| 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 | Q | 55.6 | Low | 70.8 | Confident | 214 Ų | 214 | 108.2 Ų | 108.2 | 100% | 1 | 60% | 0.601 | S | S | * | * | 0 | -43.1 | 0 | -94.3 | 167.1 | -14.7 | 0 | 0 | 113.4 | S5 | Q1-S5 WeakPolarHBondContact O-CB 3.32Å; Q1-S5 PolarHBondContact O-N 3.38Å | |||
| 2 | S | 66.1 | Low | 72.4 | Confident | 98 Ų | 98 | 103.3 Ų | 103.3 | 69% | 0.685 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -63.8 | -42.6 | -177.9 | 54.7 | 0 | 0 | 0 | 0 | 115.4 | S5 A6 | S2-S5 PolarHBondContact O-N 3.23Å; S2-A6 WeakPolarHBondContact O-CB 3.45Å; S2-A6 PolarHBondContact O-N 3.16Å |
| 3 | V | 67.7 | Low | 73.8 | Confident | 96 Ų | 96 | 96.1 Ų | 96.1 | 58% | 0.582 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -70.5 | -39.1 | -177.5 | -179.3 | 0 | 0 | 0 | 0 | 112.6 | A6 H7 | V3-A6 PolarHBondContact O-N 3.15Å; V3-H7 PolarHBondContact O-N 2.87Å; V3-H7 PolarHBondContact O-ND1 2.91Å |
| 4 | L | 67.7 | Low | 75.3 | Confident | 132 Ų | 132 | 95 Ų | 95 | 69% | 0.691 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.7 | -44.1 | 175 | -82.9 | 143.7 | 0 | 0 | 0 | 111.2 | A6 H7 S8 | L4-A6 PolarHBondContact O-N 3.3Å; L4-H7 PolarHBondContact O-N 3.24Å; L4-S8 PolarHBondContact O-N 3.32Å; L4-S8 PolarHBondContact O-OG 3Å; L4-S8 VanDerWaalsContact O-OG 3.07Å |
| 5 | S | 68 | Low | 76.7 | Confident | 81 Ų | 81 | 94.1 Ų | 94.1 | 57% | 0.566 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.2 | -41.2 | 175.7 | 177.4 | 0 | 0 | 0 | 0 | 112.4 | Q1 S2 S8 H9 | Q1-S5 WeakPolarHBondContact O-CB 3.32Å; Q1-S5 PolarHBondContact O-N 3.38Å; S2-S5 PolarHBondContact O-N 3.23Å; S5-S8 PolarHBondContact O-N 3.07Å; S5-H9 PolarHBondContact O-N 2.87Å |
| 6 | A | 69.1 | Low | 77.9 | Confident | 48 Ų | 48 | 90.6 Ų | 90.6 | 40% | 0.397 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | S2 V3 L4 H9 I10 | S2-A6 WeakPolarHBondContact O-CB 3.45Å; S2-A6 PolarHBondContact O-N 3.16Å; V3-A6 PolarHBondContact O-N 3.15Å; L4-A6 PolarHBondContact O-N 3.3Å; A6-H9 PolarHBondContact O-N 3.1Å; A6-I10 WeakPolarHBondContact O-CD1 3.35Å; A6-I10 VanDerWaalsContact O-CG1 3.27Å; A6-I10 WeakPolarHBondContact O-CG1 3.38Å; A6-I10 PolarHBondContact O-N 3.08Å |
| 7 | H | 69.4 | Low | 79 | Confident | 120 Ų | 120 | 85.4 Ų | 85.4 | 56% | 0.556 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -62.5 | -45.6 | 175.7 | -84.1 | 73 | 0 | 0 | 0 | 111.8 | V3 L4 H9 I10 M11 | V3-H7 PolarHBondContact O-N 2.87Å; V3-H7 PolarHBondContact O-ND1 2.91Å; L4-H7 PolarHBondContact O-N 3.24Å; H7-H9 VanDerWaalsContact C-N 3.3Å; H7-H9 PolarHBondContact O-N 3.25Å; H7-I10 PolarHBondContact O-N 3.29Å; H7-M11 WeakPolarHBondContact O-CG 3.36Å; H7-M11 PolarHBondContact O-N 2.91Å |
| 8 | S | 73.6 | Confident | 80.1 | Confident | 82 Ų | 82 | 84.5 Ų | 84.5 | 57% | 0.573 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -60 | -40.2 | 177 | -58.5 | 0 | 0 | 0 | 0 | 112.2 | L4 S5 M11 A12 | L4-S8 PolarHBondContact O-N 3.32Å; L4-S8 PolarHBondContact O-OG 3Å; L4-S8 VanDerWaalsContact O-OG 3.07Å; S5-S8 PolarHBondContact O-N 3.07Å; S8-M11 PolarHBondContact O-N 2.86Å; S8-A12 WeakPolarHBondContact O-CB 3.46Å; S8-A12 PolarHBondContact O-N 3.34Å |
| 9 | H | 77.4 | Confident | 81 | Confident | 92 Ų | 92 | 83.8 Ų | 83.8 | 43% | 0.426 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -66.8 | -41.7 | 177.1 | -174.9 | -86 | 0 | 0 | 0 | 112.5 | S5 A6 H7 M11 A12 V13 | S5-H9 PolarHBondContact O-N 2.87Å; A6-H9 PolarHBondContact O-N 3.1Å; H7-H9 VanDerWaalsContact C-N 3.3Å; H7-H9 PolarHBondContact O-N 3.25Å; H9-M11 VanDerWaalsContact C-N 3.34Å; H9-M11 PolarHBondContact O-N 3.25Å; H9-A12 PolarHBondContact O-N 3.03Å; H9-V13 WeakPolarHBondContact O-CG2 3.39Å; H9-V13 PolarHBondContact O-N 3.4Å |
| 10 | I | 79.4 | Confident | 81.9 | Confident | 104 Ų | 104 | 79.7 Ų | 79.7 | 53% | 0.533 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 176.4 | -68.5 | 164 | 0 | 0 | 0 | 110.7 | A6 H7 V13 R14 | A6-I10 WeakPolarHBondContact O-CD1 3.35Å; A6-I10 VanDerWaalsContact O-CG1 3.27Å; A6-I10 WeakPolarHBondContact O-CG1 3.38Å; A6-I10 PolarHBondContact O-N 3.08Å; H7-I10 PolarHBondContact O-N 3.29Å; I10-V13 PolarHBondContact O-N 3.32Å; I10-R14 PolarHBondContact O-N 3.38Å; I10-R14 VanDerWaalsContact O-N 3.07Å |
| 11 | M | 84.6 | Confident | 82.7 | Confident | 123 Ų | 123 | 77.9 Ų | 77.9 | 61% | 0.606 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.8 | -43 | 177.5 | -69.3 | -58.1 | -65.4 | 0 | 0 | 112 | H7 S8 H9 V13 R14 V15 | H7-M11 WeakPolarHBondContact O-CG 3.36Å; H7-M11 PolarHBondContact O-N 2.91Å; S8-M11 PolarHBondContact O-N 2.86Å; H9-M11 VanDerWaalsContact C-N 3.34Å; H9-M11 PolarHBondContact O-N 3.25Å; M11-V13 PolarHBondContact O-N 3Å; M11-R14 PolarHBondContact O-N 3.38Å; M11-R14 VanDerWaalsContact O-N 3.14Å; M11-V15 WeakPolarHBondContact O-CG2 3.48Å; M11-V15 PolarHBondContact O-N 2.92Å |
| 12 | A | 89.9 | Confident | 84.7 | Confident | 50 Ų | 50 | 73.9 Ų | 73.9 | 41% | 0.413 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.1 | -45.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | S8 H9 R14 V15 L16 | S8-A12 WeakPolarHBondContact O-CB 3.46Å; S8-A12 PolarHBondContact O-N 3.34Å; H9-A12 PolarHBondContact O-N 3.03Å; A12-R14 VanDerWaalsContact C-N 3.26Å; A12-R14 PolarHBondContact O-N 2.96Å; A12-V15 PolarHBondContact O-N 2.98Å; A12-L16 WeakPolarHBondContact O-CG 3.15Å; A12-L16 PolarHBondContact O-N 3.15Å |
| 13 | V | 91.3 | Very high | 86.3 | Confident | 9 Ų | 9 | 70.2 Ų | 70.2 | 6% | 0.055 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62 | -36.6 | 176 | 174.4 | 0 | 0 | 0 | 0 | 111.2 | H9 I10 M11 L16 E17 K169 Y170 | H9-V13 WeakPolarHBondContact O-CG2 3.39Å; H9-V13 PolarHBondContact O-N 3.4Å; I10-V13 PolarHBondContact O-N 3.32Å; M11-V13 PolarHBondContact O-N 3Å; V13-L16 PolarHBondContact O-N 3.46Å; V13-E17 WeakPolarHBondContact O-CG 3.47Å; V13-E17 PolarHBondContact O-N 2.97Å; V13-K169 HydrophobicContact CG1-CD 3.6Å; V13-Y170 HydrophobicContact CG1-CE2 4.26Å |
| 14 | R | 94.8 | Very high | 87.7 | Confident | 81 Ų | 81 | 65.6 Ų | 65.6 | 31% | 0.306 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67.1 | -39.5 | 177.3 | -174.7 | 55.5 | -179.8 | 162.2 | 4.5 | 112.5 | I10 M11 A12 L16 E17 I18 F94 L95 | I10-R14 PolarHBondContact O-N 3.38Å; I10-R14 VanDerWaalsContact O-N 3.07Å; M11-R14 PolarHBondContact O-N 3.38Å; M11-R14 VanDerWaalsContact O-N 3.14Å; A12-R14 VanDerWaalsContact C-N 3.26Å; A12-R14 PolarHBondContact O-N 2.96Å; R14-L16 VanDerWaalsContact C-N 3.32Å; R14-E17 VanDerWaalsContact CD-OE2 3.26Å; R14-E17 WeakPolarHBondContact CD-OE2 3.4Å; R14-E17 IonicContact CZ-OE2 3.94Å; R14-E17 IonicContact NH1-OE2 3Å; R14-E17 PolarHBondContact NH1-OE2 3.32Å; R14-E17 PolarHBondContact O-N 3.18Å; R14-I18 HydrophobicContact CG-CD1 4.45Å; R14-I18 WeakPolarHBondContact O-CG1 3.47Å; R14-I18 PolarHBondContact O-N 2.79Å; R14-I18 VanDerWaalsContact O-N 3.08Å; R14-F94 PolarHBondContact NH1-O 3.14Å; R14-L95 PolarHBondContact NH1-O 3.48Å; R14-L95 PolarHBondContact NH2-O 3.23Å |
| 15 | V | 96.1 | Very high | 89.2 | Confident | 82 Ų | 82 | 60.9 Ų | 60.9 | 50% | 0.497 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 173.7 | 172.6 | 0 | 0 | 0 | 0 | 110.5 | M11 A12 E17 I18 I19 | M11-V15 WeakPolarHBondContact O-CG2 3.48Å; M11-V15 PolarHBondContact O-N 2.92Å; A12-V15 PolarHBondContact O-N 2.98Å; V15-E17 PolarHBondContact O-N 2.91Å; V15-I18 PolarHBondContact O-N 2.86Å; V15-I18 VanDerWaalsContact O-N 3.15Å; V15-I19 HydrophobicContact CG1-CD1 4.1Å; V15-I19 WeakPolarHBondContact O-CG1 3.29Å; V15-I19 PolarHBondContact O-N 3.06Å |
| 16 | L | 96.5 | Very high | 90.6 | Very high | 38 Ų | 38 | 59.4 Ų | 59.4 | 20% | 0.199 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.3 | -43.3 | 175.7 | -68.4 | 174.3 | 0 | 0 | 0 | 112.3 | A12 V13 R14 I18 I19 F20 L159 T163 | A12-L16 WeakPolarHBondContact O-CG 3.15Å; A12-L16 PolarHBondContact O-N 3.15Å; V13-L16 PolarHBondContact O-N 3.46Å; R14-L16 VanDerWaalsContact C-N 3.32Å; L16-I18 VanDerWaalsContact C-N 3.28Å; L16-I18 PolarHBondContact O-N 3.29Å; L16-I19 HydrophobicContact CD2-CD1 4.49Å; L16-I19 WeakPolarHBondContact O-CB 3.43Å; L16-I19 PolarHBondContact O-N 3.36Å; L16-F20 HydrophobicContact CB-CE2 3.9Å; L16-F20 HydrophobicContact CB-CZ 4.04Å; L16-F20 HydrophobicContact CD2-CZ 4.47Å; L16-F20 WeakPolarHBondContact O-CD2 3.31Å; L16-F20 WeakPolarHBondContact O-CG 3.23Å; L16-F20 PolarHBondContact O-N 2.83Å; L16-L159 HydrophobicContact CD2-CD1 4.1Å; L16-L159 HydrophobicContact CD2-CD2 3.55Å; L16-L159 HydrophobicContact CD2-CG 3.92Å; L16-T163 HydrophobicContact CD1-CG2 4.38Å |
| 17 | E | 96.9 | Very high | 91.9 | Very high | 1 Ų | 1 | 57.6 Ų | 57.6 | 1% | 0.005 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.2 | -40.5 | 174.4 | -70.8 | 174.8 | 163.9 | 0 | 0 | 112.1 | V13 R14 V15 F20 F21 F94 K169 Y170 | V13-E17 WeakPolarHBondContact O-CG 3.47Å; V13-E17 PolarHBondContact O-N 2.97Å; R14-E17 VanDerWaalsContact CD-OE2 3.26Å; R14-E17 WeakPolarHBondContact CD-OE2 3.4Å; R14-E17 IonicContact CZ-OE2 3.94Å; R14-E17 IonicContact NH1-OE2 3Å; R14-E17 PolarHBondContact NH1-OE2 3.32Å; R14-E17 PolarHBondContact O-N 3.18Å; V15-E17 PolarHBondContact O-N 2.91Å; E17-F20 PolarHBondContact O-N 2.93Å; E17-F21 WeakPolarHBondContact O-CB 3.46Å; E17-F21 PolarHBondContact O-N 3.01Å; E17-F94 HydrophobicContact CB-CB 4.47Å; E17-F94 HydrophobicContact CB-CD1 4.4Å; E17-F94 HydrophobicContact CG-CD1 4.12Å; E17-F94 WeakPolarHBondContact O-CB 3.41Å; E17-K169 VanDerWaalsContact OE1-CE 3.24Å; E17-K169 WeakPolarHBondContact OE1-CE 3.41Å; E17-K169 IonicContact OE1-NZ 2.66Å; E17-K169 PolarHBondContact OE1-NZ 3.41Å; E17-K169 IonicContact OE2-NZ 3Å; E17-K169 PolarHBondContact OE2-NZ 3.48Å; E17-Y170 PolarHBondContact OE1-OH 3.34Å |
| 18 | I | 97.9 | Very high | 93.3 | Very high | 70 Ų | 70 | 54.1 Ų | 54.1 | 36% | 0.359 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -66.2 | -41.5 | 177.3 | -67.1 | 166.9 | 0 | 0 | 0 | 110.8 | R14 V15 L16 F20 F21 F22 | R14-I18 HydrophobicContact CG-CD1 4.45Å; R14-I18 WeakPolarHBondContact O-CG1 3.47Å; R14-I18 PolarHBondContact O-N 2.79Å; R14-I18 VanDerWaalsContact O-N 3.08Å; V15-I18 PolarHBondContact O-N 2.86Å; V15-I18 VanDerWaalsContact O-N 3.15Å; L16-I18 VanDerWaalsContact C-N 3.28Å; L16-I18 PolarHBondContact O-N 3.29Å; I18-F20 PolarHBondContact O-N 2.8Å; I18-F21 WeakPolarHBondContact O-CB 3.25Å; I18-F21 PolarHBondContact O-N 3.46Å; I18-F22 HydrophobicContact CG2-CD2 3.78Å; I18-F22 HydrophobicContact CG2-CE2 3.57Å; I18-F22 VanDerWaalsContact O-CD2 3.24Å; I18-F22 WeakPolarHBondContact O-CD2 3.39Å; I18-F22 PolarHBondContact O-N 3.48Å |
| 19 | I | 98 | Very high | 94.4 | Very high | 71 Ų | 71 | 52.9 Ų | 52.9 | 36% | 0.364 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.7 | -47.2 | 174.5 | -67.8 | 166.9 | 0 | 0 | 0 | 110.4 | V15 L16 F21 F22 Y23 | V15-I19 HydrophobicContact CG1-CD1 4.1Å; V15-I19 WeakPolarHBondContact O-CG1 3.29Å; V15-I19 PolarHBondContact O-N 3.06Å; L16-I19 HydrophobicContact CD2-CD1 4.49Å; L16-I19 WeakPolarHBondContact O-CB 3.43Å; L16-I19 PolarHBondContact O-N 3.36Å; I19-F21 VanDerWaalsContact C-N 3.33Å; I19-F21 PolarHBondContact O-N 3.44Å; I19-F22 PolarHBondContact O-N 2.88Å; I19-Y23 WeakPolarHBondContact O-CB 3.38Å; I19-Y23 PolarHBondContact O-N 3.08Å |
| 20 | F | 98.3 | Very high | 95.3 | Very high | 1 Ų | 1 | 50.8 Ų | 50.8 | 0% | 0.004 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 178 | -56.7 | -31.9 | 0 | 0 | 0 | 111.9 | L16 E17 I18 Y23 F24 F94 V156 L159 L160 T163 | L16-F20 HydrophobicContact CB-CE2 3.9Å; L16-F20 HydrophobicContact CB-CZ 4.04Å; L16-F20 HydrophobicContact CD2-CZ 4.47Å; L16-F20 WeakPolarHBondContact O-CD2 3.31Å; L16-F20 WeakPolarHBondContact O-CG 3.23Å; L16-F20 PolarHBondContact O-N 2.83Å; E17-F20 PolarHBondContact O-N 2.93Å; I18-F20 PolarHBondContact O-N 2.8Å; F20-Y23 PolarHBondContact O-N 3.2Å; F20-F24 HydrophobicContact CB-CD2 4.42Å; F20-F24 HydrophobicContact CB-CE2 4.45Å; F20-F24 WeakPolarHBondContact O-CD2 3.4Å; F20-F24 PolarHBondContact O-N 2.86Å; F20-F94 HydrophobicContact CB-CB 4.29Å; F20-F94 HydrophobicContact CB-CD1 4.24Å; F20-F94 HydrophobicContact CB-CD2 3.71Å; F20-F94 HydrophobicContact CB-CE2 4.13Å; F20-F94 HydrophobicContact CB-CG 3.81Å; F20-F94 HydrophobicContact CD2-CD1 4.07Å; F20-F94 AromaticContact CD2-CE1 3.98Å; F20-F94 HydrophobicContact CD2-CE1 3.98Å; F20-F94 HydrophobicContact CD2-CG 4.49Å; F20-F94 HydrophobicContact CD2-CZ 4.32Å; F20-V156 HydrophobicContact CD1-CG1 3.93Å; F20-V156 HydrophobicContact CE1-CG1 4.25Å; F20-L159 HydrophobicContact CE1-CB 4.37Å; F20-L159 HydrophobicContact CE1-CD2 4.35Å; F20-L159 HydrophobicContact CE1-CG 4.13Å; F20-L159 HydrophobicContact CZ-CG 4.12Å; F20-L160 HydrophobicContact CD1-CB 4.25Å; F20-L160 HydrophobicContact CD1-CD1 4.41Å; F20-L160 HydrophobicContact CD2-CD1 3.71Å; F20-L160 HydrophobicContact CE1-CB 3.88Å; F20-L160 HydrophobicContact CE1-CD1 4.46Å; F20-L160 HydrophobicContact CE2-CB 4.48Å; F20-L160 HydrophobicContact CE2-CD1 3.76Å; F20-L160 HydrophobicContact CG-CD1 4.06Å; F20-L160 HydrophobicContact CZ-CB 4.02Å; F20-L160 HydrophobicContact CZ-CD1 4.17Å; F20-T163 HydrophobicContact CE2-CG2 4.1Å |
| 21 | F | 98.5 | Very high | 96.1 | Very high | 43 Ų | 43 | 45.9 Ų | 45.9 | 19% | 0.189 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.2 | -53 | 174.1 | 163.5 | -109.5 | 0 | 0 | 0 | 111.4 | E17 I18 I19 Y23 F24 A25 A91 F94 L95 | E17-F21 WeakPolarHBondContact O-CB 3.46Å; E17-F21 PolarHBondContact O-N 3.01Å; I18-F21 WeakPolarHBondContact O-CB 3.25Å; I18-F21 PolarHBondContact O-N 3.46Å; I19-F21 VanDerWaalsContact C-N 3.33Å; I19-F21 PolarHBondContact O-N 3.44Å; F21-Y23 VanDerWaalsContact C-N 3.31Å; F21-Y23 PolarHBondContact O-N 3.31Å; F21-F24 PolarHBondContact O-N 3.12Å; F21-A25 HydrophobicContact CD2-CB 4.46Å; F21-A25 HydrophobicContact CE2-CB 4.12Å; F21-A25 HydrophobicContact CZ-CB 4.3Å; F21-A25 WeakPolarHBondContact O-CB 3.48Å; F21-A25 PolarHBondContact O-N 3.05Å; F21-A91 HydrophobicContact CD2-CB 4Å; F21-A91 VanDerWaalsContact CD2-O 3.29Å; F21-A91 WeakPolarHBondContact CD2-O 3.25Å; F21-A91 HydrophobicContact CE2-CB 4.23Å; F21-F94 HydrophobicContact CB-CB 4.17Å; F21-L95 HydrophobicContact CD1-CD1 4.11Å; F21-L95 HydrophobicContact CD2-CB 3.64Å; F21-L95 HydrophobicContact CD2-CD1 4.33Å; F21-L95 HydrophobicContact CD2-CD2 4.47Å; F21-L95 HydrophobicContact CD2-CG 4.36Å; F21-L95 HydrophobicContact CE1-CD1 4.04Å; F21-L95 HydrophobicContact CE2-CB 3.94Å; F21-L95 HydrophobicContact CE2-CD1 4.25Å; F21-L95 HydrophobicContact CE2-CD2 3.9Å; F21-L95 HydrophobicContact CE2-CG 4.25Å; F21-L95 HydrophobicContact CG-CB 4.07Å; F21-L95 HydrophobicContact CG-CD1 4.24Å; F21-L95 HydrophobicContact CZ-CD1 4.1Å; F21-L95 HydrophobicContact CZ-CD2 4.11Å |
| 22 | F | 98.4 | Very high | 96.6 | Very high | 129 Ų | 129 | 42.9 Ų | 42.9 | 57% | 0.566 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -63.6 | -38.6 | -179.7 | -77.7 | -64.8 | 0 | 0 | 0 | 112.3 | I18 I19 A25 S26 | I18-F22 HydrophobicContact CG2-CD2 3.78Å; I18-F22 HydrophobicContact CG2-CE2 3.57Å; I18-F22 VanDerWaalsContact O-CD2 3.24Å; I18-F22 WeakPolarHBondContact O-CD2 3.39Å; I18-F22 PolarHBondContact O-N 3.48Å; I19-F22 PolarHBondContact O-N 2.88Å; F22-A25 PolarHBondContact O-N 3.35Å; F22-S26 WeakPolarHBondContact O-CB 3.41Å; F22-S26 PolarHBondContact O-N 3.46Å; F22-S26 PolarHBondContact O-OG 2.95Å |
| 23 | Y | 98.3 | Very high | 96.8 | Very high | 21 Ų | 21 | 45.4 Ų | 45.4 | 8% | 0.082 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -57.8 | -55.2 | 174.1 | 171.7 | -92.2 | 0 | 0 | 0 | 111.4 | I19 F20 F21 A25 S26 H27 Y109 Y153 V156 P157 | I19-Y23 WeakPolarHBondContact O-CB 3.38Å; I19-Y23 PolarHBondContact O-N 3.08Å; F20-Y23 PolarHBondContact O-N 3.2Å; F21-Y23 VanDerWaalsContact C-N 3.31Å; F21-Y23 PolarHBondContact O-N 3.31Å; Y23-A25 VanDerWaalsContact C-N 3.34Å; Y23-A25 PolarHBondContact O-N 3.34Å; Y23-S26 PolarHBondContact O-N 3.44Å; Y23-S26 PolarHBondContact O-OG 2.97Å; Y23-H27 AromaticContact CD2-CE1 3.4Å; Y23-H27 VanDerWaalsContact CD2-CE1 3.4Å; Y23-H27 WeakPolarHBondContact CD2-CE1 3.46Å; Y23-H27 AromaticContact CE2-CE1 3.06Å; Y23-H27 WeakPolarHBondContact CE2-CE1 3.23Å; Y23-H27 AromaticContact CE2-ND1 3.99Å; Y23-H27 AromaticContact CE2-NE2 3.32Å; Y23-H27 VanDerWaalsContact CE2-NE2 3.32Å; Y23-H27 WeakPolarHBondContact CE2-NE2 3.36Å; Y23-H27 AromaticContact CZ-CE1 3.4Å; Y23-H27 VanDerWaalsContact CZ-CE1 3.4Å; Y23-H27 AromaticContact CZ-NE2 3.23Å; Y23-H27 PolarHBondContact O-N 3.37Å; Y23-H27 VanDerWaalsContact O-N 3.12Å; Y23-H27 PolarHBondContact O-ND1 2.87Å; Y23-H27 PolarHBondContact OH-NE2 3.38Å; Y23-Y109 HydrophobicContact CE1-CE1 4.08Å; Y23-Y109 WeakPolarHBondContact CE1-OH 3.25Å; Y23-Y109 PolarHBondContact OH-OH 3.46Å; Y23-Y153 HydrophobicContact CE2-CD1 4.42Å; Y23-V156 HydrophobicContact CD1-CG1 3.96Å; Y23-V156 HydrophobicContact CD2-CB 3.7Å; Y23-V156 HydrophobicContact CD2-CG1 3.52Å; Y23-V156 HydrophobicContact CD2-CG2 4.08Å; Y23-V156 HydrophobicContact CE1-CG1 4.41Å; Y23-V156 HydrophobicContact CE2-CB 3.87Å; Y23-V156 HydrophobicContact CE2-CG1 4.01Å; Y23-V156 HydrophobicContact CG-CB 4.22Å; Y23-V156 HydrophobicContact CG-CG1 3.5Å; Y23-P157 WeakPolarHBondContact OH-CG 3.38Å |
| 24 | F | 98.4 | Very high | 97 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.3 | -36.3 | 179.7 | -76.1 | -67.2 | 0 | 0 | 0 | 112.7 | F20 F21 H27 F86 F87 A90 A91 F94 Y109 L160 | F20-F24 HydrophobicContact CB-CD2 4.42Å; F20-F24 HydrophobicContact CB-CE2 4.45Å; F20-F24 WeakPolarHBondContact O-CD2 3.4Å; F20-F24 PolarHBondContact O-N 2.86Å; F21-F24 PolarHBondContact O-N 3.12Å; F24-H27 PolarHBondContact O-N 2.95Å; F24-F86 HydrophobicContact CE1-CD1 4.16Å; F24-F86 AromaticContact CE1-CE1 3.92Å; F24-F86 HydrophobicContact CE1-CE1 3.92Å; F24-F86 AromaticContact CZ-CE1 3.97Å; F24-F86 HydrophobicContact CZ-CE1 3.97Å; F24-F87 HydrophobicContact CD1-CB 4.5Å; F24-F87 AromaticContact CD1-CD1 3.61Å; F24-F87 HydrophobicContact CD1-CD1 3.61Å; F24-F87 HydrophobicContact CD1-CE1 4.26Å; F24-F87 HydrophobicContact CD1-CG 4.41Å; F24-F87 HydrophobicContact CE1-CD1 4.01Å; F24-F87 HydrophobicContact CE1-CE1 4.39Å; F24-A90 HydrophobicContact CB-CB 4.31Å; F24-A90 HydrophobicContact CD1-CB 3.76Å; F24-A90 HydrophobicContact CD2-CB 3.58Å; F24-A90 HydrophobicContact CE1-CB 3.86Å; F24-A90 HydrophobicContact CE2-CB 3.75Å; F24-A90 HydrophobicContact CG-CB 3.61Å; F24-A90 HydrophobicContact CZ-CB 3.87Å; F24-A91 HydrophobicContact CB-CB 4.07Å; F24-F94 AromaticContact CD2-CD2 3.8Å; F24-F94 HydrophobicContact CD2-CD2 3.8Å; F24-F94 AromaticContact CD2-CE2 3.92Å; F24-F94 HydrophobicContact CD2-CE2 3.92Å; F24-F94 AromaticContact CE2-CD2 3.89Å; F24-F94 HydrophobicContact CE2-CD2 3.89Å; F24-F94 AromaticContact CE2-CE2 3.51Å; F24-F94 HydrophobicContact CE2-CE2 3.51Å; F24-F94 HydrophobicContact CZ-CE2 4.48Å; F24-Y109 AromaticContact CE1-CD1 3.81Å; F24-Y109 HydrophobicContact CE1-CD1 3.81Å; F24-Y109 HydrophobicContact CE1-CD2 4.48Å; F24-Y109 AromaticContact CE1-CE1 3.38Å; F24-Y109 HydrophobicContact CE1-CE1 3.38Å; F24-Y109 HydrophobicContact CE1-CE2 4.12Å; F24-Y109 HydrophobicContact CE1-CG 4.34Å; F24-Y109 AromaticContact CE1-CZ 3.55Å; F24-Y109 AromaticContact CZ-CD1 3.64Å; F24-Y109 HydrophobicContact CZ-CD1 3.64Å; F24-Y109 AromaticContact CZ-CE1 3.46Å; F24-Y109 HydrophobicContact CZ-CE1 3.46Å; F24-Y109 VanDerWaalsContact CZ-CE1 3.46Å; F24-Y109 HydrophobicContact CZ-CG 4.44Å; F24-L160 HydrophobicContact CE2-CD2 3.81Å; F24-L160 HydrophobicContact CZ-CD2 3.67Å |
| 25 | A | 98.3 | Very high | 97 | Very high | 32 Ų | 32 | 44.7 Ų | 44.7 | 26% | 0.264 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -67.3 | -38.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | F21 F22 Y23 P29 | F21-A25 HydrophobicContact CD2-CB 4.46Å; F21-A25 HydrophobicContact CE2-CB 4.12Å; F21-A25 HydrophobicContact CZ-CB 4.3Å; F21-A25 WeakPolarHBondContact O-CB 3.48Å; F21-A25 PolarHBondContact O-N 3.05Å; F22-A25 PolarHBondContact O-N 3.35Å; Y23-A25 VanDerWaalsContact C-N 3.34Å; Y23-A25 PolarHBondContact O-N 3.34Å; A25-P29 WeakPolarHBondContact O-CD 3.32Å |
| 26 | S | 97.6 | Very high | 96.9 | Very high | 51 Ų | 51 | 41.9 Ų | 41.9 | 36% | 0.357 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -72.8 | -30.3 | 177.1 | 69.6 | 0 | 0 | 0 | 0 | 112.6 | F22 Y23 I28 P29 I30 | F22-S26 WeakPolarHBondContact O-CB 3.41Å; F22-S26 PolarHBondContact O-N 3.46Å; F22-S26 PolarHBondContact O-OG 2.95Å; Y23-S26 PolarHBondContact O-N 3.44Å; Y23-S26 PolarHBondContact O-OG 2.97Å; S26-I28 VanDerWaalsContact C-N 3.27Å; S26-I28 PolarHBondContact O-N 3.27Å; S26-P29 WeakPolarHBondContact O-CD 3.04Å; S26-P29 VanDerWaalsContact O-CG 3.31Å; S26-P29 WeakPolarHBondContact O-CG 3.44Å; S26-I30 VanDerWaalsContact O-CD1 3.29Å; S26-I30 WeakPolarHBondContact O-CD1 3.38Å; S26-I30 WeakPolarHBondContact O-CG1 3.26Å; S26-I30 PolarHBondContact O-N 3.22Å |
| 27 | H | 97.1 | Very high | 96.9 | Very high | 9 Ų | 9 | 41.3 Ų | 41.3 | 4% | 0.042 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.8 | -29.6 | 178.1 | -79.6 | 51.1 | 0 | 0 | 0 | 112.7 | Y23 F24 I30 T31 F87 Y153 | Y23-H27 AromaticContact CD2-CE1 3.4Å; Y23-H27 VanDerWaalsContact CD2-CE1 3.4Å; Y23-H27 WeakPolarHBondContact CD2-CE1 3.46Å; Y23-H27 AromaticContact CE2-CE1 3.06Å; Y23-H27 WeakPolarHBondContact CE2-CE1 3.23Å; Y23-H27 AromaticContact CE2-ND1 3.99Å; Y23-H27 AromaticContact CE2-NE2 3.32Å; Y23-H27 VanDerWaalsContact CE2-NE2 3.32Å; Y23-H27 WeakPolarHBondContact CE2-NE2 3.36Å; Y23-H27 AromaticContact CZ-CE1 3.4Å; Y23-H27 VanDerWaalsContact CZ-CE1 3.4Å; Y23-H27 AromaticContact CZ-NE2 3.23Å; Y23-H27 PolarHBondContact O-N 3.37Å; Y23-H27 VanDerWaalsContact O-N 3.12Å; Y23-H27 PolarHBondContact O-ND1 2.87Å; Y23-H27 PolarHBondContact OH-NE2 3.38Å; F24-H27 PolarHBondContact O-N 2.95Å; H27-I30 PolarHBondContact O-N 2.93Å; H27-T31 VanDerWaalsContact O-CB 3.31Å; H27-T31 WeakPolarHBondContact O-CB 3.11Å; H27-T31 PolarHBondContact O-N 3.33Å; H27-T31 PolarHBondContact O-OG1 3.32Å; H27-T31 VanDerWaalsContact O-OG1 3.14Å; H27-F87 HydrophobicContact CB-CD2 3.91Å; H27-F87 HydrophobicContact CB-CE1 4.35Å; H27-F87 HydrophobicContact CB-CE2 3.76Å; H27-F87 HydrophobicContact CB-CG 4.33Å; H27-F87 HydrophobicContact CB-CZ 3.98Å; H27-Y153 AromaticContact CE1-CD1 3.53Å; H27-Y153 AromaticContact CE1-CE1 3.35Å; H27-Y153 WeakPolarHBondContact CE1-CE1 3.47Å; H27-Y153 AromaticContact NE2-CD1 3.16Å; H27-Y153 WeakPolarHBondContact NE2-CD1 3.08Å; H27-Y153 AromaticContact NE2-CE1 3.32Å; H27-Y153 VanDerWaalsContact NE2-CE1 3.32Å; H27-Y153 WeakPolarHBondContact NE2-CE1 3.31Å |
| 28 | I | 97.6 | Very high | 96.7 | Very high | 47 Ų | 47 | 42.2 Ų | 42.2 | 24% | 0.241 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -56.9 | -58.6 | 179.3 | -63.3 | 165 | 0 | 0 | 0 | 112 | S26 L32 F87 P88 | S26-I28 VanDerWaalsContact C-N 3.27Å; S26-I28 PolarHBondContact O-N 3.27Å; I28-L32 HydrophobicContact CG2-CD1 3.98Å; I28-L32 WeakPolarHBondContact O-CB 3.32Å; I28-L32 VanDerWaalsContact O-CG 3.27Å; I28-L32 WeakPolarHBondContact O-CG 3.32Å; I28-L32 PolarHBondContact O-N 3.39Å; I28-L32 VanDerWaalsContact O-N 3.11Å; I28-F87 HydrophobicContact CD1-CB 4.26Å; I28-F87 HydrophobicContact CG1-CB 3.64Å; I28-F87 HydrophobicContact CG1-CD2 4.34Å; I28-F87 HydrophobicContact CG1-CG 4.48Å; I28-P88 HydrophobicContact CD1-CB 4.28Å |
| 29 | P | 97 | Very high | 96.4 | Very high | 57 Ų | 57 | 41.8 Ų | 41.8 | 37% | 0.37 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -68.6 | -32.7 | 177.5 | 26.9 | -35.1 | 0 | 0 | 0 | 112.8 | A25 S26 F33 | A25-P29 WeakPolarHBondContact O-CD 3.32Å; S26-P29 WeakPolarHBondContact O-CD 3.04Å; S26-P29 VanDerWaalsContact O-CG 3.31Å; S26-P29 WeakPolarHBondContact O-CG 3.44Å; P29-F33 HydrophobicContact CB-CD2 3.89Å; P29-F33 HydrophobicContact CB-CE2 3.99Å; P29-F33 VanDerWaalsContact O-CB 3.25Å; P29-F33 WeakPolarHBondContact O-CB 3.16Å; P29-F33 WeakPolarHBondContact O-CD2 3.32Å; P29-F33 WeakPolarHBondContact O-CG 3.08Å; P29-F33 PolarHBondContact O-N 3.39Å |
| 30 | I | 95.8 | Very high | 96.1 | Very high | 48 Ų | 48 | 42.1 Ų | 42.1 | 25% | 0.246 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.2 | -54.4 | 178.1 | -67.1 | 167.4 | 0 | 0 | 0 | 109.7 | S26 H27 L32 F33 I34 D35 | S26-I30 VanDerWaalsContact O-CD1 3.29Å; S26-I30 WeakPolarHBondContact O-CD1 3.38Å; S26-I30 WeakPolarHBondContact O-CG1 3.26Å; S26-I30 PolarHBondContact O-N 3.22Å; H27-I30 PolarHBondContact O-N 2.93Å; I30-L32 PolarHBondContact O-N 2.93Å; I30-F33 PolarHBondContact O-N 3.11Å; I30-I34 HydrophobicContact CG2-CB 4.45Å; I30-I34 WeakPolarHBondContact O-CA 3.27Å; I30-I34 WeakPolarHBondContact O-CB 3.33Å; I30-I34 PolarHBondContact O-N 2.84Å; I30-D35 PolarHBondContact O-N 3.45Å |
| 31 | T | 96 | Very high | 95.8 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.1 | -48.1 | 178.3 | -64.3 | 0 | 0 | 0 | 0 | 111.6 | H27 F33 D35 L36 E79 M84 F87 | H27-T31 VanDerWaalsContact O-CB 3.31Å; H27-T31 WeakPolarHBondContact O-CB 3.11Å; H27-T31 PolarHBondContact O-N 3.33Å; H27-T31 PolarHBondContact O-OG1 3.32Å; H27-T31 VanDerWaalsContact O-OG1 3.14Å; T31-F33 PolarHBondContact O-N 3.37Å; T31-D35 VanDerWaalsContact CA-OD2 3.31Å; T31-D35 WeakPolarHBondContact CA-OD2 3.45Å; T31-D35 PolarHBondContact O-N 2.57Å; T31-D35 PolarHBondContact OG1-OD2 3.41Å; T31-L36 HydrophobicContact CG2-CG 4.12Å; T31-L36 WeakPolarHBondContact O-CB 3.13Å; T31-L36 VanDerWaalsContact O-CG 3.26Å; T31-L36 WeakPolarHBondContact O-CG 3.22Å; T31-L36 PolarHBondContact O-N 3.43Å; T31-E79 WeakPolarHBondContact CB-OE1 2.97Å; T31-E79 HydrophobicContact CG2-CG 4.11Å; T31-E79 WeakPolarHBondContact CG2-OE1 3.15Å; T31-E79 PolarHBondContact OG1-OE1 3.48Å; T31-M84 HydrophobicContact CG2-CB 4.33Å; T31-M84 HydrophobicContact CG2-CG 4.25Å; T31-F87 WeakPolarHBondContact OG1-CE2 3.17Å |
| 32 | L | 95.9 | Very high | 95.3 | Very high | 60 Ų | 60 | 50.5 Ų | 50.5 | 31% | 0.314 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.1 | -42.7 | -177.3 | -78.2 | 174.9 | 0 | 0 | 0 | 113.2 | I28 I30 L36 Y45 M84 | I28-L32 HydrophobicContact CG2-CD1 3.98Å; I28-L32 WeakPolarHBondContact O-CB 3.32Å; I28-L32 VanDerWaalsContact O-CG 3.27Å; I28-L32 WeakPolarHBondContact O-CG 3.32Å; I28-L32 PolarHBondContact O-N 3.39Å; I28-L32 VanDerWaalsContact O-N 3.11Å; I30-L32 PolarHBondContact O-N 2.93Å; L32-L36 HydrophobicContact CD2-CD1 4.1Å; L32-Y45 VanDerWaalsContact O-CE1 3.32Å; L32-Y45 WeakPolarHBondContact O-CE1 3.45Å; L32-Y45 PolarHBondContact O-OH 3.37Å; L32-M84 HydrophobicContact CD1-CE 4.03Å; L32-M84 HydrophobicContact CD2-CE 3.52Å; L32-M84 HydrophobicContact CG-CE 3.9Å |
| 33 | F | 95.2 | Very high | 95 | Very high | 103 Ų | 103 | 51.9 Ų | 51.9 | 45% | 0.452 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -101.1 | -19.5 | -170.2 | -59.9 | -43.5 | 0 | 0 | 0 | 114.4 | P29 I30 T31 Q37 L49 | P29-F33 HydrophobicContact CB-CD2 3.89Å; P29-F33 HydrophobicContact CB-CE2 3.99Å; P29-F33 VanDerWaalsContact O-CB 3.25Å; P29-F33 WeakPolarHBondContact O-CB 3.16Å; P29-F33 WeakPolarHBondContact O-CD2 3.32Å; P29-F33 WeakPolarHBondContact O-CG 3.08Å; P29-F33 PolarHBondContact O-N 3.39Å; I30-F33 PolarHBondContact O-N 3.11Å; T31-F33 PolarHBondContact O-N 3.37Å; F33-Q37 PolarHBondContact O-NE2 3.45Å; F33-L49 HydrophobicContact CB-CD1 3.82Å; F33-L49 HydrophobicContact CB-CD2 4.07Å; F33-L49 HydrophobicContact CD1-CD1 3.71Å; F33-L49 HydrophobicContact CG-CD1 3.97Å |
| 34 | I | 94.1 | Very high | 94.8 | Very high | 35 Ų | 35 | 54.4 Ų | 54.4 | 18% | 0.179 | 29% | 0.293 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -116.7 | -65.9 | -176 | -52.4 | -60.7 | 0 | 0 | 0 | 109.4 | I30 L36 Q37 L52 L53 | I30-I34 HydrophobicContact CG2-CB 4.45Å; I30-I34 WeakPolarHBondContact O-CA 3.27Å; I30-I34 WeakPolarHBondContact O-CB 3.33Å; I30-I34 PolarHBondContact O-N 2.84Å; I34-L36 PolarHBondContact O-N 3.45Å; I34-Q37 VanDerWaalsContact O-CB 3.27Å; I34-Q37 WeakPolarHBondContact O-CB 3.44Å; I34-Q37 WeakPolarHBondContact O-CG 3.19Å; I34-Q37 PolarHBondContact O-N 2.84Å; I34-Q37 VanDerWaalsContact O-N 3.14Å; I34-L52 HydrophobicContact CD1-CD2 3.91Å; I34-L52 HydrophobicContact CD1-CG 4.38Å; I34-L53 HydrophobicContact CG2-CD1 3.65Å |
| 35 | D | 94.8 | Very high | 94.6 | Very high | 40 Ų | 40 | 55.4 Ų | 55.4 | 21% | 0.214 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -67.3 | -40.6 | -167.8 | -53.5 | -39.6 | 0 | 0 | 0 | 112.7 | I30 T31 Q37 A38 I76 E79 | I30-D35 PolarHBondContact O-N 3.45Å; T31-D35 VanDerWaalsContact CA-OD2 3.31Å; T31-D35 WeakPolarHBondContact CA-OD2 3.45Å; T31-D35 PolarHBondContact O-N 2.57Å; T31-D35 PolarHBondContact OG1-OD2 3.41Å; D35-Q37 PolarHBondContact O-N 3.42Å; D35-Q37 VanDerWaalsContact O-N 3.14Å; D35-A38 WeakPolarHBondContact O-CB 3.06Å; D35-A38 PolarHBondContact O-N 2.85Å; D35-A38 VanDerWaalsContact O-N 3.11Å; D35-I76 HydrophobicContact CB-CG2 4.36Å; D35-I76 WeakPolarHBondContact O-CG2 3.4Å; D35-E79 WeakPolarHBondContact CB-OE1 3.3Å; D35-E79 VanDerWaalsContact OD2-OE1 3.12Å |
| 36 | L | 95.3 | Very high | 94.5 | Very high | 23 Ų | 23 | 57.6 Ų | 57.6 | 12% | 0.12 | 31% | 0.308 | C | S | . | . | G | 310 helix | trans | -66 | -14.6 | 178.8 | -72 | -173.3 | 0 | 0 | 0 | 114 | T31 L32 I34 A38 L39 L40 Y45 A80 | T31-L36 HydrophobicContact CG2-CG 4.12Å; T31-L36 WeakPolarHBondContact O-CB 3.13Å; T31-L36 VanDerWaalsContact O-CG 3.26Å; T31-L36 WeakPolarHBondContact O-CG 3.22Å; T31-L36 PolarHBondContact O-N 3.43Å; L32-L36 HydrophobicContact CD2-CD1 4.1Å; I34-L36 PolarHBondContact O-N 3.45Å; L36-A38 PolarHBondContact O-N 3.01Å; L36-L39 HydrophobicContact CD2-CD1 4.45Å; L36-L39 PolarHBondContact O-N 3.36Å; L36-L39 VanDerWaalsContact O-N 3.1Å; L36-L40 HydrophobicContact CB-CD1 4.23Å; L36-L40 PolarHBondContact O-N 3Å; L36-Y45 VanDerWaalsContact C-OH 3.32Å; L36-Y45 WeakPolarHBondContact CB-OH 3.46Å; L36-A80 HydrophobicContact CD2-CB 3.44Å; L36-A80 VanDerWaalsContact CD2-CB 3.44Å |
| 37 | Q | 95.8 | Very high | 94.5 | Very high | 27 Ų | 27 | 59.4 Ų | 59.4 | 13% | 0.126 | 31% | 0.311 | C | S | . | . | G | 310 helix | trans | -60.1 | -26.6 | 171.8 | -61.6 | -165.6 | 49.2 | 0 | 0 | 112.2 | F33 I34 D35 L39 Y45 L49 L53 | F33-Q37 PolarHBondContact O-NE2 3.45Å; I34-Q37 VanDerWaalsContact O-CB 3.27Å; I34-Q37 WeakPolarHBondContact O-CB 3.44Å; I34-Q37 WeakPolarHBondContact O-CG 3.19Å; I34-Q37 PolarHBondContact O-N 2.84Å; I34-Q37 VanDerWaalsContact O-N 3.14Å; D35-Q37 PolarHBondContact O-N 3.42Å; D35-Q37 VanDerWaalsContact O-N 3.14Å; Q37-L39 VanDerWaalsContact C-N 3.27Å; Q37-L39 PolarHBondContact O-N 3Å; Q37-Y45 HydrophobicContact CB-CD2 4.26Å; Q37-Y45 HydrophobicContact CB-CE2 4.05Å; Q37-Y45 HydrophobicContact CG-CD1 3.79Å; Q37-Y45 HydrophobicContact CG-CD2 3.68Å; Q37-Y45 HydrophobicContact CG-CE1 3.74Å; Q37-Y45 HydrophobicContact CG-CE2 3.62Å; Q37-Y45 HydrophobicContact CG-CG 3.77Å; Q37-Y45 PolarHBondContact N-OH 3.3Å; Q37-L49 PolarHBondContact NE2-O 3.29Å; Q37-L53 HydrophobicContact CB-CD2 3.86Å; Q37-L53 HydrophobicContact CG-CD2 4.37Å |
| 38 | A | 92.4 | Very high | 94.5 | Very high | 19 Ų | 19 | 63.4 Ų | 63.4 | 16% | 0.157 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -72.7 | -17.4 | 178 | 0 | 0 | 0 | 0 | 0 | 114.1 | D35 L36 P68 I76 | D35-A38 WeakPolarHBondContact O-CB 3.06Å; D35-A38 PolarHBondContact O-N 2.85Å; D35-A38 VanDerWaalsContact O-N 3.11Å; L36-A38 PolarHBondContact O-N 3.01Å; A38-P68 HydrophobicContact CB-CG 3.7Å; A38-I76 HydrophobicContact CB-CD1 3.35Å |
| 39 | L | 92.2 | Very high | 94.4 | Very high | 62 Ų | 62 | 62.8 Ų | 62.8 | 33% | 0.325 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.9 | -34.5 | -177 | -64.3 | -177.5 | 0 | 0 | 0 | 113.3 | L36 Q37 K73 I76 F77 A80 | L36-L39 HydrophobicContact CD2-CD1 4.45Å; L36-L39 PolarHBondContact O-N 3.36Å; L36-L39 VanDerWaalsContact O-N 3.1Å; Q37-L39 VanDerWaalsContact C-N 3.27Å; Q37-L39 PolarHBondContact O-N 3Å; L39-K73 HydrophobicContact CD2-CB 4.05Å; L39-K73 HydrophobicContact CD2-CG 4.47Å; L39-I76 HydrophobicContact CD1-CB 4.1Å; L39-I76 HydrophobicContact CD1-CG2 3.64Å; L39-I76 HydrophobicContact CG-CB 4.21Å; L39-I76 HydrophobicContact CG-CG2 3.78Å; L39-F77 HydrophobicContact CD1-CB 4.14Å; L39-A80 HydrophobicContact CD1-CB 4.4Å |
| 40 | L | 92.1 | Very high | 94.3 | Very high | 78 Ų | 78 | 61.9 Ų | 61.9 | 41% | 0.408 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -91.6 | 153.1 | -175.3 | -62.4 | 177.4 | 0 | 0 | 0 | 111.4 | L36 V44 Y45 | L36-L40 HydrophobicContact CB-CD1 4.23Å; L36-L40 PolarHBondContact O-N 3Å; L40-V44 HydrophobicContact CB-CG2 3.81Å; L40-V44 HydrophobicContact CD1-CG2 4.14Å; L40-Y45 HydrophobicContact CB-CE2 4.01Å; L40-Y45 HydrophobicContact CD1-CE2 4.28Å |
| 41 | P | 91 | Very high | 94.4 | Very high | 69 Ų | 69 | 63.3 Ų | 63.3 | 45% | 0.448 | 33% | 0.333 | S | S | . | . | trans | -60.3 | 141.6 | 177.2 | -24 | 34.6 | 0 | 0 | 0 | 112.9 | H43 V44 | P41-H43 WeakPolarHBondContact CB-CE1 3.31Å; P41-H43 WeakPolarHBondContact CB-ND1 3.18Å; P41-H43 PolarHBondContact O-N 2.66Å; P41-V44 WeakPolarHBondContact O-CG2 3.17Å; P41-V44 PolarHBondContact O-N 3.4Å | ||
| 42 | E | 88.4 | Confident | 94.4 | Very high | 151 Ų | 151 | 67 Ų | 67 | 71% | 0.706 | 35% | 0.353 | S | S | * | . | G | 310 helix | trans | -55.1 | -26.1 | -175.9 | -63.6 | -173.8 | -178.3 | 0 | 0 | 115.5 | V44 Y45 K50 | E42-V44 PolarHBondContact O-N 2.91Å; E42-Y45 PolarHBondContact O-N 2.86Å; E42-K50 HydrophobicContact CB-CD 4.48Å |
| 43 | H | 91.1 | Very high | 94.4 | Very high | 158 Ų | 158 | 64.7 Ų | 64.7 | 73% | 0.731 | 34% | 0.34 | S | S | * | . | G | 310 helix | trans | -72.7 | -14 | -178.1 | 65.7 | -96.4 | 0 | 0 | 0 | 113.6 | P41 Y45 | P41-H43 WeakPolarHBondContact CB-CE1 3.31Å; P41-H43 WeakPolarHBondContact CB-ND1 3.18Å; P41-H43 PolarHBondContact O-N 2.66Å; H43-Y45 VanDerWaalsContact C-N 3.26Å |
| 44 | V | 94.4 | Very high | 94.4 | Very high | 74 Ų | 74 | 64.4 Ų | 64.4 | 45% | 0.448 | 34% | 0.339 | S | S | . | . | G | 310 helix | trans | -77.9 | -16.2 | 176.1 | -46.5 | 0 | 0 | 0 | 0 | 112.1 | L40 P41 E42 | L40-V44 HydrophobicContact CB-CG2 3.81Å; L40-V44 HydrophobicContact CD1-CG2 4.14Å; P41-V44 WeakPolarHBondContact O-CG2 3.17Å; P41-V44 PolarHBondContact O-N 3.4Å; E42-V44 PolarHBondContact O-N 2.91Å |
| 45 | Y | 95.4 | Very high | 94.5 | Very high | 21 Ų | 21 | 69.3 Ų | 69.3 | 8% | 0.082 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -105.7 | 132.2 | -177.3 | -71.4 | -78.9 | 0 | 0 | 0 | 112.6 | L32 L36 Q37 L40 E42 H43 L49 | L32-Y45 VanDerWaalsContact O-CE1 3.32Å; L32-Y45 WeakPolarHBondContact O-CE1 3.45Å; L32-Y45 PolarHBondContact O-OH 3.37Å; L36-Y45 VanDerWaalsContact C-OH 3.32Å; L36-Y45 WeakPolarHBondContact CB-OH 3.46Å; Q37-Y45 HydrophobicContact CB-CD2 4.26Å; Q37-Y45 HydrophobicContact CB-CE2 4.05Å; Q37-Y45 HydrophobicContact CG-CD1 3.79Å; Q37-Y45 HydrophobicContact CG-CD2 3.68Å; Q37-Y45 HydrophobicContact CG-CE1 3.74Å; Q37-Y45 HydrophobicContact CG-CE2 3.62Å; Q37-Y45 HydrophobicContact CG-CG 3.77Å; Q37-Y45 PolarHBondContact N-OH 3.3Å; L40-Y45 HydrophobicContact CB-CE2 4.01Å; L40-Y45 HydrophobicContact CD1-CE2 4.28Å; E42-Y45 PolarHBondContact O-N 2.86Å; H43-Y45 VanDerWaalsContact C-N 3.26Å; Y45-L49 HydrophobicContact CD1-CD1 4.09Å |
| 46 | P | 95.9 | Very high | 94.6 | Very high | 77 Ų | 77 | 69.6 Ų | 69.6 | 50% | 0.5 | 35% | 0.354 | S | S | . | . | trans | -65.6 | 151 | 173 | 31.2 | -37.4 | 0 | 0 | 0 | 110.7 | P48 L49 K50 | P46-P48 VanDerWaalsContact C-CD 3.44Å; P46-L49 HydrophobicContact CG-CB 4.38Å; P46-L49 HydrophobicContact CG-CD1 3.85Å; P46-L49 HydrophobicContact CG-CG 3.99Å; P46-L49 PolarHBondContact O-N 3.48Å; P46-L49 VanDerWaalsContact O-N 3.1Å; P46-K50 PolarHBondContact O-N 3.4Å | ||
| 47 | Q | 96.2 | Very high | 94.6 | Very high | 89 Ų | 89 | 68.7 Ų | 68.7 | 42% | 0.416 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -52.7 | -42.3 | -175 | -165.9 | 59.6 | 39.2 | 0 | 0 | 114.5 | L49 K50 D51 | Q47-L49 VanDerWaalsContact C-N 3.28Å; Q47-L49 PolarHBondContact O-N 2.98Å; Q47-K50 PolarHBondContact O-N 3.1Å; Q47-K50 VanDerWaalsContact O-N 3.11Å; Q47-D51 PolarHBondContact NE2-OD1 3.12Å; Q47-D51 VanDerWaalsContact O-CG 3.28Å; Q47-D51 PolarHBondContact O-N 3.15Å |
| 48 | P | 96.9 | Very high | 94.6 | Very high | 94 Ų | 94 | 73 Ų | 73 | 61% | 0.61 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -59.5 | -33.5 | 179.3 | -26.4 | 36.5 | 0 | 0 | 0 | 114.6 | P46 L52 | P46-P48 VanDerWaalsContact C-CD 3.44Å; P48-L52 VanDerWaalsContact O-CB 3.32Å; P48-L52 WeakPolarHBondContact O-CB 3.39Å; P48-L52 PolarHBondContact O-N 3.07Å |
| 49 | L | 96.1 | Very high | 94.7 | Very high | 34 Ų | 34 | 77.6 Ų | 77.6 | 18% | 0.178 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -73.2 | -34.5 | 178.3 | -70.4 | -176.6 | 0 | 0 | 0 | 111.9 | F33 Q37 Y45 P46 Q47 L53 | F33-L49 HydrophobicContact CB-CD1 3.82Å; F33-L49 HydrophobicContact CB-CD2 4.07Å; F33-L49 HydrophobicContact CD1-CD1 3.71Å; F33-L49 HydrophobicContact CG-CD1 3.97Å; Q37-L49 PolarHBondContact NE2-O 3.29Å; Y45-L49 HydrophobicContact CD1-CD1 4.09Å; P46-L49 HydrophobicContact CG-CB 4.38Å; P46-L49 HydrophobicContact CG-CD1 3.85Å; P46-L49 HydrophobicContact CG-CG 3.99Å; P46-L49 PolarHBondContact O-N 3.48Å; P46-L49 VanDerWaalsContact O-N 3.1Å; Q47-L49 VanDerWaalsContact C-N 3.28Å; Q47-L49 PolarHBondContact O-N 2.98Å; L49-L53 PolarHBondContact O-N 2.89Å |
| 50 | K | 95.9 | Very high | 94.9 | Very high | 38 Ų | 38 | 77 Ų | 77 | 17% | 0.165 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -69.6 | -40.8 | 174.4 | -63.3 | -176.9 | -65.1 | -179.7 | 0 | 111.1 | E42 P46 Q47 L52 L53 K54 | E42-K50 HydrophobicContact CB-CD 4.48Å; P46-K50 PolarHBondContact O-N 3.4Å; Q47-K50 PolarHBondContact O-N 3.1Å; Q47-K50 VanDerWaalsContact O-N 3.11Å; K50-L52 VanDerWaalsContact C-N 3.33Å; K50-L53 PolarHBondContact O-N 3.33Å; K50-K54 WeakPolarHBondContact O-CG 3.26Å; K50-K54 PolarHBondContact O-N 3.22Å |
| 51 | D | 96.4 | Very high | 95.1 | Very high | 77 Ų | 77 | 76 Ų | 76 | 41% | 0.412 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -66.4 | -38.7 | 177.1 | -63.7 | -19.3 | 0 | 0 | 0 | 111 | Q47 K54 W55 | Q47-D51 PolarHBondContact NE2-OD1 3.12Å; Q47-D51 VanDerWaalsContact O-CG 3.28Å; Q47-D51 PolarHBondContact O-N 3.15Å; D51-K54 PolarHBondContact O-N 2.92Å; D51-W55 WeakPolarHBondContact O-CB 3.24Å; D51-W55 PolarHBondContact O-N 2.84Å |
| 52 | L | 96.2 | Very high | 95.4 | Very high | 79 Ų | 79 | 72.8 Ų | 72.8 | 41% | 0.414 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.7 | -45.9 | 173.1 | 178.8 | 63.5 | 0 | 0 | 0 | 112 | I34 P48 K50 W55 Y56 | I34-L52 HydrophobicContact CD1-CD2 3.91Å; I34-L52 HydrophobicContact CD1-CG 4.38Å; P48-L52 VanDerWaalsContact O-CB 3.32Å; P48-L52 WeakPolarHBondContact O-CB 3.39Å; P48-L52 PolarHBondContact O-N 3.07Å; K50-L52 VanDerWaalsContact C-N 3.33Å; L52-W55 HydrophobicContact CD1-CE3 3.96Å; L52-W55 HydrophobicContact CD1-CZ3 4.3Å; L52-W55 PolarHBondContact O-N 3.47Å; L52-Y56 WeakPolarHBondContact O-CB 3.33Å; L52-Y56 PolarHBondContact O-N 3.26Å |
| 53 | L | 95.7 | Very high | 95.7 | Very high | 11 Ų | 11 | 66.1 Ų | 66.1 | 6% | 0.058 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 177.4 | -175.6 | 71.3 | 0 | 0 | 0 | 111.6 | I34 Q37 L49 K50 Y56 A57 V65 L66 | I34-L53 HydrophobicContact CG2-CD1 3.65Å; Q37-L53 HydrophobicContact CB-CD2 3.86Å; Q37-L53 HydrophobicContact CG-CD2 4.37Å; L49-L53 PolarHBondContact O-N 2.89Å; K50-L53 PolarHBondContact O-N 3.33Å; L53-Y56 PolarHBondContact O-N 3.5Å; L53-A57 WeakPolarHBondContact O-CB 3.43Å; L53-A57 PolarHBondContact O-N 2.84Å; L53-V65 HydrophobicContact CD1-CB 3.95Å; L53-V65 HydrophobicContact CD1-CG2 3.77Å; L53-V65 HydrophobicContact CG-CG2 4.27Å; L53-L66 HydrophobicContact CD2-CD2 4.06Å; L53-L66 HydrophobicContact CG-CD2 4.02Å |
| 54 | K | 95.5 | Very high | 95.8 | Very high | 97 Ų | 97 | 58.8 Ų | 58.8 | 42% | 0.422 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.7 | -47.8 | 176.6 | -73.1 | 174.4 | -177.3 | -177.9 | 0 | 111.9 | K50 D51 Y56 A57 E58 L66 | K50-K54 WeakPolarHBondContact O-CG 3.26Å; K50-K54 PolarHBondContact O-N 3.22Å; D51-K54 PolarHBondContact O-N 2.92Å; K54-Y56 VanDerWaalsContact C-N 3.33Å; K54-Y56 PolarHBondContact O-N 3.21Å; K54-A57 PolarHBondContact O-N 2.99Å; K54-E58 WeakPolarHBondContact O-CB 3.5Å; K54-E58 WeakPolarHBondContact O-CG 3.37Å; K54-E58 PolarHBondContact O-N 3.22Å; K54-L66 HydrophobicContact CG-CD2 3.91Å |
| 55 | W | 96.3 | Very high | 95.8 | Very high | 137 Ų | 137 | 56 Ų | 56 | 52% | 0.519 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -57.2 | -47.3 | 175.9 | 167.8 | 77.9 | 0 | 0 | 0 | 111.4 | D51 L52 A57 E58 E59 F60 | D51-W55 WeakPolarHBondContact O-CB 3.24Å; D51-W55 PolarHBondContact O-N 2.84Å; L52-W55 HydrophobicContact CD1-CE3 3.96Å; L52-W55 HydrophobicContact CD1-CZ3 4.3Å; L52-W55 PolarHBondContact O-N 3.47Å; W55-A57 PolarHBondContact O-N 3.13Å; W55-E58 PolarHBondContact O-N 3.11Å; W55-E59 HydrophobicContact CZ2-CB 4.45Å; W55-E59 HydrophobicContact CZ2-CG 4.21Å; W55-E59 VanDerWaalsContact O-CB 3.26Å; W55-E59 WeakPolarHBondContact O-CB 3.27Å; W55-E59 PolarHBondContact O-N 3.37Å; W55-F60 HydrophobicContact CH2-CE2 4.22Å; W55-F60 HydrophobicContact CZ3-CE2 4.48Å |
| 56 | Y | 96.6 | Very high | 95.7 | Very high | 46 Ų | 46 | 57 Ų | 57 | 18% | 0.18 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.5 | -49 | 177.6 | 164.7 | -90.2 | 0 | 0 | 0 | 111.3 | L52 L53 K54 E58 E59 F60 D62 V65 I149 | L52-Y56 WeakPolarHBondContact O-CB 3.33Å; L52-Y56 PolarHBondContact O-N 3.26Å; L53-Y56 PolarHBondContact O-N 3.5Å; K54-Y56 VanDerWaalsContact C-N 3.33Å; K54-Y56 PolarHBondContact O-N 3.21Å; Y56-E58 VanDerWaalsContact C-N 3.3Å; Y56-E58 PolarHBondContact O-N 3.14Å; Y56-E59 PolarHBondContact O-N 2.97Å; Y56-F60 AromaticContact CD2-CD2 3.37Å; Y56-F60 HydrophobicContact CD2-CD2 3.37Å; Y56-F60 AromaticContact CD2-CE2 3.8Å; Y56-F60 HydrophobicContact CD2-CE2 3.8Å; Y56-F60 HydrophobicContact CD2-CG 4.39Å; Y56-F60 HydrophobicContact CE2-CB 4.43Å; Y56-F60 AromaticContact CE2-CD2 3.6Å; Y56-F60 HydrophobicContact CE2-CD2 3.6Å; Y56-F60 HydrophobicContact CE2-CE2 4.18Å; Y56-F60 HydrophobicContact CE2-CG 4.24Å; Y56-F60 HydrophobicContact CG-CD2 4.14Å; Y56-F60 WeakPolarHBondContact O-CD2 3.41Å; Y56-F60 PolarHBondContact O-N 3Å; Y56-D62 HydrophobicContact CE1-CB 3.78Å; Y56-D62 WeakPolarHBondContact CE1-OD2 3.44Å; Y56-D62 PolarHBondContact OH-OD2 3.14Å; Y56-V65 HydrophobicContact CD1-CG2 3.9Å; Y56-V65 HydrophobicContact CE1-CG1 4.13Å; Y56-V65 HydrophobicContact CE1-CG2 3.97Å; Y56-I149 HydrophobicContact CE2-CD1 4.25Å; Y56-I149 HydrophobicContact CE2-CG2 4.27Å |
| 57 | A | 95.7 | Very high | 95.5 | Very high | 5 Ų | 5 | 58.2 Ų | 58.2 | 4% | 0.041 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.5 | -38.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L53 K54 W55 K61 D62 V65 L66 | L53-A57 WeakPolarHBondContact O-CB 3.43Å; L53-A57 PolarHBondContact O-N 2.84Å; K54-A57 PolarHBondContact O-N 2.99Å; W55-A57 PolarHBondContact O-N 3.13Å; A57-K61 CarbonylContact O-C 3.47Å; A57-K61 WeakPolarHBondContact O-CA 3.44Å; A57-K61 PolarHBondContact O-N 3.39Å; A57-D62 VanDerWaalsContact CB-O 3.3Å; A57-D62 WeakPolarHBondContact CB-O 3.39Å; A57-D62 PolarHBondContact O-N 2.68Å; A57-V65 HydrophobicContact CB-CG2 3.82Å; A57-L66 HydrophobicContact CB-CD1 3.42Å; A57-L66 VanDerWaalsContact CB-CD1 3.42Å; A57-L66 HydrophobicContact CB-CD2 4.34Å; A57-L66 HydrophobicContact CB-CG 3.53Å |
| 58 | E | 95 | Very high | 95.4 | Very high | 117 Ų | 117 | 54.3 Ų | 54.3 | 55% | 0.547 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -73 | -42.4 | 179 | -73.4 | 175.6 | -172.8 | 0 | 0 | 113 | K54 W55 Y56 K61 | K54-E58 WeakPolarHBondContact O-CB 3.5Å; K54-E58 WeakPolarHBondContact O-CG 3.37Å; K54-E58 PolarHBondContact O-N 3.22Å; W55-E58 PolarHBondContact O-N 3.11Å; Y56-E58 VanDerWaalsContact C-N 3.3Å; Y56-E58 PolarHBondContact O-N 3.14Å; E58-K61 PolarHBondContact O-NZ 3.14Å |
| 59 | E | 95.9 | Very high | 95.3 | Very high | 115 Ų | 115 | 51.3 Ų | 51.3 | 54% | 0.537 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -68.5 | -46.6 | -178.5 | -176.6 | 62.5 | -162.8 | 0 | 0 | 111.1 | W55 Y56 | W55-E59 HydrophobicContact CZ2-CB 4.45Å; W55-E59 HydrophobicContact CZ2-CG 4.21Å; W55-E59 VanDerWaalsContact O-CB 3.26Å; W55-E59 WeakPolarHBondContact O-CB 3.27Å; W55-E59 PolarHBondContact O-N 3.37Å; Y56-E59 PolarHBondContact O-N 2.97Å |
| 60 | F | 96 | Very high | 95.3 | Very high | 51 Ų | 51 | 57 Ų | 57 | 22% | 0.224 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -97.5 | 3 | -175.1 | -61.9 | -70.4 | 0 | 0 | 0 | 114.2 | W55 Y56 D62 L145 L146 I149 | W55-F60 HydrophobicContact CH2-CE2 4.22Å; W55-F60 HydrophobicContact CZ3-CE2 4.48Å; Y56-F60 AromaticContact CD2-CD2 3.37Å; Y56-F60 HydrophobicContact CD2-CD2 3.37Å; Y56-F60 AromaticContact CD2-CE2 3.8Å; Y56-F60 HydrophobicContact CD2-CE2 3.8Å; Y56-F60 HydrophobicContact CD2-CG 4.39Å; Y56-F60 HydrophobicContact CE2-CB 4.43Å; Y56-F60 AromaticContact CE2-CD2 3.6Å; Y56-F60 HydrophobicContact CE2-CD2 3.6Å; Y56-F60 HydrophobicContact CE2-CE2 4.18Å; Y56-F60 HydrophobicContact CE2-CG 4.24Å; Y56-F60 HydrophobicContact CG-CD2 4.14Å; Y56-F60 WeakPolarHBondContact O-CD2 3.41Å; Y56-F60 PolarHBondContact O-N 3Å; F60-D62 VanDerWaalsContact C-N 3.34Å; F60-D62 PolarHBondContact O-N 3.48Å; F60-L145 HydrophobicContact CD1-CD2 4.36Å; F60-L145 HydrophobicContact CD1-CG 4.39Å; F60-L146 HydrophobicContact CB-CD1 4.45Å; F60-I149 HydrophobicContact CB-CD1 3.55Å; F60-I149 HydrophobicContact CD1-CD1 3.24Å; F60-I149 HydrophobicContact CD1-CG1 4.36Å; F60-I149 HydrophobicContact CD2-CD1 4.03Å; F60-I149 HydrophobicContact CE1-CD1 3.84Å; F60-I149 HydrophobicContact CG-CD1 3.32Å; F60-I149 HydrophobicContact CZ-CD1 4.46Å |
| 61 | K | 96.7 | Very high | 95.3 | Very high | 57 Ų | 57 | 58.9 Ų | 58.9 | 25% | 0.248 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 56.5 | 46.3 | -177.8 | -53.2 | -57.8 | 176.2 | -150 | 0 | 112.1 | A57 E58 P63 P137 E142 | A57-K61 CarbonylContact O-C 3.47Å; A57-K61 WeakPolarHBondContact O-CA 3.44Å; A57-K61 PolarHBondContact O-N 3.39Å; E58-K61 PolarHBondContact O-NZ 3.14Å; K61-P63 WeakPolarHBondContact O-CD 3.26Å; K61-P137 HydrophobicContact CB-CB 4.2Å; K61-P137 WeakPolarHBondContact O-CD 3.32Å; K61-E142 HydrophobicContact CG-CB 4.43Å; K61-E142 HydrophobicContact CG-CG 4.2Å |
| 62 | D | 96.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 26% | 0.261 | C | S | . | . | trans | -107.3 | 83 | -179.1 | -166.6 | -6.8 | 0 | 0 | 0 | 111.2 | Y56 A57 F60 M64 V65 L146 Y150 | Y56-D62 HydrophobicContact CE1-CB 3.78Å; Y56-D62 WeakPolarHBondContact CE1-OD2 3.44Å; Y56-D62 PolarHBondContact OH-OD2 3.14Å; A57-D62 VanDerWaalsContact CB-O 3.3Å; A57-D62 WeakPolarHBondContact CB-O 3.39Å; A57-D62 PolarHBondContact O-N 2.68Å; F60-D62 VanDerWaalsContact C-N 3.34Å; F60-D62 PolarHBondContact O-N 3.48Å; D62-M64 PolarHBondContact O-N 3.04Å; D62-M64 PolarHBondContact OD1-N 2.63Å; D62-V65 WeakPolarHBondContact O-CG2 3.33Å; D62-L146 HydrophobicContact CB-CD1 3.75Å; D62-L146 HydrophobicContact CB-CD2 4.2Å; D62-Y150 WeakPolarHBondContact OD2-CE2 3.43Å; D62-Y150 PolarHBondContact OD2-OH 3.41Å | ||
| 63 | P | 94.3 | Very high | 95.3 | Very high | 12 Ų | 12 | 55.5 Ų | 55.5 | 8% | 0.078 | 26% | 0.255 | C | S | . | . | G | 310 helix | trans | -73.7 | -16.7 | -177.6 | 31.6 | -36.8 | 0 | 0 | 0 | 111.7 | K61 V65 L66 D67 F129 H134 | K61-P63 WeakPolarHBondContact O-CD 3.26Å; P63-V65 PolarHBondContact O-N 2.95Å; P63-L66 PolarHBondContact O-N 3.35Å; P63-L66 VanDerWaalsContact O-N 3.13Å; P63-D67 PolarHBondContact O-N 3.46Å; P63-F129 HydrophobicContact CG-CD1 3.51Å; P63-F129 HydrophobicContact CG-CE1 3.8Å; P63-F129 HydrophobicContact CG-CG 4.48Å; P63-H134 HydrophobicContact CB-CB 3.92Å |
| 64 | M | 94.8 | Very high | 95.4 | Very high | 3 Ų | 3 | 57.7 Ų | 57.7 | 2% | 0.015 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -65.3 | -25.3 | -177.4 | -61.6 | -177.2 | -61.8 | 0 | 0 | 111.6 | D62 P68 W71 F72 I120 H123 I124 F129 Y150 | D62-M64 PolarHBondContact O-N 3.04Å; D62-M64 PolarHBondContact OD1-N 2.63Å; M64-P68 WeakPolarHBondContact O-CA 3.48Å; M64-P68 WeakPolarHBondContact O-CB 3.31Å; M64-P68 WeakPolarHBondContact O-CG 3.48Å; M64-W71 HydrophobicContact SD-CH2 4.03Å; M64-W71 HydrophobicContact SD-CZ2 4.29Å; M64-F72 HydrophobicContact CB-CD1 4.29Å; M64-F72 HydrophobicContact CB-CE1 4.16Å; M64-F72 HydrophobicContact CB-CZ 4.36Å; M64-F72 HydrophobicContact CE-CE2 4.4Å; M64-F72 HydrophobicContact SD-CD2 4.36Å; M64-F72 HydrophobicContact SD-CE2 4.49Å; M64-I120 HydrophobicContact CE-CG2 4.17Å; M64-H123 VanDerWaalsContact SD-CD2 3.54Å; M64-I124 HydrophobicContact CE-CD1 4.09Å; M64-I124 HydrophobicContact CE-CG1 3.84Å; M64-F129 HydrophobicContact CG-CE1 4.35Å; M64-Y150 HydrophobicContact CE-CE2 4.32Å |
| 65 | V | 93.7 | Very high | 95.4 | Very high | 15 Ų | 15 | 55.4 Ų | 55.4 | 9% | 0.091 | 26% | 0.261 | C | S | . | . | G | 310 helix | trans | -83.1 | -17.6 | 178.2 | -54 | 0 | 0 | 0 | 0 | 113.3 | L53 Y56 A57 D62 P63 | L53-V65 HydrophobicContact CD1-CB 3.95Å; L53-V65 HydrophobicContact CD1-CG2 3.77Å; L53-V65 HydrophobicContact CG-CG2 4.27Å; Y56-V65 HydrophobicContact CD1-CG2 3.9Å; Y56-V65 HydrophobicContact CE1-CG1 4.13Å; Y56-V65 HydrophobicContact CE1-CG2 3.97Å; A57-V65 HydrophobicContact CB-CG2 3.82Å; D62-V65 WeakPolarHBondContact O-CG2 3.33Å; P63-V65 PolarHBondContact O-N 2.95Å |
| 66 | L | 92.9 | Very high | 95.4 | Very high | 44 Ų | 44 | 49.3 Ų | 49.3 | 23% | 0.23 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | -42.3 | 177 | -68.1 | -178.4 | 0 | 0 | 0 | 112.7 | L53 K54 A57 P63 H134 | L53-L66 HydrophobicContact CD2-CD2 4.06Å; L53-L66 HydrophobicContact CG-CD2 4.02Å; K54-L66 HydrophobicContact CG-CD2 3.91Å; A57-L66 HydrophobicContact CB-CD1 3.42Å; A57-L66 VanDerWaalsContact CB-CD1 3.42Å; A57-L66 HydrophobicContact CB-CD2 4.34Å; A57-L66 HydrophobicContact CB-CG 3.53Å; P63-L66 PolarHBondContact O-N 3.35Å; P63-L66 VanDerWaalsContact O-N 3.13Å; L66-H134 WeakPolarHBondContact CD1-ND1 3.41Å |
| 67 | D | 92.5 | Very high | 95.4 | Very high | 101 Ų | 101 | 53 Ų | 53 | 54% | 0.54 | 26% | 0.256 | S | S | . | . | S | Bend | trans | -129 | 77.1 | 176.8 | -172 | 21 | 0 | 0 | 0 | 109.4 | P63 | P63-D67 PolarHBondContact O-N 3.46Š|
| 68 | P | 93.4 | Very high | 95.5 | Very high | 8 Ų | 8 | 54.4 Ų | 54.4 | 5% | 0.052 | 27% | 0.265 | C | S | . | . | trans | -75.5 | 130.4 | -171.5 | 3.8 | 6.5 | 0 | 0 | 0 | 110.9 | A38 M64 F72 K73 | A38-P68 HydrophobicContact CB-CG 3.7Å; M64-P68 WeakPolarHBondContact O-CA 3.48Å; M64-P68 WeakPolarHBondContact O-CB 3.31Å; M64-P68 WeakPolarHBondContact O-CG 3.48Å; P68-F72 HydrophobicContact CB-CD1 3.8Å; P68-K73 HydrophobicContact CB-CD 4.42Å; P68-K73 HydrophobicContact CB-CG 3.69Å; P68-K73 HydrophobicContact CG-CD 4.43Å; P68-K73 VanDerWaalsContact CG-CE 3.48Å; P68-K73 HydrophobicContact CG-CG 4.03Å; P68-K73 WeakPolarHBondContact O-CE 3.33Å; P68-K73 PolarHBondContact O-NZ 3.01Å; P68-K73 VanDerWaalsContact O-NZ 3.09Å | ||
| 69 | P | 94.6 | Very high | 95.5 | Very high | 30 Ų | 30 | 50.4 Ų | 50.4 | 20% | 0.195 | 25% | 0.247 | C | C | . | . | trans | -64.1 | 154.9 | 170.1 | 29 | -34.9 | 0 | 0 | 0 | 110.3 | W71 F72 K73 | P69-W71 HydrophobicContact CG-CD2 4.24Å; P69-W71 VanDerWaalsContact CG-CE2 3.41Å; P69-W71 HydrophobicContact CG-CZ2 3.57Å; P69-W71 VanDerWaalsContact CG-NE1 3.25Å; P69-W71 PolarHBondContact O-N 3.37Å; P69-W71 VanDerWaalsContact O-N 3.16Å; P69-F72 HydrophobicContact CG-CB 3.84Å; P69-F72 WeakPolarHBondContact O-CA 3.27Å; P69-F72 WeakPolarHBondContact O-CB 3.36Å; P69-F72 PolarHBondContact O-N 3.19Å; P69-K73 PolarHBondContact O-N 3.18Å | ||
| 70 | E | 96 | Very high | 95.5 | Very high | 154 Ų | 154 | 46.4 Ų | 46.4 | 72% | 0.72 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -58.8 | -36.1 | -170.9 | -68.6 | 78.4 | -176.4 | 0 | 0 | 112.7 | F72 K73 S74 | E70-F72 VanDerWaalsContact C-N 3.31Å; E70-F72 PolarHBondContact O-N 2.89Å; E70-K73 PolarHBondContact O-N 3.49Å; E70-S74 PolarHBondContact O-N 3.39Å |
| 71 | W | 96.1 | Very high | 95.4 | Very high | 78 Ų | 78 | 51 Ų | 51 | 30% | 0.295 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.6 | -36.5 | 175.9 | 65.5 | -97.6 | 0 | 0 | 0 | 111.7 | M64 P69 S74 F75 I120 H123 | M64-W71 HydrophobicContact SD-CH2 4.03Å; M64-W71 HydrophobicContact SD-CZ2 4.29Å; P69-W71 HydrophobicContact CG-CD2 4.24Å; P69-W71 VanDerWaalsContact CG-CE2 3.41Å; P69-W71 HydrophobicContact CG-CZ2 3.57Å; P69-W71 VanDerWaalsContact CG-NE1 3.25Å; P69-W71 PolarHBondContact O-N 3.37Å; P69-W71 VanDerWaalsContact O-N 3.16Å; W71-S74 WeakPolarHBondContact O-CB 3.47Å; W71-S74 PolarHBondContact O-N 3.27Å; W71-S74 PolarHBondContact O-OG 3.18Å; W71-F75 AromaticContact CE3-CD2 3.96Å; W71-F75 HydrophobicContact CE3-CD2 3.96Å; W71-F75 AromaticContact CE3-CE2 3.54Å; W71-F75 HydrophobicContact CE3-CE2 3.54Å; W71-F75 HydrophobicContact CE3-CZ 4.36Å; W71-F75 HydrophobicContact CZ3-CD2 4.02Å; W71-F75 AromaticContact CZ3-CE2 3.74Å; W71-F75 HydrophobicContact CZ3-CE2 3.74Å; W71-F75 PolarHBondContact O-N 3.49Å; W71-I120 HydrophobicContact CH2-CG1 4.25Å; W71-I120 HydrophobicContact CZ3-CG1 3.84Å; W71-H123 HydrophobicContact CH2-CB 3.98Å; W71-H123 HydrophobicContact CZ2-CB 3.93Å; W71-H123 AromaticContact CZ2-CD2 3.79Å; W71-H123 AromaticContact CZ2-CE1 3.84Å; W71-H123 AromaticContact CZ2-CG 3.5Å; W71-H123 AromaticContact CZ2-ND1 3.53Å; W71-H123 AromaticContact CZ2-NE2 4Å |
| 72 | F | 96.9 | Very high | 95.3 | Very high | 15 Ų | 15 | 53.1 Ų | 53.1 | 7% | 0.066 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -72.6 | -41.9 | 177.4 | -171.9 | -101.2 | 0 | 0 | 0 | 110.5 | M64 P68 P69 E70 S74 F75 I76 I120 | M64-F72 HydrophobicContact CB-CD1 4.29Å; M64-F72 HydrophobicContact CB-CE1 4.16Å; M64-F72 HydrophobicContact CB-CZ 4.36Å; M64-F72 HydrophobicContact CE-CE2 4.4Å; M64-F72 HydrophobicContact SD-CD2 4.36Å; M64-F72 HydrophobicContact SD-CE2 4.49Å; P68-F72 HydrophobicContact CB-CD1 3.8Å; P69-F72 HydrophobicContact CG-CB 3.84Å; P69-F72 WeakPolarHBondContact O-CA 3.27Å; P69-F72 WeakPolarHBondContact O-CB 3.36Å; P69-F72 PolarHBondContact O-N 3.19Å; E70-F72 VanDerWaalsContact C-N 3.31Å; E70-F72 PolarHBondContact O-N 2.89Å; F72-S74 PolarHBondContact O-N 2.76Å; F72-F75 WeakPolarHBondContact O-CB 3.45Å; F72-F75 PolarHBondContact O-N 3.19Å; F72-I76 HydrophobicContact CD1-CD1 3.71Å; F72-I76 HydrophobicContact CD1-CG1 4.18Å; F72-I76 HydrophobicContact CE1-CD1 3.59Å; F72-I76 HydrophobicContact CE1-CG1 4.1Å; F72-I76 PolarHBondContact O-N 3Å; F72-I76 VanDerWaalsContact O-N 3.08Å; F72-I120 HydrophobicContact CD2-CD1 4.14Å; F72-I120 HydrophobicContact CD2-CG1 3.97Å; F72-I120 HydrophobicContact CE2-CD1 3.79Å; F72-I120 HydrophobicContact CE2-CG1 3.95Å; F72-I120 HydrophobicContact CE2-CG2 4.45Å |
| 73 | K | 96.3 | Very high | 95.2 | Very high | 70 Ų | 70 | 53.7 Ų | 53.7 | 30% | 0.304 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -55 | -38.4 | 171.2 | -65.4 | -175.4 | 172.5 | 143.7 | 0 | 111.9 | L39 P68 P69 E70 F75 I76 F77 | L39-K73 HydrophobicContact CD2-CB 4.05Å; L39-K73 HydrophobicContact CD2-CG 4.47Å; P68-K73 HydrophobicContact CB-CD 4.42Å; P68-K73 HydrophobicContact CB-CG 3.69Å; P68-K73 HydrophobicContact CG-CD 4.43Å; P68-K73 VanDerWaalsContact CG-CE 3.48Å; P68-K73 HydrophobicContact CG-CG 4.03Å; P68-K73 WeakPolarHBondContact O-CE 3.33Å; P68-K73 PolarHBondContact O-NZ 3.01Å; P68-K73 VanDerWaalsContact O-NZ 3.09Å; P69-K73 PolarHBondContact O-N 3.18Å; E70-K73 PolarHBondContact O-N 3.49Å; K73-F75 VanDerWaalsContact C-N 3.27Å; K73-F75 PolarHBondContact O-N 3.43Å; K73-I76 PolarHBondContact O-N 2.84Å; K73-F77 WeakPolarHBondContact O-CB 3.38Å; K73-F77 PolarHBondContact O-N 2.71Å |
| 74 | S | 97.1 | Very high | 95.3 | Very high | 56 Ų | 56 | 55.7 Ų | 55.7 | 39% | 0.392 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.5 | -33.6 | 176.9 | 83.9 | 0 | 0 | 0 | 0 | 112.8 | E70 W71 F72 F77 C78 | E70-S74 PolarHBondContact O-N 3.39Å; W71-S74 WeakPolarHBondContact O-CB 3.47Å; W71-S74 PolarHBondContact O-N 3.27Å; W71-S74 PolarHBondContact O-OG 3.18Å; F72-S74 PolarHBondContact O-N 2.76Å; S74-F77 PolarHBondContact O-N 2.82Å; S74-C78 PolarHBondContact O-N 3.33Å; S74-C78 VanDerWaalsContact O-N 3.07Å; S74-C78 PolarHBondContact O-SG 2.92Å |
| 75 | F | 96.9 | Very high | 95.4 | Very high | 49 Ų | 49 | 58.7 Ų | 58.7 | 22% | 0.215 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -73.5 | -42.7 | 175 | -61.1 | -28 | 0 | 0 | 0 | 112 | W71 F72 K73 F77 C78 E79 T116 P119 I120 | W71-F75 AromaticContact CE3-CD2 3.96Å; W71-F75 HydrophobicContact CE3-CD2 3.96Å; W71-F75 AromaticContact CE3-CE2 3.54Å; W71-F75 HydrophobicContact CE3-CE2 3.54Å; W71-F75 HydrophobicContact CE3-CZ 4.36Å; W71-F75 HydrophobicContact CZ3-CD2 4.02Å; W71-F75 AromaticContact CZ3-CE2 3.74Å; W71-F75 HydrophobicContact CZ3-CE2 3.74Å; W71-F75 PolarHBondContact O-N 3.49Å; F72-F75 WeakPolarHBondContact O-CB 3.45Å; F72-F75 PolarHBondContact O-N 3.19Å; K73-F75 VanDerWaalsContact C-N 3.27Å; K73-F75 PolarHBondContact O-N 3.43Å; F75-F77 PolarHBondContact O-N 3.12Å; F75-C78 CarbonylContact O-C 3.6Å; F75-C78 WeakPolarHBondContact O-CB 3.42Å; F75-C78 PolarHBondContact O-N 3.39Å; F75-C78 VanDerWaalsContact O-N 3.12Å; F75-E79 PolarHBondContact O-N 3.35Å; F75-T116 HydrophobicContact CD1-CG2 3.62Å; F75-T116 HydrophobicContact CE1-CG2 3.79Å; F75-T116 HydrophobicContact CG-CG2 4.03Å; F75-T116 HydrophobicContact CZ-CG2 4.32Å; F75-P119 HydrophobicContact CE2-CG 3.72Å; F75-P119 HydrophobicContact CZ-CG 3.78Å; F75-I120 HydrophobicContact CD2-CD1 4.22Å; F75-I120 HydrophobicContact CD2-CG1 4.29Å; F75-I120 HydrophobicContact CE2-CG1 4.44Å |
| 76 | I | 96.4 | Very high | 95.6 | Very high | 10 Ų | 10 | 59.1 Ų | 59.1 | 5% | 0.051 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61 | -35.6 | 173.5 | -55.2 | 176.1 | 0 | 0 | 0 | 110.3 | D35 A38 L39 F72 K73 E79 A80 | D35-I76 HydrophobicContact CB-CG2 4.36Å; D35-I76 WeakPolarHBondContact O-CG2 3.4Å; A38-I76 HydrophobicContact CB-CD1 3.35Å; L39-I76 HydrophobicContact CD1-CB 4.1Å; L39-I76 HydrophobicContact CD1-CG2 3.64Å; L39-I76 HydrophobicContact CG-CB 4.21Å; L39-I76 HydrophobicContact CG-CG2 3.78Å; F72-I76 HydrophobicContact CD1-CD1 3.71Å; F72-I76 HydrophobicContact CD1-CG1 4.18Å; F72-I76 HydrophobicContact CE1-CD1 3.59Å; F72-I76 HydrophobicContact CE1-CG1 4.1Å; F72-I76 PolarHBondContact O-N 3Å; F72-I76 VanDerWaalsContact O-N 3.08Å; K73-I76 PolarHBondContact O-N 2.84Å; I76-E79 WeakPolarHBondContact O-CB 3.48Å; I76-E79 PolarHBondContact O-N 2.75Å; I76-A80 WeakPolarHBondContact O-CB 3.37Å; I76-A80 PolarHBondContact O-N 3.23Å |
| 77 | F | 96.6 | Very high | 95.9 | Very high | 124 Ų | 124 | 57 Ų | 57 | 54% | 0.544 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 175.4 | -179 | -92.6 | 0 | 0 | 0 | 111.6 | L39 K73 S74 F75 E79 A80 F81 | L39-F77 HydrophobicContact CD1-CB 4.14Å; K73-F77 WeakPolarHBondContact O-CB 3.38Å; K73-F77 PolarHBondContact O-N 2.71Å; S74-F77 PolarHBondContact O-N 2.82Å; F75-F77 PolarHBondContact O-N 3.12Å; F77-E79 VanDerWaalsContact C-N 3.28Å; F77-E79 PolarHBondContact O-N 3.02Å; F77-A80 PolarHBondContact O-N 3.1Å; F77-F81 PolarHBondContact O-N 2.96Å |
| 78 | C | 96 | Very high | 96.2 | Very high | 34 Ų | 34 | 55.3 Ų | 55.3 | 23% | 0.23 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.1 | -40.6 | 172.2 | -64.3 | 0 | 0 | 0 | 0 | 111.4 | S74 F75 L82 Q83 | S74-C78 PolarHBondContact O-N 3.33Å; S74-C78 VanDerWaalsContact O-N 3.07Å; S74-C78 PolarHBondContact O-SG 2.92Å; F75-C78 CarbonylContact O-C 3.6Å; F75-C78 WeakPolarHBondContact O-CB 3.42Å; F75-C78 PolarHBondContact O-N 3.39Å; F75-C78 VanDerWaalsContact O-N 3.12Å; C78-L82 HydrophobicContact CB-CD1 4.48Å; C78-L82 WeakPolarHBondContact O-CA 3.26Å; C78-L82 VanDerWaalsContact O-CB 3.23Å; C78-L82 WeakPolarHBondContact O-CB 3.15Å; C78-L82 PolarHBondContact O-N 3.32Å; C78-Q83 PolarHBondContact O-N 3.42Å |
| 79 | E | 96.3 | Very high | 96.4 | Very high | 33 Ų | 33 | 58.8 Ų | 58.8 | 15% | 0.154 | 30% | 0.3 | C | S | . | . | I | π-helix | trans | -60.5 | -52.3 | 175.6 | -175 | -179.2 | 113.3 | 0 | 0 | 111.3 | T31 D35 F75 I76 F77 F81 Q83 M84 F87 | T31-E79 WeakPolarHBondContact CB-OE1 2.97Å; T31-E79 HydrophobicContact CG2-CG 4.11Å; T31-E79 WeakPolarHBondContact CG2-OE1 3.15Å; T31-E79 PolarHBondContact OG1-OE1 3.48Å; D35-E79 WeakPolarHBondContact CB-OE1 3.3Å; D35-E79 VanDerWaalsContact OD2-OE1 3.12Å; F75-E79 PolarHBondContact O-N 3.35Å; I76-E79 WeakPolarHBondContact O-CB 3.48Å; I76-E79 PolarHBondContact O-N 2.75Å; F77-E79 VanDerWaalsContact C-N 3.28Å; F77-E79 PolarHBondContact O-N 3.02Å; E79-F81 VanDerWaalsContact C-N 3.31Å; E79-F81 PolarHBondContact O-N 2.92Å; E79-Q83 HydrophobicContact CB-CB 4.49Å; E79-Q83 HydrophobicContact CG-CB 4.09Å; E79-Q83 CarbonylContact O-C 3.56Å; E79-Q83 WeakPolarHBondContact O-CA 3.32Å; E79-Q83 WeakPolarHBondContact O-CB 3.48Å; E79-Q83 PolarHBondContact O-N 2.7Å; E79-M84 PolarHBondContact O-N 3.11Å; E79-F87 HydrophobicContact CG-CZ 4.31Å |
| 80 | A | 94.9 | Very high | 96.5 | Very high | 31 Ų | 31 | 57.4 Ų | 57.4 | 26% | 0.256 | 29% | 0.291 | S | S | . | . | I | π-helix | trans | -55.1 | -43.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L36 L39 I76 F77 M84 | L36-A80 HydrophobicContact CD2-CB 3.44Å; L36-A80 VanDerWaalsContact CD2-CB 3.44Å; L39-A80 HydrophobicContact CD1-CB 4.4Å; I76-A80 WeakPolarHBondContact O-CB 3.37Å; I76-A80 PolarHBondContact O-N 3.23Å; F77-A80 PolarHBondContact O-N 3.1Å; A80-M84 WeakPolarHBondContact O-CB 3.18Å |
| 81 | F | 94.9 | Very high | 96.6 | Very high | 146 Ų | 146 | 50.4 Ų | 50.4 | 64% | 0.64 | 26% | 0.259 | S | S | * | . | I | π-helix | trans | -92.7 | -35.6 | -171.4 | -169.1 | -103.3 | 0 | 0 | 0 | 113.9 | F77 E79 P85 | F77-F81 PolarHBondContact O-N 2.96Å; E79-F81 VanDerWaalsContact C-N 3.31Å; E79-F81 PolarHBondContact O-N 2.92Å; F81-P85 WeakPolarHBondContact O-CG 3.32Å |
| 82 | L | 93.3 | Very high | 96.8 | Very high | 103 Ų | 103 | 52.6 Ų | 52.6 | 54% | 0.539 | 27% | 0.269 | S | S | . | . | I | π-helix | trans | -104.7 | -44.7 | -173.9 | -56.2 | 174.6 | 0 | 0 | 0 | 112.2 | C78 | C78-L82 HydrophobicContact CB-CD1 4.48Å; C78-L82 WeakPolarHBondContact O-CA 3.26Å; C78-L82 VanDerWaalsContact O-CB 3.23Å; C78-L82 WeakPolarHBondContact O-CB 3.15Å; C78-L82 PolarHBondContact O-N 3.32Å |
| 83 | Q | 96.1 | Very high | 96.8 | Very high | 12 Ų | 12 | 51.9 Ų | 51.9 | 6% | 0.056 | 27% | 0.265 | C | S | . | . | I | π-helix | trans | -85.2 | -43 | -171.3 | -56.1 | -176.6 | 14.9 | 0 | 0 | 111.8 | C78 E79 F86 F87 Y109 H112 | C78-Q83 PolarHBondContact O-N 3.42Å; E79-Q83 HydrophobicContact CB-CB 4.49Å; E79-Q83 HydrophobicContact CG-CB 4.09Å; E79-Q83 CarbonylContact O-C 3.56Å; E79-Q83 WeakPolarHBondContact O-CA 3.32Å; E79-Q83 WeakPolarHBondContact O-CB 3.48Å; E79-Q83 PolarHBondContact O-N 2.7Å; Q83-F86 CarbonylContact O-C 3.54Å; Q83-F86 WeakPolarHBondContact O-CA 3.16Å; Q83-F86 VanDerWaalsContact O-CB 3.32Å; Q83-F86 WeakPolarHBondContact O-CB 3.32Å; Q83-F86 PolarHBondContact O-N 2.88Å; Q83-F87 HydrophobicContact CB-CD1 4.47Å; Q83-F87 HydrophobicContact CB-CE1 3.67Å; Q83-F87 HydrophobicContact CB-CE2 4.42Å; Q83-F87 HydrophobicContact CB-CZ 3.61Å; Q83-F87 WeakPolarHBondContact O-CD1 3.4Å; Q83-F87 VanDerWaalsContact O-CG 3.32Å; Q83-F87 WeakPolarHBondContact O-CG 3.34Å; Q83-F87 PolarHBondContact O-N 3.06Å; Q83-Y109 HydrophobicContact CB-CD2 4.36Å; Q83-Y109 HydrophobicContact CB-CE2 3.95Å; Q83-Y109 HydrophobicContact CG-CD2 4.06Å; Q83-Y109 HydrophobicContact CG-CE2 3.84Å; Q83-H112 PolarHBondContact NE2-CD2 3.08Å; Q83-H112 VanDerWaalsContact NE2-CD2 3.26Å; Q83-H112 PolarHBondContact NE2-NE2 3.06Å |
| 84 | M | 96.3 | Very high | 96.9 | Very high | 53 Ų | 53 | 48.6 Ų | 48.6 | 26% | 0.261 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -47.9 | -178.2 | -171.6 | -69.7 | -171 | 0 | 0 | 112.2 | T31 L32 E79 A80 F86 F87 P88 | T31-M84 HydrophobicContact CG2-CB 4.33Å; T31-M84 HydrophobicContact CG2-CG 4.25Å; L32-M84 HydrophobicContact CD1-CE 4.03Å; L32-M84 HydrophobicContact CD2-CE 3.52Å; L32-M84 HydrophobicContact CG-CE 3.9Å; E79-M84 PolarHBondContact O-N 3.11Å; A80-M84 WeakPolarHBondContact O-CB 3.18Å; M84-F86 PolarHBondContact O-N 3.35Å; M84-F87 PolarHBondContact O-N 3.17Å; M84-P88 WeakPolarHBondContact O-CD 3.31Å |
| 85 | P | 96.8 | Very high | 96.9 | Very high | 67 Ų | 67 | 50.3 Ų | 50.3 | 44% | 0.435 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -25.3 | 175 | -22 | 35 | 0 | 0 | 0 | 113.4 | F81 I89 | F81-P85 WeakPolarHBondContact O-CG 3.32Å; P85-I89 WeakPolarHBondContact O-CD1 3.31Å |
| 86 | F | 97.9 | Very high | 96.9 | Very high | 23 Ų | 23 | 54.2 Ų | 54.2 | 10% | 0.101 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -79.4 | -32.5 | 179.4 | 178.1 | -115.8 | 0 | 0 | 0 | 113 | F24 Q83 M84 I89 A90 I102 P105 A106 Y109 | F24-F86 HydrophobicContact CE1-CD1 4.16Å; F24-F86 AromaticContact CE1-CE1 3.92Å; F24-F86 HydrophobicContact CE1-CE1 3.92Å; F24-F86 AromaticContact CZ-CE1 3.97Å; F24-F86 HydrophobicContact CZ-CE1 3.97Å; Q83-F86 CarbonylContact O-C 3.54Å; Q83-F86 WeakPolarHBondContact O-CA 3.16Å; Q83-F86 VanDerWaalsContact O-CB 3.32Å; Q83-F86 WeakPolarHBondContact O-CB 3.32Å; Q83-F86 PolarHBondContact O-N 2.88Å; M84-F86 PolarHBondContact O-N 3.35Å; F86-I89 HydrophobicContact CD2-CB 4.46Å; F86-I89 WeakPolarHBondContact O-CB 3.14Å; F86-I89 PolarHBondContact O-N 2.95Å; F86-I89 VanDerWaalsContact O-N 3.1Å; F86-A90 HydrophobicContact CD1-CB 4.29Å; F86-A90 HydrophobicContact CE1-CB 3.84Å; F86-A90 HydrophobicContact CE2-CB 4.18Å; F86-A90 HydrophobicContact CZ-CB 3.78Å; F86-A90 WeakPolarHBondContact O-CB 3.35Å; F86-A90 PolarHBondContact O-N 3.31Å; F86-I102 HydrophobicContact CE2-CD1 3.65Å; F86-I102 HydrophobicContact CZ-CD1 3.87Å; F86-P105 HydrophobicContact CD2-CB 4.27Å; F86-P105 HydrophobicContact CE2-CB 3.47Å; F86-P105 VanDerWaalsContact CE2-CB 3.47Å; F86-P105 HydrophobicContact CZ-CB 3.94Å; F86-A106 HydrophobicContact CZ-CB 4.47Å; F86-Y109 AromaticContact CD1-CD2 3.68Å; F86-Y109 HydrophobicContact CD1-CD2 3.68Å; F86-Y109 HydrophobicContact CD1-CE2 4.42Å; F86-Y109 AromaticContact CD1-CG 3.76Å; F86-Y109 HydrophobicContact CD1-CG 3.76Å; F86-Y109 VanDerWaalsContact CE1-CB 3.5Å; F86-Y109 HydrophobicContact CE1-CD1 4.1Å; F86-Y109 HydrophobicContact CE1-CD2 4Å; F86-Y109 AromaticContact CE1-CG 3.57Å; F86-Y109 HydrophobicContact CE1-CG 3.57Å |
| 87 | F | 98.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -51.5 | -51.5 | -179 | -61.7 | -22.7 | 0 | 0 | 0 | 114.8 | F24 H27 I28 T31 E79 Q83 M84 I89 A90 A91 Y109 | F24-F87 HydrophobicContact CD1-CB 4.5Å; F24-F87 AromaticContact CD1-CD1 3.61Å; F24-F87 HydrophobicContact CD1-CD1 3.61Å; F24-F87 HydrophobicContact CD1-CE1 4.26Å; F24-F87 HydrophobicContact CD1-CG 4.41Å; F24-F87 HydrophobicContact CE1-CD1 4.01Å; F24-F87 HydrophobicContact CE1-CE1 4.39Å; H27-F87 HydrophobicContact CB-CD2 3.91Å; H27-F87 HydrophobicContact CB-CE1 4.35Å; H27-F87 HydrophobicContact CB-CE2 3.76Å; H27-F87 HydrophobicContact CB-CG 4.33Å; H27-F87 HydrophobicContact CB-CZ 3.98Å; I28-F87 HydrophobicContact CD1-CB 4.26Å; I28-F87 HydrophobicContact CG1-CB 3.64Å; I28-F87 HydrophobicContact CG1-CD2 4.34Å; I28-F87 HydrophobicContact CG1-CG 4.48Å; T31-F87 WeakPolarHBondContact OG1-CE2 3.17Å; E79-F87 HydrophobicContact CG-CZ 4.31Å; Q83-F87 HydrophobicContact CB-CD1 4.47Å; Q83-F87 HydrophobicContact CB-CE1 3.67Å; Q83-F87 HydrophobicContact CB-CE2 4.42Å; Q83-F87 HydrophobicContact CB-CZ 3.61Å; Q83-F87 WeakPolarHBondContact O-CD1 3.4Å; Q83-F87 VanDerWaalsContact O-CG 3.32Å; Q83-F87 WeakPolarHBondContact O-CG 3.34Å; Q83-F87 PolarHBondContact O-N 3.06Å; M84-F87 PolarHBondContact O-N 3.17Å; F87-I89 VanDerWaalsContact C-N 3.3Å; F87-I89 PolarHBondContact O-N 2.88Å; F87-A90 PolarHBondContact O-N 3.01Å; F87-A91 VanDerWaalsContact O-CB 3.3Å; F87-A91 WeakPolarHBondContact O-CB 3.06Å; F87-A91 PolarHBondContact O-N 3.5Å; F87-Y109 HydrophobicContact CD1-CE2 4.32Å; F87-Y109 AromaticContact CE1-CE2 3.57Å; F87-Y109 HydrophobicContact CE1-CE2 3.57Å; F87-Y109 AromaticContact CE1-CZ 3.85Å; F87-Y109 WeakPolarHBondContact CE1-OH 3.14Å; F87-Y109 HydrophobicContact CZ-CE2 4.5Å |
| 88 | P | 98.3 | Very high | 96.1 | Very high | 65 Ų | 65 | 50.3 Ų | 50.3 | 42% | 0.422 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.6 | -33.5 | 178.6 | 25.2 | -34 | 0 | 0 | 0 | 112.6 | I28 M84 Y92 | I28-P88 HydrophobicContact CD1-CB 4.28Å; M84-P88 WeakPolarHBondContact O-CD 3.31Å; P88-Y92 WeakPolarHBondContact O-CB 3.18Å; P88-Y92 PolarHBondContact O-N 3.15Å |
| 89 | I | 98.1 | Very high | 96 | Very high | 82 Ų | 82 | 49.1 Ų | 49.1 | 42% | 0.421 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.9 | -47 | 176.7 | -60 | 173.7 | 0 | 0 | 0 | 110 | P85 F86 F87 A93 W101 I102 | P85-I89 WeakPolarHBondContact O-CD1 3.31Å; F86-I89 HydrophobicContact CD2-CB 4.46Å; F86-I89 WeakPolarHBondContact O-CB 3.14Å; F86-I89 PolarHBondContact O-N 2.95Å; F86-I89 VanDerWaalsContact O-N 3.1Å; F87-I89 VanDerWaalsContact C-N 3.3Å; F87-I89 PolarHBondContact O-N 2.88Å; I89-A93 WeakPolarHBondContact O-CB 3.35Å; I89-A93 PolarHBondContact O-N 3.18Å; I89-W101 HydrophobicContact CG2-CH2 3.55Å; I89-W101 HydrophobicContact CG2-CZ3 3.57Å; I89-I102 HydrophobicContact CG2-CD1 4.44Å |
| 90 | A | 98 | Very high | 95.8 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.2 | -45.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | F24 F86 F87 Y92 A93 F94 I102 | F24-A90 HydrophobicContact CB-CB 4.31Å; F24-A90 HydrophobicContact CD1-CB 3.76Å; F24-A90 HydrophobicContact CD2-CB 3.58Å; F24-A90 HydrophobicContact CE1-CB 3.86Å; F24-A90 HydrophobicContact CE2-CB 3.75Å; F24-A90 HydrophobicContact CG-CB 3.61Å; F24-A90 HydrophobicContact CZ-CB 3.87Å; F86-A90 HydrophobicContact CD1-CB 4.29Å; F86-A90 HydrophobicContact CE1-CB 3.84Å; F86-A90 HydrophobicContact CE2-CB 4.18Å; F86-A90 HydrophobicContact CZ-CB 3.78Å; F86-A90 WeakPolarHBondContact O-CB 3.35Å; F86-A90 PolarHBondContact O-N 3.31Å; F87-A90 PolarHBondContact O-N 3.01Å; A90-Y92 VanDerWaalsContact C-N 3.34Å; A90-Y92 PolarHBondContact O-N 3.08Å; A90-A93 PolarHBondContact O-N 2.95Å; A90-A93 VanDerWaalsContact O-N 3.15Å; A90-F94 HydrophobicContact CB-CD2 4.3Å; A90-F94 HydrophobicContact CB-CE2 4.14Å; A90-F94 WeakPolarHBondContact O-CD2 3.32Å; A90-F94 PolarHBondContact O-N 3.35Å; A90-I102 HydrophobicContact CB-CD1 4.38Å |
| 91 | A | 98.3 | Very high | 95.8 | Very high | 8 Ų | 8 | 57.3 Ų | 57.3 | 7% | 0.066 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -55.4 | -49 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | F21 F24 F87 A93 F94 L95 | F21-A91 HydrophobicContact CD2-CB 4Å; F21-A91 VanDerWaalsContact CD2-O 3.29Å; F21-A91 WeakPolarHBondContact CD2-O 3.25Å; F21-A91 HydrophobicContact CE2-CB 4.23Å; F24-A91 HydrophobicContact CB-CB 4.07Å; F87-A91 VanDerWaalsContact O-CB 3.3Å; F87-A91 WeakPolarHBondContact O-CB 3.06Å; F87-A91 PolarHBondContact O-N 3.5Å; A91-A93 PolarHBondContact O-N 3.31Å; A91-F94 PolarHBondContact O-N 3.03Å; A91-L95 VanDerWaalsContact O-CB 3.23Å; A91-L95 WeakPolarHBondContact O-CB 3.29Å; A91-L95 PolarHBondContact O-N 3.36Å |
| 92 | Y | 98.3 | Very high | 95.9 | Very high | 124 Ų | 124 | 50.4 Ų | 50.4 | 49% | 0.486 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58 | -49.1 | 174.6 | 169 | -99.4 | 0 | 0 | 0 | 112.5 | P88 A90 F94 L95 K96 W101 | P88-Y92 WeakPolarHBondContact O-CB 3.18Å; P88-Y92 PolarHBondContact O-N 3.15Å; A90-Y92 VanDerWaalsContact C-N 3.34Å; A90-Y92 PolarHBondContact O-N 3.08Å; Y92-F94 VanDerWaalsContact C-N 3.33Å; Y92-F94 PolarHBondContact O-N 3.35Å; Y92-L95 PolarHBondContact O-N 3.07Å; Y92-K96 HydrophobicContact CE1-CD 4.1Å; Y92-K96 HydrophobicContact CE2-CD 4.3Å; Y92-K96 VanDerWaalsContact O-CB 3.31Å; Y92-K96 WeakPolarHBondContact O-CB 3.49Å; Y92-K96 PolarHBondContact O-N 3.46Å; Y92-K96 VanDerWaalsContact OH-CD 3.32Å; Y92-K96 WeakPolarHBondContact OH-CD 3.24Å; Y92-K96 PolarHBondContact OH-NZ 3.04Å; Y92-K96 VanDerWaalsContact OH-NZ 3.16Å; Y92-W101 HydrophobicContact CD1-CZ2 4.41Å; Y92-W101 HydrophobicContact CE1-CZ2 4.46Å |
| 93 | A | 97.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.4 | -42.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | I89 A90 A91 G97 C99 W101 I102 | I89-A93 WeakPolarHBondContact O-CB 3.35Å; I89-A93 PolarHBondContact O-N 3.18Å; A90-A93 PolarHBondContact O-N 2.95Å; A90-A93 VanDerWaalsContact O-N 3.15Å; A91-A93 PolarHBondContact O-N 3.31Å; A93-G97 WeakPolarHBondContact O-CA 3.35Å; A93-G97 PolarHBondContact O-N 3.46Å; A93-C99 HydrophobicContact CB-CB 3.89Å; A93-W101 HydrophobicContact CB-CH2 3.75Å; A93-W101 HydrophobicContact CB-CZ2 3.92Å; A93-I102 HydrophobicContact CB-CB 3.92Å; A93-I102 HydrophobicContact CB-CD1 3.8Å; A93-I102 HydrophobicContact CB-CG1 3.72Å; A93-I102 HydrophobicContact CB-CG2 4.5Å |
| 94 | F | 97.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -78.7 | -35.7 | -179.5 | -67.5 | -55.2 | 0 | 0 | 0 | 112.9 | R14 E17 F20 F21 F24 A90 A91 Y92 G97 I102 A106 L160 M164 | R14-F94 PolarHBondContact NH1-O 3.14Å; E17-F94 HydrophobicContact CB-CB 4.47Å; E17-F94 HydrophobicContact CB-CD1 4.4Å; E17-F94 HydrophobicContact CG-CD1 4.12Å; E17-F94 WeakPolarHBondContact O-CB 3.41Å; F20-F94 HydrophobicContact CB-CB 4.29Å; F20-F94 HydrophobicContact CB-CD1 4.24Å; F20-F94 HydrophobicContact CB-CD2 3.71Å; F20-F94 HydrophobicContact CB-CE2 4.13Å; F20-F94 HydrophobicContact CB-CG 3.81Å; F20-F94 HydrophobicContact CD2-CD1 4.07Å; F20-F94 AromaticContact CD2-CE1 3.98Å; F20-F94 HydrophobicContact CD2-CE1 3.98Å; F20-F94 HydrophobicContact CD2-CG 4.49Å; F20-F94 HydrophobicContact CD2-CZ 4.32Å; F21-F94 HydrophobicContact CB-CB 4.17Å; F24-F94 AromaticContact CD2-CD2 3.8Å; F24-F94 HydrophobicContact CD2-CD2 3.8Å; F24-F94 AromaticContact CD2-CE2 3.92Å; F24-F94 HydrophobicContact CD2-CE2 3.92Å; F24-F94 AromaticContact CE2-CD2 3.89Å; F24-F94 HydrophobicContact CE2-CD2 3.89Å; F24-F94 AromaticContact CE2-CE2 3.51Å; F24-F94 HydrophobicContact CE2-CE2 3.51Å; F24-F94 HydrophobicContact CZ-CE2 4.48Å; A90-F94 HydrophobicContact CB-CD2 4.3Å; A90-F94 HydrophobicContact CB-CE2 4.14Å; A90-F94 WeakPolarHBondContact O-CD2 3.32Å; A90-F94 PolarHBondContact O-N 3.35Å; A91-F94 PolarHBondContact O-N 3.03Å; Y92-F94 VanDerWaalsContact C-N 3.33Å; Y92-F94 PolarHBondContact O-N 3.35Å; F94-G97 PolarHBondContact O-N 3.47Å; F94-I102 HydrophobicContact CE1-CG2 4.08Å; F94-I102 HydrophobicContact CE2-CG1 4.17Å; F94-I102 HydrophobicContact CZ-CG1 3.94Å; F94-I102 HydrophobicContact CZ-CG2 4.13Å; F94-A106 HydrophobicContact CZ-CB 4.41Å; F94-L160 HydrophobicContact CE1-CD1 4.15Å; F94-L160 HydrophobicContact CE2-CD1 4.08Å; F94-L160 HydrophobicContact CZ-CD1 3.48Å; F94-L160 VanDerWaalsContact CZ-CD1 3.48Å; F94-M164 HydrophobicContact CE1-CE 3.78Å; F94-M164 HydrophobicContact CZ-CE 4.11Å |
| 95 | L | 97.7 | Very high | 96.1 | Very high | 93 Ų | 93 | 51.8 Ų | 51.8 | 49% | 0.487 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.3 | -50.4 | 171.9 | -177.3 | 60.7 | 0 | 0 | 0 | 111 | R14 F21 A91 Y92 G97 | R14-L95 PolarHBondContact NH1-O 3.48Å; R14-L95 PolarHBondContact NH2-O 3.23Å; F21-L95 HydrophobicContact CD1-CD1 4.11Å; F21-L95 HydrophobicContact CD2-CB 3.64Å; F21-L95 HydrophobicContact CD2-CD1 4.33Å; F21-L95 HydrophobicContact CD2-CD2 4.47Å; F21-L95 HydrophobicContact CD2-CG 4.36Å; F21-L95 HydrophobicContact CE1-CD1 4.04Å; F21-L95 HydrophobicContact CE2-CB 3.94Å; F21-L95 HydrophobicContact CE2-CD1 4.25Å; F21-L95 HydrophobicContact CE2-CD2 3.9Å; F21-L95 HydrophobicContact CE2-CG 4.25Å; F21-L95 HydrophobicContact CG-CB 4.07Å; F21-L95 HydrophobicContact CG-CD1 4.24Å; F21-L95 HydrophobicContact CZ-CD1 4.1Å; F21-L95 HydrophobicContact CZ-CD2 4.11Å; A91-L95 VanDerWaalsContact O-CB 3.23Å; A91-L95 WeakPolarHBondContact O-CB 3.29Å; A91-L95 PolarHBondContact O-N 3.36Å; Y92-L95 PolarHBondContact O-N 3.07Å; L95-G97 VanDerWaalsContact C-N 3.33Å; L95-G97 PolarHBondContact O-N 3.4Å |
| 96 | K | 96.4 | Very high | 96.2 | Very high | 130 Ų | 130 | 48.6 Ų | 48.6 | 57% | 0.565 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -63.8 | -39.6 | 176.5 | -177.6 | 173.5 | 178.1 | -176.5 | 0 | 111.9 | Y92 | Y92-K96 HydrophobicContact CE1-CD 4.1Å; Y92-K96 HydrophobicContact CE2-CD 4.3Å; Y92-K96 VanDerWaalsContact O-CB 3.31Å; Y92-K96 WeakPolarHBondContact O-CB 3.49Å; Y92-K96 PolarHBondContact O-N 3.46Å; Y92-K96 VanDerWaalsContact OH-CD 3.32Å; Y92-K96 WeakPolarHBondContact OH-CD 3.24Å; Y92-K96 PolarHBondContact OH-NZ 3.04Å; Y92-K96 VanDerWaalsContact OH-NZ 3.16Å |
| 97 | G | 92.7 | Very high | 96.2 | Very high | 14 Ų | 14 | 49.1 Ų | 49.1 | 14% | 0.144 | 25% | 0.251 | C | S | . | . | trans | 73.3 | 155.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113 | A93 F94 L95 C99 | A93-G97 WeakPolarHBondContact O-CA 3.35Å; A93-G97 PolarHBondContact O-N 3.46Å; F94-G97 PolarHBondContact O-N 3.47Å; L95-G97 VanDerWaalsContact C-N 3.33Å; L95-G97 PolarHBondContact O-N 3.4Å; G97-C99 PolarHBondContact O-N 3.5Å | ||
| 98 | G | 85 | Confident | 96.2 | Very high | 39 Ų | 39 | 53.8 Ų | 53.8 | 40% | 0.402 | 28% | 0.28 | S | S | . | . | trans | 72.4 | 7.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 116 | K100 | G98-K100 PolarHBondContact O-N 3.02Š| ||
| 99 | C | 92.4 | Very high | 96.2 | Very high | 8 Ų | 8 | 51.2 Ų | 51.2 | 5% | 0.054 | 26% | 0.262 | C | S | . | . | trans | -74.6 | 82.8 | 176.8 | -68.9 | 0 | 0 | 0 | 0 | 111.3 | A93 G97 W101 I102 | A93-C99 HydrophobicContact CB-CB 3.89Å; G97-C99 PolarHBondContact O-N 3.5Å; C99-W101 HydrophobicContact CB-CD2 4.48Å; C99-W101 HydrophobicContact CB-CZ2 3.99Å; C99-W101 PolarHBondContact O-N 3.36Å; C99-W101 VanDerWaalsContact O-N 3.08Å; C99-I102 WeakPolarHBondContact O-CB 3.49Å; C99-I102 WeakPolarHBondContact O-CG2 3.48Å; C99-I102 PolarHBondContact O-N 3.37Å | ||
| 100 | K | 93.1 | Very high | 96.2 | Very high | 103 Ų | 103 | 47.3 Ų | 47.3 | 45% | 0.448 | 24% | 0.242 | S | C | . | . | G | 310 helix | trans | -56.8 | -28.5 | -175.9 | -63.7 | -170.7 | -178.9 | -175 | 0 | 114.4 | G98 I102 R103 K169 S174 | G98-K100 PolarHBondContact O-N 3.02Å; K100-I102 PolarHBondContact O-N 3.45Å; K100-R103 WeakPolarHBondContact O-CB 3.42Å; K100-R103 PolarHBondContact O-N 3.25Å; K100-K169 WeakPolarHBondContact CE-O 3.37Å; K100-S174 PolarHBondContact NZ-OG 2.82Å |
| 101 | W | 94.7 | Very high | 96.2 | Very high | 134 Ų | 134 | 50.2 Ų | 50.2 | 51% | 0.508 | 26% | 0.26 | S | S | . | . | G | 310 helix | trans | -64.3 | -20.3 | 178.4 | 58.8 | -101.7 | 0 | 0 | 0 | 113.3 | I89 Y92 A93 C99 R103 P105 | I89-W101 HydrophobicContact CG2-CH2 3.55Å; I89-W101 HydrophobicContact CG2-CZ3 3.57Å; Y92-W101 HydrophobicContact CD1-CZ2 4.41Å; Y92-W101 HydrophobicContact CE1-CZ2 4.46Å; A93-W101 HydrophobicContact CB-CH2 3.75Å; A93-W101 HydrophobicContact CB-CZ2 3.92Å; C99-W101 HydrophobicContact CB-CD2 4.48Å; C99-W101 HydrophobicContact CB-CZ2 3.99Å; C99-W101 PolarHBondContact O-N 3.36Å; C99-W101 VanDerWaalsContact O-N 3.08Å; W101-R103 PolarHBondContact O-N 3.07Å; W101-P105 WeakPolarHBondContact O-CD 3.39Å |
| 102 | I | 96.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | G | 310 helix | trans | -68.8 | -17.9 | 179.2 | -161.2 | 60.2 | 0 | 0 | 0 | 112.4 | F86 I89 A90 A93 F94 C99 K100 T104 P105 A106 M164 Y170 | F86-I102 HydrophobicContact CE2-CD1 3.65Å; F86-I102 HydrophobicContact CZ-CD1 3.87Å; I89-I102 HydrophobicContact CG2-CD1 4.44Å; A90-I102 HydrophobicContact CB-CD1 4.38Å; A93-I102 HydrophobicContact CB-CB 3.92Å; A93-I102 HydrophobicContact CB-CD1 3.8Å; A93-I102 HydrophobicContact CB-CG1 3.72Å; A93-I102 HydrophobicContact CB-CG2 4.5Å; F94-I102 HydrophobicContact CE1-CG2 4.08Å; F94-I102 HydrophobicContact CE2-CG1 4.17Å; F94-I102 HydrophobicContact CZ-CG1 3.94Å; F94-I102 HydrophobicContact CZ-CG2 4.13Å; C99-I102 WeakPolarHBondContact O-CB 3.49Å; C99-I102 WeakPolarHBondContact O-CG2 3.48Å; C99-I102 PolarHBondContact O-N 3.37Å; K100-I102 PolarHBondContact O-N 3.45Å; I102-T104 PolarHBondContact O-N 3.49Å; I102-P105 WeakPolarHBondContact O-CD 3.11Å; I102-A106 HydrophobicContact CG1-CB 4.39Å; I102-A106 WeakPolarHBondContact O-CB 3.37Å; I102-A106 PolarHBondContact O-N 3.01Å; I102-M164 HydrophobicContact CG2-SD 4.36Å; I102-Y170 HydrophobicContact CG2-CD1 4.18Å; I102-Y170 HydrophobicContact CG2-CE1 3.63Å |
| 103 | R | 96.6 | Very high | 96.2 | Very high | 53 Ų | 53 | 46.8 Ų | 46.8 | 20% | 0.2 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -54.8 | -57.4 | -170.9 | 178.7 | 176.4 | 179.2 | -82.9 | 1.4 | 113 | K100 W101 A106 I107 M164 Y170 | K100-R103 WeakPolarHBondContact O-CB 3.42Å; K100-R103 PolarHBondContact O-N 3.25Å; W101-R103 PolarHBondContact O-N 3.07Å; R103-A106 PolarHBondContact O-N 3.04Å; R103-I107 HydrophobicContact CG-CD1 3.87Å; R103-I107 VanDerWaalsContact O-CG1 3.31Å; R103-I107 WeakPolarHBondContact O-CG1 3.36Å; R103-I107 PolarHBondContact O-N 3.48Å; R103-M164 HydrophobicContact CB-SD 4.24Å; R103-M164 HydrophobicContact CG-CB 4.2Å; R103-M164 HydrophobicContact CG-SD 4.35Å; R103-M164 PolarHBondContact NE-O 3.44Å; R103-Y170 WeakPolarHBondContact CD-O 3.47Å |
| 104 | T | 96.6 | Very high | 96.2 | Very high | 91 Ų | 91 | 47.6 Ų | 47.6 | 56% | 0.558 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -65.7 | -48.8 | -175.2 | -57 | 0 | 0 | 0 | 0 | 111.5 | I102 A106 I107 V108 | I102-T104 PolarHBondContact O-N 3.49Å; T104-A106 VanDerWaalsContact C-N 3.31Å; T104-A106 PolarHBondContact O-N 3Å; T104-I107 PolarHBondContact O-N 2.94Å; T104-V108 WeakPolarHBondContact O-CG2 3.38Å; T104-V108 PolarHBondContact O-N 3.46Å; T104-V108 VanDerWaalsContact O-N 3.08Å |
| 105 | P | 97.2 | Very high | 96.2 | Very high | 54 Ų | 54 | 51.9 Ų | 51.9 | 35% | 0.351 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -55.1 | -42.7 | 173 | -27.6 | 35.6 | 0 | 0 | 0 | 113.7 | F86 W101 I102 I107 V108 Y109 | F86-P105 HydrophobicContact CD2-CB 4.27Å; F86-P105 HydrophobicContact CE2-CB 3.47Å; F86-P105 VanDerWaalsContact CE2-CB 3.47Å; F86-P105 HydrophobicContact CZ-CB 3.94Å; W101-P105 WeakPolarHBondContact O-CD 3.39Å; I102-P105 WeakPolarHBondContact O-CD 3.11Å; P105-I107 PolarHBondContact O-N 2.99Å; P105-V108 PolarHBondContact O-N 3.01Å; P105-Y109 WeakPolarHBondContact O-CB 3.39Å; P105-Y109 PolarHBondContact O-N 3.33Å |
| 106 | A | 97.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -66.6 | -35.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | F86 F94 I102 R103 T104 S110 L160 M164 | F86-A106 HydrophobicContact CZ-CB 4.47Å; F94-A106 HydrophobicContact CZ-CB 4.41Å; I102-A106 HydrophobicContact CG1-CB 4.39Å; I102-A106 WeakPolarHBondContact O-CB 3.37Å; I102-A106 PolarHBondContact O-N 3.01Å; R103-A106 PolarHBondContact O-N 3.04Å; T104-A106 VanDerWaalsContact C-N 3.31Å; T104-A106 PolarHBondContact O-N 3Å; A106-S110 VanDerWaalsContact O-CB 3.26Å; A106-S110 WeakPolarHBondContact O-CB 3.44Å; A106-S110 PolarHBondContact O-N 3.39Å; A106-S110 PolarHBondContact O-OG 2.72Å; A106-L160 HydrophobicContact CB-CD1 4.18Å; A106-L160 HydrophobicContact CB-CD2 4.19Å; A106-L160 HydrophobicContact CB-CG 4.29Å; A106-M164 HydrophobicContact CB-CG 3.76Å; A106-M164 HydrophobicContact CB-SD 4.1Å |
| 107 | I | 98.3 | Very high | 96.2 | Very high | 33 Ų | 33 | 42.5 Ų | 42.5 | 17% | 0.169 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.8 | -47.1 | 173.2 | -71.6 | 166.6 | 0 | 0 | 0 | 110.6 | R103 T104 P105 S110 T111 L161 M164 L165 | R103-I107 HydrophobicContact CG-CD1 3.87Å; R103-I107 VanDerWaalsContact O-CG1 3.31Å; R103-I107 WeakPolarHBondContact O-CG1 3.36Å; R103-I107 PolarHBondContact O-N 3.48Å; T104-I107 PolarHBondContact O-N 2.94Å; P105-I107 PolarHBondContact O-N 2.99Å; I107-S110 WeakPolarHBondContact CA-OG 3.01Å; I107-S110 PolarHBondContact O-N 2.97Å; I107-S110 PolarHBondContact O-OG 3.07Å; I107-S110 VanDerWaalsContact O-OG 3.13Å; I107-T111 VanDerWaalsContact O-CB 3.26Å; I107-T111 WeakPolarHBondContact O-CB 3.44Å; I107-T111 PolarHBondContact O-N 3.09Å; I107-T111 PolarHBondContact O-OG1 3.37Å; I107-L161 HydrophobicContact CB-CD1 4.29Å; I107-L161 HydrophobicContact CG1-CD1 4.18Å; I107-L161 HydrophobicContact CG2-CD1 3.9Å; I107-M164 HydrophobicContact CD1-CB 4.08Å; I107-M164 HydrophobicContact CG1-CB 3.61Å; I107-M164 HydrophobicContact CG1-CG 4.34Å; I107-L165 HydrophobicContact CD1-CD2 3.81Å; I107-L165 HydrophobicContact CG1-CD2 4.37Å |
| 108 | V | 98.3 | Very high | 96.4 | Very high | 98 Ų | 98 | 46.7 Ų | 46.7 | 59% | 0.594 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -60.5 | -50.9 | 178.5 | 174.1 | 0 | 0 | 0 | 0 | 110.2 | T104 P105 H112 | T104-V108 WeakPolarHBondContact O-CG2 3.38Å; T104-V108 PolarHBondContact O-N 3.46Å; T104-V108 VanDerWaalsContact O-N 3.08Å; P105-V108 PolarHBondContact O-N 3.01Å; V108-H112 WeakPolarHBondContact O-CB 3.45Å; V108-H112 PolarHBondContact O-N 2.96Å |
| 109 | Y | 98.3 | Very high | 97 | Very high | 12 Ų | 12 | 47.2 Ų | 47.2 | 5% | 0.047 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -55.4 | -55.4 | 176.9 | 171.1 | -95.7 | 0 | 0 | 0 | 112 | Y23 F24 Q83 F86 F87 P105 T111 H112 V113 L160 | Y23-Y109 HydrophobicContact CE1-CE1 4.08Å; Y23-Y109 WeakPolarHBondContact CE1-OH 3.25Å; Y23-Y109 PolarHBondContact OH-OH 3.46Å; F24-Y109 AromaticContact CE1-CD1 3.81Å; F24-Y109 HydrophobicContact CE1-CD1 3.81Å; F24-Y109 HydrophobicContact CE1-CD2 4.48Å; F24-Y109 AromaticContact CE1-CE1 3.38Å; F24-Y109 HydrophobicContact CE1-CE1 3.38Å; F24-Y109 HydrophobicContact CE1-CE2 4.12Å; F24-Y109 HydrophobicContact CE1-CG 4.34Å; F24-Y109 AromaticContact CE1-CZ 3.55Å; F24-Y109 AromaticContact CZ-CD1 3.64Å; F24-Y109 HydrophobicContact CZ-CD1 3.64Å; F24-Y109 AromaticContact CZ-CE1 3.46Å; F24-Y109 HydrophobicContact CZ-CE1 3.46Å; F24-Y109 VanDerWaalsContact CZ-CE1 3.46Å; F24-Y109 HydrophobicContact CZ-CG 4.44Å; Q83-Y109 HydrophobicContact CB-CD2 4.36Å; Q83-Y109 HydrophobicContact CB-CE2 3.95Å; Q83-Y109 HydrophobicContact CG-CD2 4.06Å; Q83-Y109 HydrophobicContact CG-CE2 3.84Å; F86-Y109 AromaticContact CD1-CD2 3.68Å; F86-Y109 HydrophobicContact CD1-CD2 3.68Å; F86-Y109 HydrophobicContact CD1-CE2 4.42Å; F86-Y109 AromaticContact CD1-CG 3.76Å; F86-Y109 HydrophobicContact CD1-CG 3.76Å; F86-Y109 VanDerWaalsContact CE1-CB 3.5Å; F86-Y109 HydrophobicContact CE1-CD1 4.1Å; F86-Y109 HydrophobicContact CE1-CD2 4Å; F86-Y109 AromaticContact CE1-CG 3.57Å; F86-Y109 HydrophobicContact CE1-CG 3.57Å; F87-Y109 HydrophobicContact CD1-CE2 4.32Å; F87-Y109 AromaticContact CE1-CE2 3.57Å; F87-Y109 HydrophobicContact CE1-CE2 3.57Å; F87-Y109 AromaticContact CE1-CZ 3.85Å; F87-Y109 WeakPolarHBondContact CE1-OH 3.14Å; F87-Y109 HydrophobicContact CZ-CE2 4.5Å; P105-Y109 WeakPolarHBondContact O-CB 3.39Å; P105-Y109 PolarHBondContact O-N 3.33Å; Y109-T111 VanDerWaalsContact C-N 3.33Å; Y109-T111 PolarHBondContact O-N 3.24Å; Y109-H112 PolarHBondContact O-N 3.42Å; Y109-V113 HydrophobicContact CD1-CG2 4.46Å; Y109-V113 HydrophobicContact CD2-CG2 4.11Å; Y109-V113 HydrophobicContact CE1-CG2 3.98Å; Y109-V113 HydrophobicContact CE2-CG2 3.57Å; Y109-V113 WeakPolarHBondContact O-CG2 3.49Å; Y109-V113 PolarHBondContact O-N 2.62Å; Y109-L160 HydrophobicContact CD1-CD2 4.08Å; Y109-L160 HydrophobicContact CE1-CD2 4.48Å |
| 110 | S | 98.2 | Very high | 97.2 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.7 | -37.6 | -173.8 | 49.2 | 0 | 0 | 0 | 0 | 113 | A106 I107 A114 P157 L161 | A106-S110 VanDerWaalsContact O-CB 3.26Å; A106-S110 WeakPolarHBondContact O-CB 3.44Å; A106-S110 PolarHBondContact O-N 3.39Å; A106-S110 PolarHBondContact O-OG 2.72Å; I107-S110 WeakPolarHBondContact CA-OG 3.01Å; I107-S110 PolarHBondContact O-N 2.97Å; I107-S110 PolarHBondContact O-OG 3.07Å; I107-S110 VanDerWaalsContact O-OG 3.13Å; S110-A114 VanDerWaalsContact O-CB 3.25Å; S110-A114 WeakPolarHBondContact O-CB 3.28Å; S110-A114 PolarHBondContact O-N 2.97Å; S110-P157 WeakPolarHBondContact CB-O 3.13Å; S110-L161 WeakPolarHBondContact OG-CB 3.35Å |
| 111 | T | 98.3 | Very high | 97.5 | Very high | 61 Ų | 61 | 43.5 Ų | 43.5 | 37% | 0.374 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -67.6 | -42.8 | 176.6 | -60.1 | 0 | 0 | 0 | 0 | 110.8 | I107 Y109 T115 | I107-T111 VanDerWaalsContact O-CB 3.26Å; I107-T111 WeakPolarHBondContact O-CB 3.44Å; I107-T111 PolarHBondContact O-N 3.09Å; I107-T111 PolarHBondContact O-OG1 3.37Å; Y109-T111 VanDerWaalsContact C-N 3.33Å; Y109-T111 PolarHBondContact O-N 3.24Å; T111-T115 WeakPolarHBondContact O-CB 3.22Å; T111-T115 PolarHBondContact O-N 3.25Å; T111-T115 PolarHBondContact O-OG1 3Å |
| 112 | H | 97.9 | Very high | 97.6 | Very high | 55 Ų | 55 | 39 Ų | 39 | 26% | 0.255 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.4 | -51.7 | 176.3 | 176 | 61.9 | 0 | 0 | 0 | 111.7 | Q83 V108 Y109 A114 T115 T116 | Q83-H112 PolarHBondContact NE2-CD2 3.08Å; Q83-H112 VanDerWaalsContact NE2-CD2 3.26Å; Q83-H112 PolarHBondContact NE2-NE2 3.06Å; V108-H112 WeakPolarHBondContact O-CB 3.45Å; V108-H112 PolarHBondContact O-N 2.96Å; Y109-H112 PolarHBondContact O-N 3.42Å; H112-A114 PolarHBondContact O-N 3Å; H112-T115 WeakPolarHBondContact O-CB 3.32Å; H112-T115 PolarHBondContact O-N 3.08Å; H112-T115 VanDerWaalsContact O-N 3.08Å; H112-T116 PolarHBondContact O-N 3.43Å; H112-T116 PolarHBondContact O-OG1 3.26Å |
| 113 | V | 97.7 | Very high | 97.7 | Very high | 5 Ų | 5 | 40.5 Ų | 40.5 | 3% | 0.03 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | 178.4 | 177.3 | 0 | 0 | 0 | 0 | 111.3 | Y109 T115 T116 L117 P157 | Y109-V113 HydrophobicContact CD1-CG2 4.46Å; Y109-V113 HydrophobicContact CD2-CG2 4.11Å; Y109-V113 HydrophobicContact CE1-CG2 3.98Å; Y109-V113 HydrophobicContact CE2-CG2 3.57Å; Y109-V113 WeakPolarHBondContact O-CG2 3.49Å; Y109-V113 PolarHBondContact O-N 2.62Å; V113-T115 PolarHBondContact O-N 3.47Å; V113-T116 PolarHBondContact O-N 2.95Å; V113-T116 PolarHBondContact O-OG1 2.82Å; V113-T116 VanDerWaalsContact O-OG1 3.06Å; V113-L117 HydrophobicContact CG1-CD2 3.82Å; V113-L117 WeakPolarHBondContact O-CB 3.44Å; V113-L117 WeakPolarHBondContact O-CD2 3.31Å; V113-L117 PolarHBondContact O-N 3.24Å; V113-P157 HydrophobicContact CB-CB 4.26Å; V113-P157 HydrophobicContact CB-CG 4.18Å; V113-P157 HydrophobicContact CG1-CB 4.23Å; V113-P157 HydrophobicContact CG1-CG 3.72Å |
| 114 | A | 97.8 | Very high | 97.7 | Very high | 17 Ų | 17 | 38 Ų | 38 | 14% | 0.14 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.2 | -39.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | S110 H112 I118 L154 V158 | S110-A114 VanDerWaalsContact O-CB 3.25Å; S110-A114 WeakPolarHBondContact O-CB 3.28Å; S110-A114 PolarHBondContact O-N 2.97Å; H112-A114 PolarHBondContact O-N 3Å; A114-I118 WeakPolarHBondContact O-CG1 3.49Å; A114-I118 PolarHBondContact O-N 3.28Å; A114-L154 HydrophobicContact CB-CD1 3.86Å; A114-V158 HydrophobicContact CB-CG2 4.28Å |
| 115 | T | 97.6 | Very high | 97.8 | Very high | 90 Ų | 90 | 36 Ų | 36 | 55% | 0.552 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -67.3 | -41.9 | 178.9 | -56.4 | 0 | 0 | 0 | 0 | 112.4 | T111 H112 V113 P119 | T111-T115 WeakPolarHBondContact O-CB 3.22Å; T111-T115 PolarHBondContact O-N 3.25Å; T111-T115 PolarHBondContact O-OG1 3Å; H112-T115 WeakPolarHBondContact O-CB 3.32Å; H112-T115 PolarHBondContact O-N 3.08Å; H112-T115 VanDerWaalsContact O-N 3.08Å; V113-T115 PolarHBondContact O-N 3.47Å; T115-P119 WeakPolarHBondContact O-CD 3.31Å |
| 116 | T | 96.9 | Very high | 97.8 | Very high | 12 Ų | 12 | 41.3 Ų | 41.3 | 7% | 0.074 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -74.1 | -26.6 | -180 | 58.4 | 0 | 0 | 0 | 0 | 112.7 | F75 H112 V113 P119 I120 | F75-T116 HydrophobicContact CD1-CG2 3.62Å; F75-T116 HydrophobicContact CE1-CG2 3.79Å; F75-T116 HydrophobicContact CG-CG2 4.03Å; F75-T116 HydrophobicContact CZ-CG2 4.32Å; H112-T116 PolarHBondContact O-N 3.43Å; H112-T116 PolarHBondContact O-OG1 3.26Å; V113-T116 PolarHBondContact O-N 2.95Å; V113-T116 PolarHBondContact O-OG1 2.82Å; V113-T116 VanDerWaalsContact O-OG1 3.06Å; T116-P119 VanDerWaalsContact O-CD 3.23Å; T116-P119 WeakPolarHBondContact O-CD 3.34Å; T116-P119 VanDerWaalsContact O-CG 3.25Å; T116-P119 WeakPolarHBondContact O-CG 3.46Å; T116-I120 WeakPolarHBondContact O-CD1 3.39Å; T116-I120 WeakPolarHBondContact O-CG1 3.45Å |
| 117 | L | 97.1 | Very high | 97.7 | Very high | 13 Ų | 13 | 45.1 Ų | 45.1 | 7% | 0.068 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -71.7 | -28 | 176.5 | -94.6 | -69.5 | 0 | 0 | 0 | 113.3 | V113 I120 L121 Y150 L154 | V113-L117 HydrophobicContact CG1-CD2 3.82Å; V113-L117 WeakPolarHBondContact O-CB 3.44Å; V113-L117 WeakPolarHBondContact O-CD2 3.31Å; V113-L117 PolarHBondContact O-N 3.24Å; L117-I120 HydrophobicContact CD1-CD1 4.44Å; L117-I120 HydrophobicContact CD2-CD1 4.32Å; L117-I120 PolarHBondContact O-N 3.47Å; L117-L121 WeakPolarHBondContact O-CB 3.21Å; L117-L121 VanDerWaalsContact O-CG 3.28Å; L117-L121 WeakPolarHBondContact O-CG 3.32Å; L117-L121 PolarHBondContact O-N 2.89Å; L117-Y150 HydrophobicContact CD1-CD1 3.85Å; L117-L154 HydrophobicContact CB-CB 4.3Å; L117-L154 HydrophobicContact CB-CD1 4.13Å; L117-L154 HydrophobicContact CG-CB 4.31Å |
| 118 | I | 97.2 | Very high | 97.6 | Very high | 103 Ų | 103 | 51.8 Ų | 51.8 | 53% | 0.528 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -57.9 | -54.9 | 177.1 | -59.3 | -51.6 | 0 | 0 | 0 | 112.7 | A114 I120 L121 A122 | A114-I118 WeakPolarHBondContact O-CG1 3.49Å; A114-I118 PolarHBondContact O-N 3.28Å; I118-I120 VanDerWaalsContact C-N 3.3Å; I118-I120 PolarHBondContact O-N 2.94Å; I118-L121 PolarHBondContact O-N 3.49Å; I118-A122 WeakPolarHBondContact O-CB 3.43Å; I118-A122 PolarHBondContact O-N 3.02Å |
| 119 | P | 97.6 | Very high | 97.4 | Very high | 50 Ų | 50 | 47.8 Ų | 47.8 | 33% | 0.325 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.8 | -32.4 | 177.8 | 24.6 | -33.6 | 0 | 0 | 0 | 112.7 | F75 T115 T116 A122 H123 | F75-P119 HydrophobicContact CE2-CG 3.72Å; F75-P119 HydrophobicContact CZ-CG 3.78Å; T115-P119 WeakPolarHBondContact O-CD 3.31Å; T116-P119 VanDerWaalsContact O-CD 3.23Å; T116-P119 WeakPolarHBondContact O-CD 3.34Å; T116-P119 VanDerWaalsContact O-CG 3.25Å; T116-P119 WeakPolarHBondContact O-CG 3.46Å; P119-A122 PolarHBondContact O-N 3.45Å; P119-H123 VanDerWaalsContact O-CB 3.27Å; P119-H123 WeakPolarHBondContact O-CB 3.08Å; P119-H123 PolarHBondContact O-N 3.23Å |
| 120 | I | 97.8 | Very high | 97.1 | Very high | 9 Ų | 9 | 50.6 Ų | 50.6 | 5% | 0.046 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.6 | -51.9 | 174.9 | -66.1 | 167.5 | 0 | 0 | 0 | 110.5 | M64 W71 F72 F75 T116 L117 I118 A122 H123 I124 Y150 | M64-I120 HydrophobicContact CE-CG2 4.17Å; W71-I120 HydrophobicContact CH2-CG1 4.25Å; W71-I120 HydrophobicContact CZ3-CG1 3.84Å; F72-I120 HydrophobicContact CD2-CD1 4.14Å; F72-I120 HydrophobicContact CD2-CG1 3.97Å; F72-I120 HydrophobicContact CE2-CD1 3.79Å; F72-I120 HydrophobicContact CE2-CG1 3.95Å; F72-I120 HydrophobicContact CE2-CG2 4.45Å; F75-I120 HydrophobicContact CD2-CD1 4.22Å; F75-I120 HydrophobicContact CD2-CG1 4.29Å; F75-I120 HydrophobicContact CE2-CG1 4.44Å; T116-I120 WeakPolarHBondContact O-CD1 3.39Å; T116-I120 WeakPolarHBondContact O-CG1 3.45Å; L117-I120 HydrophobicContact CD1-CD1 4.44Å; L117-I120 HydrophobicContact CD2-CD1 4.32Å; L117-I120 PolarHBondContact O-N 3.47Å; I118-I120 VanDerWaalsContact C-N 3.3Å; I118-I120 PolarHBondContact O-N 2.94Å; I120-A122 VanDerWaalsContact C-N 3.33Å; I120-A122 PolarHBondContact O-N 3.39Å; I120-H123 WeakPolarHBondContact O-CB 3.23Å; I120-H123 PolarHBondContact O-N 2.89Å; I120-H123 VanDerWaalsContact O-N 3.15Å; I120-I124 HydrophobicContact CG2-CD1 3.85Å; I120-I124 WeakPolarHBondContact O-CG1 3.44Å; I120-I124 PolarHBondContact O-N 2.83Å; I120-Y150 HydrophobicContact CG2-CD1 3.72Å; I120-Y150 HydrophobicContact CG2-CE1 3.64Å; I120-Y150 HydrophobicContact CG2-CG 4.27Å |
| 121 | L | 98.1 | Very high | 96.7 | Very high | 23 Ų | 23 | 55.1 Ų | 55.1 | 12% | 0.12 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 179.1 | -68.3 | 173.7 | 0 | 0 | 0 | 111.7 | L117 I118 H123 I124 L125 V147 L154 | L117-L121 WeakPolarHBondContact O-CB 3.21Å; L117-L121 VanDerWaalsContact O-CG 3.28Å; L117-L121 WeakPolarHBondContact O-CG 3.32Å; L117-L121 PolarHBondContact O-N 2.89Å; I118-L121 PolarHBondContact O-N 3.49Å; L121-H123 VanDerWaalsContact C-N 3.33Å; L121-H123 PolarHBondContact O-N 2.98Å; L121-I124 PolarHBondContact O-N 2.76Å; L121-L125 WeakPolarHBondContact O-CB 3.4Å; L121-L125 WeakPolarHBondContact O-CG 3.49Å; L121-L125 PolarHBondContact O-N 2.87Å; L121-V147 HydrophobicContact CD2-CB 4.46Å; L121-V147 HydrophobicContact CD2-CG1 4.12Å; L121-V147 HydrophobicContact CD2-CG2 4.19Å; L121-L154 HydrophobicContact CD1-CD2 3.72Å |
| 122 | A | 97.9 | Very high | 96.3 | Very high | 41 Ų | 41 | 60.5 Ų | 60.5 | 34% | 0.339 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | I118 P119 I120 L125 F126 | I118-A122 WeakPolarHBondContact O-CB 3.43Å; I118-A122 PolarHBondContact O-N 3.02Å; P119-A122 PolarHBondContact O-N 3.45Å; I120-A122 VanDerWaalsContact C-N 3.33Å; I120-A122 PolarHBondContact O-N 3.39Å; A122-L125 PolarHBondContact O-N 3.06Å; A122-F126 HydrophobicContact CB-CD2 4.25Å; A122-F126 WeakPolarHBondContact O-CB 3.37Å; A122-F126 WeakPolarHBondContact O-CD2 3.47Å; A122-F126 PolarHBondContact O-N 3.43Å |
| 123 | H | 97.8 | Very high | 95.9 | Very high | 31 Ų | 31 | 62.8 Ų | 62.8 | 14% | 0.144 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -62 | -48.1 | 175.6 | -167.1 | 85.6 | 0 | 0 | 0 | 110.8 | M64 W71 P119 I120 L121 L125 F126 H127 F129 | M64-H123 VanDerWaalsContact SD-CD2 3.54Å; W71-H123 HydrophobicContact CH2-CB 3.98Å; W71-H123 HydrophobicContact CZ2-CB 3.93Å; W71-H123 AromaticContact CZ2-CD2 3.79Å; W71-H123 AromaticContact CZ2-CE1 3.84Å; W71-H123 AromaticContact CZ2-CG 3.5Å; W71-H123 AromaticContact CZ2-ND1 3.53Å; W71-H123 AromaticContact CZ2-NE2 4Å; P119-H123 VanDerWaalsContact O-CB 3.27Å; P119-H123 WeakPolarHBondContact O-CB 3.08Å; P119-H123 PolarHBondContact O-N 3.23Å; I120-H123 WeakPolarHBondContact O-CB 3.23Å; I120-H123 PolarHBondContact O-N 2.89Å; I120-H123 VanDerWaalsContact O-N 3.15Å; L121-H123 VanDerWaalsContact C-N 3.33Å; L121-H123 PolarHBondContact O-N 2.98Å; H123-L125 VanDerWaalsContact C-N 3.29Å; H123-L125 PolarHBondContact O-N 2.93Å; H123-F126 PolarHBondContact O-N 3.19Å; H123-H127 AromaticContact CE1-CD2 3.27Å; H123-H127 PolarHBondContact CE1-CD2 3.35Å; H123-H127 AromaticContact CE1-CE1 3.81Å; H123-H127 AromaticContact CE1-CG 3.2Å; H123-H127 AromaticContact CE1-ND1 3.56Å; H123-H127 AromaticContact CE1-NE2 3.66Å; H123-H127 AromaticContact ND1-CG 3.66Å; H123-H127 AromaticContact NE2-CD2 3.25Å; H123-H127 PolarHBondContact NE2-CD2 3.05Å; H123-H127 AromaticContact NE2-CG 3.55Å; H123-H127 AromaticContact NE2-NE2 3.9Å; H123-H127 WeakPolarHBondContact O-CA 3.28Å; H123-H127 WeakPolarHBondContact O-CB 3.46Å; H123-H127 PolarHBondContact O-N 2.89Å; H123-F129 AromaticContact CD2-CE1 3.73Å; H123-F129 AromaticContact CD2-CZ 3.5Å; H123-F129 VanDerWaalsContact CD2-CZ 3.5Å; H123-F129 WeakPolarHBondContact CD2-CZ 3.25Å; H123-F129 AromaticContact NE2-CE1 3.64Å; H123-F129 AromaticContact NE2-CZ 3.85Å |
| 124 | I | 97.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -58.8 | -39.1 | 176.9 | -65.3 | 161.6 | 0 | 0 | 0 | 111.9 | M64 I120 L121 R143 L146 V147 Y150 | M64-I124 HydrophobicContact CE-CD1 4.09Å; M64-I124 HydrophobicContact CE-CG1 3.84Å; I120-I124 HydrophobicContact CG2-CD1 3.85Å; I120-I124 WeakPolarHBondContact O-CG1 3.44Å; I120-I124 PolarHBondContact O-N 2.83Å; L121-I124 PolarHBondContact O-N 2.76Å; I124-R143 WeakPolarHBondContact O-CG 3.1Å; I124-R143 PolarHBondContact O-NH1 3.28Å; I124-L146 HydrophobicContact CD1-CD2 4.27Å; I124-L146 HydrophobicContact CD1-CG 4.06Å; I124-L146 HydrophobicContact CG1-CD2 3.98Å; I124-L146 HydrophobicContact CG1-CG 4.28Å; I124-L146 HydrophobicContact CG2-CB 4.05Å; I124-L146 HydrophobicContact CG2-CD2 3.93Å; I124-L146 HydrophobicContact CG2-CG 4.03Å; I124-V147 HydrophobicContact CB-CG2 4.35Å; I124-V147 HydrophobicContact CG2-CG2 3.73Å; I124-Y150 HydrophobicContact CD1-CD2 3.5Å; I124-Y150 HydrophobicContact CD1-CE2 3.74Å; I124-Y150 HydrophobicContact CD1-CG 4.03Å |
| 125 | L | 97.8 | Very high | 95.3 | Very high | 48 Ų | 48 | 67.3 Ų | 67.3 | 25% | 0.251 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -81.3 | -35.7 | -175.6 | -72.7 | 171.7 | 0 | 0 | 0 | 113.7 | L121 A122 H123 R143 W144 V147 | L121-L125 WeakPolarHBondContact O-CB 3.4Å; L121-L125 WeakPolarHBondContact O-CG 3.49Å; L121-L125 PolarHBondContact O-N 2.87Å; A122-L125 PolarHBondContact O-N 3.06Å; H123-L125 VanDerWaalsContact C-N 3.29Å; H123-L125 PolarHBondContact O-N 2.93Å; L125-R143 PolarHBondContact O-NH1 3.36Å; L125-W144 HydrophobicContact CD2-CE3 4.49Å; L125-W144 HydrophobicContact CD2-CH2 4.23Å; L125-W144 HydrophobicContact CD2-CZ2 4.25Å; L125-W144 HydrophobicContact CD2-CZ3 4.35Å; L125-V147 HydrophobicContact CD2-CG2 3.88Å; L125-V147 HydrophobicContact CG-CG2 4Å |
| 126 | F | 97.1 | Very high | 95.1 | Very high | 166 Ų | 166 | 63.1 Ų | 63.1 | 73% | 0.728 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -119.5 | -18.7 | -166.7 | -55.1 | -64.5 | 0 | 0 | 0 | 114.4 | A122 H123 | A122-F126 HydrophobicContact CB-CD2 4.25Å; A122-F126 WeakPolarHBondContact O-CB 3.37Å; A122-F126 WeakPolarHBondContact O-CD2 3.47Å; A122-F126 PolarHBondContact O-N 3.43Å; H123-F126 PolarHBondContact O-N 3.19Å |
| 127 | H | 96.6 | Very high | 95.1 | Very high | 80 Ų | 80 | 62.5 Ų | 62.5 | 37% | 0.37 | 33% | 0.329 | S | S | . | . | trans | -71.1 | 140.9 | 179 | -170.6 | 64.4 | 0 | 0 | 0 | 111.4 | H123 F129 R143 | H123-H127 AromaticContact CE1-CD2 3.27Å; H123-H127 PolarHBondContact CE1-CD2 3.35Å; H123-H127 AromaticContact CE1-CE1 3.81Å; H123-H127 AromaticContact CE1-CG 3.2Å; H123-H127 AromaticContact CE1-ND1 3.56Å; H123-H127 AromaticContact CE1-NE2 3.66Å; H123-H127 AromaticContact ND1-CG 3.66Å; H123-H127 AromaticContact NE2-CD2 3.25Å; H123-H127 PolarHBondContact NE2-CD2 3.05Å; H123-H127 AromaticContact NE2-CG 3.55Å; H123-H127 AromaticContact NE2-NE2 3.9Å; H123-H127 WeakPolarHBondContact O-CA 3.28Å; H123-H127 WeakPolarHBondContact O-CB 3.46Å; H123-H127 PolarHBondContact O-N 2.89Å; H127-F129 HydrophobicContact CB-CD2 4.5Å; H127-F129 HydrophobicContact CB-CE2 4.11Å; H127-F129 HydrophobicContact CB-CZ 4.32Å; H127-F129 AromaticContact CD2-CD1 3.92Å; H127-F129 WeakPolarHBondContact O-CD2 3.41Å; H127-F129 PolarHBondContact O-N 3.01Å; H127-R143 PolarHBondContact O-NH1 2.91Å; H127-R143 PolarHBondContact O-NH2 3.16Å | ||
| 128 | Q | 95.4 | Very high | 95.1 | Very high | 174 Ų | 174 | 66.3 Ų | 66.3 | 81% | 0.813 | 35% | 0.346 | S | S | * | . | trans | -87.6 | 94.3 | 173.8 | -69.1 | -173.9 | -21.1 | 0 | 0 | 109.1 | ||||
| 129 | F | 94.5 | Very high | 95.1 | Very high | 13 Ų | 13 | 64.7 Ų | 64.7 | 6% | 0.057 | 34% | 0.341 | C | S | . | . | trans | -71.1 | 139.6 | -178.5 | -69.4 | -87.1 | 0 | 0 | 0 | 111.9 | P63 M64 H123 H127 P137 Q138 | P63-F129 HydrophobicContact CG-CD1 3.51Å; P63-F129 HydrophobicContact CG-CE1 3.8Å; P63-F129 HydrophobicContact CG-CG 4.48Å; M64-F129 HydrophobicContact CG-CE1 4.35Å; H123-F129 AromaticContact CD2-CE1 3.73Å; H123-F129 AromaticContact CD2-CZ 3.5Å; H123-F129 VanDerWaalsContact CD2-CZ 3.5Å; H123-F129 WeakPolarHBondContact CD2-CZ 3.25Å; H123-F129 AromaticContact NE2-CE1 3.64Å; H123-F129 AromaticContact NE2-CZ 3.85Å; H127-F129 HydrophobicContact CB-CD2 4.5Å; H127-F129 HydrophobicContact CB-CE2 4.11Å; H127-F129 HydrophobicContact CB-CZ 4.32Å; H127-F129 AromaticContact CD2-CD1 3.92Å; H127-F129 WeakPolarHBondContact O-CD2 3.41Å; H127-F129 PolarHBondContact O-N 3.01Å; F129-P137 VanDerWaalsContact CD2-CD 3.44Å; F129-P137 HydrophobicContact CD2-CG 3.78Å; F129-P137 HydrophobicContact CE2-CG 3.72Å; F129-P137 HydrophobicContact CZ-CG 4.46Å; F129-Q138 PolarHBondContact O-NE2 3.5Å | ||
| 130 | P | 91.1 | Very high | 95 | Very high | 72 Ų | 72 | 68.1 Ų | 68.1 | 47% | 0.468 | 36% | 0.357 | S | S | . | . | trans | -65.8 | 156.5 | 174.3 | 30.7 | -35.6 | 0 | 0 | 0 | 110.9 | P135 G136 | P130-P135 WeakPolarHBondContact O-CA 3.3Å; P130-G136 PolarHBondContact O-N 2.91Å | ||
| 131 | V | 89.9 | Confident | 95 | Very high | 95 Ų | 95 | 76.9 Ų | 76.9 | 58% | 0.576 | 39% | 0.389 | S | S | * | . | S | Bend | trans | -86.9 | -20.1 | 177.2 | -176.3 | 0 | 0 | 0 | 0 | 111.7 | P135 | V131-P135 WeakPolarHBondContact O-CB 3.49Š|
| 132 | K | 90.1 | Very high | 95 | Very high | 174 Ų | 174 | 78 Ų | 78 | 76% | 0.757 | 39% | 0.394 | S | S | * | . | S | Bend | trans | -143.7 | 152.5 | 179.8 | -67.6 | -174.5 | 179.7 | -178.8 | 0 | 109.9 | ||
| 133 | P | 89.6 | Confident | 95 | Very high | 102 Ų | 102 | 77.4 Ų | 77.4 | 66% | 0.662 | 38% | 0.383 | S | S | * | . | S | Bend | cis | -74.6 | -27.3 | -4 | 30 | -34 | 0 | 0 | 0 | 113.3 | ||
| 134 | H | 90.9 | Very high | 95 | Very high | 69 Ų | 69 | 83.2 Ų | 83.2 | 32% | 0.319 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -112.3 | 107.6 | 178.2 | -58.7 | -60.3 | 0 | 0 | 0 | 109.9 | P63 L66 G136 | P63-H134 HydrophobicContact CB-CB 3.92Å; L66-H134 WeakPolarHBondContact CD1-ND1 3.41Å; H134-G136 PolarHBondContact O-N 3.33Å |
| 135 | P | 91.6 | Very high | 95 | Very high | 49 Ų | 49 | 86 Ų | 86 | 32% | 0.318 | 42% | 0.418 | S | S | . | . | trans | -70.5 | 123.9 | -178.4 | 26.2 | -31.9 | 0 | 0 | 0 | 111.3 | P130 V131 | P130-P135 WeakPolarHBondContact O-CA 3.3Å; V131-P135 WeakPolarHBondContact O-CB 3.49Å | ||
| 136 | G | 94.7 | Very high | 95 | Very high | 1 Ų | 1 | 83.8 Ų | 83.8 | 1% | 0.01 | 41% | 0.406 | C | S | . | . | trans | -85 | -178 | 166.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | P130 H134 Q138 | P130-G136 PolarHBondContact O-N 2.91Å; H134-G136 PolarHBondContact O-N 3.33Å; G136-Q138 WeakPolarHBondContact O-CG 3.46Å; G136-Q138 PolarHBondContact O-N 2.85Å; G136-Q138 PolarHBondContact O-NE2 3.13Å | ||
| 137 | P | 96.7 | Very high | 95 | Very high | 0 Ų | 0 | 76.3 Ų | 76.3 | 0% | 0 | 38% | 0.375 | C | S | . | . | trans | -68 | 120.8 | -174 | 31.8 | -36 | 0 | 0 | 0 | 110.1 | K61 F129 E142 R143 L146 | K61-P137 HydrophobicContact CB-CB 4.2Å; K61-P137 WeakPolarHBondContact O-CD 3.32Å; F129-P137 VanDerWaalsContact CD2-CD 3.44Å; F129-P137 HydrophobicContact CD2-CG 3.78Å; F129-P137 HydrophobicContact CE2-CG 3.72Å; F129-P137 HydrophobicContact CZ-CG 4.46Å; P137-E142 HydrophobicContact CB-CB 3.62Å; P137-R143 HydrophobicContact CB-CB 4.46Å; P137-R143 HydrophobicContact CB-CG 3.72Å; P137-R143 HydrophobicContact CG-CG 3.84Å; P137-R143 PolarHBondContact O-NH2 3.33Å; P137-L146 HydrophobicContact CG-CD2 4.26Å | ||
| 138 | Q | 96.4 | Very high | 95.1 | Very high | 92 Ų | 92 | 75.7 Ų | 75.7 | 43% | 0.43 | 38% | 0.379 | S | S | . | . | trans | -97.3 | -34 | -176.3 | -59.6 | -57.2 | -52.5 | 0 | 0 | 111.4 | F129 G136 E142 | F129-Q138 PolarHBondContact O-NE2 3.5Å; G136-Q138 WeakPolarHBondContact O-CG 3.46Å; G136-Q138 PolarHBondContact O-N 2.85Å; G136-Q138 PolarHBondContact O-NE2 3.13Å; Q138-E142 PolarHBondContact N-OE2 3.24Å | ||
| 139 | T | 96.8 | Very high | 95.1 | Very high | 69 Ų | 69 | 69.1 Ų | 69.1 | 42% | 0.423 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -99.1 | 156.9 | -179.1 | 66.9 | 0 | 0 | 0 | 0 | 111.9 | W141 E142 R143 | T139-W141 PolarHBondContact O-N 3.34Å; T139-E142 PolarHBondContact N-OE2 2.94Å; T139-E142 PolarHBondContact O-N 3.39Å; T139-E142 VanDerWaalsContact OG1-CG 3.25Å; T139-E142 WeakPolarHBondContact OG1-CG 3.42Å; T139-E142 PolarHBondContact OG1-N 3Å; T139-E142 VanDerWaalsContact OG1-N 3.15Å; T139-E142 PolarHBondContact OG1-OE2 3.42Å; T139-R143 WeakPolarHBondContact O-CG 3.18Å; T139-R143 PolarHBondContact O-N 3.4Å |
| 140 | N | 96.9 | Very high | 95.3 | Very high | 123 Ų | 123 | 69.7 Ų | 69.7 | 66% | 0.658 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -58.3 | -35.2 | 173 | -72.1 | -21.4 | 0 | 0 | 0 | 111.9 | R143 W144 | N140-R143 PolarHBondContact O-N 2.95Å; N140-W144 PolarHBondContact O-N 3.09Å |
| 141 | W | 97.4 | Very high | 95.5 | Very high | 192 Ų | 192 | 68.4 Ų | 68.4 | 73% | 0.727 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -62.7 | -50.4 | 176.9 | 175.6 | -106.1 | 0 | 0 | 0 | 111.9 | T139 R143 W144 L145 | T139-W141 PolarHBondContact O-N 3.34Å; W141-R143 VanDerWaalsContact C-N 3.28Å; W141-R143 PolarHBondContact O-N 3.46Å; W141-W144 PolarHBondContact O-N 3.02Å; W141-L145 WeakPolarHBondContact O-CB 3.5Å; W141-L145 PolarHBondContact O-N 3.24Å |
| 142 | E | 97.6 | Very high | 95.8 | Very high | 46 Ų | 46 | 67 Ų | 67 | 22% | 0.215 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -60 | -39.3 | 177 | -69.6 | 163.4 | 147.9 | 0 | 0 | 111.6 | K61 P137 Q138 T139 L145 L146 | K61-E142 HydrophobicContact CG-CB 4.43Å; K61-E142 HydrophobicContact CG-CG 4.2Å; P137-E142 HydrophobicContact CB-CB 3.62Å; Q138-E142 PolarHBondContact N-OE2 3.24Å; T139-E142 PolarHBondContact N-OE2 2.94Å; T139-E142 PolarHBondContact O-N 3.39Å; T139-E142 VanDerWaalsContact OG1-CG 3.25Å; T139-E142 WeakPolarHBondContact OG1-CG 3.42Å; T139-E142 PolarHBondContact OG1-N 3Å; T139-E142 VanDerWaalsContact OG1-N 3.15Å; T139-E142 PolarHBondContact OG1-OE2 3.42Å; E142-L145 PolarHBondContact O-N 3.49Å; E142-L146 WeakPolarHBondContact O-CB 3.43Å; E142-L146 PolarHBondContact O-N 3.33Å |
| 143 | R | 98.1 | Very high | 96.1 | Very high | 30 Ų | 30 | 62.2 Ų | 62.2 | 11% | 0.113 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.1 | -47.9 | 176 | -68.5 | 179 | -175.1 | -92.5 | 1.2 | 111.7 | I124 L125 H127 P137 T139 N140 W141 L145 L146 V147 | I124-R143 WeakPolarHBondContact O-CG 3.1Å; I124-R143 PolarHBondContact O-NH1 3.28Å; L125-R143 PolarHBondContact O-NH1 3.36Å; H127-R143 PolarHBondContact O-NH1 2.91Å; H127-R143 PolarHBondContact O-NH2 3.16Å; P137-R143 HydrophobicContact CB-CB 4.46Å; P137-R143 HydrophobicContact CB-CG 3.72Å; P137-R143 HydrophobicContact CG-CG 3.84Å; P137-R143 PolarHBondContact O-NH2 3.33Å; T139-R143 WeakPolarHBondContact O-CG 3.18Å; T139-R143 PolarHBondContact O-N 3.4Å; N140-R143 PolarHBondContact O-N 2.95Å; W141-R143 VanDerWaalsContact C-N 3.28Å; W141-R143 PolarHBondContact O-N 3.46Å; R143-L145 VanDerWaalsContact C-N 3.34Å; R143-L146 PolarHBondContact O-N 2.85Å; R143-V147 WeakPolarHBondContact O-CB 3.34Å; R143-V147 VanDerWaalsContact O-CG2 3.29Å; R143-V147 WeakPolarHBondContact O-CG2 3.45Å; R143-V147 PolarHBondContact O-N 2.89Å |
| 144 | W | 98 | Very high | 96.4 | Very high | 153 Ų | 153 | 58.9 Ų | 58.9 | 58% | 0.58 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -68.4 | -34.3 | 179 | -75.7 | 118.2 | 0 | 0 | 0 | 112.7 | L125 N140 W141 V147 S148 | L125-W144 HydrophobicContact CD2-CE3 4.49Å; L125-W144 HydrophobicContact CD2-CH2 4.23Å; L125-W144 HydrophobicContact CD2-CZ2 4.25Å; L125-W144 HydrophobicContact CD2-CZ3 4.35Å; N140-W144 PolarHBondContact O-N 3.09Å; W141-W144 PolarHBondContact O-N 3.02Å; W144-V147 HydrophobicContact CE3-CB 4.21Å; W144-V147 HydrophobicContact CE3-CG1 4Å; W144-V147 HydrophobicContact CZ3-CG1 4.08Å; W144-V147 PolarHBondContact O-N 3.25Å; W144-S148 WeakPolarHBondContact O-CB 3.43Å; W144-S148 PolarHBondContact O-N 2.91Å |
| 145 | L | 97.8 | Very high | 96.8 | Very high | 59 Ų | 59 | 60.8 Ų | 60.8 | 31% | 0.309 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -60.3 | -50.4 | 171.8 | -179.3 | 63.9 | 0 | 0 | 0 | 110.3 | F60 W141 E142 R143 V147 S148 I149 | F60-L145 HydrophobicContact CD1-CD2 4.36Å; F60-L145 HydrophobicContact CD1-CG 4.39Å; W141-L145 WeakPolarHBondContact O-CB 3.5Å; W141-L145 PolarHBondContact O-N 3.24Å; E142-L145 PolarHBondContact O-N 3.49Å; R143-L145 VanDerWaalsContact C-N 3.34Å; L145-V147 PolarHBondContact O-N 3.27Å; L145-S148 WeakPolarHBondContact O-CB 3.07Å; L145-S148 PolarHBondContact O-N 2.86Å; L145-S148 VanDerWaalsContact O-N 3.12Å; L145-S148 PolarHBondContact O-OG 3.42Å; L145-I149 PolarHBondContact O-N 3.37Å |
| 146 | L | 98 | Very high | 97 | Very high | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.6 | -43 | 177.9 | -174.7 | 54.4 | 0 | 0 | 0 | 112 | F60 D62 I124 P137 E142 R143 S148 I149 Y150 | F60-L146 HydrophobicContact CB-CD1 4.45Å; D62-L146 HydrophobicContact CB-CD1 3.75Å; D62-L146 HydrophobicContact CB-CD2 4.2Å; I124-L146 HydrophobicContact CD1-CD2 4.27Å; I124-L146 HydrophobicContact CD1-CG 4.06Å; I124-L146 HydrophobicContact CG1-CD2 3.98Å; I124-L146 HydrophobicContact CG1-CG 4.28Å; I124-L146 HydrophobicContact CG2-CB 4.05Å; I124-L146 HydrophobicContact CG2-CD2 3.93Å; I124-L146 HydrophobicContact CG2-CG 4.03Å; P137-L146 HydrophobicContact CG-CD2 4.26Å; E142-L146 WeakPolarHBondContact O-CB 3.43Å; E142-L146 PolarHBondContact O-N 3.33Å; R143-L146 PolarHBondContact O-N 2.85Å; L146-S148 PolarHBondContact O-N 3.44Å; L146-I149 HydrophobicContact CD1-CD1 4.11Å; L146-I149 WeakPolarHBondContact O-CB 3.26Å; L146-I149 PolarHBondContact O-N 3.15Å; L146-Y150 HydrophobicContact CD1-CD2 4.07Å; L146-Y150 HydrophobicContact CD1-CE2 3.75Å; L146-Y150 HydrophobicContact CG-CD2 4.28Å; L146-Y150 HydrophobicContact CG-CE2 4.17Å; L146-Y150 WeakPolarHBondContact O-CD2 3.5Å; L146-Y150 PolarHBondContact O-N 3.5Å |
| 147 | V | 98.2 | Very high | 97.2 | Very high | 10 Ų | 10 | 59.6 Ų | 59.6 | 6% | 0.061 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -55 | -41.2 | 172.8 | 164.3 | 0 | 0 | 0 | 0 | 111.2 | L121 I124 L125 R143 W144 L145 I149 Y150 V151 | L121-V147 HydrophobicContact CD2-CB 4.46Å; L121-V147 HydrophobicContact CD2-CG1 4.12Å; L121-V147 HydrophobicContact CD2-CG2 4.19Å; I124-V147 HydrophobicContact CB-CG2 4.35Å; I124-V147 HydrophobicContact CG2-CG2 3.73Å; L125-V147 HydrophobicContact CD2-CG2 3.88Å; L125-V147 HydrophobicContact CG-CG2 4Å; R143-V147 WeakPolarHBondContact O-CB 3.34Å; R143-V147 VanDerWaalsContact O-CG2 3.29Å; R143-V147 WeakPolarHBondContact O-CG2 3.45Å; R143-V147 PolarHBondContact O-N 2.89Å; W144-V147 HydrophobicContact CE3-CB 4.21Å; W144-V147 HydrophobicContact CE3-CG1 4Å; W144-V147 HydrophobicContact CZ3-CG1 4.08Å; W144-V147 PolarHBondContact O-N 3.25Å; L145-V147 PolarHBondContact O-N 3.27Å; V147-I149 PolarHBondContact O-N 2.83Å; V147-Y150 PolarHBondContact O-N 3.43Å; V147-Y150 VanDerWaalsContact O-N 3.09Å; V147-V151 HydrophobicContact CG1-CG2 3.62Å; V147-V151 WeakPolarHBondContact O-CB 3.27Å; V147-V151 WeakPolarHBondContact O-CG2 3.35Å; V147-V151 PolarHBondContact O-N 3.46Å |
| 148 | S | 97.4 | Very high | 97.3 | Very high | 66 Ų | 66 | 62.2 Ų | 62.2 | 46% | 0.462 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.9 | -26 | 179.9 | 81.6 | 0 | 0 | 0 | 0 | 113.5 | W144 L145 L146 P152 | W144-S148 WeakPolarHBondContact O-CB 3.43Å; W144-S148 PolarHBondContact O-N 2.91Å; L145-S148 WeakPolarHBondContact O-CB 3.07Å; L145-S148 PolarHBondContact O-N 2.86Å; L145-S148 VanDerWaalsContact O-N 3.12Å; L145-S148 PolarHBondContact O-OG 3.42Å; L146-S148 PolarHBondContact O-N 3.44Å; S148-P152 WeakPolarHBondContact O-CD 3.4Å |
| 149 | I | 96.6 | Very high | 97.3 | Very high | 37 Ų | 37 | 60.9 Ų | 60.9 | 19% | 0.19 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -74.6 | -41.4 | 175.1 | -59 | 170.2 | 0 | 0 | 0 | 110.5 | Y56 F60 L145 L146 V147 P152 Y153 | Y56-I149 HydrophobicContact CE2-CD1 4.25Å; Y56-I149 HydrophobicContact CE2-CG2 4.27Å; F60-I149 HydrophobicContact CB-CD1 3.55Å; F60-I149 HydrophobicContact CD1-CD1 3.24Å; F60-I149 HydrophobicContact CD1-CG1 4.36Å; F60-I149 HydrophobicContact CD2-CD1 4.03Å; F60-I149 HydrophobicContact CE1-CD1 3.84Å; F60-I149 HydrophobicContact CG-CD1 3.32Å; F60-I149 HydrophobicContact CZ-CD1 4.46Å; L145-I149 PolarHBondContact O-N 3.37Å; L146-I149 HydrophobicContact CD1-CD1 4.11Å; L146-I149 WeakPolarHBondContact O-CB 3.26Å; L146-I149 PolarHBondContact O-N 3.15Å; V147-I149 PolarHBondContact O-N 2.83Å; I149-P152 WeakPolarHBondContact O-CD 3.49Å; I149-Y153 WeakPolarHBondContact O-CD2 3.2Å; I149-Y153 WeakPolarHBondContact O-CE2 3.37Å |
| 150 | Y | 97 | Very high | 97.4 | Very high | 24 Ų | 24 | 57.6 Ų | 57.6 | 9% | 0.094 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -78.4 | -29 | -179.5 | -80.5 | -88 | 0 | 0 | 0 | 113.7 | D62 M64 L117 I120 I124 L146 V147 Y153 L154 | D62-Y150 WeakPolarHBondContact OD2-CE2 3.43Å; D62-Y150 PolarHBondContact OD2-OH 3.41Å; M64-Y150 HydrophobicContact CE-CE2 4.32Å; L117-Y150 HydrophobicContact CD1-CD1 3.85Å; I120-Y150 HydrophobicContact CG2-CD1 3.72Å; I120-Y150 HydrophobicContact CG2-CE1 3.64Å; I120-Y150 HydrophobicContact CG2-CG 4.27Å; I124-Y150 HydrophobicContact CD1-CD2 3.5Å; I124-Y150 HydrophobicContact CD1-CE2 3.74Å; I124-Y150 HydrophobicContact CD1-CG 4.03Å; L146-Y150 HydrophobicContact CD1-CD2 4.07Å; L146-Y150 HydrophobicContact CD1-CE2 3.75Å; L146-Y150 HydrophobicContact CG-CD2 4.28Å; L146-Y150 HydrophobicContact CG-CE2 4.17Å; L146-Y150 WeakPolarHBondContact O-CD2 3.5Å; L146-Y150 PolarHBondContact O-N 3.5Å; V147-Y150 PolarHBondContact O-N 3.43Å; V147-Y150 VanDerWaalsContact O-N 3.09Å; Y150-Y153 WeakPolarHBondContact O-CA 3.06Å; Y150-Y153 WeakPolarHBondContact O-CB 3.34Å; Y150-Y153 PolarHBondContact O-N 2.96Å; Y150-L154 PolarHBondContact O-N 3.38Å |
| 151 | V | 96.3 | Very high | 97.5 | Very high | 46 Ų | 46 | 53.4 Ų | 53.4 | 28% | 0.279 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -57.3 | -42.9 | -175.8 | 160.1 | 0 | 0 | 0 | 0 | 113.9 | V147 Y153 L154 L155 | V147-V151 HydrophobicContact CG1-CG2 3.62Å; V147-V151 WeakPolarHBondContact O-CB 3.27Å; V147-V151 WeakPolarHBondContact O-CG2 3.35Å; V147-V151 PolarHBondContact O-N 3.46Å; V151-Y153 PolarHBondContact O-N 3.38Å; V151-L154 WeakPolarHBondContact O-CA 3.47Å; V151-L154 PolarHBondContact O-N 2.91Å; V151-L155 HydrophobicContact CG1-CD1 3.48Å; V151-L155 VanDerWaalsContact CG1-CD1 3.48Å; V151-L155 HydrophobicContact CG1-CG 3.76Å; V151-L155 WeakPolarHBondContact O-CG 3.2Å; V151-L155 PolarHBondContact O-N 3.37Å |
| 152 | P | 96.1 | Very high | 97.5 | Very high | 64 Ų | 64 | 48.2 Ų | 48.2 | 42% | 0.416 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -53.6 | -37.7 | 173.1 | -29.3 | 35.4 | 0 | 0 | 0 | 113.6 | S148 I149 L154 L155 V156 | S148-P152 WeakPolarHBondContact O-CD 3.4Å; I149-P152 WeakPolarHBondContact O-CD 3.49Å; P152-L154 PolarHBondContact O-N 3.49Å; P152-L155 PolarHBondContact O-N 3.3Å; P152-V156 WeakPolarHBondContact O-CG2 3.46Å; P152-V156 PolarHBondContact O-N 2.94Å |
| 153 | Y | 95.5 | Very high | 97.4 | Very high | 75 Ų | 75 | 46.5 Ų | 46.5 | 29% | 0.294 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -71.3 | -13 | 177.1 | -58.4 | -89.7 | 0 | 0 | 0 | 113.5 | Y23 H27 I149 Y150 V151 P157 | Y23-Y153 HydrophobicContact CE2-CD1 4.42Å; H27-Y153 AromaticContact CE1-CD1 3.53Å; H27-Y153 AromaticContact CE1-CE1 3.35Å; H27-Y153 WeakPolarHBondContact CE1-CE1 3.47Å; H27-Y153 AromaticContact NE2-CD1 3.16Å; H27-Y153 WeakPolarHBondContact NE2-CD1 3.08Å; H27-Y153 AromaticContact NE2-CE1 3.32Å; H27-Y153 VanDerWaalsContact NE2-CE1 3.32Å; H27-Y153 WeakPolarHBondContact NE2-CE1 3.31Å; I149-Y153 WeakPolarHBondContact O-CD2 3.2Å; I149-Y153 WeakPolarHBondContact O-CE2 3.37Å; Y150-Y153 WeakPolarHBondContact O-CA 3.06Å; Y150-Y153 WeakPolarHBondContact O-CB 3.34Å; Y150-Y153 PolarHBondContact O-N 2.96Å; V151-Y153 PolarHBondContact O-N 3.38Å; Y153-P157 WeakPolarHBondContact O-CD 2.97Å; Y153-P157 WeakPolarHBondContact O-CG 3.38Å |
| 154 | L | 97.1 | Very high | 97.3 | Very high | 31 Ų | 31 | 45.1 Ų | 45.1 | 16% | 0.162 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -96.3 | -44.9 | 168.9 | 177.5 | 60.7 | 0 | 0 | 0 | 111.5 | A114 L117 L121 Y150 V151 P152 V156 P157 V158 | A114-L154 HydrophobicContact CB-CD1 3.86Å; L117-L154 HydrophobicContact CB-CB 4.3Å; L117-L154 HydrophobicContact CB-CD1 4.13Å; L117-L154 HydrophobicContact CG-CB 4.31Å; L121-L154 HydrophobicContact CD1-CD2 3.72Å; Y150-L154 PolarHBondContact O-N 3.38Å; V151-L154 WeakPolarHBondContact O-CA 3.47Å; V151-L154 PolarHBondContact O-N 2.91Å; P152-L154 PolarHBondContact O-N 3.49Å; L154-V156 PolarHBondContact O-N 3.03Å; L154-P157 WeakPolarHBondContact O-CD 3.46Å; L154-V158 HydrophobicContact CD1-CG2 4.01Å; L154-V158 HydrophobicContact CG-CG2 4.44Å; L154-V158 VanDerWaalsContact O-CG2 3.32Å; L154-V158 WeakPolarHBondContact O-CG2 3.4Å; L154-V158 PolarHBondContact O-N 3.43Å |
| 155 | L | 97.8 | Very high | 97.1 | Very high | 109 Ų | 109 | 41.9 Ų | 41.9 | 57% | 0.571 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -63.1 | -44.7 | -175.6 | -70.7 | 179 | 0 | 0 | 0 | 112.3 | V151 P152 V158 L159 | V151-L155 HydrophobicContact CG1-CD1 3.48Å; V151-L155 VanDerWaalsContact CG1-CD1 3.48Å; V151-L155 HydrophobicContact CG1-CG 3.76Å; V151-L155 WeakPolarHBondContact O-CG 3.2Å; V151-L155 PolarHBondContact O-N 3.37Å; P152-L155 PolarHBondContact O-N 3.3Å; L155-V158 PolarHBondContact O-N 3.2Å; L155-L159 VanDerWaalsContact O-CB 3.31Å; L155-L159 WeakPolarHBondContact O-CB 3.43Å; L155-L159 PolarHBondContact O-N 3.27Å |
| 156 | V | 97.8 | Very high | 96.9 | Very high | 25 Ų | 25 | 45.5 Ų | 45.5 | 15% | 0.152 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.4 | -45.9 | -178.4 | 177.6 | 0 | 0 | 0 | 0 | 111.5 | F20 Y23 P152 L154 V158 L159 L160 | F20-V156 HydrophobicContact CD1-CG1 3.93Å; F20-V156 HydrophobicContact CE1-CG1 4.25Å; Y23-V156 HydrophobicContact CD1-CG1 3.96Å; Y23-V156 HydrophobicContact CD2-CB 3.7Å; Y23-V156 HydrophobicContact CD2-CG1 3.52Å; Y23-V156 HydrophobicContact CD2-CG2 4.08Å; Y23-V156 HydrophobicContact CE1-CG1 4.41Å; Y23-V156 HydrophobicContact CE2-CB 3.87Å; Y23-V156 HydrophobicContact CE2-CG1 4.01Å; Y23-V156 HydrophobicContact CG-CB 4.22Å; Y23-V156 HydrophobicContact CG-CG1 3.5Å; P152-V156 WeakPolarHBondContact O-CG2 3.46Å; P152-V156 PolarHBondContact O-N 2.94Å; L154-V156 PolarHBondContact O-N 3.03Å; V156-V158 PolarHBondContact O-N 3.49Å; V156-L159 PolarHBondContact O-N 2.62Å; V156-L160 WeakPolarHBondContact O-CB 3.21Å; V156-L160 PolarHBondContact O-N 2.93Å |
| 157 | P | 97.9 | Very high | 96.5 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.8 | -41.4 | 171.5 | -32.8 | 41.9 | 0 | 0 | 0 | 114.4 | Y23 S110 V113 Y153 L154 L159 L160 L161 | Y23-P157 WeakPolarHBondContact OH-CG 3.38Å; S110-P157 WeakPolarHBondContact CB-O 3.13Å; V113-P157 HydrophobicContact CB-CB 4.26Å; V113-P157 HydrophobicContact CB-CG 4.18Å; V113-P157 HydrophobicContact CG1-CB 4.23Å; V113-P157 HydrophobicContact CG1-CG 3.72Å; Y153-P157 WeakPolarHBondContact O-CD 2.97Å; Y153-P157 WeakPolarHBondContact O-CG 3.38Å; L154-P157 WeakPolarHBondContact O-CD 3.46Å; P157-L159 VanDerWaalsContact C-N 3.33Å; P157-L159 PolarHBondContact O-N 3.12Å; P157-L160 WeakPolarHBondContact O-CB 3.32Å; P157-L160 PolarHBondContact O-N 3.04Å; P157-L161 WeakPolarHBondContact O-CB 3.43Å; P157-L161 PolarHBondContact O-N 2.97Å |
| 158 | V | 98.3 | Very high | 96 | Very high | 55 Ų | 55 | 49 Ų | 49 | 33% | 0.333 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 175.4 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | A114 L154 L155 V156 L160 L161 L162 | A114-V158 HydrophobicContact CB-CG2 4.28Å; L154-V158 HydrophobicContact CD1-CG2 4.01Å; L154-V158 HydrophobicContact CG-CG2 4.44Å; L154-V158 VanDerWaalsContact O-CG2 3.32Å; L154-V158 WeakPolarHBondContact O-CG2 3.4Å; L154-V158 PolarHBondContact O-N 3.43Å; L155-V158 PolarHBondContact O-N 3.2Å; V156-V158 PolarHBondContact O-N 3.49Å; V158-L160 VanDerWaalsContact C-N 3.32Å; V158-L160 PolarHBondContact O-N 3.47Å; V158-L161 WeakPolarHBondContact O-CB 3.46Å; V158-L161 PolarHBondContact O-N 3.18Å; V158-L162 HydrophobicContact CG1-CD1 4.13Å; V158-L162 HydrophobicContact CG1-CG 4.45Å; V158-L162 VanDerWaalsContact O-CG 3.31Å; V158-L162 WeakPolarHBondContact O-CG 3.43Å; V158-L162 PolarHBondContact O-N 2.86Å |
| 159 | L | 97.9 | Very high | 95.5 | Very high | 65 Ų | 65 | 49.1 Ų | 49.1 | 34% | 0.34 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63 | -39.4 | 175.6 | -176.4 | 59.2 | 0 | 0 | 0 | 111.9 | L16 F20 L155 V156 P157 T163 | L16-L159 HydrophobicContact CD2-CD1 4.1Å; L16-L159 HydrophobicContact CD2-CD2 3.55Å; L16-L159 HydrophobicContact CD2-CG 3.92Å; F20-L159 HydrophobicContact CE1-CB 4.37Å; F20-L159 HydrophobicContact CE1-CD2 4.35Å; F20-L159 HydrophobicContact CE1-CG 4.13Å; F20-L159 HydrophobicContact CZ-CG 4.12Å; L155-L159 VanDerWaalsContact O-CB 3.31Å; L155-L159 WeakPolarHBondContact O-CB 3.43Å; L155-L159 PolarHBondContact O-N 3.27Å; V156-L159 PolarHBondContact O-N 2.62Å; P157-L159 VanDerWaalsContact C-N 3.33Å; P157-L159 PolarHBondContact O-N 3.12Å; L159-T163 WeakPolarHBondContact O-CB 3.29Å; L159-T163 PolarHBondContact O-N 2.87Å; L159-T163 PolarHBondContact O-OG1 3.24Å |
| 160 | L | 98.2 | Very high | 95.1 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.3 | -48.2 | 173.4 | 174.8 | 62.8 | 0 | 0 | 0 | 111.1 | F20 F24 F94 A106 Y109 V156 P157 V158 L162 T163 M164 | F20-L160 HydrophobicContact CD1-CB 4.25Å; F20-L160 HydrophobicContact CD1-CD1 4.41Å; F20-L160 HydrophobicContact CD2-CD1 3.71Å; F20-L160 HydrophobicContact CE1-CB 3.88Å; F20-L160 HydrophobicContact CE1-CD1 4.46Å; F20-L160 HydrophobicContact CE2-CB 4.48Å; F20-L160 HydrophobicContact CE2-CD1 3.76Å; F20-L160 HydrophobicContact CG-CD1 4.06Å; F20-L160 HydrophobicContact CZ-CB 4.02Å; F20-L160 HydrophobicContact CZ-CD1 4.17Å; F24-L160 HydrophobicContact CE2-CD2 3.81Å; F24-L160 HydrophobicContact CZ-CD2 3.67Å; F94-L160 HydrophobicContact CE1-CD1 4.15Å; F94-L160 HydrophobicContact CE2-CD1 4.08Å; F94-L160 HydrophobicContact CZ-CD1 3.48Å; F94-L160 VanDerWaalsContact CZ-CD1 3.48Å; A106-L160 HydrophobicContact CB-CD1 4.18Å; A106-L160 HydrophobicContact CB-CD2 4.19Å; A106-L160 HydrophobicContact CB-CG 4.29Å; Y109-L160 HydrophobicContact CD1-CD2 4.08Å; Y109-L160 HydrophobicContact CE1-CD2 4.48Å; V156-L160 WeakPolarHBondContact O-CB 3.21Å; V156-L160 PolarHBondContact O-N 2.93Å; P157-L160 WeakPolarHBondContact O-CB 3.32Å; P157-L160 PolarHBondContact O-N 3.04Å; V158-L160 VanDerWaalsContact C-N 3.32Å; V158-L160 PolarHBondContact O-N 3.47Å; L160-L162 PolarHBondContact O-N 3.41Å; L160-T163 WeakPolarHBondContact O-CB 3.49Å; L160-T163 PolarHBondContact O-N 2.83Å; L160-M164 HydrophobicContact CD1-CE 3.83Å; L160-M164 HydrophobicContact CD1-CG 4.13Å; L160-M164 WeakPolarHBondContact O-CG 3.45Å; L160-M164 PolarHBondContact O-N 2.7Å |
| 161 | L | 98.2 | Very high | 94.5 | Very high | 34 Ų | 34 | 49.4 Ų | 49.4 | 18% | 0.178 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -56.6 | -52.4 | 177.6 | -179.6 | 57.7 | 0 | 0 | 0 | 110.9 | I107 S110 P157 V158 T163 M164 L165 | I107-L161 HydrophobicContact CB-CD1 4.29Å; I107-L161 HydrophobicContact CG1-CD1 4.18Å; I107-L161 HydrophobicContact CG2-CD1 3.9Å; S110-L161 WeakPolarHBondContact OG-CB 3.35Å; P157-L161 WeakPolarHBondContact O-CB 3.43Å; P157-L161 PolarHBondContact O-N 2.97Å; V158-L161 WeakPolarHBondContact O-CB 3.46Å; V158-L161 PolarHBondContact O-N 3.18Å; L161-T163 VanDerWaalsContact C-N 3.29Å; L161-T163 PolarHBondContact O-N 3.34Å; L161-M164 PolarHBondContact O-N 2.84Å; L161-L165 HydrophobicContact CD1-CD1 3.82Å; L161-L165 HydrophobicContact CD1-CG 4.13Å; L161-L165 HydrophobicContact CG-CD1 3.95Å; L161-L165 WeakPolarHBondContact O-CB 3.4Å; L161-L165 VanDerWaalsContact O-CG 3.31Å; L161-L165 WeakPolarHBondContact O-CG 3.25Å; L161-L165 PolarHBondContact O-N 3.49Å |
| 162 | L | 97.1 | Very high | 93.1 | Very high | 83 Ų | 83 | 51.7 Ų | 51.7 | 44% | 0.435 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.9 | -40.5 | 177.9 | -67.6 | 175.9 | 0 | 0 | 0 | 111.3 | V158 L160 M164 L165 L166 | V158-L162 HydrophobicContact CG1-CD1 4.13Å; V158-L162 HydrophobicContact CG1-CG 4.45Å; V158-L162 VanDerWaalsContact O-CG 3.31Å; V158-L162 WeakPolarHBondContact O-CG 3.43Å; V158-L162 PolarHBondContact O-N 2.86Å; L160-L162 PolarHBondContact O-N 3.41Å; L162-M164 PolarHBondContact O-N 2.89Å; L162-L165 PolarHBondContact O-N 2.91Å; L162-L166 HydrophobicContact CB-CD1 4.35Å; L162-L166 HydrophobicContact CD2-CD1 4.23Å; L162-L166 WeakPolarHBondContact O-CB 3.18Å; L162-L166 VanDerWaalsContact O-CG 3.28Å; L162-L166 WeakPolarHBondContact O-CG 3.48Å; L162-L166 PolarHBondContact O-N 3.34Å |
| 163 | T | 95.6 | Very high | 91.5 | Very high | 11 Ų | 11 | 54 Ų | 54 | 7% | 0.067 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 176.6 | -57 | 0 | 0 | 0 | 0 | 111.5 | L16 F20 L159 L160 L161 L165 S167 | L16-T163 HydrophobicContact CD1-CG2 4.38Å; F20-T163 HydrophobicContact CE2-CG2 4.1Å; L159-T163 WeakPolarHBondContact O-CB 3.29Å; L159-T163 PolarHBondContact O-N 2.87Å; L159-T163 PolarHBondContact O-OG1 3.24Å; L160-T163 WeakPolarHBondContact O-CB 3.49Å; L160-T163 PolarHBondContact O-N 2.83Å; L161-T163 VanDerWaalsContact C-N 3.29Å; L161-T163 PolarHBondContact O-N 3.34Å; T163-L165 VanDerWaalsContact C-N 3.33Å; T163-L165 PolarHBondContact O-N 3.29Å; T163-S167 WeakPolarHBondContact O-CB 3.49Å; T163-S167 PolarHBondContact O-N 3.37Å |
| 164 | M | 96.4 | Very high | 89.6 | Confident | 0 Ų | 0 | 52.6 Ų | 52.6 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.1 | -31.2 | 179.3 | -68.3 | -53.9 | 113.4 | 0 | 0 | 113 | F94 I102 R103 A106 I107 L160 L161 L162 Y170 | F94-M164 HydrophobicContact CE1-CE 3.78Å; F94-M164 HydrophobicContact CZ-CE 4.11Å; I102-M164 HydrophobicContact CG2-SD 4.36Å; R103-M164 HydrophobicContact CB-SD 4.24Å; R103-M164 HydrophobicContact CG-CB 4.2Å; R103-M164 HydrophobicContact CG-SD 4.35Å; R103-M164 PolarHBondContact NE-O 3.44Å; A106-M164 HydrophobicContact CB-CG 3.76Å; A106-M164 HydrophobicContact CB-SD 4.1Å; I107-M164 HydrophobicContact CD1-CB 4.08Å; I107-M164 HydrophobicContact CG1-CB 3.61Å; I107-M164 HydrophobicContact CG1-CG 4.34Å; L160-M164 HydrophobicContact CD1-CE 3.83Å; L160-M164 HydrophobicContact CD1-CG 4.13Å; L160-M164 WeakPolarHBondContact O-CG 3.45Å; L160-M164 PolarHBondContact O-N 2.7Å; L161-M164 PolarHBondContact O-N 2.84Å; L162-M164 PolarHBondContact O-N 2.89Å; M164-Y170 HydrophobicContact CE-CD1 4.23Å; M164-Y170 HydrophobicContact CE-CD2 3.78Å; M164-Y170 HydrophobicContact CE-CE1 4.13Å; M164-Y170 HydrophobicContact CE-CE2 3.68Å; M164-Y170 HydrophobicContact CE-CG 4.07Å; M164-Y170 HydrophobicContact SD-CD1 3.94Å; M164-Y170 HydrophobicContact SD-CD2 4.25Å; M164-Y170 HydrophobicContact SD-CE1 4.27Å; M164-Y170 HydrophobicContact SD-CG 3.93Å |
| 165 | L | 94.6 | Very high | 87.1 | Confident | 85 Ų | 85 | 60 Ų | 60 | 45% | 0.445 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -83 | -39.9 | 179.6 | -68.4 | 177.7 | 0 | 0 | 0 | 113 | I107 L161 L162 T163 | I107-L165 HydrophobicContact CD1-CD2 3.81Å; I107-L165 HydrophobicContact CG1-CD2 4.37Å; L161-L165 HydrophobicContact CD1-CD1 3.82Å; L161-L165 HydrophobicContact CD1-CG 4.13Å; L161-L165 HydrophobicContact CG-CD1 3.95Å; L161-L165 WeakPolarHBondContact O-CB 3.4Å; L161-L165 VanDerWaalsContact O-CG 3.31Å; L161-L165 WeakPolarHBondContact O-CG 3.25Å; L161-L165 PolarHBondContact O-N 3.49Å; L162-L165 PolarHBondContact O-N 2.91Å; T163-L165 VanDerWaalsContact C-N 3.33Å; T163-L165 PolarHBondContact O-N 3.29Å |
| 166 | L | 92.3 | Very high | 84.6 | Confident | 135 Ų | 135 | 60.6 Ų | 60.6 | 71% | 0.707 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -102.2 | -22.7 | -168.1 | -55.5 | 178.1 | 0 | 0 | 0 | 113.5 | L162 S168 | L162-L166 HydrophobicContact CB-CD1 4.35Å; L162-L166 HydrophobicContact CD2-CD1 4.23Å; L162-L166 WeakPolarHBondContact O-CB 3.18Å; L162-L166 VanDerWaalsContact O-CG 3.28Å; L162-L166 WeakPolarHBondContact O-CG 3.48Å; L162-L166 PolarHBondContact O-N 3.34Å; L166-S168 PolarHBondContact O-N 2.98Å |
| 167 | S | 90.2 | Very high | 82.1 | Confident | 7 Ų | 7 | 62.7 Ų | 62.7 | 5% | 0.049 | 37% | 0.366 | C | S | . | . | trans | -76 | 124.8 | -177.9 | -172.8 | 0 | 0 | 0 | 0 | 112.2 | T163 K169 Y170 N171 | T163-S167 WeakPolarHBondContact O-CB 3.49Å; T163-S167 PolarHBondContact O-N 3.37Å; S167-K169 PolarHBondContact O-N 2.93Å; S167-K169 PolarHBondContact OG-N 3.25Å; S167-Y170 PolarHBondContact O-N 2.92Å; S167-N171 PolarHBondContact O-N 2.85Å | ||
| 168 | S | 87.8 | Confident | 79.3 | Confident | 78 Ų | 78 | 68 Ų | 68 | 55% | 0.545 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | -26.9 | 173.1 | 61.3 | 0 | 0 | 0 | 0 | 113.2 | L166 Y170 N171 | L166-S168 PolarHBondContact O-N 2.98Å; S168-Y170 VanDerWaalsContact C-N 3.26Å; S168-Y170 PolarHBondContact O-N 3.4Å; S168-N171 PolarHBondContact O-N 3.23Å |
| 169 | K | 87.4 | Confident | 76.7 | Confident | 68 Ų | 68 | 72 Ų | 72 | 30% | 0.296 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -38.3 | 178.3 | -174.4 | 178.6 | -174.8 | 175.1 | 0 | 112.2 | V13 E17 K100 S167 | V13-K169 HydrophobicContact CG1-CD 3.6Å; E17-K169 VanDerWaalsContact OE1-CE 3.24Å; E17-K169 WeakPolarHBondContact OE1-CE 3.41Å; E17-K169 IonicContact OE1-NZ 2.66Å; E17-K169 PolarHBondContact OE1-NZ 3.41Å; E17-K169 IonicContact OE2-NZ 3Å; E17-K169 PolarHBondContact OE2-NZ 3.48Å; K100-K169 WeakPolarHBondContact CE-O 3.37Å; S167-K169 PolarHBondContact O-N 2.93Å; S167-K169 PolarHBondContact OG-N 3.25Å |
| 170 | Y | 88.3 | Confident | 73.8 | Confident | 2 Ų | 2 | 73.6 Ų | 73.6 | 1% | 0.008 | 44% | 0.444 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | -9.7 | -176.5 | -70.1 | -77.6 | 0 | 0 | 0 | 112.7 | V13 E17 I102 R103 M164 S167 S168 P172 | V13-Y170 HydrophobicContact CG1-CE2 4.26Å; E17-Y170 PolarHBondContact OE1-OH 3.34Å; I102-Y170 HydrophobicContact CG2-CD1 4.18Å; I102-Y170 HydrophobicContact CG2-CE1 3.63Å; R103-Y170 WeakPolarHBondContact CD-O 3.47Å; M164-Y170 HydrophobicContact CE-CD1 4.23Å; M164-Y170 HydrophobicContact CE-CD2 3.78Å; M164-Y170 HydrophobicContact CE-CE1 4.13Å; M164-Y170 HydrophobicContact CE-CE2 3.68Å; M164-Y170 HydrophobicContact CE-CG 4.07Å; M164-Y170 HydrophobicContact SD-CD1 3.94Å; M164-Y170 HydrophobicContact SD-CD2 4.25Å; M164-Y170 HydrophobicContact SD-CE1 4.27Å; M164-Y170 HydrophobicContact SD-CG 3.93Å; S167-Y170 PolarHBondContact O-N 2.92Å; S168-Y170 VanDerWaalsContact C-N 3.26Å; S168-Y170 PolarHBondContact O-N 3.4Å; Y170-P172 WeakPolarHBondContact O-CD 3.38Å |
| 171 | N | 83.3 | Confident | 71.2 | Confident | 64 Ų | 64 | 77.1 Ų | 77.1 | 34% | 0.342 | 48% | 0.481 | S | S | . | . | trans | -69.8 | 123.3 | -178.2 | -158.5 | -16 | 0 | 0 | 0 | 111.5 | S167 S168 T173 S174 | S167-N171 PolarHBondContact O-N 2.85Å; S168-N171 PolarHBondContact O-N 3.23Å; N171-T173 PolarHBondContact O-N 3.36Å; N171-T173 VanDerWaalsContact O-N 3.15Å; N171-T173 PolarHBondContact OD1-OG1 3.05Å; N171-T173 VanDerWaalsContact OD1-OG1 3.12Å; N171-S174 PolarHBondContact O-N 3.41Å; N171-S174 PolarHBondContact O-OG 3.02Å | ||
| 172 | P | 68.1 | Low | 68.4 | Low | 95 Ų | 95 | 85.5 Ų | 85.5 | 62% | 0.617 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | -23.4 | -179.6 | -22.9 | 32.1 | 0 | 0 | 0 | 114.2 | Y170 S174 | Y170-P172 WeakPolarHBondContact O-CD 3.38Å; P172-S174 PolarHBondContact O-N 2.98Å |
| 173 | T | 62.5 | Low | 66.1 | Low | 111 Ų | 111 | 86.1 Ų | 86.1 | 68% | 0.681 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79 | -0.4 | -175.4 | 55.9 | 0 | 0 | 0 | 0 | 114.4 | N171 K175 | N171-T173 PolarHBondContact O-N 3.36Å; N171-T173 VanDerWaalsContact O-N 3.15Å; N171-T173 PolarHBondContact OD1-OG1 3.05Å; N171-T173 VanDerWaalsContact OD1-OG1 3.12Å; T173-K175 VanDerWaalsContact C-N 3.26Å; T173-K175 PolarHBondContact O-N 3.42Å |
| 174 | S | 54.8 | Low | 63.5 | Low | 47 Ų | 47 | 95.4 Ų | 95.4 | 33% | 0.329 | 57% | 0.572 | S | S | . | * | trans | -71.9 | 79.5 | 169.5 | 53.4 | 0 | 0 | 0 | 0 | 110.6 | K100 N171 P172 | K100-S174 PolarHBondContact NZ-OG 2.82Å; N171-S174 PolarHBondContact O-N 3.41Å; N171-S174 PolarHBondContact O-OG 3.02Å; P172-S174 PolarHBondContact O-N 2.98Å | ||
| 175 | K | 44 | Very low | 60.9 | Low | 185 Ų | 185 | 105 Ų | 105 | 80% | 0.804 | 61% | 0.614 | S | S | * | * | trans | -52.2 | 127.9 | 169.5 | -80.5 | -177 | 177.3 | 177 | 0 | 109.3 | T173 | T173-K175 VanDerWaalsContact C-N 3.26Å; T173-K175 PolarHBondContact O-N 3.42Å | ||
| 176 | P | 46.7 | Very low | 58.3 | Low | 123 Ų | 123 | 110 Ų | 110 | 80% | 0.799 | 63% | 0.632 | S | S | * | * | trans | -63.1 | 140.6 | 160.9 | 27.6 | -28.4 | 0 | 0 | 0 | 108 | S178 | P176-S178 PolarHBondContact O-N 2.83Š| ||
| 177 | G | 45.7 | Very low | 55.8 | Low | 69 Ų | 69 | 114.8 Ų | 114.8 | 71% | 0.711 | 66% | 0.659 | S | S | * | * | trans | -39.1 | 123.4 | -163.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | T179 | G177-T179 PolarHBondContact O-N 3.15Š| ||
| 178 | S | 37.9 | Very low | 54.1 | Low | 111 Ų | 111 | 120.2 Ų | 120.2 | 78% | 0.776 | 69% | 0.689 | S | S | * | * | trans | -77.8 | 73 | 158.8 | 165.6 | 0 | 0 | 0 | 0 | 109.2 | P176 | P176-S178 PolarHBondContact O-N 2.83Š| ||
| 179 | T | 43.9 | Very low | 52.3 | Low | 138 Ų | 138 | 122.4 Ų | 122.4 | 85% | 0.847 | 70% | 0.697 | S | S | * | * | trans | -96.2 | 70.2 | 156.5 | 26.6 | 0 | 0 | 0 | 0 | 108.3 | G177 | G177-T179 PolarHBondContact O-N 3.15Š| ||
| 180 | S | 37.7 | Very low | 50.4 | Low | 99 Ų | 99 | 125.4 Ų | 125.4 | 69% | 0.692 | 72% | 0.719 | S | S | * | * | trans | -95.7 | 90.9 | 158.7 | -179.5 | 0 | 0 | 0 | 0 | 107.5 | K182 | S180-K182 PolarHBondContact O-N 3.26Š| ||
| 181 | G | 42.4 | Very low | 48.1 | Very low | 74 Ų | 74 | 132.7 Ų | 132.7 | 76% | 0.763 | 76% | 0.761 | S | S | * | * | trans | -58.3 | 105.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | A183 | G181-A183 VanDerWaalsContact C-N 3.27Å; G181-A183 PolarHBondContact O-N 3.27Å | ||
| 182 | K | 40.6 | Very low | 45.9 | Very low | 210 Ų | 210 | 137 Ų | 137 | 91% | 0.913 | 79% | 0.787 | S | S | * | * | trans | -84.1 | 80.9 | 158.5 | -82.4 | -171.2 | 177 | -179 | 0 | 108.2 | S180 | S180-K182 PolarHBondContact O-N 3.26Š| ||
| 183 | A | 48.1 | Very low | 44.5 | Very low | 97 Ų | 97 | 139.8 Ų | 139.8 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | trans | -110.9 | 92.7 | 156.7 | 0 | 0 | 0 | 0 | 0 | 108 | G181 | G181-A183 VanDerWaalsContact C-N 3.27Å; G181-A183 PolarHBondContact O-N 3.27Å | ||
| 184 | K | 41.6 | Very low | 43.2 | Very low | 205 Ų | 205 | 141.9 Ų | 141.9 | 89% | 0.891 | 81% | 0.807 | S | S | * | * | trans | -143.3 | 79.8 | 161.4 | -124.8 | -177.1 | 178.4 | -178.4 | 0 | 105.5 | ||||
| 185 | K | 40.9 | Very low | 42.3 | Very low | 202 Ų | 202 | 149.2 Ų | 149.2 | 88% | 0.878 | 84% | 0.843 | S | S | * | * | 60.7 | 95 | 94.7 | -150.1 | 178.4 | -172.5 | -178.4 | 0 | 111.7 | |||||
| 186 | K | 39.6 | Very low | 42.1 | Very low | 191 Ų | 191 | 146.2 Ų | 146.2 | 83% | 0.83 | 85% | 0.847 | S | S | * | * | trans | -10.3 | 124.5 | 148.2 | -154.5 | 178.1 | -173.3 | -176.9 | 0 | 114.2 | ||||
| 187 | N | 40.6 | Very low | 41.7 | Very low | 235 Ų | 235 | 148.3 Ų | 148.3 | 100% | 1.257 | 85% | 0.851 | S | S | * | * | trans | -158.3 | 0 | 130.3 | -96.4 | 2.7 | 0 | 0 | 0 | 108.1 |
Retrieved 187 of 187 residues in 40.2 ms
(Link to these results)