S36 PolarHBondContact O-N 2.89Å; F32-S36 PolarHBondContact O-OG 2.03Å; Y33-S36 PolarHBondContact O-N 3.42Å; L34-S36 PolarHBondContact O-N 3.22Å; S36-F38 PolarHBondContact O-N 2.82Å; S36-F39 PolarHBondContact O-N 3.35Å; S36-E40 VanDerWaalsContact O-CB 3.27Å; S36-E40 WeakPolarHBondContact O-CB 3.32Å; S36-E40 PolarHBondContact O-N 2.71Å |
| 37 | F | 73.7 | Confident | 76.3 | Confident | 38 Ų | 38 | 89.2 Ų | 89.2 | 17% | 0.167 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -61.8 | -41.2 | 176.3 | -172.6 | -93.4 | 0 | 0 | 0 | 112.7 | W6 Y33 L34 L35 R41 | W6-F37 HydrophobicContact CB-CE1 3.85Å; W6-F37 HydrophobicContact CB-CE2 4.31Å; W6-F37 HydrophobicContact CB-CZ 3.55Å; W6-F37 AromaticContact CD1-CZ 3.94Å; W6-F37 HydrophobicContact CD2-CE1 4.36Å; W6-F37 AromaticContact CD2-CE2 3.59Å; W6-F37 HydrophobicContact CD2-CE2 3.59Å; W6-F37 AromaticContact CD2-CZ 3.25Å; W6-F37 HydrophobicContact CD2-CZ 3.25Å; W6-F37 AromaticContact CE2-CZ 3.89Å; W6-F37 HydrophobicContact CE3-CD2 4.38Å; W6-F37 AromaticContact CE3-CE2 3.24Å; W6-F37 HydrophobicContact CE3-CE2 3.24Å; W6-F37 AromaticContact CE3-CZ 3.47Å; W6-F37 HydrophobicContact CE3-CZ 3.47Å; W6-F37 VanDerWaalsContact CE3-CZ 3.47Å; W6-F37 HydrophobicContact CG-CE1 4Å; W6-F37 HydrophobicContact CG-CE2 4.07Å; W6-F37 AromaticContact CG-CZ 3.29Å; W6-F37 HydrophobicContact CG-CZ 3.29Å; W6-F37 HydrophobicContact CH2-CE2 4.41Å; W6-F37 AromaticContact CZ3-CE2 3.7Å; W6-F37 HydrophobicContact CZ3-CE2 3.7Å; W6-F37 HydrophobicContact CZ3-CZ 4.24Å; Y33-F37 VanDerWaalsContact O-CB 3.28Å; Y33-F37 WeakPolarHBondContact O-CB 3.06Å; Y33-F37 PolarHBondContact O-N 3.48Å; L34-F37 WeakPolarHBondContact O-CB 3.48Å; L34-F37 PolarHBondContact O-N 3.02Å; L35-F37 VanDerWaalsContact C-N 3.27Å; L35-F37 PolarHBondContact O-N 3.38Å; F37-R41 HydrophobicContact CD2-CG 4.02Å; F37-R41 HydrophobicContact CE1-CB 4.38Å; F37-R41 HydrophobicContact CE1-CG 4.38Å; F37-R41 HydrophobicContact CE2-CB 4.43Å; F37-R41 HydrophobicContact CE2-CG 3.58Å; F37-R41 HydrophobicContact CZ-CB 4.16Å; F37-R41 HydrophobicContact CZ-CG 3.75Å; F37-R41 WeakPolarHBondContact O-CB 3.27Å; F37-R41 PolarHBondContact O-N 3.46Å |
| 38 | F | 74.2 | Confident | 76.7 | Confident | 49 Ų | 49 | 89.8 Ų | 89.8 | 22% | 0.215 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 174.7 | -79.7 | -68.7 | 0 | 0 | 0 | 112.2 | L34 L35 S36 R42 P43 S48 F51 | L34-F38 HydrophobicContact CB-CE2 4.4Å; L34-F38 WeakPolarHBondContact O-CD2 3.25Å; L34-F38 PolarHBondContact O-N 3.28Å; L35-F38 WeakPolarHBondContact O-CB 3.34Å; L35-F38 PolarHBondContact O-N 2.82Å; L35-F38 VanDerWaalsContact O-N 3.11Å; S36-F38 PolarHBondContact O-N 2.82Å; F38-R42 PolarHBondContact O-N 3.47Å; F38-P43 HydrophobicContact CD1-CG 3.21Å; F38-P43 HydrophobicContact CE1-CB 4.49Å; F38-P43 HydrophobicContact CE1-CG 3.47Å; F38-P43 VanDerWaalsContact CE1-CG 3.47Å; F38-P43 HydrophobicContact CG-CG 4.29Å; F38-P43 WeakPolarHBondContact O-CD 3.36Å; F38-S48 VanDerWaalsContact CE1-CB 3.43Å; F38-S48 VanDerWaalsContact CE1-OG 3.23Å; F38-S48 WeakPolarHBondContact CE1-OG 3.41Å; F38-F51 AromaticContact CE2-CD1 3.77Å; F38-F51 HydrophobicContact CE2-CD1 3.77Å; F38-F51 AromaticContact CE2-CE1 3.94Å; F38-F51 HydrophobicContact CE2-CE1 3.94Å; F38-F51 HydrophobicContact CZ-CB 4.47Å; F38-F51 AromaticContact CZ-CD1 3.56Å; F38-F51 HydrophobicContact CZ-CD1 3.56Å; F38-F51 HydrophobicContact CZ-CE1 4.2Å; F38-F51 HydrophobicContact CZ-CG 4.27Å |
| 39 | F | 77.9 | Confident | 77 | Confident | 161 Ų | 161 | 92.8 Ų | 92.8 | 71% | 0.706 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -68.9 | -43 | 179.3 | -89.8 | -88.8 | 0 | 0 | 0 | 112.6 | L35 S36 | L35-F39 HydrophobicContact CD1-CD2 4.2Å; L35-F39 HydrophobicContact CD1-CE2 3.89Å; L35-F39 HydrophobicContact CG-CD2 4.04Å; L35-F39 HydrophobicContact CG-CE2 4.01Å; L35-F39 WeakPolarHBondContact O-CD2 3.27Å; L35-F39 PolarHBondContact O-N 3.43Å; S36-F39 PolarHBondContact O-N 3.35Å |
| 40 | E | 76.1 | Confident | 77.2 | Confident | 168 Ų | 168 | 91.4 Ų | 91.4 | 79% | 0.785 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -76 | -46.6 | -174.3 | -164.6 | 109.3 | -134.8 | 0 | 0 | 112.2 | S36 | S36-E40 VanDerWaalsContact O-CB 3.27Å; S36-E40 WeakPolarHBondContact O-CB 3.32Å; S36-E40 PolarHBondContact O-N 2.71Å |
| 41 | R | 72.9 | Confident | 77.3 | Confident | 155 Ų | 155 | 91.9 Ų | 91.9 | 59% | 0.585 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -90.1 | -15.4 | -172 | -66.6 | -71.3 | -165.2 | -174 | -2.2 | 114.1 | F37 | F37-R41 HydrophobicContact CD2-CG 4.02Å; F37-R41 HydrophobicContact CE1-CB 4.38Å; F37-R41 HydrophobicContact CE1-CG 4.38Å; F37-R41 HydrophobicContact CE2-CB 4.43Å; F37-R41 HydrophobicContact CE2-CG 3.58Å; F37-R41 HydrophobicContact CZ-CB 4.16Å; F37-R41 HydrophobicContact CZ-CG 3.75Å; F37-R41 WeakPolarHBondContact O-CB 3.27Å; F37-R41 PolarHBondContact O-N 3.46Å |
| 42 | R | 70.2 | Confident | 77.5 | Confident | 219 Ų | 219 | 91.8 Ų | 91.8 | 83% | 0.826 | 45% | 0.449 | S | S | * | . | trans | 43.8 | 63.8 | -170.2 | -61.8 | -171.7 | -178 | -156.8 | 1.3 | 111.8 | F38 | F38-R42 PolarHBondContact O-N 3.47Š| ||
| 43 | P | 70.5 | Confident | 77.7 | Confident | 39 Ų | 39 | 90.1 Ų | 90.1 | 25% | 0.253 | 45% | 0.445 | S | S | . | . | trans | -60 | 150.4 | 179.3 | 27.5 | -32.9 | 0 | 0 | 0 | 110.1 | F38 V45 | F38-P43 HydrophobicContact CD1-CG 3.21Å; F38-P43 HydrophobicContact CE1-CB 4.49Å; F38-P43 HydrophobicContact CE1-CG 3.47Å; F38-P43 VanDerWaalsContact CE1-CG 3.47Å; F38-P43 HydrophobicContact CG-CG 4.29Å; F38-P43 WeakPolarHBondContact O-CD 3.36Å; P43-V45 PolarHBondContact O-N 2.89Å | ||
| 44 | C | 78.2 | Confident | 77.9 | Confident | 84 Ų | 84 | 86.8 Ų | 86.8 | 57% | 0.568 | 44% | 0.439 | S | S | * | . | trans | -52.9 | 139 | 174.9 | -51 | 0 | 0 | 0 | 0 | 109.6 | I46 C47 S48 | C44-I46 PolarHBondContact O-N 2.94Å; C44-I46 VanDerWaalsContact O-N 3.11Å; C44-C47 HydrophobicContact CB-CB 4.46Å; C44-C47 WeakPolarHBondContact O-CA 3.22Å; C44-C47 WeakPolarHBondContact O-CB 3.37Å; C44-C47 PolarHBondContact O-N 3.44Å; C44-S48 PolarHBondContact O-N 2.95Å | ||
| 45 | V | 78.7 | Confident | 77.9 | Confident | 125 Ų | 125 | 87.3 Ų | 87.3 | 76% | 0.758 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -51.5 | -41.3 | -176.8 | 178 | 0 | 0 | 0 | 0 | 111.9 | P43 C47 S48 F49 | P43-V45 PolarHBondContact O-N 2.89Å; V45-C47 PolarHBondContact O-N 3.17Å; V45-S48 PolarHBondContact O-N 2.87Å; V45-F49 PolarHBondContact O-N 3.35Å |
| 46 | I | 81.1 | Confident | 77.9 | Confident | 131 Ų | 131 | 90.9 Ų | 90.9 | 67% | 0.672 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -58.5 | -38.6 | 177.9 | -58 | 168.7 | 0 | 0 | 0 | 111.4 | C44 F49 V50 | C44-I46 PolarHBondContact O-N 2.94Å; C44-I46 VanDerWaalsContact O-N 3.11Å; I46-F49 PolarHBondContact O-N 3.46Å; I46-V50 WeakPolarHBondContact O-CG2 3.45Å; I46-V50 PolarHBondContact O-N 2.95Å |
| 47 | C | 80.1 | Confident | 78 | Confident | 28 Ų | 28 | 93.2 Ų | 93.2 | 19% | 0.189 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -75 | -37.4 | -177.3 | -60 | 0 | 0 | 0 | 0 | 112.2 | C3 C44 V45 F49 F51 | C3-C47 HydrophobicContact CB-CB 3.42Å; C3-C47 VanDerWaalsContact CB-CB 3.42Å; C3-C47 WeakPolarHBondContact CB-SG 3.43Å; C3-C47 WeakPolarHBondContact SG-CB 3.28Å; C3-C47 CovalentContact SG-SG 2.01Å; C3-C47 PolarHBondContact SG-SG 2.98Å; C44-C47 HydrophobicContact CB-CB 4.46Å; C44-C47 WeakPolarHBondContact O-CA 3.22Å; C44-C47 WeakPolarHBondContact O-CB 3.37Å; C44-C47 PolarHBondContact O-N 3.44Å; V45-C47 PolarHBondContact O-N 3.17Å; C47-F49 VanDerWaalsContact C-N 3.31Å; C47-F51 WeakPolarHBondContact O-CB 3.49Å; C47-F51 PolarHBondContact O-N 2.99Å; C47-F51 VanDerWaalsContact O-N 3.12Å |
| 48 | S | 78.7 | Confident | 77.9 | Confident | 32 Ų | 32 | 95 Ų | 95 | 22% | 0.224 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -60.8 | -42.8 | 169.3 | -176.4 | 0 | 0 | 0 | 0 | 111.3 | F38 C44 V45 F51 L52 | F38-S48 VanDerWaalsContact CE1-CB 3.43Å; F38-S48 VanDerWaalsContact CE1-OG 3.23Å; F38-S48 WeakPolarHBondContact CE1-OG 3.41Å; C44-S48 PolarHBondContact O-N 2.95Å; V45-S48 PolarHBondContact O-N 2.87Å; S48-F51 WeakPolarHBondContact O-CB 3.48Å; S48-F51 PolarHBondContact O-N 3.29Å; S48-L52 WeakPolarHBondContact O-CG 3.43Å; S48-L52 PolarHBondContact O-N 3.11Å |
| 49 | F | 81.7 | Confident | 77.8 | Confident | 130 Ų | 130 | 93.9 Ų | 93.9 | 57% | 0.57 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.8 | -47.5 | 179.7 | -169.5 | -104.9 | 0 | 0 | 0 | 112.7 | V45 I46 C47 F51 L52 L53 | V45-F49 PolarHBondContact O-N 3.35Å; I46-F49 PolarHBondContact O-N 3.46Å; C47-F49 VanDerWaalsContact C-N 3.31Å; F49-F51 VanDerWaalsContact C-N 3.27Å; F49-F51 PolarHBondContact O-N 2.95Å; F49-L52 PolarHBondContact O-N 3.07Å; F49-L53 HydrophobicContact CD1-CD1 3.71Å; F49-L53 HydrophobicContact CD1-CG 4.23Å; F49-L53 HydrophobicContact CE1-CD1 3.38Å; F49-L53 HydrophobicContact CE1-CD2 4.48Å; F49-L53 HydrophobicContact CE1-CG 3.99Å; F49-L53 HydrophobicContact CZ-CD1 4.08Å; F49-L53 HydrophobicContact CZ-CD2 4.38Å; F49-L53 HydrophobicContact CZ-CG 4.28Å; F49-L53 WeakPolarHBondContact O-CG 3.22Å; F49-L53 PolarHBondContact O-N 3.23Å |
| 50 | V | 82.5 | Confident | 77.7 | Confident | 79 Ų | 79 | 94.8 Ų | 94.8 | 48% | 0.479 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.1 | -39.5 | 176.3 | 172 | 0 | 0 | 0 | 0 | 111.4 | I46 L53 A54 | I46-V50 WeakPolarHBondContact O-CG2 3.45Å; I46-V50 PolarHBondContact O-N 2.95Å; V50-L53 PolarHBondContact O-N 2.83Å; V50-A54 PolarHBondContact O-N 2.89Å |
| 51 | F | 78.2 | Confident | 77.6 | Confident | 20 Ų | 20 | 92.3 Ų | 92.3 | 9% | 0.088 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 176.6 | 176 | -111.2 | 0 | 0 | 0 | 112.7 | L7 L34 F38 C47 S48 F49 L53 A54 L55 | L7-F51 HydrophobicContact CD1-CD2 3.13Å; L7-F51 HydrophobicContact CD1-CE2 3.11Å; L7-F51 HydrophobicContact CD1-CG 4.43Å; L7-F51 HydrophobicContact CD1-CZ 4.41Å; L7-F51 HydrophobicContact CG-CD2 4.4Å; L34-F51 HydrophobicContact CD1-CE1 3.72Å; L34-F51 HydrophobicContact CD1-CZ 3.43Å; L34-F51 VanDerWaalsContact CD1-CZ 3.43Å; L34-F51 HydrophobicContact CD2-CE1 3.6Å; L34-F51 HydrophobicContact CD2-CE2 4.07Å; L34-F51 HydrophobicContact CD2-CZ 3.24Å; L34-F51 HydrophobicContact CG-CE1 4.13Å; L34-F51 HydrophobicContact CG-CZ 3.91Å; F38-F51 AromaticContact CE2-CD1 3.77Å; F38-F51 HydrophobicContact CE2-CD1 3.77Å; F38-F51 AromaticContact CE2-CE1 3.94Å; F38-F51 HydrophobicContact CE2-CE1 3.94Å; F38-F51 HydrophobicContact CZ-CB 4.47Å; F38-F51 AromaticContact CZ-CD1 3.56Å; F38-F51 HydrophobicContact CZ-CD1 3.56Å; F38-F51 HydrophobicContact CZ-CE1 4.2Å; F38-F51 HydrophobicContact CZ-CG 4.27Å; C47-F51 WeakPolarHBondContact O-CB 3.49Å; C47-F51 PolarHBondContact O-N 2.99Å; C47-F51 VanDerWaalsContact O-N 3.12Å; S48-F51 WeakPolarHBondContact O-CB 3.48Å; S48-F51 PolarHBondContact O-N 3.29Å; F49-F51 VanDerWaalsContact C-N 3.27Å; F49-F51 PolarHBondContact O-N 2.95Å; F51-L53 VanDerWaalsContact C-N 3.33Å; F51-L53 PolarHBondContact O-N 3.49Å; F51-A54 PolarHBondContact O-N 2.88Å; F51-L55 HydrophobicContact CD1-CD1 4.2Å; F51-L55 HydrophobicContact CE1-CD1 3.47Å; F51-L55 VanDerWaalsContact CE1-CD1 3.47Å; F51-L55 HydrophobicContact CE1-CG 4.22Å; F51-L55 HydrophobicContact CE2-CD1 4.17Å; F51-L55 HydrophobicContact CE2-CD2 4.31Å; F51-L55 HydrophobicContact CE2-CG 4.09Å; F51-L55 HydrophobicContact CZ-CD1 3.47Å; F51-L55 VanDerWaalsContact CZ-CD1 3.47Å; F51-L55 HydrophobicContact CZ-CD2 4.19Å; F51-L55 HydrophobicContact CZ-CG 3.89Å; F51-L55 PolarHBondContact O-N 3.27Å; F51-L55 VanDerWaalsContact O-N 3.07Å |
| 52 | L | 79.8 | Confident | 77 | Confident | 99 Ų | 99 | 89.2 Ų | 89.2 | 52% | 0.518 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.9 | -41.1 | 177 | -72.4 | 175.6 | 0 | 0 | 0 | 112 | S48 F49 A54 L55 F56 | S48-L52 WeakPolarHBondContact O-CG 3.43Å; S48-L52 PolarHBondContact O-N 3.11Å; F49-L52 PolarHBondContact O-N 3.07Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.06Å; L52-L55 PolarHBondContact O-N 3.23Å; L52-F56 WeakPolarHBondContact O-CB 3.11Å; L52-F56 PolarHBondContact O-N 3.34Å |
| 53 | L | 84.8 | Confident | 76.6 | Confident | 82 Ų | 82 | 86.2 Ų | 86.2 | 43% | 0.429 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.7 | -41 | 175.2 | -75.9 | 179.6 | 0 | 0 | 0 | 112.4 | F49 V50 F51 F56 M57 | F49-L53 HydrophobicContact CD1-CD1 3.71Å; F49-L53 HydrophobicContact CD1-CG 4.23Å; F49-L53 HydrophobicContact CE1-CD1 3.38Å; F49-L53 HydrophobicContact CE1-CD2 4.48Å; F49-L53 HydrophobicContact CE1-CG 3.99Å; F49-L53 HydrophobicContact CZ-CD1 4.08Å; F49-L53 HydrophobicContact CZ-CD2 4.38Å; F49-L53 HydrophobicContact CZ-CG 4.28Å; F49-L53 WeakPolarHBondContact O-CG 3.22Å; F49-L53 PolarHBondContact O-N 3.23Å; V50-L53 PolarHBondContact O-N 2.83Å; F51-L53 VanDerWaalsContact C-N 3.33Å; F51-L53 PolarHBondContact O-N 3.49Å; L53-F56 PolarHBondContact O-N 3.48Å; L53-M57 WeakPolarHBondContact O-CB 3.19Å; L53-M57 WeakPolarHBondContact O-CG 3.49Å; L53-M57 PolarHBondContact O-N 3.32Å |
| 54 | A | 81.5 | Confident | 75.9 | Confident | 34 Ų | 34 | 88.6 Ų | 88.6 | 28% | 0.281 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.2 | -47.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | V50 F51 L52 F56 M57 L58 | V50-A54 PolarHBondContact O-N 2.89Å; F51-A54 PolarHBondContact O-N 2.88Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.06Å; A54-F56 VanDerWaalsContact C-N 3.32Å; A54-F56 PolarHBondContact O-N 3.44Å; A54-M57 PolarHBondContact O-N 3.37Å; A54-L58 WeakPolarHBondContact O-CD1 3.35Å; A54-L58 PolarHBondContact O-N 3.45Å |
| 55 | L | 76.2 | Confident | 74.8 | Confident | 30 Ų | 30 | 86.4 Ų | 86.4 | 16% | 0.157 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -58.9 | -43.7 | 175.7 | -69.8 | -179.5 | 0 | 0 | 0 | 112.2 | M30 F51 L52 L58 C59 L67 | M30-L55 HydrophobicContact CE-CD2 4.4Å; F51-L55 HydrophobicContact CD1-CD1 4.2Å; F51-L55 HydrophobicContact CE1-CD1 3.47Å; F51-L55 VanDerWaalsContact CE1-CD1 3.47Å; F51-L55 HydrophobicContact CE1-CG 4.22Å; F51-L55 HydrophobicContact CE2-CD1 4.17Å; F51-L55 HydrophobicContact CE2-CD2 4.31Å; F51-L55 HydrophobicContact CE2-CG 4.09Å; F51-L55 HydrophobicContact CZ-CD1 3.47Å; F51-L55 VanDerWaalsContact CZ-CD1 3.47Å; F51-L55 HydrophobicContact CZ-CD2 4.19Å; F51-L55 HydrophobicContact CZ-CG 3.89Å; F51-L55 PolarHBondContact O-N 3.27Å; F51-L55 VanDerWaalsContact O-N 3.07Å; L52-L55 PolarHBondContact O-N 3.23Å; L55-L58 PolarHBondContact O-N 2.81Å; L55-C59 WeakPolarHBondContact O-CB 3.49Å; L55-C59 PolarHBondContact O-N 2.81Å; L55-L67 HydrophobicContact CD2-CD1 4.1Å |
| 56 | F | 80.5 | Confident | 74.1 | Confident | 140 Ų | 140 | 81.3 Ų | 81.3 | 61% | 0.614 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -63.5 | -43.4 | 177.9 | -170.6 | -95.8 | 0 | 0 | 0 | 111.8 | L52 L53 A54 C59 Y60 | L52-F56 WeakPolarHBondContact O-CB 3.11Å; L52-F56 PolarHBondContact O-N 3.34Å; L53-F56 PolarHBondContact O-N 3.48Å; A54-F56 VanDerWaalsContact C-N 3.32Å; A54-F56 PolarHBondContact O-N 3.44Å; F56-C59 WeakPolarHBondContact O-CB 3.44Å; F56-C59 PolarHBondContact O-N 3.44Å; F56-Y60 VanDerWaalsContact O-CB 3.32Å; F56-Y60 WeakPolarHBondContact O-CB 3.15Å; F56-Y60 PolarHBondContact O-N 2.97Å |
| 57 | M | 80.1 | Confident | 73.1 | Confident | 115 Ų | 115 | 77.9 Ų | 77.9 | 57% | 0.567 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -63.3 | -41.6 | 175.8 | -82.1 | -73.3 | -175.8 | 0 | 0 | 112.4 | L53 A54 C59 Y60 N61 | L53-M57 WeakPolarHBondContact O-CB 3.19Å; L53-M57 WeakPolarHBondContact O-CG 3.49Å; L53-M57 PolarHBondContact O-N 3.32Å; A54-M57 PolarHBondContact O-N 3.37Å; M57-C59 VanDerWaalsContact C-N 3.31Å; M57-C59 PolarHBondContact O-N 2.9Å; M57-Y60 PolarHBondContact O-N 2.96Å; M57-N61 PolarHBondContact O-N 3.19Å; M57-N61 PolarHBondContact O-ND2 2.72Å |
| 58 | L | 72.7 | Confident | 72 | Confident | 74 Ų | 74 | 80.6 Ų | 80.6 | 39% | 0.387 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 174.9 | -94.4 | 74.8 | 0 | 0 | 0 | 110.5 | A54 L55 Y60 N61 D62 L67 | A54-L58 WeakPolarHBondContact O-CD1 3.35Å; A54-L58 PolarHBondContact O-N 3.45Å; L55-L58 PolarHBondContact O-N 2.81Å; L58-Y60 VanDerWaalsContact C-N 3.32Å; L58-Y60 PolarHBondContact O-N 2.91Å; L58-N61 PolarHBondContact O-N 3.16Å; L58-D62 PolarHBondContact O-N 3.2Å; L58-L67 HydrophobicContact CD2-CD1 4.13Å |
| 59 | C | 72.7 | Confident | 70.7 | Confident | 27 Ų | 27 | 87.5 Ų | 87.5 | 18% | 0.182 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -65.3 | -33.3 | 177 | -93.8 | 0 | 0 | 0 | 0 | 114.2 | L55 F56 M57 D62 C66 | L55-C59 WeakPolarHBondContact O-CB 3.49Å; L55-C59 PolarHBondContact O-N 2.81Å; F56-C59 WeakPolarHBondContact O-CB 3.44Å; F56-C59 PolarHBondContact O-N 3.44Å; M57-C59 VanDerWaalsContact C-N 3.31Å; M57-C59 PolarHBondContact O-N 2.9Å; C59-D62 CarbonylContact O-C 3.46Å; C59-C66 WeakPolarHBondContact CA-SG 3.33Å; C59-C66 HydrophobicContact CB-CB 4.3Å; C59-C66 WeakPolarHBondContact CB-SG 3.23Å; C59-C66 WeakPolarHBondContact SG-CA 3.25Å; C59-C66 WeakPolarHBondContact SG-CB 3.48Å; C59-C66 CovalentContact SG-SG 2.03Å; C59-C66 PolarHBondContact SG-SG 2.91Å |
| 60 | Y | 74.9 | Confident | 69.5 | Low | 180 Ų | 180 | 83.4 Ų | 83.4 | 71% | 0.706 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -74.9 | -35.4 | -179.9 | -172.4 | -96.8 | 0 | 0 | 0 | 112.3 | F56 M57 L58 | F56-Y60 VanDerWaalsContact O-CB 3.32Å; F56-Y60 WeakPolarHBondContact O-CB 3.15Å; F56-Y60 PolarHBondContact O-N 2.97Å; M57-Y60 PolarHBondContact O-N 2.96Å; L58-Y60 VanDerWaalsContact C-N 3.32Å; L58-Y60 PolarHBondContact O-N 2.91Å |
| 61 | N | 72.9 | Confident | 68.1 | Low | 116 Ų | 116 | 83 Ų | 83 | 62% | 0.62 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -69.2 | -41.2 | 175.8 | -79.5 | -74.7 | 0 | 0 | 0 | 111.6 | M57 L58 | M57-N61 PolarHBondContact O-N 3.19Å; M57-N61 PolarHBondContact O-ND2 2.72Å; L58-N61 PolarHBondContact O-N 3.16Å |
| 62 | D | 61.7 | Low | 67.1 | Low | 89 Ų | 89 | 83.9 Ų | 83.9 | 48% | 0.476 | 43% | 0.426 | S | S | . | . | trans | -142.8 | 103.9 | -174.9 | -76.8 | -74.4 | 0 | 0 | 0 | 110 | L58 C59 D64 S65 C66 | L58-D62 PolarHBondContact O-N 3.2Å; C59-D62 CarbonylContact O-C 3.46Å; D62-D64 PolarHBondContact O-N 3.19Å; D62-S65 CarbonylContact O-C 3.52Å; D62-S65 PolarHBondContact O-N 3.33Å; D62-C66 PolarHBondContact O-N 3.36Å; D62-C66 VanDerWaalsContact O-N 3.07Å | ||
| 63 | Q | 60.4 | Low | 65.7 | Low | 156 Ų | 156 | 89.5 Ų | 89.5 | 73% | 0.729 | 44% | 0.44 | S | S | * | . | G | 310 helix | trans | -57.7 | -33 | 173.3 | -82.4 | -177.7 | -4.9 | 0 | 0 | 111.8 | C66 | Q63-C66 WeakPolarHBondContact O-CB 3.34Š|
| 64 | D | 57.1 | Low | 64.1 | Low | 90 Ų | 90 | 89.8 Ų | 89.8 | 48% | 0.481 | 45% | 0.445 | S | S | . | . | G | 310 helix | trans | -79.1 | -22.9 | 178.9 | -61.4 | -41.7 | 0 | 0 | 0 | 113 | D62 T71 | D62-D64 PolarHBondContact O-N 3.19Å; D64-T71 WeakPolarHBondContact OD1-CB 3.36Å |
| 65 | S | 55 | Low | 62.4 | Low | 38 Ų | 38 | 91.8 Ų | 91.8 | 27% | 0.266 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | -95.9 | 6.7 | 174.3 | -65.2 | 0 | 0 | 0 | 0 | 113.1 | K15 D62 L67 | K15-S65 PolarHBondContact NZ-OG 3.45Å; D62-S65 CarbonylContact O-C 3.52Å; D62-S65 PolarHBondContact O-N 3.33Å; S65-L67 PolarHBondContact O-N 3.06Å |
| 66 | C | 62.7 | Low | 61.2 | Low | 17 Ų | 17 | 96.5 Ų | 96.5 | 12% | 0.115 | 49% | 0.489 | C | S | . | . | trans | -53.1 | 114.5 | 167.5 | -98 | 0 | 0 | 0 | 0 | 109.3 | C59 D62 Q63 L68 W69 P70 | C59-C66 WeakPolarHBondContact CA-SG 3.33Å; C59-C66 HydrophobicContact CB-CB 4.3Å; C59-C66 WeakPolarHBondContact CB-SG 3.23Å; C59-C66 WeakPolarHBondContact SG-CA 3.25Å; C59-C66 WeakPolarHBondContact SG-CB 3.48Å; C59-C66 CovalentContact SG-SG 2.03Å; C59-C66 PolarHBondContact SG-SG 2.91Å; D62-C66 PolarHBondContact O-N 3.36Å; D62-C66 VanDerWaalsContact O-N 3.07Å; Q63-C66 WeakPolarHBondContact O-CB 3.34Å; C66-L68 PolarHBondContact O-N 3.35Å; C66-W69 HydrophobicContact CB-CB 4.45Å; C66-W69 CarbonylContact O-C 3.38Å; C66-W69 PolarHBondContact O-N 3.29Å; C66-P70 WeakPolarHBondContact O-CD 3.05Å | ||
| 67 | L | 61 | Low | 59.9 | Low | 60 Ų | 60 | 98 Ų | 98 | 31% | 0.314 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54 | -20.4 | 171.2 | -87.4 | 150.3 | 0 | 0 | 0 | 112.6 | V27 M30 L55 L58 S65 | V27-L67 WeakPolarHBondContact CG2-O 3.35Å; M30-L67 HydrophobicContact CE-CB 4.15Å; M30-L67 HydrophobicContact CE-CD1 3.86Å; M30-L67 HydrophobicContact CE-CD2 3.89Å; M30-L67 HydrophobicContact CE-CG 4.18Å; M30-L67 HydrophobicContact SD-CD2 3.64Å; M30-L67 HydrophobicContact SD-CG 4.49Å; L55-L67 HydrophobicContact CD2-CD1 4.1Å; L58-L67 HydrophobicContact CD2-CD1 4.13Å; S65-L67 PolarHBondContact O-N 3.06Å |
| 68 | L | 56.6 | Low | 58.4 | Low | 84 Ų | 84 | 97.1 Ų | 97.1 | 44% | 0.44 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93 | -20.1 | 179.6 | -73.2 | 152.2 | 0 | 0 | 0 | 114.2 | V27 F31 C66 | V27-L68 HydrophobicContact CG1-CD2 4.09Å; F31-L68 HydrophobicContact CD2-CD2 4.3Å; C66-L68 PolarHBondContact O-N 3.35Å |
| 69 | W | 52.4 | Low | 57.5 | Low | 177 Ų | 177 | 101.9 Ų | 101.9 | 67% | 0.67 | 52% | 0.516 | S | S | * | . | trans | -155.7 | 69.8 | -175.1 | -157.4 | -87 | 0 | 0 | 0 | 111.2 | C66 T71 | C66-W69 HydrophobicContact CB-CB 4.45Å; C66-W69 CarbonylContact O-C 3.38Å; C66-W69 PolarHBondContact O-N 3.29Å; W69-T71 PolarHBondContact O-N 2.96Å | ||
| 70 | P | 55.2 | Low | 56.4 | Low | 45 Ų | 45 | 107.3 Ų | 107.3 | 29% | 0.292 | 54% | 0.539 | S | S | . | . | trans | -65.2 | 104.1 | 169.4 | 27.4 | -32.5 | 0 | 0 | 0 | 108.3 | M23 C66 C72 | M23-P70 HydrophobicContact CB-CG 4.24Å; M23-P70 HydrophobicContact CG-CG 4.41Å; M23-P70 HydrophobicContact SD-CB 3.88Å; M23-P70 HydrophobicContact SD-CG 3.52Å; M23-P70 VanDerWaalsContact SD-CG 3.52Å; C66-P70 WeakPolarHBondContact O-CD 3.05Å; P70-C72 VanDerWaalsContact C-N 3.31Å; P70-C72 PolarHBondContact O-N 3.46Å | ||
| 71 | T | 54.1 | Low | 55 | Low | 71 Ų | 71 | 102 Ų | 102 | 44% | 0.436 | 53% | 0.528 | S | S | . | . | trans | -71.9 | 91.1 | 173.8 | -46 | 0 | 0 | 0 | 0 | 107.8 | D64 W69 R73 | D64-T71 WeakPolarHBondContact OD1-CB 3.36Å; W69-T71 PolarHBondContact O-N 2.96Å; T71-R73 PolarHBondContact O-N 3.35Å; T71-R73 VanDerWaalsContact O-N 3.16Å | ||
| 72 | C | 56.4 | Low | 54 | Low | 38 Ų | 38 | 96.9 Ų | 96.9 | 26% | 0.257 | 50% | 0.501 | S | S | . | . | trans | -71.6 | 110.2 | 174.8 | 178.2 | 0 | 0 | 0 | 0 | 109.5 | M23 P70 T74 C82 | M23-C72 HydrophobicContact CE-CB 4.11Å; M23-C72 HydrophobicContact SD-CB 4.31Å; P70-C72 VanDerWaalsContact C-N 3.31Å; P70-C72 PolarHBondContact O-N 3.46Å; C72-T74 PolarHBondContact O-N 2.01Å; C72-C82 HydrophobicContact CB-CB 3.84Å; C72-C82 WeakPolarHBondContact CB-SG 3.49Å; C72-C82 WeakPolarHBondContact SG-CA 2.93Å; C72-C82 WeakPolarHBondContact SG-CB 3.48Å; C72-C82 CovalentContact SG-SG 2.01Å; C72-C82 PolarHBondContact SG-SG 3.24Å | ||
| 73 | R | 50.7 | Low | 53.6 | Low | 217 Ų | 217 | 96.8 Ų | 96.8 | 82% | 0.819 | 51% | 0.507 | S | S | * | . | trans | -77.3 | 99.7 | 158.5 | -75.1 | -160.6 | -169.5 | 132.9 | 5.6 | 107.8 | T71 S75 | T71-R73 PolarHBondContact O-N 3.35Å; T71-R73 VanDerWaalsContact O-N 3.16Å; R73-S75 PolarHBondContact O-N 3.1Å; R73-S75 VanDerWaalsContact O-N 3.1Å | ||
| 74 | T | 51 | Low | 53.3 | Low | 87 Ų | 87 | 90.8 Ų | 90.8 | 53% | 0.534 | 49% | 0.485 | S | S | . | . | trans | -61.1 | 109.1 | 165.6 | 52.5 | 0 | 0 | 0 | 0 | 107.9 | C72 | C72-T74 PolarHBondContact O-N 2.01Š| ||
| 75 | S | 45.3 | Very low | 52.9 | Low | 76 Ų | 76 | 93.8 Ų | 93.8 | 53% | 0.531 | 50% | 0.501 | S | S | . | . | trans | -70.3 | 131.2 | 167.9 | -167.6 | 0 | 0 | 0 | 0 | 107.7 | R73 E77 N78 | R73-S75 PolarHBondContact O-N 3.1Å; R73-S75 VanDerWaalsContact O-N 3.1Å; S75-E77 PolarHBondContact O-N 3.17Å; S75-N78 PolarHBondContact O-N 2.81Å | ||
| 76 | P | 51.7 | Low | 52.3 | Low | 129 Ų | 129 | 98.5 Ų | 98.5 | 84% | 0.838 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.7 | -3 | -170.4 | 25.3 | -35.2 | 0 | 0 | 0 | 115.3 | ||
| 77 | E | 53.6 | Low | 51.3 | Low | 171 Ų | 171 | 105.3 Ų | 105.3 | 80% | 0.799 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.5 | -22.4 | -178.7 | -147.6 | 169.7 | 106.6 | 0 | 0 | 113.6 | S75 | S75-E77 PolarHBondContact O-N 3.17Š|
| 78 | N | 48 | Very low | 50.1 | Low | 97 Ų | 97 | 114.7 Ų | 114.7 | 52% | 0.519 | 59% | 0.585 | S | S | . | * | trans | -140.3 | 86 | -179.3 | -63.7 | -43.9 | 0 | 0 | 0 | 109.6 | S75 E80 S81 | S75-N78 PolarHBondContact O-N 2.81Å; N78-E80 PolarHBondContact O-N 3.14Å; N78-S81 PolarHBondContact O-N 3.33Å | ||
| 79 | E | 53.2 | Low | 49.8 | Very low | 174 Ų | 174 | 116.2 Ų | 116.2 | 81% | 0.813 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -5.3 | -178.7 | -68.2 | 174.6 | 82.4 | 0 | 0 | 114.5 | ||
| 80 | E | 50.4 | Low | 49.7 | Very low | 142 Ų | 142 | 113 Ų | 113 | 66% | 0.664 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111 | 1 | -171.9 | 58 | -171.6 | 106 | 0 | 0 | 114.5 | N78 | N78-E80 PolarHBondContact O-N 3.14Š|
| 81 | S | 45.3 | Very low | 49.3 | Very low | 69 Ų | 69 | 116.8 Ų | 116.8 | 48% | 0.483 | 60% | 0.604 | S | S | . | * | trans | -132.9 | 99.3 | -176.9 | -53.3 | 0 | 0 | 0 | 0 | 112.3 | N78 S83 | N78-S81 PolarHBondContact O-N 3.33Å; S81-S83 PolarHBondContact O-N 3.06Å | ||
| 82 | C | 53.1 | Low | 49.1 | Very low | 8 Ų | 8 | 119.5 Ų | 119.5 | 5% | 0.054 | 61% | 0.614 | C | S | . | * | trans | -75.7 | 90.8 | 165.2 | -69.6 | 0 | 0 | 0 | 0 | 109.7 | M23 C72 A84 | M23-C82 HydrophobicContact CE-CB 3.12Å; M23-C82 WeakPolarHBondContact CE-SG 3.46Å; C72-C82 HydrophobicContact CB-CB 3.84Å; C72-C82 WeakPolarHBondContact CB-SG 3.49Å; C72-C82 WeakPolarHBondContact SG-CA 2.93Å; C72-C82 WeakPolarHBondContact SG-CB 3.48Å; C72-C82 CovalentContact SG-SG 2.01Å; C72-C82 PolarHBondContact SG-SG 3.24Å; C82-A84 PolarHBondContact O-N 3.35Å; C82-A84 VanDerWaalsContact O-N 3.17Å | ||
| 83 | S | 52.2 | Low | 48.6 | Very low | 86 Ų | 86 | 124.6 Ų | 124.6 | 60% | 0.601 | 64% | 0.637 | S | S | * | * | trans | -71.8 | 101.7 | 167.3 | 176.7 | 0 | 0 | 0 | 0 | 108.6 | S81 N85 | S81-S83 PolarHBondContact O-N 3.06Å; S83-N85 PolarHBondContact O-N 2.93Å | ||
| 84 | A | 54.7 | Low | 48.5 | Very low | 31 Ų | 31 | 118.4 Ų | 118.4 | 26% | 0.256 | 62% | 0.624 | S | S | . | * | trans | -63.8 | 113.5 | 154.9 | 0 | 0 | 0 | 0 | 0 | 105.3 | C82 W86 | C82-A84 PolarHBondContact O-N 3.35Å; C82-A84 VanDerWaalsContact O-N 3.17Å; A84-W86 PolarHBondContact O-N 2.92Å | ||
| 85 | N | 48.6 | Very low | 48.3 | Very low | 153 Ų | 153 | 120.6 Ų | 120.6 | 82% | 0.818 | 63% | 0.631 | S | S | * | * | trans | -58.8 | 93 | 175.6 | -90.9 | -41.2 | 0 | 0 | 0 | 108.5 | S83 H87 | S83-N85 PolarHBondContact O-N 2.93Å; N85-H87 PolarHBondContact O-N 3.31Å | ||
| 86 | W | 42.9 | Very low | 48.5 | Very low | 137 Ų | 137 | 124.1 Ų | 124.1 | 52% | 0.519 | 64% | 0.638 | S | S | . | * | trans | -76.6 | 101.4 | 165.7 | -69.8 | 99.6 | 0 | 0 | 0 | 106.3 | K15 M17 A84 | K15-W86 HydrophobicContact CD-CH2 3.93Å; K15-W86 HydrophobicContact CD-CZ2 3.26Å; K15-W86 HydrophobicContact CG-CZ2 4.05Å; K15-W86 VanDerWaalsContact NZ-CZ3 3.31Å; M17-W86 VanDerWaalsContact CE-NE1 3.3Å; A84-W86 PolarHBondContact O-N 2.92Å | ||
| 87 | H | 39.9 | Very low | 48.3 | Very low | 159 Ų | 159 | 123.7 Ų | 123.7 | 74% | 0.736 | 62% | 0.622 | S | S | * | * | trans | 68.3 | 120.9 | 162.4 | -65.7 | -85.4 | 0 | 0 | 0 | 117.8 | N85 | N85-H87 PolarHBondContact O-N 3.31Š| ||
| 88 | Q | 37.1 | Very low | 47.8 | Very low | 257 Ų | 257 | 119.4 Ų | 119.4 | 100% | 1.201 | 61% | 0.606 | S | S | * | * | -129.2 | 0 | 108.5 | -167.2 | 90.1 | 33.1 | 0 | 0 | 108.1 |
Retrieved 88 of 88 residues in 170.8 ms
(Link to these results)