| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 44.5 | Very low | 55.5 | Low | 232 Ų | 232 | 107.1 Ų | 107.1 | 100% | 1.143 | 51% | 0.514 | S | S | * | . | 0 | -31.3 | 0 | -87 | 174.4 | 176.3 | 0 | 0 | 115.6 | L3 G4 | M1-L3 PolarHBondContact O-N 3.04Å; M1-G4 PolarHBondContact O-N 2.73Å | |||
| 2 | R | 53.3 | Low | 55.8 | Low | 210 Ų | 210 | 106.4 Ų | 106.4 | 79% | 0.792 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.7 | -29.4 | -171.1 | -146.4 | 177.4 | -93.7 | 162.8 | -7.8 | 115.5 | G4 S5 | R2-G4 VanDerWaalsContact C-N 3.27Å; R2-G4 PolarHBondContact O-N 2.97Å; R2-S5 WeakPolarHBondContact O-CB 3.41Å; R2-S5 PolarHBondContact O-N 3.4Å |
| 3 | L | 52.6 | Low | 56.5 | Low | 72 Ų | 72 | 101.4 Ų | 101.4 | 38% | 0.377 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.7 | -34.9 | 175.1 | -163.7 | 74.8 | 0 | 0 | 0 | 112.6 | M1 S5 H6 H7 K246 Y249 | M1-L3 PolarHBondContact O-N 3.04Å; L3-S5 PolarHBondContact O-N 3.1Å; L3-H6 PolarHBondContact O-N 3.17Å; L3-H7 PolarHBondContact O-N 3.31Å; L3-H7 VanDerWaalsContact O-N 3.08Å; L3-K246 HydrophobicContact CD1-CG 4.43Å; L3-K246 HydrophobicContact CD2-CG 4.39Å; L3-Y249 HydrophobicContact CD1-CD1 4.35Å; L3-Y249 HydrophobicContact CD1-CG 4.24Å |
| 4 | G | 50.4 | Low | 56.7 | Low | 36 Ų | 36 | 101.4 Ų | 101.4 | 37% | 0.371 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68 | -22 | 176 | 0 | 0 | 0 | 0 | 0 | 113.6 | M1 R2 R8 | M1-G4 PolarHBondContact O-N 2.73Å; R2-G4 VanDerWaalsContact C-N 3.27Å; R2-G4 PolarHBondContact O-N 2.97Å; G4-R8 WeakPolarHBondContact O-CB 3.45Å; G4-R8 VanDerWaalsContact O-CG 3.3Å; G4-R8 WeakPolarHBondContact O-CG 3.31Å; G4-R8 PolarHBondContact O-N 3.44Å; G4-R8 VanDerWaalsContact O-N 3.13Å; G4-R8 PolarHBondContact O-NE 3.39Å |
| 5 | S | 54.1 | Low | 57.1 | Low | 62 Ų | 62 | 106 Ų | 106 | 43% | 0.434 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73.8 | -44.1 | 174 | -158.3 | 0 | 0 | 0 | 0 | 111.7 | R2 L3 R8 H9 | R2-S5 WeakPolarHBondContact O-CB 3.41Å; R2-S5 PolarHBondContact O-N 3.4Å; L3-S5 PolarHBondContact O-N 3.1Å; S5-R8 PolarHBondContact O-N 3.45Å; S5-H9 PolarHBondContact O-N 3.49Å |
| 6 | H | 56.5 | Low | 57.4 | Low | 108 Ų | 108 | 99.9 Ų | 99.9 | 50% | 0.5 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -40.9 | 175.6 | -76.9 | -78.4 | 0 | 0 | 0 | 111.7 | L3 R8 H9 F10 | L3-H6 PolarHBondContact O-N 3.17Å; H6-R8 VanDerWaalsContact C-N 3.28Å; H6-R8 PolarHBondContact O-N 3.42Å; H6-H9 PolarHBondContact O-N 3.23Å; H6-H9 VanDerWaalsContact O-N 3.13Å; H6-F10 WeakPolarHBondContact O-CD2 3.37Å; H6-F10 PolarHBondContact O-N 2.8Å |
| 7 | H | 58.5 | Low | 57.6 | Low | 65 Ų | 65 | 102.2 Ų | 102.2 | 30% | 0.301 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 173.7 | -168.4 | -66.7 | 0 | 0 | 0 | 111.9 | L3 A11 Y238 | L3-H7 PolarHBondContact O-N 3.31Å; L3-H7 VanDerWaalsContact O-N 3.08Å; H7-A11 WeakPolarHBondContact O-CB 3.27Å; H7-A11 PolarHBondContact O-N 3.47Å; H7-Y238 PolarHBondContact CE1-OH 3.06Å; H7-Y238 PolarHBondContact ND1-OH 3.22Å; H7-Y238 PolarHBondContact NE2-OH 2.86Å; H7-Y238 VanDerWaalsContact NE2-OH 3.12Å |
| 8 | R | 57.5 | Low | 57.6 | Low | 166 Ų | 166 | 97.9 Ų | 97.9 | 63% | 0.626 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -66.5 | -36.6 | 174.4 | -78.9 | -177.2 | -73.5 | -175.7 | 1.9 | 112.8 | G4 S5 H6 A11 N12 | G4-R8 WeakPolarHBondContact O-CB 3.45Å; G4-R8 VanDerWaalsContact O-CG 3.3Å; G4-R8 WeakPolarHBondContact O-CG 3.31Å; G4-R8 PolarHBondContact O-N 3.44Å; G4-R8 VanDerWaalsContact O-N 3.13Å; G4-R8 PolarHBondContact O-NE 3.39Å; S5-R8 PolarHBondContact O-N 3.45Å; H6-R8 VanDerWaalsContact C-N 3.28Å; H6-R8 PolarHBondContact O-N 3.42Å; R8-A11 PolarHBondContact O-N 2.95Å; R8-N12 WeakPolarHBondContact O-CB 3.17Å; R8-N12 VanDerWaalsContact O-CG 3.3Å; R8-N12 PolarHBondContact O-N 3.33Å; R8-N12 VanDerWaalsContact O-N 3.11Å; R8-N12 PolarHBondContact O-ND2 3.03Å |
| 9 | H | 61.9 | Low | 57.5 | Low | 144 Ų | 144 | 98.9 Ų | 98.9 | 67% | 0.667 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -67.5 | -45.5 | 177.5 | -164.1 | -82.6 | 0 | 0 | 0 | 112 | S5 H6 N12 D13 | S5-H9 PolarHBondContact O-N 3.49Å; H6-H9 PolarHBondContact O-N 3.23Å; H6-H9 VanDerWaalsContact O-N 3.13Å; H9-N12 PolarHBondContact O-N 2.92Å; H9-D13 PolarHBondContact O-N 3.42Å |
| 10 | F | 63.1 | Low | 57.3 | Low | 64 Ų | 64 | 96.6 Ų | 96.6 | 28% | 0.281 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.8 | -38.5 | 173.4 | -77 | -69.8 | 0 | 0 | 0 | 112.1 | H6 N12 D13 F16 Y238 A241 A245 | H6-F10 WeakPolarHBondContact O-CD2 3.37Å; H6-F10 PolarHBondContact O-N 2.8Å; F10-N12 PolarHBondContact O-N 3.46Å; F10-D13 PolarHBondContact O-N 3.05Å; F10-F16 HydrophobicContact CD1-CE2 4.17Å; F10-F16 VanDerWaalsContact O-CD2 3.24Å; F10-F16 WeakPolarHBondContact O-CD2 3.16Å; F10-Y238 HydrophobicContact CB-CE2 4.26Å; F10-A241 HydrophobicContact CD1-CB 4.17Å; F10-A241 HydrophobicContact CE1-CB 4.09Å; F10-A245 HydrophobicContact CE2-CB 4.25Å |
| 11 | A | 58 | Low | 57.1 | Low | 19 Ų | 19 | 98.2 Ų | 98.2 | 16% | 0.157 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -61.1 | -23.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | H7 R8 H23 | H7-A11 WeakPolarHBondContact O-CB 3.27Å; H7-A11 PolarHBondContact O-N 3.47Å; R8-A11 PolarHBondContact O-N 2.95Å; A11-H23 WeakPolarHBondContact CB-NE2 3.43Å |
| 12 | N | 59 | Low | 58.1 | Low | 99 Ų | 99 | 90.1 Ų | 90.1 | 53% | 0.529 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -90.5 | -14.8 | -179.4 | -78.9 | -15.8 | 0 | 0 | 0 | 114.3 | R8 H9 F10 | R8-N12 WeakPolarHBondContact O-CB 3.17Å; R8-N12 VanDerWaalsContact O-CG 3.3Å; R8-N12 PolarHBondContact O-N 3.33Å; R8-N12 VanDerWaalsContact O-N 3.11Å; R8-N12 PolarHBondContact O-ND2 3.03Å; H9-N12 PolarHBondContact O-N 2.92Å; F10-N12 PolarHBondContact O-N 3.46Å |
| 13 | D | 64.6 | Low | 59.1 | Low | 41 Ų | 41 | 82.1 Ų | 82.1 | 22% | 0.219 | 44% | 0.444 | C | S | . | . | S | Bend | trans | -63.8 | 126.5 | 178.9 | -171.9 | -34.6 | 0 | 0 | 0 | 108.7 | H9 F10 R15 F16 | H9-D13 PolarHBondContact O-N 3.42Å; F10-D13 PolarHBondContact O-N 3.05Å; D13-R15 PolarHBondContact O-N 3.45Å; D13-R15 WeakPolarHBondContact OD1-CB 3.43Å; D13-R15 PolarHBondContact OD1-N 2.93Å; D13-R15 VanDerWaalsContact OD1-N 3.09Å; D13-R15 IonicContact OD1-NE 3.35Å; D13-R15 PolarHBondContact OD1-NE 3.44Å; D13-R15 IonicContact OD2-CZ 3.82Å; D13-R15 IonicContact OD2-NE 3.51Å; D13-R15 IonicContact OD2-NH2 3.25Å; D13-R15 PolarHBondContact OD2-NH2 3.18Å; D13-F16 HydrophobicContact CB-CD2 3.84Å; D13-F16 HydrophobicContact CB-CE2 4.2Å; D13-F16 PolarHBondContact O-N 3.35Å |
| 14 | P | 59.9 | Low | 60.3 | Low | 102 Ų | 102 | 78.8 Ų | 78.8 | 66% | 0.662 | 43% | 0.427 | S | S | * | . | G | 310 helix | trans | -56.2 | -23.5 | -177.5 | 22.1 | -34.6 | 0 | 0 | 0 | 113.3 | F16 R17 | P14-F16 PolarHBondContact O-N 2.78Å; P14-R17 PolarHBondContact O-N 3.18Å |
| 15 | R | 62.1 | Low | 61.8 | Low | 170 Ų | 170 | 78.8 Ų | 78.8 | 64% | 0.642 | 42% | 0.417 | S | S | * | . | G | 310 helix | trans | -64.7 | -21.6 | 174.7 | -70 | -177.9 | -82.2 | -163.9 | -4.1 | 114 | D13 | D13-R15 PolarHBondContact O-N 3.45Å; D13-R15 WeakPolarHBondContact OD1-CB 3.43Å; D13-R15 PolarHBondContact OD1-N 2.93Å; D13-R15 VanDerWaalsContact OD1-N 3.09Å; D13-R15 IonicContact OD1-NE 3.35Å; D13-R15 PolarHBondContact OD1-NE 3.44Å; D13-R15 IonicContact OD2-CZ 3.82Å; D13-R15 IonicContact OD2-NE 3.51Å; D13-R15 IonicContact OD2-NH2 3.25Å; D13-R15 PolarHBondContact OD2-NH2 3.18Å |
| 16 | F | 62.6 | Low | 63.3 | Low | 9 Ų | 9 | 78.3 Ų | 78.3 | 4% | 0.039 | 41% | 0.411 | C | S | . | . | G | 310 helix | trans | -108.1 | 22.2 | 179.4 | -54.3 | -60.8 | 0 | 0 | 0 | 113.1 | F10 D13 P14 V24 Q237 Y238 | F10-F16 HydrophobicContact CD1-CE2 4.17Å; F10-F16 VanDerWaalsContact O-CD2 3.24Å; F10-F16 WeakPolarHBondContact O-CD2 3.16Å; D13-F16 HydrophobicContact CB-CD2 3.84Å; D13-F16 HydrophobicContact CB-CE2 4.2Å; D13-F16 PolarHBondContact O-N 3.35Å; P14-F16 PolarHBondContact O-N 2.78Å; F16-V24 HydrophobicContact CB-CG1 4.49Å; F16-V24 HydrophobicContact CB-CG2 3.86Å; F16-V24 WeakPolarHBondContact O-CG1 3.37Å; F16-V24 VanDerWaalsContact O-CG2 3.3Å; F16-V24 WeakPolarHBondContact O-CG2 2.91Å; F16-V24 PolarHBondContact O-N 2.82Å; F16-Q237 HydrophobicContact CE1-CB 4.16Å; F16-Q237 HydrophobicContact CE1-CG 3.91Å; F16-Q237 HydrophobicContact CZ-CG 4.36Å; F16-Y238 HydrophobicContact CB-CD2 4.04Å; F16-Y238 HydrophobicContact CD1-CD2 4.08Å; F16-Y238 HydrophobicContact CD1-CG 4.35Å; F16-Y238 HydrophobicContact CD2-CD2 4.16Å; F16-Y238 AromaticContact CG-CD2 3.83Å; F16-Y238 HydrophobicContact CG-CD2 3.83Å |
| 17 | R | 60.7 | Low | 64.8 | Low | 138 Ų | 138 | 73.9 Ų | 73.9 | 52% | 0.521 | 40% | 0.395 | S | S | . | . | B | Isolated β-bridge | trans | -104.8 | 129 | 171.2 | -64.3 | -178.2 | 176.5 | -127.9 | -4.1 | 109 | P14 | P14-R17 PolarHBondContact O-N 3.18Å |
| 18 | C | 57.3 | Low | 66.2 | Low | 26 Ų | 26 | 70.8 Ų | 70.8 | 18% | 0.176 | 38% | 0.381 | C | S | . | . | trans | -82 | 163.1 | 168.5 | 65.3 | 0 | 0 | 0 | 0 | 110.3 | G20 C22 | C18-G20 PolarHBondContact O-N 3.48Å; C18-C22 PolarHBondContact N-O 3.24Å; C18-C22 PolarHBondContact SG-O 3.12Å | ||
| 19 | C | 56.6 | Low | 67.8 | Low | 117 Ų | 117 | 65.5 Ų | 65.5 | 79% | 0.791 | 37% | 0.365 | S | S | * | . | S | Bend | trans | -59.9 | 106.5 | 174.6 | -160.9 | 0 | 0 | 0 | 0 | 108.9 | ||
| 20 | G | 52.9 | Low | 69.2 | Low | 51 Ų | 51 | 65.5 Ų | 65.5 | 53% | 0.526 | 36% | 0.363 | S | S | . | . | S | Bend | trans | 109 | 55.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | C18 C22 | C18-G20 PolarHBondContact O-N 3.48Å; G20-C22 PolarHBondContact O-N 3.02Å; G20-C22 PolarHBondContact O-SG 3.48Å |
| 21 | C | 52.9 | Low | 70.5 | Confident | 131 Ų | 131 | 63 Ų | 63 | 89% | 0.885 | 35% | 0.352 | S | S | * | . | S | Bend | trans | 55.5 | -6.3 | 162.9 | -58.4 | 0 | 0 | 0 | 0 | 118.5 | ||
| 22 | C | 64.8 | Low | 72.1 | Confident | 62 Ų | 62 | 62.1 Ų | 62.1 | 42% | 0.419 | 35% | 0.345 | S | S | . | . | trans | -86.9 | 146.3 | -177.6 | -64.3 | 0 | 0 | 0 | 0 | 109.7 | C18 G20 | C18-C22 PolarHBondContact N-O 3.24Å; C18-C22 PolarHBondContact SG-O 3.12Å; G20-C22 PolarHBondContact O-N 3.02Å; G20-C22 PolarHBondContact O-SG 3.48Å | ||
| 23 | H | 75.5 | Confident | 73.8 | Confident | 42 Ų | 42 | 61.8 Ų | 61.8 | 19% | 0.194 | 34% | 0.341 | C | S | . | . | B | Isolated β-bridge | trans | -64.1 | 138.6 | 172.1 | -170.4 | -100.5 | 0 | 0 | 0 | 109.2 | A11 Q25 T26 G27 Y238 | A11-H23 WeakPolarHBondContact CB-NE2 3.43Å; H23-Q25 WeakPolarHBondContact ND1-CB 3.4Å; H23-Q25 PolarHBondContact ND1-N 2.92Å; H23-Q25 PolarHBondContact O-N 3.46Å; H23-T26 WeakPolarHBondContact O-CA 3.25Å; H23-T26 VanDerWaalsContact O-CB 3.3Å; H23-T26 WeakPolarHBondContact O-CB 3.03Å; H23-T26 PolarHBondContact O-N 2.81Å; H23-G27 PolarHBondContact O-N 3.27Å; H23-Y238 AromaticContact CE1-CE1 3.44Å; H23-Y238 VanDerWaalsContact CE1-CE1 3.44Å; H23-Y238 WeakPolarHBondContact CE1-CE1 3.49Å; H23-Y238 AromaticContact CE1-CE2 3.75Å; H23-Y238 AromaticContact CE1-CZ 3.2Å; H23-Y238 PolarHBondContact CE1-OH 2.9Å; H23-Y238 AromaticContact NE2-CE2 3.53Å; H23-Y238 AromaticContact NE2-CZ 3.35Å; H23-Y238 VanDerWaalsContact NE2-CZ 3.35Å; H23-Y238 PolarHBondContact NE2-OH 3.47Å |
| 24 | V | 77.4 | Confident | 75.1 | Confident | 3 Ų | 3 | 66.3 Ų | 66.3 | 2% | 0.018 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -51.7 | -33.5 | -179.1 | -80.4 | 0 | 0 | 0 | 0 | 113.6 | F16 T26 G27 A28 Y238 | F16-V24 HydrophobicContact CB-CG1 4.49Å; F16-V24 HydrophobicContact CB-CG2 3.86Å; F16-V24 WeakPolarHBondContact O-CG1 3.37Å; F16-V24 VanDerWaalsContact O-CG2 3.3Å; F16-V24 WeakPolarHBondContact O-CG2 2.91Å; F16-V24 PolarHBondContact O-N 2.82Å; V24-T26 VanDerWaalsContact C-N 3.34Å; V24-T26 PolarHBondContact O-N 3.44Å; V24-G27 PolarHBondContact O-N 3.43Å; V24-A28 PolarHBondContact O-N 3.24Å; V24-Y238 HydrophobicContact CG2-CD1 4.39Å; V24-Y238 HydrophobicContact CG2-CD2 4.26Å; V24-Y238 HydrophobicContact CG2-CG 3.89Å |
| 25 | Q | 81.7 | Confident | 76.6 | Confident | 35 Ų | 35 | 62.7 Ų | 62.7 | 16% | 0.164 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 176 | -162.9 | -176.5 | 1.6 | 0 | 0 | 112.2 | H23 A28 I29 V150 | H23-Q25 WeakPolarHBondContact ND1-CB 3.4Å; H23-Q25 PolarHBondContact ND1-N 2.92Å; H23-Q25 PolarHBondContact O-N 3.46Å; Q25-A28 PolarHBondContact O-N 3.41Å; Q25-I29 HydrophobicContact CG-CD1 4.27Å; Q25-I29 VanDerWaalsContact O-CG1 3.29Å; Q25-I29 WeakPolarHBondContact O-CG1 3.25Å; Q25-I29 PolarHBondContact O-N 2.98Å; Q25-V150 HydrophobicContact CG-CG1 3.3Å; Q25-V150 PolarHBondContact NE2-O 3.03Å; Q25-V150 VanDerWaalsContact NE2-O 3.16Å |
| 26 | T | 86.6 | Confident | 78.1 | Confident | 52 Ų | 52 | 56.6 Ų | 56.6 | 32% | 0.319 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -65 | -43.5 | 178.4 | -55.3 | 0 | 0 | 0 | 0 | 109.9 | H23 V24 A28 I29 F30 | H23-T26 WeakPolarHBondContact O-CA 3.25Å; H23-T26 VanDerWaalsContact O-CB 3.3Å; H23-T26 WeakPolarHBondContact O-CB 3.03Å; H23-T26 PolarHBondContact O-N 2.81Å; V24-T26 VanDerWaalsContact C-N 3.34Å; V24-T26 PolarHBondContact O-N 3.44Å; T26-A28 PolarHBondContact O-N 3.09Å; T26-I29 PolarHBondContact O-N 3.02Å; T26-F30 HydrophobicContact CG2-CD2 3.6Å; T26-F30 HydrophobicContact CG2-CE2 3.42Å; T26-F30 VanDerWaalsContact CG2-CE2 3.42Å; T26-F30 VanDerWaalsContact O-CD2 3.22Å; T26-F30 WeakPolarHBondContact O-CD2 3.17Å; T26-F30 PolarHBondContact O-N 3Å |
| 27 | G | 86.2 | Confident | 79.6 | Confident | 16 Ų | 16 | 60.7 Ų | 60.7 | 17% | 0.165 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -57.9 | -45 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | H23 V24 I29 F30 L31 | H23-G27 PolarHBondContact O-N 3.27Å; V24-G27 PolarHBondContact O-N 3.43Å; G27-I29 PolarHBondContact O-N 3.39Å; G27-F30 PolarHBondContact O-N 3.29Å; G27-L31 WeakPolarHBondContact O-CB 2.94Å; G27-L31 PolarHBondContact O-N 3.01Å |
| 28 | A | 89 | Confident | 81 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.5 | -37.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | V24 Q25 T26 G32 M146 I231 I232 C235 | V24-A28 PolarHBondContact O-N 3.24Å; Q25-A28 PolarHBondContact O-N 3.41Å; T26-A28 PolarHBondContact O-N 3.09Å; A28-G32 PolarHBondContact O-N 3.35Å; A28-M146 WeakPolarHBondContact O-CE 3.05Å; A28-I231 HydrophobicContact CB-CG2 4.46Å; A28-I232 HydrophobicContact CB-CD1 4.11Å; A28-C235 HydrophobicContact CB-CB 3.7Å; A28-C235 VanDerWaalsContact CB-SG 3.54Å |
| 29 | I | 90.9 | Very high | 82.7 | Confident | 55 Ų | 55 | 58 Ų | 58 | 28% | 0.282 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.6 | -48.2 | 175.3 | -68.1 | 165.1 | 0 | 0 | 0 | 110.3 | Q25 T26 G27 L31 G32 M33 V150 | Q25-I29 HydrophobicContact CG-CD1 4.27Å; Q25-I29 VanDerWaalsContact O-CG1 3.29Å; Q25-I29 WeakPolarHBondContact O-CG1 3.25Å; Q25-I29 PolarHBondContact O-N 2.98Å; T26-I29 PolarHBondContact O-N 3.02Å; G27-I29 PolarHBondContact O-N 3.39Å; I29-L31 VanDerWaalsContact C-N 3.31Å; I29-L31 PolarHBondContact O-N 3.43Å; I29-G32 PolarHBondContact O-N 3.39Å; I29-G32 VanDerWaalsContact O-N 3.16Å; I29-M33 HydrophobicContact CG2-CG 4.29Å; I29-M33 VanDerWaalsContact O-CG 3.32Å; I29-M33 WeakPolarHBondContact O-CG 3.32Å; I29-M33 PolarHBondContact O-N 2.96Å; I29-V150 HydrophobicContact CD1-CG1 3.95Å; I29-V150 HydrophobicContact CG1-CG1 3.79Å |
| 30 | F | 91.2 | Very high | 84.4 | Confident | 144 Ų | 144 | 54.7 Ų | 54.7 | 63% | 0.632 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60.4 | -41.5 | 177.5 | -84.7 | -69.6 | 0 | 0 | 0 | 112 | T26 G27 M33 Y34 | T26-F30 HydrophobicContact CG2-CD2 3.6Å; T26-F30 HydrophobicContact CG2-CE2 3.42Å; T26-F30 VanDerWaalsContact CG2-CE2 3.42Å; T26-F30 VanDerWaalsContact O-CD2 3.22Å; T26-F30 WeakPolarHBondContact O-CD2 3.17Å; T26-F30 PolarHBondContact O-N 3Å; G27-F30 PolarHBondContact O-N 3.29Å; F30-M33 PolarHBondContact O-N 2.95Å; F30-Y34 WeakPolarHBondContact O-CB 3.22Å; F30-Y34 PolarHBondContact O-N 3.33Å |
| 31 | L | 90.9 | Very high | 86.3 | Confident | 12 Ų | 12 | 59 Ų | 59 | 6% | 0.063 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 174.6 | -176.5 | 60.3 | 0 | 0 | 0 | 111.8 | G27 I29 Y34 N35 F228 I231 I232 | G27-L31 WeakPolarHBondContact O-CB 2.94Å; G27-L31 PolarHBondContact O-N 3.01Å; I29-L31 VanDerWaalsContact C-N 3.31Å; I29-L31 PolarHBondContact O-N 3.43Å; L31-Y34 PolarHBondContact O-N 3.33Å; L31-N35 VanDerWaalsContact O-CG 3.32Å; L31-N35 PolarHBondContact O-N 2.83Å; L31-N35 PolarHBondContact O-ND2 2.93Å; L31-N35 VanDerWaalsContact O-ND2 3.11Å; L31-F228 HydrophobicContact CD1-CD1 3.35Å; L31-F228 HydrophobicContact CD1-CE1 3.43Å; L31-F228 VanDerWaalsContact CD1-CE1 3.43Å; L31-F228 HydrophobicContact CD1-CG 4.08Å; L31-F228 HydrophobicContact CD1-CZ 4.21Å; L31-F228 HydrophobicContact CD2-CB 4.11Å; L31-F228 HydrophobicContact CD2-CD1 3.79Å; L31-F228 HydrophobicContact CD2-CG 4.28Å; L31-F228 HydrophobicContact CG-CD1 4.22Å; L31-I231 HydrophobicContact CD2-CG2 4.45Å; L31-I232 HydrophobicContact CD2-CD1 3.9Å; L31-I232 HydrophobicContact CD2-CG1 4.05Å |
| 32 | G | 92.1 | Very high | 88 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.4 | -47.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A28 I29 Y34 N35 I36 | A28-G32 PolarHBondContact O-N 3.35Å; I29-G32 PolarHBondContact O-N 3.39Å; I29-G32 VanDerWaalsContact O-N 3.16Å; G32-Y34 PolarHBondContact O-N 3.46Å; G32-N35 PolarHBondContact O-N 2.8Å; G32-I36 WeakPolarHBondContact O-CG1 3.3Å; G32-I36 PolarHBondContact O-N 3.38Å |
| 33 | M | 93.1 | Very high | 89.2 | Confident | 91 Ų | 91 | 51.9 Ų | 51.9 | 45% | 0.448 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 177.4 | -68.5 | -54.7 | -59.6 | 0 | 0 | 111.7 | I29 F30 N35 I36 V37 I147 | I29-M33 HydrophobicContact CG2-CG 4.29Å; I29-M33 VanDerWaalsContact O-CG 3.32Å; I29-M33 WeakPolarHBondContact O-CG 3.32Å; I29-M33 PolarHBondContact O-N 2.96Å; F30-M33 PolarHBondContact O-N 2.95Å; M33-N35 PolarHBondContact O-N 3.26Å; M33-I36 PolarHBondContact O-N 2.81Å; M33-V37 WeakPolarHBondContact O-CG2 3.41Å; M33-V37 PolarHBondContact O-N 2.93Å; M33-I147 HydrophobicContact SD-CD1 3.93Å |
| 34 | Y | 92.1 | Very high | 89.9 | Confident | 137 Ų | 137 | 53.8 Ų | 53.8 | 54% | 0.537 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -59.1 | -46 | 175.4 | 177.8 | -97 | 0 | 0 | 0 | 111.6 | F30 L31 G32 I36 V37 L38 | F30-Y34 WeakPolarHBondContact O-CB 3.22Å; F30-Y34 PolarHBondContact O-N 3.33Å; L31-Y34 PolarHBondContact O-N 3.33Å; G32-Y34 PolarHBondContact O-N 3.46Å; Y34-I36 PolarHBondContact O-N 2.84Å; Y34-V37 PolarHBondContact O-N 3.46Å; Y34-L38 HydrophobicContact CE1-CD2 4.3Å; Y34-L38 WeakPolarHBondContact O-CB 3.31Å; Y34-L38 PolarHBondContact O-N 3.04Å |
| 35 | N | 91.2 | Very high | 90.3 | Very high | 26 Ų | 26 | 60.2 Ų | 60.2 | 14% | 0.139 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 177.1 | -69.7 | -33.7 | 0 | 0 | 0 | 112.1 | L31 G32 M33 L38 H39 T143 F161 | L31-N35 VanDerWaalsContact O-CG 3.32Å; L31-N35 PolarHBondContact O-N 2.83Å; L31-N35 PolarHBondContact O-ND2 2.93Å; L31-N35 VanDerWaalsContact O-ND2 3.11Å; G32-N35 PolarHBondContact O-N 2.8Å; M33-N35 PolarHBondContact O-N 3.26Å; N35-L38 PolarHBondContact O-N 3.44Å; N35-H39 WeakPolarHBondContact O-CB 3.22Å; N35-H39 PolarHBondContact O-CD2 2.84Å; N35-H39 PolarHBondContact O-N 3.35Å; N35-T143 HydrophobicContact CB-CG2 4.08Å; N35-F161 WeakPolarHBondContact ND2-CZ 3.21Å |
| 36 | I | 94 | Very high | 90.4 | Very high | 42 Ų | 42 | 60.9 Ų | 60.9 | 22% | 0.215 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.7 | -45.2 | 174.7 | -73 | 177.8 | 0 | 0 | 0 | 111 | G32 M33 Y34 S40 L140 I147 | G32-I36 WeakPolarHBondContact O-CG1 3.3Å; G32-I36 PolarHBondContact O-N 3.38Å; M33-I36 PolarHBondContact O-N 2.81Å; Y34-I36 PolarHBondContact O-N 2.84Å; I36-S40 VanDerWaalsContact O-CB 3.23Å; I36-S40 WeakPolarHBondContact O-CB 3.28Å; I36-S40 PolarHBondContact O-N 3.1Å; I36-S40 PolarHBondContact O-OG 2.93Å; I36-L140 HydrophobicContact CB-CD2 4.26Å; I36-L140 HydrophobicContact CG1-CD2 4.16Å; I36-L140 HydrophobicContact CG2-CD2 4.09Å; I36-I147 HydrophobicContact CD1-CD1 3.39Å; I36-I147 HydrophobicContact CG1-CD1 4.43Å |
| 37 | V | 94.3 | Very high | 90.3 | Very high | 94 Ų | 94 | 62 Ų | 62 | 57% | 0.57 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -62.9 | -44.8 | 177.8 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | M33 Y34 S40 F41 | M33-V37 WeakPolarHBondContact O-CG2 3.41Å; M33-V37 PolarHBondContact O-N 2.93Å; Y34-V37 PolarHBondContact O-N 3.46Å; V37-S40 PolarHBondContact O-N 3.41Å; V37-F41 WeakPolarHBondContact O-CB 3.46Å; V37-F41 PolarHBondContact O-N 2.89Å |
| 38 | L | 90.6 | Very high | 90.2 | Very high | 81 Ų | 81 | 67.7 Ų | 67.7 | 42% | 0.424 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 179.6 | -170.8 | 69.8 | 0 | 0 | 0 | 111.9 | Y34 N35 F41 A42 | Y34-L38 HydrophobicContact CE1-CD2 4.3Å; Y34-L38 WeakPolarHBondContact O-CB 3.31Å; Y34-L38 PolarHBondContact O-N 3.04Å; N35-L38 PolarHBondContact O-N 3.44Å; L38-F41 PolarHBondContact O-N 3.41Å; L38-A42 WeakPolarHBondContact O-CB 3.37Å; L38-A42 PolarHBondContact O-N 2.97Å |
| 39 | H | 92.6 | Very high | 89.7 | Confident | 28 Ų | 28 | 69.8 Ų | 69.8 | 13% | 0.13 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -66.8 | -39.5 | 176.6 | -65.7 | -37.2 | 0 | 0 | 0 | 111.9 | N35 F41 A42 I43 L136 L140 | N35-H39 WeakPolarHBondContact O-CB 3.22Å; N35-H39 PolarHBondContact O-CD2 2.84Å; N35-H39 PolarHBondContact O-N 3.35Å; H39-F41 VanDerWaalsContact C-N 3.35Å; H39-A42 PolarHBondContact O-N 3.19Å; H39-I43 VanDerWaalsContact O-CG1 3.3Å; H39-I43 WeakPolarHBondContact O-CG1 3.41Å; H39-I43 PolarHBondContact O-N 2.8Å; H39-L136 HydrophobicContact CB-CD2 4.37Å; H39-L140 HydrophobicContact CB-CD2 3.69Å; H39-L140 HydrophobicContact CB-CG 4.03Å |
| 40 | S | 92.3 | Very high | 89 | Confident | 47 Ų | 47 | 69.8 Ų | 69.8 | 33% | 0.329 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.8 | -43.1 | 175.5 | -58.2 | 0 | 0 | 0 | 0 | 111.1 | I36 V37 I43 C44 | I36-S40 VanDerWaalsContact O-CB 3.23Å; I36-S40 WeakPolarHBondContact O-CB 3.28Å; I36-S40 PolarHBondContact O-N 3.1Å; I36-S40 PolarHBondContact O-OG 2.93Å; V37-S40 PolarHBondContact O-N 3.41Å; S40-I43 PolarHBondContact O-N 3.33Å; S40-C44 PolarHBondContact O-N 3.33Å; S40-C44 PolarHBondContact O-SG 2.8Å |
| 41 | F | 91.7 | Very high | 88.2 | Confident | 140 Ų | 140 | 69.4 Ų | 69.4 | 61% | 0.614 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62.9 | -43.5 | 175.4 | -178.5 | -100.8 | 0 | 0 | 0 | 111.9 | V37 L38 H39 I43 C44 F45 | V37-F41 WeakPolarHBondContact O-CB 3.46Å; V37-F41 PolarHBondContact O-N 2.89Å; L38-F41 PolarHBondContact O-N 3.41Å; H39-F41 VanDerWaalsContact C-N 3.35Å; F41-I43 PolarHBondContact O-N 3.07Å; F41-C44 PolarHBondContact O-N 2.65Å; F41-F45 WeakPolarHBondContact O-CB 3.41Å; F41-F45 PolarHBondContact O-N 3.29Å |
| 42 | A | 90.4 | Very high | 87.2 | Confident | 33 Ų | 33 | 71.6 Ų | 71.6 | 27% | 0.273 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.7 | -42 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L38 H39 F45 L46 L136 | L38-A42 WeakPolarHBondContact O-CB 3.37Å; L38-A42 PolarHBondContact O-N 2.97Å; H39-A42 PolarHBondContact O-N 3.19Å; A42-F45 PolarHBondContact O-N 3.43Å; A42-L46 WeakPolarHBondContact O-CB 3.25Å; A42-L46 WeakPolarHBondContact O-CG 3.03Å; A42-L46 PolarHBondContact O-N 3.45Å; A42-L136 HydrophobicContact CB-CD1 4.12Å; A42-L136 HydrophobicContact CB-CD2 4.22Å |
| 43 | I | 89.5 | Confident | 85.8 | Confident | 12 Ų | 12 | 73.9 Ų | 73.9 | 6% | 0.062 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 174.8 | -68.3 | 168.6 | 0 | 0 | 0 | 110.6 | H39 S40 F41 F45 L46 I47 L136 F137 L140 | H39-I43 VanDerWaalsContact O-CG1 3.3Å; H39-I43 WeakPolarHBondContact O-CG1 3.41Å; H39-I43 PolarHBondContact O-N 2.8Å; S40-I43 PolarHBondContact O-N 3.33Å; F41-I43 PolarHBondContact O-N 3.07Å; I43-F45 VanDerWaalsContact C-N 3.3Å; I43-F45 PolarHBondContact O-N 2.89Å; I43-L46 PolarHBondContact O-N 3.02Å; I43-I47 HydrophobicContact CG2-CD1 3.61Å; I43-I47 HydrophobicContact CG2-CG1 4.22Å; I43-I47 WeakPolarHBondContact O-CB 3.17Å; I43-I47 VanDerWaalsContact O-CG1 3.31Å; I43-I47 WeakPolarHBondContact O-CG1 3.09Å; I43-I47 PolarHBondContact O-N 3.41Å; I43-L136 HydrophobicContact CD1-CB 3.89Å; I43-L136 HydrophobicContact CG1-CB 3.65Å; I43-L136 HydrophobicContact CG1-CD1 3.8Å; I43-L136 HydrophobicContact CG1-CG 4.31Å; I43-F137 HydrophobicContact CD1-CD1 4.42Å; I43-F137 HydrophobicContact CD1-CE1 4.37Å; I43-F137 HydrophobicContact CD1-CZ 4.47Å; I43-L140 HydrophobicContact CD1-CD1 3.49Å; I43-L140 VanDerWaalsContact CD1-CD1 3.49Å; I43-L140 HydrophobicContact CD1-CG 4.39Å |
| 44 | C | 89.3 | Confident | 84.2 | Confident | 81 Ų | 81 | 75.6 Ų | 75.6 | 55% | 0.547 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -58.8 | -42.8 | 176.8 | -70.6 | 0 | 0 | 0 | 0 | 111.9 | S40 F41 I47 F48 | S40-C44 PolarHBondContact O-N 3.33Å; S40-C44 PolarHBondContact O-SG 2.8Å; F41-C44 PolarHBondContact O-N 2.65Å; C44-I47 PolarHBondContact O-N 2.85Å; C44-F48 VanDerWaalsContact O-CB 3.31Å; C44-F48 WeakPolarHBondContact O-CB 3.32Å; C44-F48 PolarHBondContact O-N 3Å |
| 45 | F | 86.3 | Confident | 82.4 | Confident | 139 Ų | 139 | 74.6 Ų | 74.6 | 61% | 0.61 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -65 | -41.6 | 176.8 | -175.9 | -98.7 | 0 | 0 | 0 | 112.1 | F41 A42 I43 F48 G49 | F41-F45 WeakPolarHBondContact O-CB 3.41Å; F41-F45 PolarHBondContact O-N 3.29Å; A42-F45 PolarHBondContact O-N 3.43Å; I43-F45 VanDerWaalsContact C-N 3.3Å; I43-F45 PolarHBondContact O-N 2.89Å; F45-F48 PolarHBondContact O-N 2.92Å; F45-G49 PolarHBondContact O-N 2.65Å |
| 46 | L | 84.3 | Confident | 80.6 | Confident | 48 Ų | 48 | 81.7 Ų | 81.7 | 25% | 0.251 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.8 | -41.6 | 175.8 | -74.2 | 179 | 0 | 0 | 0 | 112.4 | A42 I43 A50 A132 I133 L136 | A42-L46 WeakPolarHBondContact O-CB 3.25Å; A42-L46 WeakPolarHBondContact O-CG 3.03Å; A42-L46 PolarHBondContact O-N 3.45Å; I43-L46 PolarHBondContact O-N 3.02Å; L46-A50 WeakPolarHBondContact O-CB 3.06Å; L46-A50 PolarHBondContact O-N 3.16Å; L46-A132 HydrophobicContact CD1-CB 4.16Å; L46-I133 HydrophobicContact CB-CG1 4.45Å; L46-I133 HydrophobicContact CD1-CG1 4.1Å; L46-L136 HydrophobicContact CD1-CD1 3.48Å; L46-L136 VanDerWaalsContact CD1-CD1 3.48Å |
| 47 | I | 84.7 | Confident | 78.6 | Confident | 76 Ų | 76 | 85.8 Ų | 85.8 | 39% | 0.39 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64.9 | -47.3 | 176.1 | -68.2 | 170.7 | 0 | 0 | 0 | 109.5 | I43 C44 G49 A50 L51 | I43-I47 HydrophobicContact CG2-CD1 3.61Å; I43-I47 HydrophobicContact CG2-CG1 4.22Å; I43-I47 WeakPolarHBondContact O-CB 3.17Å; I43-I47 VanDerWaalsContact O-CG1 3.31Å; I43-I47 WeakPolarHBondContact O-CG1 3.09Å; I43-I47 PolarHBondContact O-N 3.41Å; C44-I47 PolarHBondContact O-N 2.85Å; I47-G49 PolarHBondContact O-N 2.98Å; I47-A50 CarbonylContact O-C 3.58Å; I47-A50 WeakPolarHBondContact O-CA 3.31Å; I47-A50 PolarHBondContact O-N 2.88Å; I47-L51 HydrophobicContact CG2-CD1 3.74Å; I47-L51 HydrophobicContact CG2-CG 4.05Å; I47-L51 WeakPolarHBondContact O-CB 3.23Å; I47-L51 VanDerWaalsContact O-CG 3.23Å; I47-L51 WeakPolarHBondContact O-CG 3.13Å; I47-L51 PolarHBondContact O-N 3.44Å |
| 48 | F | 84.2 | Confident | 76.3 | Confident | 136 Ų | 136 | 83.2 Ų | 83.2 | 60% | 0.596 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -60.2 | -45.1 | 177.8 | -175.5 | -98.4 | 0 | 0 | 0 | 111.9 | C44 F45 A50 L51 D52 | C44-F48 VanDerWaalsContact O-CB 3.31Å; C44-F48 WeakPolarHBondContact O-CB 3.32Å; C44-F48 PolarHBondContact O-N 3Å; F45-F48 PolarHBondContact O-N 2.92Å; F48-A50 PolarHBondContact O-N 3.06Å; F48-L51 PolarHBondContact O-N 2.86Å; F48-D52 PolarHBondContact O-N 2.87Å |
| 49 | G | 77.2 | Confident | 74.3 | Confident | 43 Ų | 43 | 85.4 Ų | 85.4 | 44% | 0.443 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.8 | -24.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114 | F45 I47 | F45-G49 PolarHBondContact O-N 2.65Å; I47-G49 PolarHBondContact O-N 2.98Å |
| 50 | A | 76.1 | Confident | 72 | Confident | 56 Ų | 56 | 92 Ų | 92 | 46% | 0.463 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -85.4 | -24.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L46 I47 F48 P53 | L46-A50 WeakPolarHBondContact O-CB 3.06Å; L46-A50 PolarHBondContact O-N 3.16Å; I47-A50 CarbonylContact O-C 3.58Å; I47-A50 WeakPolarHBondContact O-CA 3.31Å; I47-A50 PolarHBondContact O-N 2.88Å; F48-A50 PolarHBondContact O-N 3.06Å; A50-P53 WeakPolarHBondContact O-CD 3.26Å |
| 51 | L | 75 | Confident | 69.4 | Low | 136 Ų | 136 | 96.3 Ų | 96.3 | 71% | 0.712 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -81.9 | -31 | 175.7 | -70.8 | 175.4 | 0 | 0 | 0 | 112.1 | I47 F48 P53 | I47-L51 HydrophobicContact CG2-CD1 3.74Å; I47-L51 HydrophobicContact CG2-CG 4.05Å; I47-L51 WeakPolarHBondContact O-CB 3.23Å; I47-L51 VanDerWaalsContact O-CG 3.23Å; I47-L51 WeakPolarHBondContact O-CG 3.13Å; I47-L51 PolarHBondContact O-N 3.44Å; F48-L51 PolarHBondContact O-N 2.86Å; L51-P53 VanDerWaalsContact O-CD 3.3Å; L51-P53 WeakPolarHBondContact O-CD 3.19Å |
| 52 | D | 69.8 | Low | 67.2 | Low | 58 Ų | 58 | 94.1 Ų | 94.1 | 31% | 0.31 | 51% | 0.513 | S | S | . | . | trans | -117.5 | 57.8 | 176.4 | -164.7 | 6.7 | 0 | 0 | 0 | 112.8 | F48 D54 L55 | F48-D52 PolarHBondContact O-N 2.87Å; D52-D54 PolarHBondContact O-N 3.45Å; D52-L55 WeakPolarHBondContact OD1-CB 3.19Å; D52-L55 PolarHBondContact OD1-N 3.46Å; D52-L55 VanDerWaalsContact OD2-CB 3.32Å; D52-L55 WeakPolarHBondContact OD2-CB 3.23Å | ||
| 53 | P | 62 | Low | 64.8 | Low | 47 Ų | 47 | 99.5 Ų | 99.5 | 31% | 0.305 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.5 | -25.4 | 170.1 | 30.8 | -33 | 0 | 0 | 0 | 110.6 | A50 L51 F56 F57 | A50-P53 WeakPolarHBondContact O-CD 3.26Å; L51-P53 VanDerWaalsContact O-CD 3.3Å; L51-P53 WeakPolarHBondContact O-CD 3.19Å; P53-F56 PolarHBondContact O-N 2.91Å; P53-F57 HydrophobicContact CB-CD2 4.38Å; P53-F57 VanDerWaalsContact O-CD2 3.31Å; P53-F57 WeakPolarHBondContact O-CD2 3.44Å; P53-F57 PolarHBondContact O-N 3.22Å |
| 54 | D | 60.3 | Low | 61.9 | Low | 128 Ų | 128 | 104 Ų | 104 | 68% | 0.684 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68.8 | -38 | -173.4 | -67 | -23.3 | 0 | 0 | 0 | 112.5 | D52 F56 G58 | D52-D54 PolarHBondContact O-N 3.45Å; D54-F56 VanDerWaalsContact C-N 3.3Å; D54-F56 PolarHBondContact O-N 2.84Å; D54-G58 WeakPolarHBondContact O-CA 3.44Å; D54-G58 PolarHBondContact O-N 2.87Å |
| 55 | L | 54.4 | Low | 58.9 | Low | 115 Ų | 115 | 105.8 Ų | 105.8 | 60% | 0.602 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.7 | -35.7 | 174.3 | -163.1 | 100.2 | 0 | 0 | 0 | 111.6 | D52 I59 | D52-L55 WeakPolarHBondContact OD1-CB 3.19Å; D52-L55 PolarHBondContact OD1-N 3.46Å; D52-L55 VanDerWaalsContact OD2-CB 3.32Å; D52-L55 WeakPolarHBondContact OD2-CB 3.23Å; L55-I59 PolarHBondContact O-N 3.44Å |
| 56 | F | 52.4 | Low | 56 | Low | 176 Ų | 176 | 107.3 Ų | 107.3 | 77% | 0.772 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -75.2 | -39.1 | -179.3 | -144.6 | -87.5 | 0 | 0 | 0 | 112.2 | P53 D54 | P53-F56 PolarHBondContact O-N 2.91Å; D54-F56 VanDerWaalsContact C-N 3.3Å; D54-F56 PolarHBondContact O-N 2.84Å |
| 57 | F | 52.8 | Low | 53.4 | Low | 127 Ų | 127 | 111.2 Ų | 111.2 | 56% | 0.557 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -73.8 | -31.7 | 172.9 | -82.7 | -74.2 | 0 | 0 | 0 | 112.7 | P53 I59 K60 N61 | P53-F57 HydrophobicContact CB-CD2 4.38Å; P53-F57 VanDerWaalsContact O-CD2 3.31Å; P53-F57 WeakPolarHBondContact O-CD2 3.44Å; P53-F57 PolarHBondContact O-N 3.22Å; F57-I59 VanDerWaalsContact C-N 3.35Å; F57-I59 PolarHBondContact O-N 2.87Å; F57-K60 PolarHBondContact O-N 3.49Å; F57-N61 PolarHBondContact O-N 3.36Å |
| 58 | G | 46.3 | Very low | 50.5 | Low | 40 Ų | 40 | 113.5 Ų | 113.5 | 41% | 0.412 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -61.7 | -39 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | D54 | D54-G58 WeakPolarHBondContact O-CA 3.44Å; D54-G58 PolarHBondContact O-N 2.87Å |
| 59 | I | 49.4 | Very low | 47.9 | Very low | 128 Ų | 128 | 112.7 Ų | 112.7 | 66% | 0.656 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -72.4 | -33.3 | 175.5 | -63.3 | 178.5 | 0 | 0 | 0 | 111.2 | L55 F57 N61 S62 | L55-I59 PolarHBondContact O-N 3.44Å; F57-I59 VanDerWaalsContact C-N 3.35Å; F57-I59 PolarHBondContact O-N 2.87Å; I59-N61 PolarHBondContact O-N 2.73Å; I59-S62 PolarHBondContact O-N 3.45Å |
| 60 | K | 43.3 | Very low | 45.7 | Very low | 166 Ų | 166 | 115.7 Ų | 115.7 | 72% | 0.722 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -73 | -16.1 | -179.9 | -161.8 | 167.7 | 178.2 | 178.5 | 0 | 113.8 | F57 | F57-K60 PolarHBondContact O-N 3.49Å |
| 61 | N | 38.9 | Very low | 43.5 | Very low | 137 Ų | 137 | 120.5 Ų | 120.5 | 73% | 0.733 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | -7.1 | 176.9 | -88 | 4.5 | 0 | 0 | 0 | 114.9 | F57 I59 | F57-N61 PolarHBondContact O-N 3.36Å; I59-N61 PolarHBondContact O-N 2.73Å |
| 62 | S | 44.3 | Very low | 41.3 | Very low | 95 Ų | 95 | 121.2 Ų | 121.2 | 66% | 0.664 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -82.3 | -20.7 | -178.3 | -65.9 | 0 | 0 | 0 | 0 | 114.1 | I59 | I59-S62 PolarHBondContact O-N 3.45Š|
| 63 | D | 41.1 | Very low | 39.2 | Very low | 146 Ų | 146 | 124.1 Ų | 124.1 | 78% | 0.781 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -128.3 | 55 | -175.8 | -64.4 | -37.3 | 0 | 0 | 0 | 113.5 | ||
| 64 | S | 28.6 | Very low | 37.6 | Very low | 105 Ų | 105 | 128 Ų | 128 | 73% | 0.734 | 71% | 0.709 | S | S | * | * | trans | -166.5 | 134.9 | 144.3 | -96.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 65 | P | 24.9 | Very low | 35.8 | Very low | 120 Ų | 120 | 124.7 Ų | 124.7 | 78% | 0.779 | 71% | 0.705 | S | S | * | * | trans | -72.2 | 131.5 | -177.8 | 29.6 | -33.1 | 0 | 0 | 0 | 112.4 | ||||
| 66 | M | 26.1 | Very low | 34.5 | Very low | 171 Ų | 171 | 124.4 Ų | 124.4 | 84% | 0.842 | 71% | 0.712 | S | S | * | * | trans | 33.9 | 91.7 | 137.9 | -171.8 | 176 | 152.6 | 0 | 0 | 117 | ||||
| 67 | V | 30.4 | Very low | 33.3 | Very low | 130 Ų | 130 | 121 Ų | 121 | 79% | 0.788 | 71% | 0.711 | S | S | * | * | trans | -129.3 | 95.2 | 136.7 | -173.7 | 0 | 0 | 0 | 0 | 107.2 | V69 | V67-V69 HydrophobicContact CG1-CG2 3.74Å; V67-V69 PolarHBondContact O-N 3.43Å | ||
| 68 | T | 23.6 | Very low | 32.1 | Very low | 123 Ų | 123 | 123.9 Ų | 123.9 | 76% | 0.755 | 73% | 0.726 | S | S | * | * | trans | -65.4 | 94.1 | 167.9 | -49.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 69 | V | 29.6 | Very low | 31.2 | Very low | 120 Ų | 120 | 129.4 Ų | 129.4 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | trans | -108 | 95.7 | 159.9 | -171.9 | 0 | 0 | 0 | 0 | 108.2 | V67 | V67-V69 HydrophobicContact CG1-CG2 3.74Å; V67-V69 PolarHBondContact O-N 3.43Å | ||
| 70 | V | 31.3 | Very low | 30 | Very low | 106 Ų | 106 | 132.2 Ų | 132.2 | 64% | 0.642 | 75% | 0.752 | S | S | * | * | trans | 31.3 | 118 | 143.1 | -169.6 | 0 | 0 | 0 | 0 | 117.5 | E72 | V70-E72 HydrophobicContact CG1-CG 4.19Å; V70-E72 PolarHBondContact O-N 3.18Å; V70-E72 VanDerWaalsContact O-N 3.1Å | ||
| 71 | N | 30 | Very low | 29.2 | Very low | 157 Ų | 157 | 130.4 Ų | 130.4 | 84% | 0.84 | 76% | 0.755 | S | S | * | * | trans | -49.4 | 106.3 | 157.2 | -68.9 | -16.8 | 0 | 0 | 0 | 111.1 | ||||
| 72 | E | 28 | Very low | 28.7 | Very low | 150 Ų | 150 | 132.8 Ų | 132.8 | 70% | 0.701 | 76% | 0.762 | S | S | * | * | trans | -116.7 | 89.1 | 159.3 | -71.8 | -157.7 | 152.1 | 0 | 0 | 109.7 | V70 I74 | V70-E72 HydrophobicContact CG1-CG 4.19Å; V70-E72 PolarHBondContact O-N 3.18Å; V70-E72 VanDerWaalsContact O-N 3.1Å; E72-I74 VanDerWaalsContact C-N 3.25Å; E72-I74 HydrophobicContact CB-CD1 4.28Å; E72-I74 HydrophobicContact CB-CG1 4.25Å; E72-I74 HydrophobicContact CG-CD1 4.45Å; E72-I74 PolarHBondContact O-N 3.34Å | ||
| 73 | S | 26.2 | Very low | 27.7 | Very low | 119 Ų | 119 | 133.5 Ų | 133.5 | 83% | 0.832 | 77% | 0.767 | S | S | * | * | trans | -62.2 | 88.8 | 150.2 | 53.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 74 | I | 27.1 | Very low | 27.1 | Very low | 129 Ų | 129 | 133.5 Ų | 133.5 | 66% | 0.662 | 77% | 0.766 | S | S | * | * | trans | -127.7 | 113.7 | 167.9 | -60.4 | 178.4 | 0 | 0 | 0 | 107.9 | E72 | E72-I74 VanDerWaalsContact C-N 3.25Å; E72-I74 HydrophobicContact CB-CD1 4.28Å; E72-I74 HydrophobicContact CB-CG1 4.25Å; E72-I74 HydrophobicContact CG-CD1 4.45Å; E72-I74 PolarHBondContact O-N 3.34Å | ||
| 75 | G | 24.2 | Very low | 27.1 | Very low | 58 Ų | 58 | 135.8 Ų | 135.8 | 60% | 0.598 | 77% | 0.77 | S | S | * | * | trans | -60.1 | 156.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 76 | S | 26.3 | Very low | 27.6 | Very low | 109 Ų | 109 | 138 Ų | 138 | 76% | 0.762 | 77% | 0.77 | S | S | * | * | trans | 28.9 | 128.4 | 135.8 | 54.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 77 | S | 27.4 | Very low | 27.7 | Very low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 77% | 0.77 | S | S | * | * | trans | 103.1 | 110.2 | 150.6 | -27 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 78 | E | 26.4 | Very low | 27.7 | Very low | 186 Ų | 186 | 139.4 Ų | 139.4 | 87% | 0.869 | 77% | 0.771 | S | S | * | * | trans | 60.2 | 85.2 | 140.7 | -59.9 | -178.5 | 166.2 | 0 | 0 | 117.6 | K80 | E78-K80 PolarHBondContact O-N 2.84Š| ||
| 79 | L | 28.4 | Very low | 28.2 | Very low | 156 Ų | 156 | 139.2 Ų | 139.2 | 82% | 0.817 | 77% | 0.772 | S | S | * | * | trans | -62.5 | 101.5 | 163.7 | -179.4 | -95.2 | 0 | 0 | 0 | 109.6 | V81 | L79-V81 HydrophobicContact CD1-CG2 4.29Š| ||
| 80 | K | 23.9 | Very low | 28.2 | Very low | 187 Ų | 187 | 141.8 Ų | 141.8 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | trans | -94.1 | 114.1 | 168.9 | -158.1 | 178.9 | -176.1 | -176.4 | 0 | 108.1 | E78 Q82 | E78-K80 PolarHBondContact O-N 2.84Å; K80-Q82 PolarHBondContact O-N 3.28Å | ||
| 81 | V | 26.4 | Very low | 28.1 | Very low | 128 Ų | 128 | 144.4 Ų | 144.4 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -52.7 | 108.1 | 178.3 | 177.9 | 0 | 0 | 0 | 0 | 109.8 | L79 S83 | L79-V81 HydrophobicContact CD1-CG2 4.29Å; V81-S83 PolarHBondContact O-N 2.86Å | ||
| 82 | Q | 27.6 | Very low | 28.4 | Very low | 188 Ų | 188 | 141.4 Ų | 141.4 | 88% | 0.879 | 78% | 0.775 | S | S | * | * | trans | -89.2 | 103.6 | 178.4 | -145.5 | 168.5 | -0.5 | 0 | 0 | 108 | K80 L84 | K80-Q82 PolarHBondContact O-N 3.28Å; Q82-L84 PolarHBondContact O-N 2.94Å; Q82-L84 VanDerWaalsContact O-N 3.17Å | ||
| 83 | S | 24.8 | Very low | 28.9 | Very low | 110 Ų | 110 | 140.6 Ų | 140.6 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | -59.5 | 108 | 169.6 | 159.9 | 0 | 0 | 0 | 0 | 109 | V81 N85 | V81-S83 PolarHBondContact O-N 2.86Å; S83-N85 PolarHBondContact O-N 3.28Å | ||
| 84 | L | 28.9 | Very low | 29.6 | Very low | 146 Ų | 146 | 140.8 Ų | 140.8 | 76% | 0.764 | 78% | 0.779 | S | S | * | * | trans | -88.7 | 104.1 | 173.2 | -158.4 | 127.3 | 0 | 0 | 0 | 108.4 | Q82 E86 | Q82-L84 PolarHBondContact O-N 2.94Å; Q82-L84 VanDerWaalsContact O-N 3.17Å; L84-E86 HydrophobicContact CD2-CB 4.12Å | ||
| 85 | N | 27.4 | Very low | 30.5 | Very low | 153 Ų | 153 | 140.5 Ų | 140.5 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -81.1 | 102.9 | 174.8 | 174.8 | 83.2 | 0 | 0 | 0 | 108.6 | S83 | S83-N85 PolarHBondContact O-N 3.28Š| ||
| 86 | E | 35.1 | Very low | 31.4 | Very low | 165 Ų | 165 | 143.2 Ų | 143.2 | 77% | 0.771 | 79% | 0.79 | S | S | * | * | trans | -139.2 | 100.8 | 170.5 | -151.2 | 165.2 | -165.7 | 0 | 0 | 112.6 | L84 | L84-E86 HydrophobicContact CD2-CB 4.12Š| ||
| 87 | M | 29.6 | Very low | 32.2 | Very low | 171 Ų | 171 | 143.1 Ų | 143.1 | 84% | 0.842 | 78% | 0.778 | S | S | * | * | trans | 39.4 | 104.7 | 140.7 | -161 | 159.5 | -109.6 | 0 | 0 | 119 | P89 | M87-P89 WeakPolarHBondContact O-CD 3.38Š| ||
| 88 | I | 28.8 | Very low | 33.1 | Very low | 160 Ų | 160 | 145.7 Ų | 145.7 | 82% | 0.821 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -79 | 121.7 | 169 | -62.4 | 159.3 | 0 | 0 | 0 | 109.5 | ||
| 89 | P | 34.9 | Very low | 34.4 | Very low | 119 Ų | 119 | 141.6 Ų | 141.6 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 140.5 | 160 | -1.1 | 21.5 | 0 | 0 | 0 | 110.5 | M87 | M87-P89 WeakPolarHBondContact O-CD 3.38Š|
| 90 | E | 29.3 | Very low | 35.2 | Very low | 175 Ų | 175 | 137.1 Ų | 137.1 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 147.7 | -171 | -56.4 | -170.2 | 121.2 | 0 | 0 | 115.7 | ||
| 91 | L | 29.6 | Very low | 35.8 | Very low | 161 Ų | 161 | 135.7 Ų | 135.7 | 84% | 0.843 | 74% | 0.741 | S | S | * | * | trans | 69.7 | 161.7 | 144.6 | -122.7 | 64.4 | 0 | 0 | 0 | 119.3 | ||||
| 92 | P | 35.8 | Very low | 36.9 | Very low | 94 Ų | 94 | 135 Ų | 135 | 61% | 0.61 | 73% | 0.733 | S | S | * | * | cis | -123.9 | 158.4 | -31.1 | 8.1 | 16.4 | 0 | 0 | 0 | 114.6 | ||||
| 93 | T | 38.8 | Very low | 38.2 | Very low | 132 Ų | 132 | 129 Ų | 129 | 81% | 0.81 | 71% | 0.712 | S | S | * | * | trans | 76.2 | 143.7 | 149 | 55.9 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 94 | P | 41.8 | Very low | 39.5 | Very low | 123 Ų | 123 | 128.1 Ų | 128.1 | 80% | 0.799 | 70% | 0.698 | S | S | * | * | trans | -99.6 | 115.3 | -144.8 | 35.7 | -26.6 | 0 | 0 | 0 | 111.6 | ||||
| 95 | V | 44.5 | Very low | 40.6 | Very low | 124 Ų | 124 | 126.7 Ų | 126.7 | 75% | 0.752 | 69% | 0.691 | S | S | * | * | trans | -98.4 | 137.9 | 160.4 | -178.3 | 0 | 0 | 0 | 0 | 106.9 | Q97 | V95-Q97 VanDerWaalsContact C-N 3.32Å; V95-Q97 PolarHBondContact O-N 3.35Å | ||
| 96 | P | 44.6 | Very low | 41.5 | Very low | 114 Ų | 114 | 126.8 Ų | 126.8 | 74% | 0.74 | 68% | 0.684 | S | S | * | * | trans | -57.5 | 92.4 | -179.6 | -22.6 | 33.2 | 0 | 0 | 0 | 111.2 | E98 | P96-E98 PolarHBondContact O-N 3.39Š| ||
| 97 | Q | 42.7 | Very low | 42.2 | Very low | 108 Ų | 108 | 124.7 Ų | 124.7 | 51% | 0.505 | 68% | 0.675 | S | S | . | * | trans | -82.3 | 62.3 | 179.2 | -167.3 | 176.8 | -27.1 | 0 | 0 | 108.4 | V95 W101 | V95-Q97 VanDerWaalsContact C-N 3.32Å; V95-Q97 PolarHBondContact O-N 3.35Å; Q97-W101 VanDerWaalsContact CD-NE1 3.32Å; Q97-W101 VanDerWaalsContact O-CD1 3.22Å | ||
| 98 | E | 46.8 | Very low | 43 | Very low | 160 Ų | 160 | 120.9 Ų | 120.9 | 75% | 0.748 | 66% | 0.657 | S | S | * | * | trans | -95.3 | -16.7 | 175.4 | -67.7 | -159.9 | 145.3 | 0 | 0 | 112.7 | P96 N102 | P96-E98 PolarHBondContact O-N 3.39Å; E98-N102 PolarHBondContact O-ND2 2.91Å | ||
| 99 | S | 52.6 | Low | 43.9 | Very low | 100 Ų | 100 | 118.7 Ų | 118.7 | 70% | 0.699 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -92.7 | -27.8 | -177.6 | 58.8 | 0 | 0 | 0 | 0 | 114.5 | ||
| 100 | S | 44.5 | Very low | 44.8 | Very low | 61 Ų | 61 | 116.9 Ų | 116.9 | 43% | 0.427 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -87.3 | -31.1 | -170.3 | -166 | 0 | 0 | 0 | 0 | 114.8 | N102 S103 L104 | S100-N102 VanDerWaalsContact C-N 3.34Å; S100-S103 PolarHBondContact O-OG 2.95Å; S100-S103 VanDerWaalsContact O-OG 3.05Å; S100-L104 PolarHBondContact O-N 3.16Å |
| 101 | W | 37.5 | Very low | 46 | Very low | 158 Ų | 158 | 112.3 Ų | 112.3 | 60% | 0.598 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69.5 | -37.5 | 176.7 | -62.5 | 110.1 | 0 | 0 | 0 | 111.2 | Q97 S103 L104 D105 | Q97-W101 VanDerWaalsContact CD-NE1 3.32Å; Q97-W101 VanDerWaalsContact O-CD1 3.22Å; W101-S103 PolarHBondContact O-N 3.48Å; W101-L104 PolarHBondContact O-N 3.44Å; W101-D105 VanDerWaalsContact O-CB 3.27Å; W101-D105 WeakPolarHBondContact O-CB 3.39Å; W101-D105 PolarHBondContact O-N 3.18Å |
| 102 | N | 50.2 | Low | 47.3 | Very low | 113 Ų | 113 | 107.4 Ų | 107.4 | 60% | 0.604 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.7 | -35.7 | 178.7 | -71.3 | -35.8 | 0 | 0 | 0 | 112.3 | E98 S100 K106 | E98-N102 PolarHBondContact O-ND2 2.91Å; S100-N102 VanDerWaalsContact C-N 3.34Å; N102-K106 WeakPolarHBondContact O-CB 3.45Å; N102-K106 PolarHBondContact O-N 3.15Å; N102-K106 VanDerWaalsContact O-N 3.09Å |
| 103 | S | 53.1 | Low | 48.2 | Very low | 63 Ų | 63 | 109.9 Ų | 109.9 | 44% | 0.441 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -72.6 | -45.7 | 176.8 | 61.7 | 0 | 0 | 0 | 0 | 111.5 | S100 W101 K106 Q107 | S100-S103 PolarHBondContact O-OG 2.95Å; S100-S103 VanDerWaalsContact O-OG 3.05Å; W101-S103 PolarHBondContact O-N 3.48Å; S103-K106 PolarHBondContact O-N 3.37Å; S103-Q107 WeakPolarHBondContact O-CB 3.41Å; S103-Q107 PolarHBondContact O-N 2.91Å |
| 104 | L | 52.1 | Low | 48.9 | Very low | 91 Ų | 91 | 107.3 Ų | 107.3 | 48% | 0.476 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67.5 | -43.7 | -177.7 | -170.5 | 68.6 | 0 | 0 | 0 | 111.9 | S100 W101 Q107 N108 | S100-L104 PolarHBondContact O-N 3.16Å; W101-L104 PolarHBondContact O-N 3.44Å; L104-Q107 PolarHBondContact O-N 3.43Å; L104-N108 VanDerWaalsContact O-CB 3.31Å; L104-N108 WeakPolarHBondContact O-CB 3.07Å; L104-N108 PolarHBondContact O-N 3.44Å; L104-N108 PolarHBondContact O-ND2 3.34Å |
| 105 | D | 53.8 | Low | 49.6 | Very low | 116 Ų | 116 | 106.8 Ų | 106.8 | 62% | 0.62 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -68.6 | -40.2 | 177 | -168.9 | 37.1 | 0 | 0 | 0 | 111.3 | W101 Q107 N108 F109 | W101-D105 VanDerWaalsContact O-CB 3.27Å; W101-D105 WeakPolarHBondContact O-CB 3.39Å; W101-D105 PolarHBondContact O-N 3.18Å; D105-Q107 VanDerWaalsContact C-N 3.34Å; D105-Q107 PolarHBondContact O-N 2.77Å; D105-N108 PolarHBondContact O-N 3Å; D105-F109 WeakPolarHBondContact O-CB 3.38Å; D105-F109 PolarHBondContact O-N 3.25Å |
| 106 | K | 45.6 | Very low | 50.3 | Low | 155 Ų | 155 | 106.6 Ų | 106.6 | 67% | 0.674 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.8 | -38.8 | 174.3 | -166.6 | 177 | -165.4 | -178.3 | 0 | 111.5 | N102 S103 V110 | N102-K106 WeakPolarHBondContact O-CB 3.45Å; N102-K106 PolarHBondContact O-N 3.15Å; N102-K106 VanDerWaalsContact O-N 3.09Å; S103-K106 PolarHBondContact O-N 3.37Å; K106-V110 HydrophobicContact CG-CG2 4.47Å; K106-V110 VanDerWaalsContact O-CB 3.25Å; K106-V110 WeakPolarHBondContact O-CB 3.31Å; K106-V110 WeakPolarHBondContact O-CG2 3.31Å; K106-V110 PolarHBondContact O-N 3.25Å |
| 107 | Q | 49 | Very low | 51.1 | Low | 121 Ų | 121 | 105.4 Ų | 105.4 | 57% | 0.565 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -70.8 | -43.4 | 178.8 | -158.4 | 176.1 | -23.6 | 0 | 0 | 111 | S103 L104 D105 V110 I111 | S103-Q107 WeakPolarHBondContact O-CB 3.41Å; S103-Q107 PolarHBondContact O-N 2.91Å; L104-Q107 PolarHBondContact O-N 3.43Å; D105-Q107 VanDerWaalsContact C-N 3.34Å; D105-Q107 PolarHBondContact O-N 2.77Å; Q107-V110 PolarHBondContact O-N 3Å; Q107-I111 HydrophobicContact CG-CD1 3.97Å; Q107-I111 WeakPolarHBondContact O-CB 3.5Å; Q107-I111 WeakPolarHBondContact O-CD1 3.19Å; Q107-I111 WeakPolarHBondContact O-CG1 3.5Å; Q107-I111 PolarHBondContact O-N 3.5Å |
| 108 | N | 46.3 | Very low | 51.7 | Low | 90 Ų | 90 | 102.8 Ų | 102.8 | 48% | 0.481 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.2 | -39.5 | 175.6 | -71.8 | -20.3 | 0 | 0 | 0 | 112.3 | L104 D105 A112 | L104-N108 VanDerWaalsContact O-CB 3.31Å; L104-N108 WeakPolarHBondContact O-CB 3.07Å; L104-N108 PolarHBondContact O-N 3.44Å; L104-N108 PolarHBondContact O-ND2 3.34Å; D105-N108 PolarHBondContact O-N 3Å; N108-A112 VanDerWaalsContact O-CB 3.22Å; N108-A112 WeakPolarHBondContact O-CB 3.1Å; N108-A112 PolarHBondContact O-N 2.86Å |
| 109 | F | 48.2 | Very low | 52.3 | Low | 115 Ų | 115 | 100.3 Ų | 100.3 | 50% | 0.504 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.8 | -38 | 176.6 | -176.3 | -105.9 | 0 | 0 | 0 | 112 | D105 A112 R113 | D105-F109 WeakPolarHBondContact O-CB 3.38Å; D105-F109 PolarHBondContact O-N 3.25Å; F109-A112 PolarHBondContact O-N 3.36Å; F109-R113 VanDerWaalsContact O-CB 3.23Å; F109-R113 WeakPolarHBondContact O-CB 3.37Å; F109-R113 PolarHBondContact O-N 2.93Å |
| 110 | V | 55 | Low | 52.3 | Low | 80 Ų | 80 | 98 Ų | 98 | 49% | 0.485 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.8 | -45.8 | 174.6 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | K106 Q107 A112 R113 D114 | K106-V110 HydrophobicContact CG-CG2 4.47Å; K106-V110 VanDerWaalsContact O-CB 3.25Å; K106-V110 WeakPolarHBondContact O-CB 3.31Å; K106-V110 WeakPolarHBondContact O-CG2 3.31Å; K106-V110 PolarHBondContact O-N 3.25Å; Q107-V110 PolarHBondContact O-N 3Å; V110-A112 VanDerWaalsContact C-N 3.33Å; V110-A112 PolarHBondContact O-N 2.93Å; V110-R113 PolarHBondContact O-N 3.25Å; V110-D114 PolarHBondContact O-N 3.42Å |
| 111 | I | 53.8 | Low | 53 | Low | 79 Ų | 79 | 103.5 Ų | 103.5 | 41% | 0.405 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68 | -29.2 | 177 | -64.3 | 166 | 0 | 0 | 0 | 112.1 | Q107 D114 Q115 | Q107-I111 HydrophobicContact CG-CD1 3.97Å; Q107-I111 WeakPolarHBondContact O-CB 3.5Å; Q107-I111 WeakPolarHBondContact O-CD1 3.19Å; Q107-I111 WeakPolarHBondContact O-CG1 3.5Å; Q107-I111 PolarHBondContact O-N 3.5Å; I111-D114 WeakPolarHBondContact CA-OD1 3.04Å; I111-Q115 HydrophobicContact CG2-CG 4.29Å; I111-Q115 VanDerWaalsContact O-CB 3.25Å; I111-Q115 WeakPolarHBondContact O-CB 3.46Å; I111-Q115 WeakPolarHBondContact O-CG 3.48Å; I111-Q115 PolarHBondContact O-N 2.7Å |
| 112 | A | 56.4 | Low | 53.8 | Low | 59 Ų | 59 | 104.9 Ų | 104.9 | 49% | 0.488 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -73.6 | -36.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111 | N108 F109 V110 L116 | N108-A112 VanDerWaalsContact O-CB 3.22Å; N108-A112 WeakPolarHBondContact O-CB 3.1Å; N108-A112 PolarHBondContact O-N 2.86Å; F109-A112 PolarHBondContact O-N 3.36Å; V110-A112 VanDerWaalsContact C-N 3.33Å; V110-A112 PolarHBondContact O-N 2.93Å; A112-L116 WeakPolarHBondContact O-CB 3.01Å; A112-L116 PolarHBondContact O-N 2.92Å |
| 113 | R | 54.5 | Low | 54 | Low | 146 Ų | 146 | 110.1 Ų | 110.1 | 55% | 0.551 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -79 | -40.3 | -173.2 | -156.4 | 176.3 | -177.7 | 165 | 0 | 112.3 | F109 V110 L116 I117 | F109-R113 VanDerWaalsContact O-CB 3.23Å; F109-R113 WeakPolarHBondContact O-CB 3.37Å; F109-R113 PolarHBondContact O-N 2.93Å; V110-R113 PolarHBondContact O-N 3.25Å; R113-L116 PolarHBondContact O-N 3.24Å; R113-I117 HydrophobicContact CG-CD1 4.21Å; R113-I117 WeakPolarHBondContact O-CB 3.01Å; R113-I117 VanDerWaalsContact O-CD1 3.31Å; R113-I117 WeakPolarHBondContact O-CD1 3.32Å; R113-I117 WeakPolarHBondContact O-CG1 3.25Å; R113-I117 PolarHBondContact O-N 3.43Å |
| 114 | D | 54.8 | Low | 54.1 | Low | 77 Ų | 77 | 112.1 Ų | 112.1 | 41% | 0.412 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.9 | -38.6 | 174 | 62.5 | -6.8 | 0 | 0 | 0 | 111.9 | V110 I111 I117 A118 | V110-D114 PolarHBondContact O-N 3.42Å; I111-D114 WeakPolarHBondContact CA-OD1 3.04Å; D114-I117 PolarHBondContact O-N 2.81Å; D114-A118 VanDerWaalsContact O-CB 3.25Å; D114-A118 WeakPolarHBondContact O-CB 3.5Å; D114-A118 PolarHBondContact O-N 2.93Å |
| 115 | Q | 56.4 | Low | 54.8 | Low | 113 Ų | 113 | 113.1 Ų | 113.1 | 53% | 0.528 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.1 | -43.5 | 172.4 | -66.8 | -74.8 | -30.9 | 0 | 0 | 111 | I111 A118 L119 | I111-Q115 HydrophobicContact CG2-CG 4.29Å; I111-Q115 VanDerWaalsContact O-CB 3.25Å; I111-Q115 WeakPolarHBondContact O-CB 3.46Å; I111-Q115 WeakPolarHBondContact O-CG 3.48Å; I111-Q115 PolarHBondContact O-N 2.7Å; Q115-A118 PolarHBondContact O-N 3.4Å; Q115-L119 WeakPolarHBondContact O-CB 3.27Å; Q115-L119 WeakPolarHBondContact O-CG 3.35Å; Q115-L119 PolarHBondContact O-N 2.68Å |
| 116 | L | 57.9 | Low | 55.4 | Low | 119 Ų | 119 | 112.8 Ų | 112.8 | 62% | 0.623 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -63.6 | -42.4 | 175 | -176.4 | 67.4 | 0 | 0 | 0 | 111.4 | A112 R113 A118 A120 | A112-L116 WeakPolarHBondContact O-CB 3.01Å; A112-L116 PolarHBondContact O-N 2.92Å; R113-L116 PolarHBondContact O-N 3.24Å; L116-A118 VanDerWaalsContact C-N 3.33Å; L116-A120 WeakPolarHBondContact O-CB 3.17Å; L116-A120 PolarHBondContact O-N 2.84Å |
| 117 | I | 61.2 | Low | 56.7 | Low | 90 Ų | 90 | 107.2 Ų | 107.2 | 46% | 0.462 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.4 | -39.5 | 175.5 | -70.7 | 162.5 | 0 | 0 | 0 | 110.3 | R113 D114 R121 | R113-I117 HydrophobicContact CG-CD1 4.21Å; R113-I117 WeakPolarHBondContact O-CB 3.01Å; R113-I117 VanDerWaalsContact O-CD1 3.31Å; R113-I117 WeakPolarHBondContact O-CD1 3.32Å; R113-I117 WeakPolarHBondContact O-CG1 3.25Å; R113-I117 PolarHBondContact O-N 3.43Å; D114-I117 PolarHBondContact O-N 2.81Å; I117-R121 WeakPolarHBondContact O-CB 3.27Å; I117-R121 PolarHBondContact O-N 2.98Å |
| 118 | A | 57.1 | Low | 58.2 | Low | 53 Ų | 53 | 104.1 Ų | 104.1 | 44% | 0.438 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.7 | -44.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | D114 Q115 L116 R121 R122 | D114-A118 VanDerWaalsContact O-CB 3.25Å; D114-A118 WeakPolarHBondContact O-CB 3.5Å; D114-A118 PolarHBondContact O-N 2.93Å; Q115-A118 PolarHBondContact O-N 3.4Å; L116-A118 VanDerWaalsContact C-N 3.33Å; A118-R121 PolarHBondContact O-N 2.88Å; A118-R122 WeakPolarHBondContact O-CB 3.49Å; A118-R122 PolarHBondContact O-N 3.35Å |
| 119 | L | 57.4 | Low | 59.8 | Low | 108 Ų | 108 | 102.2 Ų | 102.2 | 57% | 0.565 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.8 | -43.1 | 176.6 | -71.1 | 178 | 0 | 0 | 0 | 111.8 | Q115 R122 R123 | Q115-L119 WeakPolarHBondContact O-CB 3.27Å; Q115-L119 WeakPolarHBondContact O-CG 3.35Å; Q115-L119 PolarHBondContact O-N 2.68Å; L119-R122 PolarHBondContact O-N 3.31Å; L119-R123 WeakPolarHBondContact O-CB 3.43Å; L119-R123 PolarHBondContact O-N 2.86Å |
| 120 | A | 54.3 | Low | 61.5 | Low | 51 Ų | 51 | 102.1 Ų | 102.1 | 42% | 0.421 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.3 | -49 | 173 | 0 | 0 | 0 | 0 | 0 | 109.9 | L116 R122 R123 L124 | L116-A120 WeakPolarHBondContact O-CB 3.17Å; L116-A120 PolarHBondContact O-N 2.84Å; A120-R122 VanDerWaalsContact C-N 3.32Å; A120-R122 PolarHBondContact O-N 2.94Å; A120-R123 PolarHBondContact O-N 2.87Å; A120-L124 WeakPolarHBondContact O-CB 3.13Å; A120-L124 PolarHBondContact O-N 3.41Å |
| 121 | R | 57.5 | Low | 63.1 | Low | 176 Ų | 176 | 103 Ų | 103 | 66% | 0.664 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -57.8 | -41.1 | 177.5 | -177.5 | 175.9 | -66.8 | -150.9 | -1.4 | 112.5 | I117 A118 Q125 | I117-R121 WeakPolarHBondContact O-CB 3.27Å; I117-R121 PolarHBondContact O-N 2.98Å; A118-R121 PolarHBondContact O-N 2.88Å; R121-Q125 WeakPolarHBondContact O-CB 3.4Å; R121-Q125 PolarHBondContact O-N 3.32Å |
| 122 | R | 55 | Low | 64.7 | Low | 188 Ų | 188 | 100.9 Ų | 100.9 | 71% | 0.709 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -73.7 | -41.3 | -178 | -159.8 | -177.1 | -111.4 | 171.1 | -4.7 | 112.6 | A118 L119 A120 Q125 | A118-R122 WeakPolarHBondContact O-CB 3.49Å; A118-R122 PolarHBondContact O-N 3.35Å; L119-R122 PolarHBondContact O-N 3.31Å; A120-R122 VanDerWaalsContact C-N 3.32Å; A120-R122 PolarHBondContact O-N 2.94Å; R122-Q125 PolarHBondContact O-N 3.41Å |
| 123 | R | 55.3 | Low | 66.2 | Low | 223 Ų | 223 | 99.8 Ų | 99.8 | 84% | 0.842 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -72.8 | -35.1 | 178.9 | -155.4 | -178.7 | -165.2 | 159.2 | 4.8 | 111.8 | L119 A120 | L119-R123 WeakPolarHBondContact O-CB 3.43Å; L119-R123 PolarHBondContact O-N 2.86Å; A120-R123 PolarHBondContact O-N 2.87Å |
| 124 | L | 55.4 | Low | 68 | Low | 104 Ų | 104 | 95.8 Ų | 95.8 | 55% | 0.545 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -53 | 169.2 | -151.4 | 49.5 | 0 | 0 | 0 | 107.3 | A120 T126 G127 D128 | A120-L124 WeakPolarHBondContact O-CB 3.13Å; A120-L124 PolarHBondContact O-N 3.41Å; L124-T126 PolarHBondContact O-N 3.47Å; L124-G127 CarbonylContact O-C 3.55Å; L124-G127 WeakPolarHBondContact O-CA 3.18Å; L124-G127 PolarHBondContact O-N 3.23Å; L124-D128 WeakPolarHBondContact CB-OD2 3.41Å; L124-D128 WeakPolarHBondContact CD1-OD1 3.5Å; L124-D128 VanDerWaalsContact CG-CG 3.49Å; L124-D128 WeakPolarHBondContact CG-OD1 3.31Å; L124-D128 VanDerWaalsContact CG-OD2 3.25Å; L124-D128 WeakPolarHBondContact CG-OD2 3.35Å; L124-D128 WeakPolarHBondContact O-CA 3.36Å; L124-D128 VanDerWaalsContact O-CB 3.27Å; L124-D128 WeakPolarHBondContact O-CB 3.42Å; L124-D128 PolarHBondContact O-N 2.89Å; L124-D128 VanDerWaalsContact O-OD1 3.07Å |
| 125 | Q | 66.5 | Low | 69.7 | Low | 113 Ų | 113 | 97.1 Ų | 97.1 | 53% | 0.528 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -49 | -43.9 | -171.7 | -164.2 | -176.6 | -29.5 | 0 | 0 | 116.6 | R121 R122 D128 V129 | R121-Q125 WeakPolarHBondContact O-CB 3.4Å; R121-Q125 PolarHBondContact O-N 3.32Å; R122-Q125 PolarHBondContact O-N 3.41Å; Q125-D128 WeakPolarHBondContact CA-OD2 3.35Å; Q125-D128 PolarHBondContact N-OD2 2.93Å; Q125-D128 VanDerWaalsContact N-OD2 3.16Å; Q125-V129 PolarHBondContact O-N 3.47Å |
| 126 | T | 65.3 | Low | 71.4 | Confident | 109 Ų | 109 | 92.8 Ų | 92.8 | 67% | 0.669 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -75.3 | -40.8 | 177.8 | -48.5 | 0 | 0 | 0 | 0 | 111.9 | L124 D128 | L124-T126 PolarHBondContact O-N 3.47Å; T126-D128 PolarHBondContact O-N 2.91Å |
| 127 | G | 74.2 | Confident | 73.1 | Confident | 37 Ų | 37 | 92.6 Ų | 92.6 | 38% | 0.381 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.9 | -27.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113 | L124 N130 L131 | L124-G127 CarbonylContact O-C 3.55Å; L124-G127 WeakPolarHBondContact O-CA 3.18Å; L124-G127 PolarHBondContact O-N 3.23Å; G127-N130 PolarHBondContact O-N 2.9Å; G127-L131 VanDerWaalsContact O-CB 3.27Å; G127-L131 WeakPolarHBondContact O-CB 3.23Å; G127-L131 PolarHBondContact O-N 3.02Å |
| 128 | D | 79.3 | Confident | 74.7 | Confident | 57 Ų | 57 | 90 Ų | 90 | 31% | 0.305 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -71.1 | -40.5 | -176.5 | -71.3 | -17.8 | 0 | 0 | 0 | 111.1 | L124 Q125 T126 L131 A132 | L124-D128 WeakPolarHBondContact CB-OD2 3.41Å; L124-D128 WeakPolarHBondContact CD1-OD1 3.5Å; L124-D128 VanDerWaalsContact CG-CG 3.49Å; L124-D128 WeakPolarHBondContact CG-OD1 3.31Å; L124-D128 VanDerWaalsContact CG-OD2 3.25Å; L124-D128 WeakPolarHBondContact CG-OD2 3.35Å; L124-D128 WeakPolarHBondContact O-CA 3.36Å; L124-D128 VanDerWaalsContact O-CB 3.27Å; L124-D128 WeakPolarHBondContact O-CB 3.42Å; L124-D128 PolarHBondContact O-N 2.89Å; L124-D128 VanDerWaalsContact O-OD1 3.07Å; Q125-D128 WeakPolarHBondContact CA-OD2 3.35Å; Q125-D128 PolarHBondContact N-OD2 2.93Å; Q125-D128 VanDerWaalsContact N-OD2 3.16Å; T126-D128 PolarHBondContact O-N 2.91Å; D128-L131 PolarHBondContact O-N 3.44Å; D128-A132 WeakPolarHBondContact O-CA 3.25Å; D128-A132 WeakPolarHBondContact O-CB 3.37Å; D128-A132 PolarHBondContact O-N 2.93Å |
| 129 | V | 80.2 | Confident | 76.4 | Confident | 49 Ų | 49 | 88.7 Ų | 88.7 | 30% | 0.297 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.9 | -46.5 | 176.6 | 177.7 | 0 | 0 | 0 | 0 | 109.5 | Q125 L131 A132 I133 | Q125-V129 PolarHBondContact O-N 3.47Å; V129-L131 PolarHBondContact O-N 3.49Å; V129-A132 PolarHBondContact O-N 2.9Å; V129-I133 HydrophobicContact CG1-CD1 3.72Å; V129-I133 HydrophobicContact CG1-CG1 4.39Å; V129-I133 WeakPolarHBondContact O-CB 3.23Å; V129-I133 WeakPolarHBondContact O-CG1 3.36Å; V129-I133 PolarHBondContact O-N 2.86Å |
| 130 | N | 84.6 | Confident | 78.1 | Confident | 113 Ų | 113 | 85.4 Ų | 85.4 | 60% | 0.604 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.1 | -44.3 | 177.6 | -69.8 | -11.1 | 0 | 0 | 0 | 112.1 | G127 I133 A134 | G127-N130 PolarHBondContact O-N 2.9Å; N130-I133 PolarHBondContact O-N 2.8Å; N130-A134 WeakPolarHBondContact O-CB 3.44Å; N130-A134 PolarHBondContact O-N 2.91Å |
| 131 | L | 87.3 | Confident | 80.1 | Confident | 100 Ų | 100 | 89.6 Ų | 89.6 | 52% | 0.524 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 176.4 | 179.1 | 62.3 | 0 | 0 | 0 | 111.2 | G127 D128 V129 A134 L135 | G127-L131 VanDerWaalsContact O-CB 3.27Å; G127-L131 WeakPolarHBondContact O-CB 3.23Å; G127-L131 PolarHBondContact O-N 3.02Å; D128-L131 PolarHBondContact O-N 3.44Å; V129-L131 PolarHBondContact O-N 3.49Å; L131-A134 PolarHBondContact O-N 3.36Å; L131-L135 HydrophobicContact CD1-CD1 4.36Å; L131-L135 HydrophobicContact CD1-CG 4.25Å; L131-L135 HydrophobicContact CG-CD1 4.11Å; L131-L135 HydrophobicContact CG-CG 4.4Å; L131-L135 WeakPolarHBondContact O-CB 3.3Å; L131-L135 VanDerWaalsContact O-CG 3.25Å; L131-L135 WeakPolarHBondContact O-CG 3.49Å; L131-L135 PolarHBondContact O-N 2.97Å |
| 132 | A | 87.6 | Confident | 81.9 | Confident | 34 Ų | 34 | 82.8 Ų | 82.8 | 28% | 0.281 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.4 | -44.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L46 D128 V129 L135 L136 | L46-A132 HydrophobicContact CD1-CB 4.16Å; D128-A132 WeakPolarHBondContact O-CA 3.25Å; D128-A132 WeakPolarHBondContact O-CB 3.37Å; D128-A132 PolarHBondContact O-N 2.93Å; V129-A132 PolarHBondContact O-N 2.9Å; A132-L135 PolarHBondContact O-N 3.36Å; A132-L136 WeakPolarHBondContact O-CB 3.24Å; A132-L136 VanDerWaalsContact O-CG 3.24Å; A132-L136 WeakPolarHBondContact O-CG 3.49Å; A132-L136 PolarHBondContact O-N 3.48Å |
| 133 | I | 88.5 | Confident | 83.8 | Confident | 36 Ų | 36 | 73.9 Ų | 73.9 | 19% | 0.185 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -60.3 | -48.3 | 174.2 | -70.3 | 168.5 | 0 | 0 | 0 | 110.1 | L46 V129 N130 L135 L136 F137 | L46-I133 HydrophobicContact CB-CG1 4.45Å; L46-I133 HydrophobicContact CD1-CG1 4.1Å; V129-I133 HydrophobicContact CG1-CD1 3.72Å; V129-I133 HydrophobicContact CG1-CG1 4.39Å; V129-I133 WeakPolarHBondContact O-CB 3.23Å; V129-I133 WeakPolarHBondContact O-CG1 3.36Å; V129-I133 PolarHBondContact O-N 2.86Å; N130-I133 PolarHBondContact O-N 2.8Å; I133-L135 VanDerWaalsContact C-N 3.34Å; I133-L135 PolarHBondContact O-N 2.8Å; I133-L136 PolarHBondContact O-N 3.17Å; I133-F137 HydrophobicContact CG2-CD2 3.58Å; I133-F137 HydrophobicContact CG2-CE2 3.46Å; I133-F137 VanDerWaalsContact CG2-CE2 3.46Å; I133-F137 VanDerWaalsContact O-CD2 3.23Å; I133-F137 WeakPolarHBondContact O-CD2 3.43Å; I133-F137 PolarHBondContact O-N 3.43Å |
| 134 | A | 91.5 | Very high | 85.6 | Confident | 61 Ų | 61 | 64.6 Ų | 64.6 | 50% | 0.504 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60.1 | -42.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N130 L131 F137 G138 | N130-A134 WeakPolarHBondContact O-CB 3.44Å; N130-A134 PolarHBondContact O-N 2.91Å; L131-A134 PolarHBondContact O-N 3.36Å; A134-F137 PolarHBondContact O-N 2.79Å; A134-G138 PolarHBondContact O-N 3.46Å |
| 135 | L | 90.8 | Very high | 87.5 | Confident | 105 Ų | 105 | 62.2 Ų | 62.2 | 55% | 0.55 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.2 | -49.5 | 175 | -71.5 | 174.8 | 0 | 0 | 0 | 110.5 | L131 A132 I133 F137 G138 L139 | L131-L135 HydrophobicContact CD1-CD1 4.36Å; L131-L135 HydrophobicContact CD1-CG 4.25Å; L131-L135 HydrophobicContact CG-CD1 4.11Å; L131-L135 HydrophobicContact CG-CG 4.4Å; L131-L135 WeakPolarHBondContact O-CB 3.3Å; L131-L135 VanDerWaalsContact O-CG 3.25Å; L131-L135 WeakPolarHBondContact O-CG 3.49Å; L131-L135 PolarHBondContact O-N 2.97Å; A132-L135 PolarHBondContact O-N 3.36Å; I133-L135 VanDerWaalsContact C-N 3.34Å; I133-L135 PolarHBondContact O-N 2.8Å; L135-F137 VanDerWaalsContact C-N 3.33Å; L135-F137 PolarHBondContact O-N 2.78Å; L135-G138 CarbonylContact O-C 3.5Å; L135-G138 WeakPolarHBondContact O-CA 3.47Å; L135-G138 PolarHBondContact O-N 2.81Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.41Å; L135-L139 PolarHBondContact O-N 3.24Å |
| 136 | L | 92.5 | Very high | 88.8 | Confident | 23 Ų | 23 | 56.9 Ų | 56.9 | 12% | 0.12 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.3 | -40.6 | 179 | -72.3 | 168 | 0 | 0 | 0 | 112.5 | H39 A42 I43 L46 A132 I133 L139 L140 | H39-L136 HydrophobicContact CB-CD2 4.37Å; A42-L136 HydrophobicContact CB-CD1 4.12Å; A42-L136 HydrophobicContact CB-CD2 4.22Å; I43-L136 HydrophobicContact CD1-CB 3.89Å; I43-L136 HydrophobicContact CG1-CB 3.65Å; I43-L136 HydrophobicContact CG1-CD1 3.8Å; I43-L136 HydrophobicContact CG1-CG 4.31Å; L46-L136 HydrophobicContact CD1-CD1 3.48Å; L46-L136 VanDerWaalsContact CD1-CD1 3.48Å; A132-L136 WeakPolarHBondContact O-CB 3.24Å; A132-L136 VanDerWaalsContact O-CG 3.24Å; A132-L136 WeakPolarHBondContact O-CG 3.49Å; A132-L136 PolarHBondContact O-N 3.48Å; I133-L136 PolarHBondContact O-N 3.17Å; L136-L139 PolarHBondContact O-N 3.15Å; L136-L140 WeakPolarHBondContact O-CG 3.07Å; L136-L140 PolarHBondContact O-N 3.44Å |
| 137 | F | 93.8 | Very high | 90.2 | Very high | 114 Ų | 114 | 53.1 Ų | 53.1 | 50% | 0.5 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 172.1 | -83.4 | -66.1 | 0 | 0 | 0 | 112.3 | I43 I133 A134 L135 L139 L140 F141 | I43-F137 HydrophobicContact CD1-CD1 4.42Å; I43-F137 HydrophobicContact CD1-CE1 4.37Å; I43-F137 HydrophobicContact CD1-CZ 4.47Å; I133-F137 HydrophobicContact CG2-CD2 3.58Å; I133-F137 HydrophobicContact CG2-CE2 3.46Å; I133-F137 VanDerWaalsContact CG2-CE2 3.46Å; I133-F137 VanDerWaalsContact O-CD2 3.23Å; I133-F137 WeakPolarHBondContact O-CD2 3.43Å; I133-F137 PolarHBondContact O-N 3.43Å; A134-F137 PolarHBondContact O-N 2.79Å; L135-F137 VanDerWaalsContact C-N 3.33Å; L135-F137 PolarHBondContact O-N 2.78Å; F137-L139 VanDerWaalsContact C-N 3.3Å; F137-L139 PolarHBondContact O-N 3.47Å; F137-L140 HydrophobicContact CD1-CD1 4.44Å; F137-L140 PolarHBondContact O-N 3.27Å; F137-F141 PolarHBondContact O-N 3.26Å |
| 138 | G | 94.2 | Very high | 91.1 | Very high | 35 Ų | 35 | 56.8 Ų | 56.8 | 36% | 0.361 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -58.9 | -40.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A134 L135 F141 I142 | A134-G138 PolarHBondContact O-N 3.46Å; L135-G138 CarbonylContact O-C 3.5Å; L135-G138 WeakPolarHBondContact O-CA 3.47Å; L135-G138 PolarHBondContact O-N 2.81Å; G138-F141 WeakPolarHBondContact O-CB 3.42Å; G138-F141 PolarHBondContact O-N 2.96Å; G138-I142 PolarHBondContact O-N 3.25Å |
| 139 | L | 92.4 | Very high | 91.7 | Very high | 26 Ų | 26 | 54.1 Ų | 54.1 | 14% | 0.136 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.7 | -40 | 176.4 | -61.2 | -170.2 | 0 | 0 | 0 | 112.1 | L135 L136 F137 F141 I142 T143 F164 | L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.41Å; L135-L139 PolarHBondContact O-N 3.24Å; L136-L139 PolarHBondContact O-N 3.15Å; F137-L139 VanDerWaalsContact C-N 3.3Å; F137-L139 PolarHBondContact O-N 3.47Å; L139-F141 VanDerWaalsContact C-N 3.32Å; L139-F141 PolarHBondContact O-N 2.9Å; L139-I142 HydrophobicContact CD2-CD1 3.62Å; L139-I142 HydrophobicContact CD2-CG1 4.46Å; L139-I142 VanDerWaalsContact O-CG1 3.23Å; L139-I142 WeakPolarHBondContact O-CG1 3.35Å; L139-T143 WeakPolarHBondContact O-CB 2.96Å; L139-T143 WeakPolarHBondContact O-CG2 3.37Å; L139-T143 PolarHBondContact O-N 3.37Å; L139-T143 PolarHBondContact O-OG1 2.88Å; L139-F164 HydrophobicContact CD1-CE1 4.06Å; L139-F164 HydrophobicContact CD1-CZ 3.79Å; L139-F164 HydrophobicContact CD2-CD1 3.94Å; L139-F164 HydrophobicContact CD2-CD2 3.82Å; L139-F164 HydrophobicContact CD2-CE1 3.48Å; L139-F164 VanDerWaalsContact CD2-CE1 3.48Å; L139-F164 HydrophobicContact CD2-CE2 3.34Å; L139-F164 HydrophobicContact CD2-CG 4.11Å; L139-F164 HydrophobicContact CD2-CZ 3.16Å; L139-F164 HydrophobicContact CG-CE1 4.4Å; L139-F164 HydrophobicContact CG-CZ 4.11Å |
| 140 | L | 94.6 | Very high | 92.2 | Very high | 39 Ų | 39 | 51.8 Ų | 51.8 | 20% | 0.204 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.9 | -40.2 | 171.5 | -74.1 | 179 | 0 | 0 | 0 | 111.9 | I36 H39 I43 L136 F137 T143 G144 | I36-L140 HydrophobicContact CB-CD2 4.26Å; I36-L140 HydrophobicContact CG1-CD2 4.16Å; I36-L140 HydrophobicContact CG2-CD2 4.09Å; H39-L140 HydrophobicContact CB-CD2 3.69Å; H39-L140 HydrophobicContact CB-CG 4.03Å; I43-L140 HydrophobicContact CD1-CD1 3.49Å; I43-L140 VanDerWaalsContact CD1-CD1 3.49Å; I43-L140 HydrophobicContact CD1-CG 4.39Å; L136-L140 WeakPolarHBondContact O-CG 3.07Å; L136-L140 PolarHBondContact O-N 3.44Å; F137-L140 HydrophobicContact CD1-CD1 4.44Å; F137-L140 PolarHBondContact O-N 3.27Å; L140-T143 VanDerWaalsContact CA-OG1 3.3Å; L140-T143 WeakPolarHBondContact CA-OG1 3.29Å; L140-T143 PolarHBondContact O-OG1 2.93Å; L140-G144 PolarHBondContact O-N 3.47Å |
| 141 | F | 95.7 | Very high | 92.5 | Very high | 140 Ų | 140 | 50.9 Ų | 50.9 | 61% | 0.614 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -65.4 | -50.5 | 177.4 | -175.1 | -103.5 | 0 | 0 | 0 | 111.8 | F137 G138 L139 T143 G144 M145 | F137-F141 PolarHBondContact O-N 3.26Å; G138-F141 WeakPolarHBondContact O-CB 3.42Å; G138-F141 PolarHBondContact O-N 2.96Å; L139-F141 VanDerWaalsContact C-N 3.32Å; L139-F141 PolarHBondContact O-N 2.9Å; F141-T143 VanDerWaalsContact C-N 3.33Å; F141-T143 PolarHBondContact O-N 3.41Å; F141-G144 PolarHBondContact O-N 2.95Å; F141-M145 HydrophobicContact CD1-CG 4.26Å; F141-M145 HydrophobicContact CE1-CG 3.95Å; F141-M145 HydrophobicContact CE1-SD 4.35Å; F141-M145 HydrophobicContact CE2-SD 4.36Å; F141-M145 HydrophobicContact CZ-CG 4.11Å; F141-M145 HydrophobicContact CZ-SD 3.95Å; F141-M145 VanDerWaalsContact O-CG 3.28Å; F141-M145 WeakPolarHBondContact O-CG 3.43Å; F141-M145 PolarHBondContact O-N 2.97Å |
| 142 | I | 95 | Very high | 92.6 | Very high | 33 Ų | 33 | 52 Ų | 52 | 17% | 0.169 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.4 | -35.8 | 179.4 | 65.7 | 179 | 0 | 0 | 0 | 112.4 | G138 L139 M145 M146 F161 F164 | G138-I142 PolarHBondContact O-N 3.25Å; L139-I142 HydrophobicContact CD2-CD1 3.62Å; L139-I142 HydrophobicContact CD2-CG1 4.46Å; L139-I142 VanDerWaalsContact O-CG1 3.23Å; L139-I142 WeakPolarHBondContact O-CG1 3.35Å; I142-M145 PolarHBondContact O-N 3.49Å; I142-M146 PolarHBondContact O-N 3.03Å; I142-F161 HydrophobicContact CD1-CD2 4.35Å; I142-F161 HydrophobicContact CG1-CD2 4.3Å; I142-F164 HydrophobicContact CD1-CB 3.78Å; I142-F164 HydrophobicContact CD1-CD1 3.97Å; I142-F164 HydrophobicContact CD1-CD2 4.18Å; I142-F164 HydrophobicContact CD1-CG 3.67Å |
| 143 | T | 94.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -69.4 | -39.1 | 175.9 | 50.3 | 0 | 0 | 0 | 0 | 111.2 | N35 L139 L140 F141 M146 I147 F161 | N35-T143 HydrophobicContact CB-CG2 4.08Å; L139-T143 WeakPolarHBondContact O-CB 2.96Å; L139-T143 WeakPolarHBondContact O-CG2 3.37Å; L139-T143 PolarHBondContact O-N 3.37Å; L139-T143 PolarHBondContact O-OG1 2.88Å; L140-T143 VanDerWaalsContact CA-OG1 3.3Å; L140-T143 WeakPolarHBondContact CA-OG1 3.29Å; L140-T143 PolarHBondContact O-OG1 2.93Å; F141-T143 VanDerWaalsContact C-N 3.33Å; F141-T143 PolarHBondContact O-N 3.41Å; T143-M146 WeakPolarHBondContact O-CB 3.5Å; T143-M146 PolarHBondContact O-N 3.3Å; T143-I147 WeakPolarHBondContact O-CG1 3.45Å; T143-I147 PolarHBondContact O-N 2.92Å; T143-F161 HydrophobicContact CG2-CD2 3.79Å; T143-F161 HydrophobicContact CG2-CE2 3.46Å; T143-F161 VanDerWaalsContact CG2-CE2 3.46Å; T143-F161 HydrophobicContact CG2-CZ 4.31Å |
| 144 | G | 94.4 | Very high | 92.7 | Very high | 29 Ų | 29 | 57.5 Ų | 57.5 | 30% | 0.299 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.7 | -44.1 | 171 | 0 | 0 | 0 | 0 | 0 | 112.5 | L140 F141 M146 I147 Y148 | L140-G144 PolarHBondContact O-N 3.47Å; F141-G144 PolarHBondContact O-N 2.95Å; G144-M146 VanDerWaalsContact C-N 3.31Å; G144-M146 PolarHBondContact O-N 3.29Å; G144-I147 PolarHBondContact O-N 2.73Å; G144-Y148 WeakPolarHBondContact O-CB 3.28Å; G144-Y148 PolarHBondContact O-N 3.22Å |
| 145 | M | 94.2 | Very high | 92.6 | Very high | 54 Ų | 54 | 55 Ų | 55 | 27% | 0.266 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -61.8 | -38.8 | 175.3 | -65.1 | -64.2 | -75.6 | 0 | 0 | 111.8 | F141 I142 G149 Y157 | F141-M145 HydrophobicContact CD1-CG 4.26Å; F141-M145 HydrophobicContact CE1-CG 3.95Å; F141-M145 HydrophobicContact CE1-SD 4.35Å; F141-M145 HydrophobicContact CE2-SD 4.36Å; F141-M145 HydrophobicContact CZ-CG 4.11Å; F141-M145 HydrophobicContact CZ-SD 3.95Å; F141-M145 VanDerWaalsContact O-CG 3.28Å; F141-M145 WeakPolarHBondContact O-CG 3.43Å; F141-M145 PolarHBondContact O-N 2.97Å; I142-M145 PolarHBondContact O-N 3.49Å; M145-G149 PolarHBondContact O-N 3.27Å; M145-Y157 HydrophobicContact CE-CD1 3.42Å; M145-Y157 VanDerWaalsContact CE-CD1 3.42Å; M145-Y157 HydrophobicContact CE-CE1 3.45Å; M145-Y157 VanDerWaalsContact CE-CE1 3.45Å; M145-Y157 WeakPolarHBondContact O-CB 3.32Å |
| 146 | M | 94.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.1 | -51.3 | 174 | -175.1 | -152.9 | 67.1 | 0 | 0 | 111.3 | A28 I142 T143 G144 Y148 G149 V150 L158 F161 I232 | A28-M146 WeakPolarHBondContact O-CE 3.05Å; I142-M146 PolarHBondContact O-N 3.03Å; T143-M146 WeakPolarHBondContact O-CB 3.5Å; T143-M146 PolarHBondContact O-N 3.3Å; G144-M146 VanDerWaalsContact C-N 3.31Å; G144-M146 PolarHBondContact O-N 3.29Å; M146-Y148 VanDerWaalsContact C-N 3.34Å; M146-Y148 PolarHBondContact O-N 2.93Å; M146-G149 PolarHBondContact O-N 3.45Å; M146-G149 VanDerWaalsContact O-N 3.17Å; M146-V150 WeakPolarHBondContact O-CG2 3.42Å; M146-V150 PolarHBondContact O-N 3.26Å; M146-L158 HydrophobicContact CG-CD2 4.43Å; M146-L158 HydrophobicContact CG-CG 4.06Å; M146-F161 HydrophobicContact CB-CB 4.01Å; M146-F161 HydrophobicContact CB-CD1 4.31Å; M146-F161 HydrophobicContact CB-CG 4.2Å; M146-F161 HydrophobicContact CG-CB 4.33Å; M146-F161 HydrophobicContact CG-CD1 3.94Å; M146-F161 HydrophobicContact CG-CG 4.32Å; M146-F161 HydrophobicContact SD-CD1 3.21Å; M146-F161 WeakPolarHBondContact SD-CD1 3.49Å; M146-F161 HydrophobicContact SD-CE1 3.36Å; M146-F161 WeakPolarHBondContact SD-CE1 3.23Å; M146-F161 HydrophobicContact SD-CG 4Å; M146-F161 HydrophobicContact SD-CZ 4.3Å; M146-I232 HydrophobicContact SD-CD1 3.62Å |
| 147 | I | 94.1 | Very high | 92.8 | Very high | 30 Ų | 30 | 59.2 Ų | 59.2 | 15% | 0.154 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.7 | -45.6 | 179.8 | -65.9 | 169.3 | 0 | 0 | 0 | 110.4 | M33 I36 T143 G144 G149 V150 V151 | M33-I147 HydrophobicContact SD-CD1 3.93Å; I36-I147 HydrophobicContact CD1-CD1 3.39Å; I36-I147 HydrophobicContact CG1-CD1 4.43Å; T143-I147 WeakPolarHBondContact O-CG1 3.45Å; T143-I147 PolarHBondContact O-N 2.92Å; G144-I147 PolarHBondContact O-N 2.73Å; I147-G149 VanDerWaalsContact C-N 3.33Å; I147-G149 PolarHBondContact O-N 2.87Å; I147-V150 PolarHBondContact O-N 3.01Å; I147-V151 WeakPolarHBondContact O-CG2 3.33Å; I147-V151 PolarHBondContact O-N 3.33Å |
| 148 | Y | 94.2 | Very high | 92.7 | Very high | 115 Ų | 115 | 53.9 Ų | 53.9 | 45% | 0.451 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.5 | -44.5 | 175.4 | 178.1 | -102.3 | 0 | 0 | 0 | 112 | G144 M146 V150 V151 K152 Y157 | G144-Y148 WeakPolarHBondContact O-CB 3.28Å; G144-Y148 PolarHBondContact O-N 3.22Å; M146-Y148 VanDerWaalsContact C-N 3.34Å; M146-Y148 PolarHBondContact O-N 2.93Å; Y148-V150 VanDerWaalsContact C-N 3.34Å; Y148-V150 PolarHBondContact O-N 3.46Å; Y148-V151 PolarHBondContact O-N 3.46Å; Y148-K152 HydrophobicContact CD2-CG 4.18Å; Y148-K152 HydrophobicContact CE1-CG 4.13Å; Y148-K152 HydrophobicContact CE2-CD 4.41Å; Y148-K152 HydrophobicContact CE2-CG 3.65Å; Y148-K152 WeakPolarHBondContact O-CB 3.36Å; Y148-K152 PolarHBondContact O-N 2.89Å; Y148-Y157 HydrophobicContact CE1-CE2 4.31Å |
| 149 | G | 92.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58 | -43.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | M145 M146 I147 I153 R154 | M145-G149 PolarHBondContact O-N 3.27Å; M146-G149 PolarHBondContact O-N 3.45Å; M146-G149 VanDerWaalsContact O-N 3.17Å; I147-G149 VanDerWaalsContact C-N 3.33Å; I147-G149 PolarHBondContact O-N 2.87Å; G149-I153 PolarHBondContact O-N 2.92Å; G149-R154 PolarHBondContact O-N 3.48Å |
| 150 | V | 90.7 | Very high | 92.8 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 177.4 | 173.6 | 0 | 0 | 0 | 0 | 111.5 | Q25 I29 M146 I147 Y148 I153 L158 | Q25-V150 HydrophobicContact CG-CG1 3.3Å; Q25-V150 PolarHBondContact NE2-O 3.03Å; Q25-V150 VanDerWaalsContact NE2-O 3.16Å; I29-V150 HydrophobicContact CD1-CG1 3.95Å; I29-V150 HydrophobicContact CG1-CG1 3.79Å; M146-V150 WeakPolarHBondContact O-CG2 3.42Å; M146-V150 PolarHBondContact O-N 3.26Å; I147-V150 PolarHBondContact O-N 3.01Å; Y148-V150 VanDerWaalsContact C-N 3.34Å; Y148-V150 PolarHBondContact O-N 3.46Å; V150-I153 PolarHBondContact O-N 3.27Å; V150-L158 HydrophobicContact CG2-CD1 4.2Å; V150-L158 HydrophobicContact CG2-CD2 3.98Å; V150-L158 HydrophobicContact CG2-CG 4.27Å |
| 151 | V | 90.1 | Very high | 92.7 | Very high | 94 Ų | 94 | 55.4 Ų | 55.4 | 57% | 0.57 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -68.6 | -41.8 | 179.4 | 173.3 | 0 | 0 | 0 | 0 | 111.8 | I147 Y148 I153 | I147-V151 WeakPolarHBondContact O-CG2 3.33Å; I147-V151 PolarHBondContact O-N 3.33Å; Y148-V151 PolarHBondContact O-N 3.46Å; V151-I153 VanDerWaalsContact C-N 3.27Å; V151-I153 PolarHBondContact O-N 3.5Å |
| 152 | K | 90.3 | Very high | 92.7 | Very high | 124 Ų | 124 | 50.7 Ų | 50.7 | 54% | 0.539 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -83.1 | -0.1 | 179.4 | -69.7 | -69.5 | -173.2 | 178.1 | 0 | 113.9 | Y148 R154 | Y148-K152 HydrophobicContact CD2-CG 4.18Å; Y148-K152 HydrophobicContact CE1-CG 4.13Å; Y148-K152 HydrophobicContact CE2-CD 4.41Å; Y148-K152 HydrophobicContact CE2-CG 3.65Å; Y148-K152 WeakPolarHBondContact O-CB 3.36Å; Y148-K152 PolarHBondContact O-N 2.89Å; K152-R154 HydrophobicContact CB-CG 4.27Å |
| 153 | I | 87.8 | Confident | 92.7 | Very high | 34 Ų | 34 | 52.4 Ų | 52.4 | 17% | 0.174 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 55.3 | 52.9 | -178.9 | -52.7 | 168.7 | 0 | 0 | 0 | 111.1 | G149 V150 V151 L239 V242 | G149-I153 PolarHBondContact O-N 2.92Å; V150-I153 PolarHBondContact O-N 3.27Å; V151-I153 VanDerWaalsContact C-N 3.27Å; V151-I153 PolarHBondContact O-N 3.5Å; I153-L239 HydrophobicContact CB-CD1 3.92Å; I153-L239 HydrophobicContact CG1-CD1 4.13Å; I153-L239 HydrophobicContact CG2-CD1 3.51Å; I153-L239 HydrophobicContact CG2-CG 4.05Å; I153-V242 HydrophobicContact CG2-CB 4.24Å; I153-V242 HydrophobicContact CG2-CG1 3.71Å |
| 154 | R | 90.5 | Very high | 92.6 | Very high | 151 Ų | 151 | 55.6 Ų | 55.6 | 57% | 0.57 | 28% | 0.276 | S | S | * | . | trans | -125.7 | 101.6 | 179.3 | -70.2 | -66.8 | -168.1 | 166.3 | 4.5 | 109.6 | G149 K152 L156 Y157 | G149-R154 PolarHBondContact O-N 3.48Å; K152-R154 HydrophobicContact CB-CG 4.27Å; R154-L156 VanDerWaalsContact C-N 3.26Å; R154-L156 PolarHBondContact O-N 3.15Å; R154-Y157 HydrophobicContact CB-CD2 3.57Å; R154-Y157 HydrophobicContact CB-CE2 3.9Å; R154-Y157 HydrophobicContact CG-CD2 4.43Å; R154-Y157 HydrophobicContact CG-CE2 4.29Å; R154-Y157 PolarHBondContact O-N 3.21Å | ||
| 155 | P | 89.4 | Confident | 92.5 | Very high | 9 Ų | 9 | 55 Ų | 55 | 6% | 0.058 | 27% | 0.265 | C | S | . | . | G | 310 helix | trans | -62.8 | -28.2 | -174.4 | 21.8 | -30.7 | 0 | 0 | 0 | 114.4 | Y157 L158 Y236 L239 | P155-Y157 PolarHBondContact O-N 2.95Å; P155-L158 PolarHBondContact O-N 3.45Å; P155-L158 VanDerWaalsContact O-N 3.08Å; P155-Y236 HydrophobicContact CB-CD2 3.89Å; P155-Y236 HydrophobicContact CB-CE2 3.68Å; P155-Y236 WeakPolarHBondContact O-CE2 3.39Å; P155-L239 HydrophobicContact CB-CB 4.25Å; P155-L239 HydrophobicContact CB-CD2 4.43Å |
| 156 | L | 92.3 | Very high | 92.6 | Very high | 126 Ų | 126 | 55.3 Ų | 55.3 | 66% | 0.66 | 27% | 0.267 | S | S | * | . | G | 310 helix | trans | -60.9 | -29.5 | -176.3 | -79.4 | 71.8 | 0 | 0 | 0 | 113.3 | R154 L158 I159 | R154-L156 VanDerWaalsContact C-N 3.26Å; R154-L156 PolarHBondContact O-N 3.15Å; L156-L158 VanDerWaalsContact C-N 3.27Å; L156-L158 PolarHBondContact O-N 2.95Å; L156-I159 WeakPolarHBondContact O-CB 3.22Å; L156-I159 WeakPolarHBondContact O-CG1 3.35Å; L156-I159 PolarHBondContact O-N 2.82Å |
| 157 | Y | 93.9 | Very high | 92.6 | Very high | 91 Ų | 91 | 60.6 Ų | 60.6 | 36% | 0.357 | 29% | 0.291 | S | S | . | . | G | 310 helix | trans | -77 | -11.8 | -179.8 | -67.4 | -71.6 | 0 | 0 | 0 | 113.9 | M145 Y148 R154 P155 P160 | M145-Y157 HydrophobicContact CE-CD1 3.42Å; M145-Y157 VanDerWaalsContact CE-CD1 3.42Å; M145-Y157 HydrophobicContact CE-CE1 3.45Å; M145-Y157 VanDerWaalsContact CE-CE1 3.45Å; M145-Y157 WeakPolarHBondContact O-CB 3.32Å; Y148-Y157 HydrophobicContact CE1-CE2 4.31Å; R154-Y157 HydrophobicContact CB-CD2 3.57Å; R154-Y157 HydrophobicContact CB-CE2 3.9Å; R154-Y157 HydrophobicContact CG-CD2 4.43Å; R154-Y157 HydrophobicContact CG-CE2 4.29Å; R154-Y157 PolarHBondContact O-N 3.21Å; P155-Y157 PolarHBondContact O-N 2.95Å; Y157-P160 WeakPolarHBondContact O-CD 3.3Å; Y157-P160 WeakPolarHBondContact O-CG 3.28Å |
| 158 | L | 92.8 | Very high | 92.5 | Very high | 1 Ų | 1 | 61.9 Ų | 61.9 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | G | 310 helix | trans | -81.2 | -23.1 | 174.1 | -72.2 | 87.9 | 0 | 0 | 0 | 112.1 | M146 V150 P155 L156 F161 F162 C235 Y236 L239 | M146-L158 HydrophobicContact CG-CD2 4.43Å; M146-L158 HydrophobicContact CG-CG 4.06Å; V150-L158 HydrophobicContact CG2-CD1 4.2Å; V150-L158 HydrophobicContact CG2-CD2 3.98Å; V150-L158 HydrophobicContact CG2-CG 4.27Å; P155-L158 PolarHBondContact O-N 3.45Å; P155-L158 VanDerWaalsContact O-N 3.08Å; L156-L158 VanDerWaalsContact C-N 3.27Å; L156-L158 PolarHBondContact O-N 2.95Å; L158-F161 PolarHBondContact O-N 2.65Å; L158-F162 WeakPolarHBondContact O-CB 3.35Å; L158-F162 PolarHBondContact O-N 3.41Å; L158-C235 HydrophobicContact CD2-CB 4.47Å; L158-Y236 HydrophobicContact CB-CD2 4.29Å; L158-L239 HydrophobicContact CD1-CD2 3.58Å |
| 159 | I | 93.7 | Very high | 92.6 | Very high | 70 Ų | 70 | 58.9 Ų | 58.9 | 36% | 0.359 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -54.2 | -50.8 | -177.8 | -59.8 | 174.9 | 0 | 0 | 0 | 113 | L156 F161 F162 C163 Y236 | L156-I159 WeakPolarHBondContact O-CB 3.22Å; L156-I159 WeakPolarHBondContact O-CG1 3.35Å; L156-I159 PolarHBondContact O-N 2.82Å; I159-F161 VanDerWaalsContact C-N 3.31Å; I159-F161 PolarHBondContact O-N 2.91Å; I159-F162 WeakPolarHBondContact O-CB 3.39Å; I159-F162 PolarHBondContact O-N 2.85Å; I159-F162 VanDerWaalsContact O-N 3.17Å; I159-C163 PolarHBondContact O-N 2.63Å; I159-C163 PolarHBondContact O-SG 3.1Å; I159-Y236 HydrophobicContact CG1-CE2 4.09Å |
| 160 | P | 94.3 | Very high | 92.8 | Very high | 57 Ų | 57 | 62.8 Ų | 62.8 | 37% | 0.37 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.5 | -40.4 | -178 | 22.3 | -34.5 | 0 | 0 | 0 | 112.7 | Y157 F164 | Y157-P160 WeakPolarHBondContact O-CD 3.3Å; Y157-P160 WeakPolarHBondContact O-CG 3.28Å; P160-F164 WeakPolarHBondContact O-CB 3.33Å; P160-F164 PolarHBondContact O-N 3.11Å |
| 161 | F | 93.3 | Very high | 92.8 | Very high | 5 Ų | 5 | 66.3 Ų | 66.3 | 2% | 0.022 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -68.8 | -40.5 | 176.7 | -178.1 | -109.8 | 0 | 0 | 0 | 111.9 | N35 I142 T143 M146 L158 I159 F164 Q165 I232 | N35-F161 WeakPolarHBondContact ND2-CZ 3.21Å; I142-F161 HydrophobicContact CD1-CD2 4.35Å; I142-F161 HydrophobicContact CG1-CD2 4.3Å; T143-F161 HydrophobicContact CG2-CD2 3.79Å; T143-F161 HydrophobicContact CG2-CE2 3.46Å; T143-F161 VanDerWaalsContact CG2-CE2 3.46Å; T143-F161 HydrophobicContact CG2-CZ 4.31Å; M146-F161 HydrophobicContact CB-CB 4.01Å; M146-F161 HydrophobicContact CB-CD1 4.31Å; M146-F161 HydrophobicContact CB-CG 4.2Å; M146-F161 HydrophobicContact CG-CB 4.33Å; M146-F161 HydrophobicContact CG-CD1 3.94Å; M146-F161 HydrophobicContact CG-CG 4.32Å; M146-F161 HydrophobicContact SD-CD1 3.21Å; M146-F161 WeakPolarHBondContact SD-CD1 3.49Å; M146-F161 HydrophobicContact SD-CE1 3.36Å; M146-F161 WeakPolarHBondContact SD-CE1 3.23Å; M146-F161 HydrophobicContact SD-CG 4Å; M146-F161 HydrophobicContact SD-CZ 4.3Å; L158-F161 PolarHBondContact O-N 2.65Å; I159-F161 VanDerWaalsContact C-N 3.31Å; I159-F161 PolarHBondContact O-N 2.91Å; F161-F164 WeakPolarHBondContact O-CB 3.3Å; F161-F164 PolarHBondContact O-N 3.25Å; F161-Q165 HydrophobicContact CD1-CG 4.36Å; F161-Q165 HydrophobicContact CE1-CG 4.01Å; F161-Q165 HydrophobicContact CE2-CG 4.4Å; F161-Q165 HydrophobicContact CZ-CG 4Å; F161-Q165 WeakPolarHBondContact O-CG 3.38Å; F161-Q165 PolarHBondContact O-N 3.18Å; F161-I232 HydrophobicContact CD1-CD1 4.29Å; F161-I232 HydrophobicContact CD1-CG1 4.21Å; F161-I232 HydrophobicContact CD1-CG2 4.41Å; F161-I232 HydrophobicContact CE1-CD1 3.88Å; F161-I232 HydrophobicContact CE1-CG1 3.84Å |
| 162 | F | 94.5 | Very high | 92.8 | Very high | 41 Ų | 41 | 62.6 Ų | 62.6 | 18% | 0.18 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.6 | -45.5 | 175.4 | 177.5 | -108.1 | 0 | 0 | 0 | 112.3 | L158 I159 F164 Q165 I166 I229 I232 W233 | L158-F162 WeakPolarHBondContact O-CB 3.35Å; L158-F162 PolarHBondContact O-N 3.41Å; I159-F162 WeakPolarHBondContact O-CB 3.39Å; I159-F162 PolarHBondContact O-N 2.85Å; I159-F162 VanDerWaalsContact O-N 3.17Å; F162-F164 VanDerWaalsContact C-N 3.28Å; F162-F164 PolarHBondContact O-N 2.85Å; F162-Q165 PolarHBondContact O-N 2.9Å; F162-I166 HydrophobicContact CD1-CD1 3.91Å; F162-I166 HydrophobicContact CE1-CD1 3.37Å; F162-I166 HydrophobicContact CE1-CG1 4.5Å; F162-I166 HydrophobicContact CE2-CD1 4.1Å; F162-I166 HydrophobicContact CG-CD1 4.48Å; F162-I166 HydrophobicContact CZ-CD1 3.49Å; F162-I166 VanDerWaalsContact CZ-CD1 3.49Å; F162-I166 HydrophobicContact CZ-CG1 4.36Å; F162-I166 PolarHBondContact O-N 2.83Å; F162-I229 HydrophobicContact CD2-CG2 4.42Å; F162-I229 HydrophobicContact CE2-CG2 3.74Å; F162-I232 HydrophobicContact CB-CG2 4.2Å; F162-I232 HydrophobicContact CD2-CG2 4.11Å; F162-W233 HydrophobicContact CE1-CE3 4.22Å; F162-W233 HydrophobicContact CE1-CZ3 4.27Å; F162-W233 HydrophobicContact CE2-CB 4.3Å; F162-W233 AromaticContact CE2-CE3 3.9Å; F162-W233 HydrophobicContact CE2-CE3 3.9Å; F162-W233 AromaticContact CZ-CE3 3.57Å; F162-W233 HydrophobicContact CZ-CE3 3.57Å; F162-W233 HydrophobicContact CZ-CZ3 4.01Å |
| 163 | C | 95.6 | Very high | 93 | Very high | 69 Ų | 69 | 58.5 Ų | 58.5 | 47% | 0.466 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60 | -40.4 | 174.2 | -67.2 | 0 | 0 | 0 | 0 | 111.6 | I159 I166 F167 | I159-C163 PolarHBondContact O-N 2.63Å; I159-C163 PolarHBondContact O-SG 3.1Å; C163-I166 PolarHBondContact O-N 2.9Å; C163-F167 WeakPolarHBondContact O-CB 3.49Å; C163-F167 PolarHBondContact O-N 3.41Å |
| 164 | F | 92 | Very high | 93.1 | Very high | 67 Ų | 67 | 62.1 Ų | 62.1 | 29% | 0.294 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 176 | -176.8 | -97.3 | 0 | 0 | 0 | 112.3 | L139 I142 P160 F161 F162 I166 F167 D168 | L139-F164 HydrophobicContact CD1-CE1 4.06Å; L139-F164 HydrophobicContact CD1-CZ 3.79Å; L139-F164 HydrophobicContact CD2-CD1 3.94Å; L139-F164 HydrophobicContact CD2-CD2 3.82Å; L139-F164 HydrophobicContact CD2-CE1 3.48Å; L139-F164 VanDerWaalsContact CD2-CE1 3.48Å; L139-F164 HydrophobicContact CD2-CE2 3.34Å; L139-F164 HydrophobicContact CD2-CG 4.11Å; L139-F164 HydrophobicContact CD2-CZ 3.16Å; L139-F164 HydrophobicContact CG-CE1 4.4Å; L139-F164 HydrophobicContact CG-CZ 4.11Å; I142-F164 HydrophobicContact CD1-CB 3.78Å; I142-F164 HydrophobicContact CD1-CD1 3.97Å; I142-F164 HydrophobicContact CD1-CD2 4.18Å; I142-F164 HydrophobicContact CD1-CG 3.67Å; P160-F164 WeakPolarHBondContact O-CB 3.33Å; P160-F164 PolarHBondContact O-N 3.11Å; F161-F164 WeakPolarHBondContact O-CB 3.3Å; F161-F164 PolarHBondContact O-N 3.25Å; F162-F164 VanDerWaalsContact C-N 3.28Å; F162-F164 PolarHBondContact O-N 2.85Å; F164-I166 VanDerWaalsContact C-N 3.34Å; F164-I166 PolarHBondContact O-N 3.39Å; F164-F167 PolarHBondContact O-N 3.45Å; F164-D168 HydrophobicContact CE1-CB 4.39Å; F164-D168 WeakPolarHBondContact O-CB 3.33Å; F164-D168 PolarHBondContact O-N 3.26Å |
| 165 | Q | 92.8 | Very high | 93 | Very high | 17 Ų | 17 | 58.4 Ų | 58.4 | 8% | 0.079 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.3 | -39.5 | 176.1 | -70.9 | -174.6 | -23.4 | 0 | 0 | 112.8 | F161 F162 F169 I229 I232 | F161-Q165 HydrophobicContact CD1-CG 4.36Å; F161-Q165 HydrophobicContact CE1-CG 4.01Å; F161-Q165 HydrophobicContact CE2-CG 4.4Å; F161-Q165 HydrophobicContact CZ-CG 4Å; F161-Q165 WeakPolarHBondContact O-CG 3.38Å; F161-Q165 PolarHBondContact O-N 3.18Å; F162-Q165 PolarHBondContact O-N 2.9Å; Q165-F169 WeakPolarHBondContact O-CB 3.37Å; Q165-F169 PolarHBondContact O-N 3.48Å; Q165-I229 HydrophobicContact CB-CG1 3.9Å; Q165-I232 VanDerWaalsContact OE1-CG1 3.31Å |
| 166 | I | 95.1 | Very high | 93 | Very high | 60 Ų | 60 | 58.8 Ų | 58.8 | 31% | 0.308 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.3 | -45.3 | 175 | -69.8 | 171.1 | 0 | 0 | 0 | 110.3 | F162 C163 F164 F169 I170 | F162-I166 HydrophobicContact CD1-CD1 3.91Å; F162-I166 HydrophobicContact CE1-CD1 3.37Å; F162-I166 HydrophobicContact CE1-CG1 4.5Å; F162-I166 HydrophobicContact CE2-CD1 4.1Å; F162-I166 HydrophobicContact CG-CD1 4.48Å; F162-I166 HydrophobicContact CZ-CD1 3.49Å; F162-I166 VanDerWaalsContact CZ-CD1 3.49Å; F162-I166 HydrophobicContact CZ-CG1 4.36Å; F162-I166 PolarHBondContact O-N 2.83Å; C163-I166 PolarHBondContact O-N 2.9Å; F164-I166 VanDerWaalsContact C-N 3.34Å; F164-I166 PolarHBondContact O-N 3.39Å; I166-F169 WeakPolarHBondContact O-CB 3.45Å; I166-F169 PolarHBondContact O-N 3.29Å; I166-I170 HydrophobicContact CG2-CD1 3.87Å; I166-I170 HydrophobicContact CG2-CG1 4.45Å; I166-I170 VanDerWaalsContact O-CG1 3.32Å; I166-I170 WeakPolarHBondContact O-CG1 3.32Å; I166-I170 PolarHBondContact O-N 3.5Å |
| 167 | F | 95.7 | Very high | 92.7 | Very high | 111 Ų | 111 | 56.6 Ų | 56.6 | 49% | 0.487 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 178 | 177.4 | -106.9 | 0 | 0 | 0 | 111.9 | C163 F164 F169 I170 L171 | C163-F167 WeakPolarHBondContact O-CB 3.49Å; C163-F167 PolarHBondContact O-N 3.41Å; F164-F167 PolarHBondContact O-N 3.45Å; F167-F169 VanDerWaalsContact C-N 3.3Å; F167-F169 PolarHBondContact O-N 2.99Å; F167-I170 PolarHBondContact O-N 3.41Å; F167-L171 HydrophobicContact CD1-CD1 3.89Å; F167-L171 HydrophobicContact CD1-CG 4.34Å; F167-L171 HydrophobicContact CE1-CD1 3.28Å; F167-L171 HydrophobicContact CE1-CG 3.94Å; F167-L171 HydrophobicContact CE2-CD1 4.36Å; F167-L171 HydrophobicContact CE2-CD2 4.33Å; F167-L171 HydrophobicContact CE2-CG 4.18Å; F167-L171 HydrophobicContact CZ-CD1 3.56Å; F167-L171 HydrophobicContact CZ-CD2 4.06Å; F167-L171 HydrophobicContact CZ-CG 3.84Å; F167-L171 WeakPolarHBondContact O-CG 3.46Å; F167-L171 PolarHBondContact O-N 2.85Å |
| 168 | D | 91.8 | Very high | 92.4 | Very high | 58 Ų | 58 | 53.8 Ų | 53.8 | 31% | 0.31 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60 | -38.7 | 174.4 | 171.1 | 65.3 | 0 | 0 | 0 | 112 | F164 S172 K225 | F164-D168 HydrophobicContact CE1-CB 4.39Å; F164-D168 WeakPolarHBondContact O-CB 3.33Å; F164-D168 PolarHBondContact O-N 3.26Å; D168-S172 WeakPolarHBondContact O-CB 3.36Å; D168-S172 PolarHBondContact O-N 2.9Å; D168-S172 PolarHBondContact O-OG 3.2Å; D168-K225 IonicContact OD1-NZ 3.11Å; D168-K225 PolarHBondContact OD1-NZ 2.91Å; D168-K225 VanDerWaalsContact OD1-NZ 3.11Å; D168-K225 IonicContact OD2-NZ 2.63Å; D168-K225 PolarHBondContact OD2-NZ 3.33Å |
| 169 | F | 95.5 | Very high | 91.9 | Very high | 51 Ų | 51 | 58.6 Ų | 58.6 | 22% | 0.224 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.2 | -46.3 | 172.3 | 171.4 | -102.4 | 0 | 0 | 0 | 112.3 | Q165 I166 F167 L171 S172 C173 L222 K225 I226 I229 | Q165-F169 WeakPolarHBondContact O-CB 3.37Å; Q165-F169 PolarHBondContact O-N 3.48Å; I166-F169 WeakPolarHBondContact O-CB 3.45Å; I166-F169 PolarHBondContact O-N 3.29Å; F167-F169 VanDerWaalsContact C-N 3.3Å; F167-F169 PolarHBondContact O-N 2.99Å; F169-L171 VanDerWaalsContact C-N 3.33Å; F169-L171 PolarHBondContact O-N 3.35Å; F169-S172 WeakPolarHBondContact O-CB 3.34Å; F169-S172 PolarHBondContact O-N 3.24Å; F169-S172 VanDerWaalsContact O-N 3.1Å; F169-C173 VanDerWaalsContact CZ-SG 3.54Å; F169-C173 PolarHBondContact O-N 3.41Å; F169-C173 PolarHBondContact O-SG 3.31Å; F169-C173 VanDerWaalsContact O-SG 3.39Å; F169-L222 HydrophobicContact CD2-CD2 4.21Å; F169-L222 HydrophobicContact CE2-CB 4.4Å; F169-L222 HydrophobicContact CE2-CD2 3.96Å; F169-K225 HydrophobicContact CD2-CB 4.16Å; F169-I226 HydrophobicContact CD2-CG1 4.16Å; F169-I226 HydrophobicContact CE2-CD1 3.85Å; F169-I226 HydrophobicContact CE2-CG1 3.57Å; F169-I226 HydrophobicContact CZ-CD1 4.02Å; F169-I226 HydrophobicContact CZ-CG1 3.98Å; F169-I229 HydrophobicContact CB-CD1 3.81Å; F169-I229 HydrophobicContact CG-CD1 4.16Å |
| 170 | I | 96.1 | Very high | 91.4 | Very high | 83 Ų | 83 | 63.7 Ų | 63.7 | 43% | 0.426 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -59.6 | -46.4 | 176.5 | -67.8 | 165.8 | 0 | 0 | 0 | 110.2 | I166 F167 S172 C173 L174 | I166-I170 HydrophobicContact CG2-CD1 3.87Å; I166-I170 HydrophobicContact CG2-CG1 4.45Å; I166-I170 VanDerWaalsContact O-CG1 3.32Å; I166-I170 WeakPolarHBondContact O-CG1 3.32Å; I166-I170 PolarHBondContact O-N 3.5Å; F167-I170 PolarHBondContact O-N 3.41Å; I170-S172 VanDerWaalsContact C-N 3.29Å; I170-S172 PolarHBondContact O-N 3.02Å; I170-C173 PolarHBondContact O-N 3.06Å; I170-L174 HydrophobicContact CG2-CD1 4.06Å; I170-L174 HydrophobicContact CG2-CG 4.44Å; I170-L174 WeakPolarHBondContact O-CG 3.36Å; I170-L174 PolarHBondContact O-N 2.91Å |
| 171 | L | 90.2 | Very high | 90.8 | Very high | 73 Ų | 73 | 66.9 Ų | 66.9 | 38% | 0.382 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.2 | -40.4 | 174.4 | -73.6 | -175.5 | 0 | 0 | 0 | 111.6 | F167 F169 C173 L174 T175 | F167-L171 HydrophobicContact CD1-CD1 3.89Å; F167-L171 HydrophobicContact CD1-CG 4.34Å; F167-L171 HydrophobicContact CE1-CD1 3.28Å; F167-L171 HydrophobicContact CE1-CG 3.94Å; F167-L171 HydrophobicContact CE2-CD1 4.36Å; F167-L171 HydrophobicContact CE2-CD2 4.33Å; F167-L171 HydrophobicContact CE2-CG 4.18Å; F167-L171 HydrophobicContact CZ-CD1 3.56Å; F167-L171 HydrophobicContact CZ-CD2 4.06Å; F167-L171 HydrophobicContact CZ-CG 3.84Å; F167-L171 WeakPolarHBondContact O-CG 3.46Å; F167-L171 PolarHBondContact O-N 2.85Å; F169-L171 VanDerWaalsContact C-N 3.33Å; F169-L171 PolarHBondContact O-N 3.35Å; L171-C173 PolarHBondContact O-N 2.85Å; L171-L174 PolarHBondContact O-N 3.11Å; L171-T175 WeakPolarHBondContact O-CB 3.39Å; L171-T175 VanDerWaalsContact O-CG2 3.28Å; L171-T175 WeakPolarHBondContact O-CG2 3.36Å; L171-T175 PolarHBondContact O-N 3.18Å; L171-T175 PolarHBondContact O-OG1 3.39Å |
| 172 | S | 91.5 | Very high | 89.8 | Confident | 17 Ų | 17 | 77 Ų | 77 | 12% | 0.119 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.3 | -43.4 | 177.2 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | D168 F169 I170 T175 A176 K225 | D168-S172 WeakPolarHBondContact O-CB 3.36Å; D168-S172 PolarHBondContact O-N 2.9Å; D168-S172 PolarHBondContact O-OG 3.2Å; F169-S172 WeakPolarHBondContact O-CB 3.34Å; F169-S172 PolarHBondContact O-N 3.24Å; F169-S172 VanDerWaalsContact O-N 3.1Å; I170-S172 VanDerWaalsContact C-N 3.29Å; I170-S172 PolarHBondContact O-N 3.02Å; S172-T175 WeakPolarHBondContact CA-OG1 3.23Å; S172-T175 PolarHBondContact O-N 3.23Å; S172-T175 PolarHBondContact O-OG1 2.92Å; S172-A176 WeakPolarHBondContact O-CB 3.36Å; S172-A176 PolarHBondContact O-N 3.05Å; S172-K225 WeakPolarHBondContact OG-CD 3.06Å; S172-K225 WeakPolarHBondContact OG-CE 3.3Å; S172-K225 PolarHBondContact OG-NZ 3.47Å |
| 173 | C | 93.7 | Very high | 88.6 | Confident | 38 Ų | 38 | 79.8 Ų | 79.8 | 26% | 0.257 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 173.4 | -67.5 | 0 | 0 | 0 | 0 | 111.8 | F169 I170 L171 T175 A176 V177 | F169-C173 VanDerWaalsContact CZ-SG 3.54Å; F169-C173 PolarHBondContact O-N 3.41Å; F169-C173 PolarHBondContact O-SG 3.31Å; F169-C173 VanDerWaalsContact O-SG 3.39Å; I170-C173 PolarHBondContact O-N 3.06Å; L171-C173 PolarHBondContact O-N 2.85Å; C173-T175 VanDerWaalsContact C-N 3.34Å; C173-T175 PolarHBondContact O-N 3.45Å; C173-A176 PolarHBondContact O-N 3.39Å; C173-V177 WeakPolarHBondContact O-CG2 3.43Å; C173-V177 PolarHBondContact O-N 3.31Å |
| 174 | L | 91 | Very high | 87.1 | Confident | 110 Ų | 110 | 79.9 Ų | 79.9 | 58% | 0.576 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -63.3 | -40.2 | 178.6 | -71.8 | 174.4 | 0 | 0 | 0 | 112.1 | I170 L171 G178 | I170-L174 HydrophobicContact CG2-CD1 4.06Å; I170-L174 HydrophobicContact CG2-CG 4.44Å; I170-L174 WeakPolarHBondContact O-CG 3.36Å; I170-L174 PolarHBondContact O-N 2.91Å; L171-L174 PolarHBondContact O-N 3.11Å; L174-G178 PolarHBondContact O-N 3.39Å |
| 175 | T | 87.8 | Confident | 85.7 | Confident | 73 Ų | 73 | 80.2 Ų | 80.2 | 45% | 0.448 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.6 | -45.2 | 173.9 | 59 | 0 | 0 | 0 | 0 | 110.6 | L171 S172 C173 V177 G178 H179 | L171-T175 WeakPolarHBondContact O-CB 3.39Å; L171-T175 VanDerWaalsContact O-CG2 3.28Å; L171-T175 WeakPolarHBondContact O-CG2 3.36Å; L171-T175 PolarHBondContact O-N 3.18Å; L171-T175 PolarHBondContact O-OG1 3.39Å; S172-T175 WeakPolarHBondContact CA-OG1 3.23Å; S172-T175 PolarHBondContact O-N 3.23Å; S172-T175 PolarHBondContact O-OG1 2.92Å; C173-T175 VanDerWaalsContact C-N 3.34Å; C173-T175 PolarHBondContact O-N 3.45Å; T175-V177 PolarHBondContact O-N 2.98Å; T175-G178 CarbonylContact O-C 3.42Å; T175-G178 WeakPolarHBondContact O-CA 3.47Å; T175-G178 PolarHBondContact O-N 3.26Å; T175-G178 VanDerWaalsContact O-N 3.15Å; T175-H179 PolarHBondContact O-N 2.89Å; T175-H179 PolarHBondContact O-ND1 3.23Å |
| 176 | A | 88.3 | Confident | 84.3 | Confident | 17 Ų | 17 | 82 Ų | 82 | 14% | 0.14 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | S172 C173 G178 H179 Y180 Y218 | S172-A176 WeakPolarHBondContact O-CB 3.36Å; S172-A176 PolarHBondContact O-N 3.05Å; C173-A176 PolarHBondContact O-N 3.39Å; A176-G178 VanDerWaalsContact C-N 3.35Å; A176-H179 PolarHBondContact O-N 3.01Å; A176-Y180 WeakPolarHBondContact O-CB 3.42Å; A176-Y180 PolarHBondContact O-N 3.06Å; A176-Y218 HydrophobicContact CB-CD1 4.17Å; A176-Y218 HydrophobicContact CB-CG 4.35Å |
| 177 | V | 87.8 | Confident | 82.8 | Confident | 80 Ų | 80 | 82.9 Ų | 82.9 | 49% | 0.485 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.9 | -42.8 | 174.2 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | C173 T175 Y180 I181 | C173-V177 WeakPolarHBondContact O-CG2 3.43Å; C173-V177 PolarHBondContact O-N 3.31Å; T175-V177 PolarHBondContact O-N 2.98Å; V177-Y180 PolarHBondContact O-N 3.44Å; V177-I181 HydrophobicContact CG1-CD1 3.6Å; V177-I181 HydrophobicContact CG1-CG1 4.25Å; V177-I181 WeakPolarHBondContact O-CB 3.33Å; V177-I181 VanDerWaalsContact O-CG1 3.31Å; V177-I181 WeakPolarHBondContact O-CG1 3.25Å; V177-I181 PolarHBondContact O-N 3.05Å |
| 178 | G | 85.8 | Confident | 81.5 | Confident | 31 Ų | 31 | 82 Ų | 82 | 32% | 0.32 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58.3 | -48.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L174 T175 A176 Y180 I181 W182 | L174-G178 PolarHBondContact O-N 3.39Å; T175-G178 CarbonylContact O-C 3.42Å; T175-G178 WeakPolarHBondContact O-CA 3.47Å; T175-G178 PolarHBondContact O-N 3.26Å; T175-G178 VanDerWaalsContact O-N 3.15Å; A176-G178 VanDerWaalsContact C-N 3.35Å; G178-Y180 VanDerWaalsContact C-N 3.32Å; G178-Y180 PolarHBondContact O-N 3.39Å; G178-I181 PolarHBondContact O-N 3.32Å; G178-W182 WeakPolarHBondContact O-CB 3.28Å; G178-W182 PolarHBondContact O-N 2.92Å |
| 179 | H | 83 | Confident | 80.2 | Confident | 103 Ų | 103 | 82.6 Ų | 82.6 | 48% | 0.477 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.9 | -39.6 | 176.4 | -74 | 77.6 | 0 | 0 | 0 | 111.6 | T175 A176 M183 Y218 | T175-H179 PolarHBondContact O-N 2.89Å; T175-H179 PolarHBondContact O-ND1 3.23Å; A176-H179 PolarHBondContact O-N 3.01Å; H179-M183 WeakPolarHBondContact O-CB 3.48Å; H179-M183 PolarHBondContact O-N 3.24Å; H179-Y218 PolarHBondContact CD2-OH 2.85Å |
| 180 | Y | 82.7 | Confident | 78.7 | Confident | 176 Ų | 176 | 81.4 Ų | 81.4 | 69% | 0.69 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -68.1 | -42.9 | 178.6 | -176.2 | -97.8 | 0 | 0 | 0 | 112.7 | A176 V177 G178 | A176-Y180 WeakPolarHBondContact O-CB 3.42Å; A176-Y180 PolarHBondContact O-N 3.06Å; V177-Y180 PolarHBondContact O-N 3.44Å; G178-Y180 VanDerWaalsContact C-N 3.32Å; G178-Y180 PolarHBondContact O-N 3.39Å |
| 181 | I | 82.9 | Confident | 77.3 | Confident | 125 Ų | 125 | 84.7 Ų | 84.7 | 64% | 0.641 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -69.5 | -37.1 | 178.2 | -67.1 | 170.8 | 0 | 0 | 0 | 111.3 | V177 G178 | V177-I181 HydrophobicContact CG1-CD1 3.6Å; V177-I181 HydrophobicContact CG1-CG1 4.25Å; V177-I181 WeakPolarHBondContact O-CB 3.33Å; V177-I181 VanDerWaalsContact O-CG1 3.31Å; V177-I181 WeakPolarHBondContact O-CG1 3.25Å; V177-I181 PolarHBondContact O-N 3.05Å; G178-I181 PolarHBondContact O-N 3.32Å |
| 182 | W | 72.5 | Confident | 76.4 | Confident | 217 Ų | 217 | 88.6 Ų | 88.6 | 82% | 0.822 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -88.5 | -7.2 | -177.6 | -101.4 | 75.1 | 0 | 0 | 0 | 114.8 | G178 P184 | G178-W182 WeakPolarHBondContact O-CB 3.28Å; G178-W182 PolarHBondContact O-N 2.92Å; W182-P184 WeakPolarHBondContact O-CD 3.46Å |
| 183 | M | 68.5 | Low | 75.3 | Confident | 100 Ų | 100 | 91.6 Ų | 91.6 | 49% | 0.493 | 47% | 0.467 | S | S | . | . | trans | -62.2 | 107.2 | -179.4 | -173.9 | 166.3 | -77.1 | 0 | 0 | 108.3 | H179 N185 F214 | H179-M183 WeakPolarHBondContact O-CB 3.48Å; H179-M183 PolarHBondContact O-N 3.24Å; M183-N185 PolarHBondContact O-N 3.25Å; M183-F214 HydrophobicContact CE-CD2 4.45Å | ||
| 184 | P | 63.6 | Low | 73.9 | Confident | 70 Ų | 70 | 94.3 Ų | 94.3 | 46% | 0.455 | 48% | 0.484 | S | S | . | . | trans | -61.4 | 139.8 | 175.3 | 27.8 | -33.5 | 0 | 0 | 0 | 107.3 | W182 V186 I189 | W182-P184 WeakPolarHBondContact O-CD 3.46Å; P184-V186 PolarHBondContact O-N 3.4Å; P184-I189 HydrophobicContact CB-CD1 4.09Å; P184-I189 HydrophobicContact CB-CG1 4.22Å; P184-I189 HydrophobicContact CG-CD1 3.51Å; P184-I189 HydrophobicContact CG-CG1 4.15Å | ||
| 185 | N | 64.3 | Low | 73 | Confident | 75 Ų | 75 | 96.6 Ų | 96.6 | 40% | 0.401 | 50% | 0.497 | S | S | . | . | trans | -59.2 | 128.7 | 171.3 | -168.3 | 10.3 | 0 | 0 | 0 | 106.8 | M183 D187 D188 | M183-N185 PolarHBondContact O-N 3.25Å; N185-D187 PolarHBondContact ND2-OD2 3.41Å; N185-D187 PolarHBondContact O-N 2.91Å; N185-D187 PolarHBondContact OD1-OD2 2.93Å; N185-D188 WeakPolarHBondContact O-CB 3.39Å; N185-D188 PolarHBondContact O-N 3.42Å | ||
| 186 | V | 62.5 | Low | 72 | Confident | 53 Ų | 53 | 96.4 Ų | 96.4 | 32% | 0.321 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -55 | -27.5 | -178.8 | -62.8 | 0 | 0 | 0 | 0 | 111.1 | P184 D188 I189 I190 S207 | P184-V186 PolarHBondContact O-N 3.4Å; V186-D188 VanDerWaalsContact C-N 3.33Å; V186-D188 PolarHBondContact O-N 2.97Å; V186-I189 PolarHBondContact O-N 3.16Å; V186-I190 WeakPolarHBondContact O-CD1 3.44Å; V186-I190 WeakPolarHBondContact O-CG1 3.47Å; V186-I190 PolarHBondContact O-N 3.5Å; V186-S207 VanDerWaalsContact CG2-CB 3.47Å; V186-S207 WeakPolarHBondContact CG2-OG 3.4Å |
| 187 | D | 64.5 | Low | 70.7 | Confident | 79 Ų | 79 | 100.5 Ų | 100.5 | 42% | 0.422 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.2 | -40.8 | 173.6 | -58.4 | -34.9 | 0 | 0 | 0 | 112.7 | N185 I190 Q191 | N185-D187 PolarHBondContact ND2-OD2 3.41Å; N185-D187 PolarHBondContact O-N 2.91Å; N185-D187 PolarHBondContact OD1-OD2 2.93Å; D187-I190 PolarHBondContact O-N 2.88Å; D187-Q191 WeakPolarHBondContact O-CB 3.32Å; D187-Q191 VanDerWaalsContact O-CG 3.28Å; D187-Q191 WeakPolarHBondContact O-CG 3.22Å; D187-Q191 PolarHBondContact O-N 3.44Å |
| 188 | D | 67.5 | Low | 69.5 | Low | 93 Ų | 93 | 104.2 Ų | 104.2 | 50% | 0.497 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.4 | -39 | 179.8 | -66.1 | -26.7 | 0 | 0 | 0 | 111.1 | N185 V186 Q191 Q192 | N185-D188 WeakPolarHBondContact O-CB 3.39Å; N185-D188 PolarHBondContact O-N 3.42Å; V186-D188 VanDerWaalsContact C-N 3.33Å; V186-D188 PolarHBondContact O-N 2.97Å; D188-Q191 PolarHBondContact O-N 3Å; D188-Q192 WeakPolarHBondContact O-CB 3.46Å; D188-Q192 PolarHBondContact O-N 3.43Å |
| 189 | I | 64.3 | Low | 68.4 | Low | 70 Ų | 70 | 108.5 Ų | 108.5 | 36% | 0.359 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.1 | -43 | 176.4 | -64.3 | 167.6 | 0 | 0 | 0 | 110.4 | P184 V186 Q191 Q192 N193 L196 | P184-I189 HydrophobicContact CB-CD1 4.09Å; P184-I189 HydrophobicContact CB-CG1 4.22Å; P184-I189 HydrophobicContact CG-CD1 3.51Å; P184-I189 HydrophobicContact CG-CG1 4.15Å; V186-I189 PolarHBondContact O-N 3.16Å; I189-Q191 VanDerWaalsContact C-N 3.33Å; I189-Q192 PolarHBondContact O-N 3.29Å; I189-N193 PolarHBondContact O-N 3Å; I189-N193 VanDerWaalsContact O-N 3.12Å; I189-L196 HydrophobicContact CG2-CD1 4.06Å |
| 190 | I | 64.2 | Low | 67.5 | Low | 26 Ų | 26 | 111.8 Ų | 111.8 | 13% | 0.133 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -65 | -39.2 | 179.2 | -68.3 | 165.1 | 0 | 0 | 0 | 110.7 | V186 D187 N193 R199 | V186-I190 WeakPolarHBondContact O-CD1 3.44Å; V186-I190 WeakPolarHBondContact O-CG1 3.47Å; V186-I190 PolarHBondContact O-N 3.5Å; D187-I190 PolarHBondContact O-N 2.88Å; I190-N193 CarbonylContact O-C 3.5Å; I190-R199 HydrophobicContact CG2-CG 4.4Å |
| 191 | Q | 67.4 | Low | 66.5 | Low | 152 Ų | 152 | 109.2 Ų | 109.2 | 71% | 0.71 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.6 | -36.6 | 175.8 | -74.7 | 178.6 | 30.8 | 0 | 0 | 112.3 | D187 D188 I189 | D187-Q191 WeakPolarHBondContact O-CB 3.32Å; D187-Q191 VanDerWaalsContact O-CG 3.28Å; D187-Q191 WeakPolarHBondContact O-CG 3.22Å; D187-Q191 PolarHBondContact O-N 3.44Å; D188-Q191 PolarHBondContact O-N 3Å; I189-Q191 VanDerWaalsContact C-N 3.33Å |
| 192 | Q | 70.3 | Confident | 65.4 | Low | 155 Ų | 155 | 107.9 Ų | 107.9 | 72% | 0.724 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -73.9 | -28.2 | -178.4 | -163.8 | 171.9 | 15.3 | 0 | 0 | 112.9 | D188 I189 | D188-Q192 WeakPolarHBondContact O-CB 3.46Å; D188-Q192 PolarHBondContact O-N 3.43Å; I189-Q192 PolarHBondContact O-N 3.29Å |
| 193 | N | 69.4 | Low | 64.9 | Low | 81 Ų | 81 | 101.2 Ų | 101.2 | 43% | 0.433 | 52% | 0.521 | S | S | . | . | trans | -137.7 | 86.8 | -177.7 | -65.7 | -80.3 | 0 | 0 | 0 | 112 | I189 I190 N195 L196 | I189-N193 PolarHBondContact O-N 3Å; I189-N193 VanDerWaalsContact O-N 3.12Å; I190-N193 CarbonylContact O-C 3.5Å; N193-N195 PolarHBondContact O-N 3.24Å; N193-L196 HydrophobicContact CB-CD1 3.98Å; N193-L196 HydrophobicContact CB-CD2 4.32Å; N193-L196 HydrophobicContact CB-CG 3.85Å; N193-L196 WeakPolarHBondContact O-CG 3.46Å | ||
| 194 | P | 64.5 | Low | 64.7 | Low | 95 Ų | 95 | 102.8 Ų | 102.8 | 62% | 0.617 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -17 | 179.2 | 24 | -32.9 | 0 | 0 | 0 | 114.4 | ||
| 195 | N | 71.8 | Confident | 64.6 | Low | 157 Ų | 157 | 102 Ų | 102 | 84% | 0.84 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | 16.8 | -175.4 | -71.1 | -20.2 | 0 | 0 | 0 | 114.7 | N193 P197 | N193-N195 PolarHBondContact O-N 3.24Å; N195-P197 WeakPolarHBondContact O-CD 3.35Å |
| 196 | L | 66.4 | Low | 64.9 | Low | 69 Ų | 69 | 101.8 Ų | 101.8 | 36% | 0.361 | 52% | 0.524 | S | S | . | . | trans | -70.4 | 124.9 | -178.9 | -70.2 | 168.7 | 0 | 0 | 0 | 111.5 | I189 N193 R199 | I189-L196 HydrophobicContact CG2-CD1 4.06Å; N193-L196 HydrophobicContact CB-CD1 3.98Å; N193-L196 HydrophobicContact CB-CD2 4.32Å; N193-L196 HydrophobicContact CB-CG 3.85Å; N193-L196 WeakPolarHBondContact O-CG 3.46Å; L196-R199 PolarHBondContact O-N 2.94Å | ||
| 197 | P | 61.7 | Low | 65.4 | Low | 103 Ų | 103 | 101 Ų | 101 | 67% | 0.669 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | 141.7 | 166 | 27.7 | -32.1 | 0 | 0 | 0 | 108.5 | N195 | N195-P197 WeakPolarHBondContact O-CD 3.35Š|
| 198 | F | 61.5 | Low | 65.9 | Low | 158 Ų | 158 | 103.2 Ų | 103.2 | 69% | 0.693 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77 | 13.3 | -174.5 | -51.8 | -83 | 0 | 0 | 0 | 117.5 | E200 H201 L202 | F198-E200 PolarHBondContact O-N 3.17Å; F198-H201 HydrophobicContact CB-CB 4.44Å; F198-H201 PolarHBondContact O-N 3.18Å; F198-H201 VanDerWaalsContact O-N 3.1Å; F198-L202 PolarHBondContact O-N 3.43Å |
| 199 | R | 64.1 | Low | 66.4 | Low | 122 Ų | 122 | 104.2 Ų | 104.2 | 46% | 0.46 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -52 | -44.6 | 171.4 | -176.1 | 179.2 | -176 | -94.5 | -3.4 | 112.2 | I190 L196 H201 L202 T203 | I190-R199 HydrophobicContact CG2-CG 4.4Å; L196-R199 PolarHBondContact O-N 2.94Å; R199-H201 VanDerWaalsContact C-N 3.31Å; R199-H201 PolarHBondContact O-N 2.87Å; R199-L202 PolarHBondContact O-N 3.47Å; R199-T203 VanDerWaalsContact O-CB 3.26Å; R199-T203 WeakPolarHBondContact O-CB 3.21Å; R199-T203 PolarHBondContact O-N 2.94Å; R199-T203 PolarHBondContact O-OG1 2.93Å |
| 200 | E | 62.6 | Low | 67.1 | Low | 172 Ų | 172 | 104.7 Ų | 104.7 | 80% | 0.804 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -59.7 | -42.7 | 179.6 | -65 | 178.8 | -176.4 | 0 | 0 | 111.6 | F198 T203 D204 | F198-E200 PolarHBondContact O-N 3.17Å; E200-T203 PolarHBondContact O-N 3.41Å; E200-D204 WeakPolarHBondContact O-CB 3.33Å; E200-D204 PolarHBondContact O-N 2.92Å |
| 201 | H | 63.2 | Low | 67.9 | Low | 121 Ų | 121 | 105.5 Ų | 105.5 | 56% | 0.56 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -70.2 | -42 | 178.7 | -160.5 | 56.2 | 0 | 0 | 0 | 112 | F198 R199 T203 D204 V205 | F198-H201 HydrophobicContact CB-CB 4.44Å; F198-H201 PolarHBondContact O-N 3.18Å; F198-H201 VanDerWaalsContact O-N 3.1Å; R199-H201 VanDerWaalsContact C-N 3.31Å; R199-H201 PolarHBondContact O-N 2.87Å; H201-T203 VanDerWaalsContact C-N 3.29Å; H201-T203 PolarHBondContact O-N 3.29Å; H201-D204 PolarHBondContact O-N 3.24Å; H201-V205 WeakPolarHBondContact O-CG2 3.35Å; H201-V205 PolarHBondContact O-N 3.13Å |
| 202 | L | 59 | Low | 68.8 | Low | 97 Ų | 97 | 104.3 Ų | 104.3 | 51% | 0.508 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.2 | -28.4 | 176 | -71.3 | 166.5 | 0 | 0 | 0 | 113.1 | F198 R199 | F198-L202 PolarHBondContact O-N 3.43Å; R199-L202 PolarHBondContact O-N 3.47Å |
| 203 | T | 62.3 | Low | 69.6 | Low | 78 Ų | 78 | 100.7 Ų | 100.7 | 48% | 0.479 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -82 | -33.1 | 176.3 | -50.5 | 0 | 0 | 0 | 0 | 110.9 | R199 E200 H201 | R199-T203 VanDerWaalsContact O-CB 3.26Å; R199-T203 WeakPolarHBondContact O-CB 3.21Å; R199-T203 PolarHBondContact O-N 2.94Å; R199-T203 PolarHBondContact O-OG1 2.93Å; E200-T203 PolarHBondContact O-N 3.41Å; H201-T203 VanDerWaalsContact C-N 3.29Å; H201-T203 PolarHBondContact O-N 3.29Å |
| 204 | D | 63.1 | Low | 70.4 | Confident | 132 Ų | 132 | 101.1 Ų | 101.1 | 71% | 0.706 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -71.6 | -41.4 | 178.8 | -173.8 | 57.7 | 0 | 0 | 0 | 112.2 | E200 H201 N206 | E200-D204 WeakPolarHBondContact O-CB 3.33Å; E200-D204 PolarHBondContact O-N 2.92Å; H201-D204 PolarHBondContact O-N 3.24Å; D204-N206 PolarHBondContact O-N 3.17Å |
| 205 | V | 62.3 | Low | 71.5 | Confident | 53 Ų | 53 | 100.5 Ų | 100.5 | 32% | 0.321 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -68.4 | 110.7 | 166.7 | -82.5 | 0 | 0 | 0 | 0 | 109.1 | H201 S207 M210 | H201-V205 WeakPolarHBondContact O-CG2 3.35Å; H201-V205 PolarHBondContact O-N 3.13Å; V205-S207 PolarHBondContact O-N 2.87Å; V205-M210 HydrophobicContact CB-CG 4.16Å; V205-M210 HydrophobicContact CG2-CG 4.3Å |
| 206 | N | 71.4 | Confident | 72.5 | Confident | 71 Ų | 71 | 98.4 Ų | 98.4 | 38% | 0.38 | 51% | 0.505 | S | S | . | . | trans | -49.7 | 109.8 | 174.2 | 179.4 | 2.6 | 0 | 0 | 0 | 109.2 | D204 Q208 M209 M210 | D204-N206 PolarHBondContact O-N 3.17Å; N206-Q208 PolarHBondContact O-N 2.86Å; N206-Q208 WeakPolarHBondContact OD1-CB 3.48Å; N206-Q208 PolarHBondContact OD1-N 3.31Å; N206-Q208 VanDerWaalsContact OD1-N 3.15Å; N206-M209 HydrophobicContact CB-CB 4.13Å; N206-M209 HydrophobicContact CB-CG 3.73Å; N206-M209 WeakPolarHBondContact O-CA 3.49Å; N206-M209 WeakPolarHBondContact O-CB 3.48Å; N206-M209 PolarHBondContact O-N 3.39Å; N206-M210 PolarHBondContact O-N 2.92Å | ||
| 207 | S | 72.1 | Confident | 73.7 | Confident | 38 Ų | 38 | 99.9 Ų | 99.9 | 27% | 0.266 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -43.2 | -40.6 | 178.3 | 175.5 | 0 | 0 | 0 | 0 | 112.2 | V186 V205 M210 A211 | V186-S207 VanDerWaalsContact CG2-CB 3.47Å; V186-S207 WeakPolarHBondContact CG2-OG 3.4Å; V205-S207 PolarHBondContact O-N 2.87Å; S207-M210 PolarHBondContact O-N 3.24Å; S207-A211 PolarHBondContact O-N 3.37Å |
| 208 | Q | 75.1 | Confident | 75.1 | Confident | 125 Ų | 125 | 98.9 Ų | 98.9 | 58% | 0.584 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.6 | -43.2 | 178.1 | -59.9 | -177.9 | -38.5 | 0 | 0 | 111.9 | N206 M210 A211 F212 | N206-Q208 PolarHBondContact O-N 2.86Å; N206-Q208 WeakPolarHBondContact OD1-CB 3.48Å; N206-Q208 PolarHBondContact OD1-N 3.31Å; N206-Q208 VanDerWaalsContact OD1-N 3.15Å; Q208-M210 VanDerWaalsContact C-N 3.31Å; Q208-M210 PolarHBondContact O-N 3.3Å; Q208-A211 PolarHBondContact O-N 3.02Å; Q208-F212 HydrophobicContact CB-CD2 4.43Å; Q208-F212 HydrophobicContact CB-CE2 4.23Å; Q208-F212 WeakPolarHBondContact O-CD2 3.44Å; Q208-F212 PolarHBondContact O-N 2.84Å |
| 209 | M | 78.2 | Confident | 76.7 | Confident | 114 Ų | 114 | 95.1 Ų | 95.1 | 56% | 0.562 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.7 | -38.9 | 177.6 | -65.4 | -65.6 | 136.9 | 0 | 0 | 111.7 | N206 F212 C213 | N206-M209 HydrophobicContact CB-CB 4.13Å; N206-M209 HydrophobicContact CB-CG 3.73Å; N206-M209 WeakPolarHBondContact O-CA 3.49Å; N206-M209 WeakPolarHBondContact O-CB 3.48Å; N206-M209 PolarHBondContact O-N 3.39Å; M209-F212 PolarHBondContact O-N 3.45Å; M209-C213 WeakPolarHBondContact O-CB 3.31Å; M209-C213 PolarHBondContact O-N 3.34Å |
| 210 | M | 79.6 | Confident | 78.2 | Confident | 80 Ų | 80 | 93 Ų | 93 | 39% | 0.394 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64 | -46.6 | 174.2 | -74.6 | -64.4 | -71.7 | 0 | 0 | 111.5 | V205 N206 S207 Q208 F212 C213 F214 | V205-M210 HydrophobicContact CB-CG 4.16Å; V205-M210 HydrophobicContact CG2-CG 4.3Å; N206-M210 PolarHBondContact O-N 2.92Å; S207-M210 PolarHBondContact O-N 3.24Å; Q208-M210 VanDerWaalsContact C-N 3.31Å; Q208-M210 PolarHBondContact O-N 3.3Å; M210-F212 PolarHBondContact O-N 3.17Å; M210-C213 WeakPolarHBondContact O-CB 3.4Å; M210-C213 PolarHBondContact O-N 2.64Å; M210-C213 VanDerWaalsContact O-N 3.16Å; M210-F214 HydrophobicContact CB-CE2 4.45Å; M210-F214 HydrophobicContact CE-CE2 3.78Å; M210-F214 HydrophobicContact CE-CZ 3.92Å; M210-F214 WeakPolarHBondContact O-CD2 3.5Å; M210-F214 PolarHBondContact O-N 2.99Å |
| 211 | A | 80 | Confident | 79.6 | Confident | 43 Ų | 43 | 88 Ų | 88 | 36% | 0.355 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.6 | -43.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S207 Q208 C213 F214 L215 | S207-A211 PolarHBondContact O-N 3.37Å; Q208-A211 PolarHBondContact O-N 3.02Å; A211-C213 VanDerWaalsContact C-N 3.34Å; A211-C213 PolarHBondContact O-N 3.21Å; A211-F214 PolarHBondContact O-N 3.44Å; A211-L215 WeakPolarHBondContact O-CB 3.44Å; A211-L215 PolarHBondContact O-N 3.02Å |
| 212 | F | 86.1 | Confident | 81.1 | Confident | 127 Ų | 127 | 83.6 Ų | 83.6 | 56% | 0.557 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.2 | -39.9 | 174.3 | -75.8 | -62.1 | 0 | 0 | 0 | 112.3 | Q208 M209 M210 L215 L216 | Q208-F212 HydrophobicContact CB-CD2 4.43Å; Q208-F212 HydrophobicContact CB-CE2 4.23Å; Q208-F212 WeakPolarHBondContact O-CD2 3.44Å; Q208-F212 PolarHBondContact O-N 2.84Å; M209-F212 PolarHBondContact O-N 3.45Å; M210-F212 PolarHBondContact O-N 3.17Å; F212-L215 PolarHBondContact O-N 2.83Å; F212-L216 VanDerWaalsContact O-CB 3.28Å; F212-L216 WeakPolarHBondContact O-CB 3.3Å; F212-L216 PolarHBondContact O-N 3.48Å |
| 213 | C | 87.4 | Confident | 82.8 | Confident | 79 Ų | 79 | 84.6 Ų | 84.6 | 53% | 0.534 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.5 | -46.9 | 177.2 | -170.5 | 0 | 0 | 0 | 0 | 111.7 | M209 M210 A211 L216 L217 | M209-C213 WeakPolarHBondContact O-CB 3.31Å; M209-C213 PolarHBondContact O-N 3.34Å; M210-C213 WeakPolarHBondContact O-CB 3.4Å; M210-C213 PolarHBondContact O-N 2.64Å; M210-C213 VanDerWaalsContact O-N 3.16Å; A211-C213 VanDerWaalsContact C-N 3.34Å; A211-C213 PolarHBondContact O-N 3.21Å; C213-L216 PolarHBondContact O-N 2.91Å; C213-L217 WeakPolarHBondContact O-CB 3.45Å; C213-L217 PolarHBondContact O-N 3.29Å |
| 214 | F | 86.5 | Confident | 84.3 | Confident | 90 Ų | 90 | 84.1 Ų | 84.1 | 40% | 0.395 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 175.6 | -72.3 | -59.2 | 0 | 0 | 0 | 112.1 | M183 M210 A211 L216 L217 Y218 | M183-F214 HydrophobicContact CE-CD2 4.45Å; M210-F214 HydrophobicContact CB-CE2 4.45Å; M210-F214 HydrophobicContact CE-CE2 3.78Å; M210-F214 HydrophobicContact CE-CZ 3.92Å; M210-F214 WeakPolarHBondContact O-CD2 3.5Å; M210-F214 PolarHBondContact O-N 2.99Å; A211-F214 PolarHBondContact O-N 3.44Å; F214-L216 PolarHBondContact O-N 3.44Å; F214-L217 WeakPolarHBondContact O-CB 3.4Å; F214-L217 PolarHBondContact O-N 2.95Å; F214-Y218 WeakPolarHBondContact O-CD2 3.38Å; F214-Y218 PolarHBondContact O-N 2.9Å |
| 215 | L | 88.2 | Confident | 85.7 | Confident | 81 Ų | 81 | 80 Ų | 80 | 42% | 0.424 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -57.8 | -50 | 175.1 | -173 | 166.5 | 0 | 0 | 0 | 110.4 | A211 F212 L217 Y218 I219 | A211-L215 WeakPolarHBondContact O-CB 3.44Å; A211-L215 PolarHBondContact O-N 3.02Å; F212-L215 PolarHBondContact O-N 2.83Å; L215-L217 VanDerWaalsContact C-N 3.32Å; L215-L217 PolarHBondContact O-N 3.38Å; L215-Y218 WeakPolarHBondContact O-CB 3.29Å; L215-Y218 PolarHBondContact O-N 3.33Å; L215-Y218 VanDerWaalsContact O-N 3.15Å; L215-I219 HydrophobicContact CD2-CG1 3.73Å; L215-I219 WeakPolarHBondContact O-CG1 3.45Å; L215-I219 PolarHBondContact O-N 3.32Å |
| 216 | L | 91.6 | Very high | 87.3 | Confident | 113 Ų | 113 | 81.4 Ų | 81.4 | 59% | 0.592 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -60.3 | -42.4 | 179.3 | -176.2 | 137.7 | 0 | 0 | 0 | 111.4 | F212 C213 F214 Y218 I219 V220 | F212-L216 VanDerWaalsContact O-CB 3.28Å; F212-L216 WeakPolarHBondContact O-CB 3.3Å; F212-L216 PolarHBondContact O-N 3.48Å; C213-L216 PolarHBondContact O-N 2.91Å; F214-L216 PolarHBondContact O-N 3.44Å; L216-Y218 PolarHBondContact O-N 3.46Å; L216-I219 PolarHBondContact O-N 3.46Å; L216-V220 HydrophobicContact CD2-CG2 4.33Å; L216-V220 VanDerWaalsContact O-CG2 3.32Å; L216-V220 WeakPolarHBondContact O-CG2 3.45Å; L216-V220 PolarHBondContact O-N 3.31Å |
| 217 | L | 92 | Very high | 88.3 | Confident | 100 Ų | 100 | 83.4 Ų | 83.4 | 52% | 0.524 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.4 | -46 | 174 | -178.3 | 66.7 | 0 | 0 | 0 | 111.5 | C213 F214 L215 I219 V220 V221 | C213-L217 WeakPolarHBondContact O-CB 3.45Å; C213-L217 PolarHBondContact O-N 3.29Å; F214-L217 WeakPolarHBondContact O-CB 3.4Å; F214-L217 PolarHBondContact O-N 2.95Å; L215-L217 VanDerWaalsContact C-N 3.32Å; L215-L217 PolarHBondContact O-N 3.38Å; L217-I219 PolarHBondContact O-N 3.16Å; L217-V220 PolarHBondContact O-N 3.08Å; L217-V221 WeakPolarHBondContact O-CG2 3.38Å; L217-V221 PolarHBondContact O-N 3.18Å |
| 218 | Y | 91.6 | Very high | 89.2 | Confident | 82 Ų | 82 | 84.9 Ų | 84.9 | 32% | 0.322 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60.9 | -43.5 | 175.7 | -79.1 | -62.6 | 0 | 0 | 0 | 111.9 | A176 H179 F214 L215 L216 V220 V221 L222 | A176-Y218 HydrophobicContact CB-CD1 4.17Å; A176-Y218 HydrophobicContact CB-CG 4.35Å; H179-Y218 PolarHBondContact CD2-OH 2.85Å; F214-Y218 WeakPolarHBondContact O-CD2 3.38Å; F214-Y218 PolarHBondContact O-N 2.9Å; L215-Y218 WeakPolarHBondContact O-CB 3.29Å; L215-Y218 PolarHBondContact O-N 3.33Å; L215-Y218 VanDerWaalsContact O-N 3.15Å; L216-Y218 PolarHBondContact O-N 3.46Å; Y218-V220 VanDerWaalsContact C-N 3.33Å; Y218-V220 PolarHBondContact O-N 3.4Å; Y218-V221 PolarHBondContact O-N 3.44Å; Y218-L222 VanDerWaalsContact O-CG 3.3Å; Y218-L222 WeakPolarHBondContact O-CG 3.47Å; Y218-L222 PolarHBondContact O-N 3.45Å |
| 219 | I | 94.1 | Very high | 90.1 | Very high | 80 Ų | 80 | 80.3 Ų | 80.3 | 41% | 0.41 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 176.3 | -66.4 | -63.9 | 0 | 0 | 0 | 110.7 | L215 L216 L217 V221 L222 M223 | L215-I219 HydrophobicContact CD2-CG1 3.73Å; L215-I219 WeakPolarHBondContact O-CG1 3.45Å; L215-I219 PolarHBondContact O-N 3.32Å; L216-I219 PolarHBondContact O-N 3.46Å; L217-I219 PolarHBondContact O-N 3.16Å; I219-V221 VanDerWaalsContact C-N 3.35Å; I219-V221 PolarHBondContact O-N 3.24Å; I219-L222 PolarHBondContact O-N 3.16Å; I219-M223 HydrophobicContact CG2-CE 4.38Å; I219-M223 HydrophobicContact CG2-CG 4.38Å; I219-M223 VanDerWaalsContact O-CG 3.25Å; I219-M223 WeakPolarHBondContact O-CG 3.48Å; I219-M223 PolarHBondContact O-N 3.03Å |
| 220 | V | 96 | Very high | 90.7 | Very high | 78 Ų | 78 | 76.4 Ų | 76.4 | 47% | 0.473 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60 | -45.1 | 175.7 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | L216 L217 Y218 L222 M223 V224 | L216-V220 HydrophobicContact CD2-CG2 4.33Å; L216-V220 VanDerWaalsContact O-CG2 3.32Å; L216-V220 WeakPolarHBondContact O-CG2 3.45Å; L216-V220 PolarHBondContact O-N 3.31Å; L217-V220 PolarHBondContact O-N 3.08Å; Y218-V220 VanDerWaalsContact C-N 3.33Å; Y218-V220 PolarHBondContact O-N 3.4Å; V220-L222 PolarHBondContact O-N 3.43Å; V220-M223 PolarHBondContact O-N 3.2Å; V220-V224 WeakPolarHBondContact O-CG2 3.44Å; V220-V224 PolarHBondContact O-N 3.34Å |
| 221 | V | 92.9 | Very high | 91.2 | Very high | 66 Ų | 66 | 73.6 Ų | 73.6 | 40% | 0.4 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.2 | -42.4 | 176.6 | 170.8 | 0 | 0 | 0 | 0 | 111.6 | L217 Y218 I219 V224 K225 | L217-V221 WeakPolarHBondContact O-CG2 3.38Å; L217-V221 PolarHBondContact O-N 3.18Å; Y218-V221 PolarHBondContact O-N 3.44Å; I219-V221 VanDerWaalsContact C-N 3.35Å; I219-V221 PolarHBondContact O-N 3.24Å; V221-V224 PolarHBondContact O-N 2.81Å; V221-K225 PolarHBondContact O-N 3.13Å |
| 222 | L | 94.2 | Very high | 91.7 | Very high | 28 Ų | 28 | 71.5 Ų | 71.5 | 15% | 0.147 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.9 | -40.9 | 176.5 | -68.9 | 177.7 | 0 | 0 | 0 | 111.8 | F169 Y218 I219 V220 V224 K225 I226 | F169-L222 HydrophobicContact CD2-CD2 4.21Å; F169-L222 HydrophobicContact CE2-CB 4.4Å; F169-L222 HydrophobicContact CE2-CD2 3.96Å; Y218-L222 VanDerWaalsContact O-CG 3.3Å; Y218-L222 WeakPolarHBondContact O-CG 3.47Å; Y218-L222 PolarHBondContact O-N 3.45Å; I219-L222 PolarHBondContact O-N 3.16Å; V220-L222 PolarHBondContact O-N 3.43Å; L222-V224 VanDerWaalsContact C-N 3.32Å; L222-V224 PolarHBondContact O-N 3.31Å; L222-K225 PolarHBondContact O-N 3.46Å; L222-I226 WeakPolarHBondContact O-CG1 3.43Å; L222-I226 PolarHBondContact O-N 2.88Å |
| 223 | M | 95.3 | Very high | 91.9 | Very high | 119 Ų | 119 | 71.5 Ų | 71.5 | 59% | 0.586 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61.4 | -41.4 | 175.2 | -70.5 | -66.2 | 174.9 | 0 | 0 | 111.6 | I219 V220 I226 Y227 | I219-M223 HydrophobicContact CG2-CE 4.38Å; I219-M223 HydrophobicContact CG2-CG 4.38Å; I219-M223 VanDerWaalsContact O-CG 3.25Å; I219-M223 WeakPolarHBondContact O-CG 3.48Å; I219-M223 PolarHBondContact O-N 3.03Å; V220-M223 PolarHBondContact O-N 3.2Å; M223-I226 PolarHBondContact O-N 3.12Å; M223-Y227 WeakPolarHBondContact O-CB 3.38Å; M223-Y227 PolarHBondContact O-N 2.82Å |
| 224 | V | 92.3 | Very high | 92 | Very high | 67 Ų | 67 | 69.2 Ų | 69.2 | 41% | 0.406 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 174.3 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | V220 V221 L222 Y227 F228 | V220-V224 WeakPolarHBondContact O-CG2 3.44Å; V220-V224 PolarHBondContact O-N 3.34Å; V221-V224 PolarHBondContact O-N 2.81Å; L222-V224 VanDerWaalsContact C-N 3.32Å; L222-V224 PolarHBondContact O-N 3.31Å; V224-Y227 WeakPolarHBondContact O-CB 3.18Å; V224-Y227 PolarHBondContact O-N 3.43Å; V224-F228 HydrophobicContact CG1-CD2 3.98Å; V224-F228 HydrophobicContact CG1-CE2 3.35Å; V224-F228 HydrophobicContact CG1-CZ 3.86Å; V224-F228 VanDerWaalsContact O-CD2 3.23Å; V224-F228 WeakPolarHBondContact O-CD2 3.43Å; V224-F228 PolarHBondContact O-N 2.93Å |
| 225 | K | 93.3 | Very high | 92.1 | Very high | 46 Ų | 46 | 65 Ų | 65 | 20% | 0.2 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.8 | -44.3 | 175.9 | -73.7 | -173.7 | 176.2 | -123.9 | 0 | 112.7 | D168 F169 S172 V221 L222 Y227 F228 I229 | D168-K225 IonicContact OD1-NZ 3.11Å; D168-K225 PolarHBondContact OD1-NZ 2.91Å; D168-K225 VanDerWaalsContact OD1-NZ 3.11Å; D168-K225 IonicContact OD2-NZ 2.63Å; D168-K225 PolarHBondContact OD2-NZ 3.33Å; F169-K225 HydrophobicContact CD2-CB 4.16Å; S172-K225 WeakPolarHBondContact OG-CD 3.06Å; S172-K225 WeakPolarHBondContact OG-CE 3.3Å; S172-K225 PolarHBondContact OG-NZ 3.47Å; V221-K225 PolarHBondContact O-N 3.13Å; L222-K225 PolarHBondContact O-N 3.46Å; K225-Y227 VanDerWaalsContact C-N 3.27Å; K225-Y227 PolarHBondContact O-N 3.2Å; K225-F228 PolarHBondContact O-N 3.42Å; K225-I229 WeakPolarHBondContact O-CG1 3.3Å; K225-I229 PolarHBondContact O-N 2.96Å |
| 226 | I | 94.8 | Very high | 92.2 | Very high | 82 Ų | 82 | 63.5 Ų | 63.5 | 42% | 0.421 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.9 | -40.6 | 175.8 | -67.6 | 165.1 | 0 | 0 | 0 | 110.5 | F169 L222 M223 F228 I229 G230 | F169-I226 HydrophobicContact CD2-CG1 4.16Å; F169-I226 HydrophobicContact CE2-CD1 3.85Å; F169-I226 HydrophobicContact CE2-CG1 3.57Å; F169-I226 HydrophobicContact CZ-CD1 4.02Å; F169-I226 HydrophobicContact CZ-CG1 3.98Å; L222-I226 WeakPolarHBondContact O-CG1 3.43Å; L222-I226 PolarHBondContact O-N 2.88Å; M223-I226 PolarHBondContact O-N 3.12Å; I226-F228 PolarHBondContact O-N 3.18Å; I226-I229 PolarHBondContact O-N 3.26Å; I226-G230 PolarHBondContact O-N 3.29Å |
| 227 | Y | 92.4 | Very high | 92 | Very high | 114 Ų | 114 | 61.6 Ų | 61.6 | 45% | 0.447 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 176.1 | 177.7 | -105.4 | 0 | 0 | 0 | 112.3 | M223 V224 K225 G230 I231 | M223-Y227 WeakPolarHBondContact O-CB 3.38Å; M223-Y227 PolarHBondContact O-N 2.82Å; V224-Y227 WeakPolarHBondContact O-CB 3.18Å; V224-Y227 PolarHBondContact O-N 3.43Å; K225-Y227 VanDerWaalsContact C-N 3.27Å; K225-Y227 PolarHBondContact O-N 3.2Å; Y227-G230 WeakPolarHBondContact O-CA 3.47Å; Y227-G230 PolarHBondContact O-N 2.92Å; Y227-I231 HydrophobicContact CD1-CD1 3.81Å; Y227-I231 HydrophobicContact CE1-CD1 3.26Å; Y227-I231 HydrophobicContact CE1-CG1 4.14Å; Y227-I231 HydrophobicContact CE2-CD1 4.41Å; Y227-I231 HydrophobicContact CE2-CG1 4.48Å; Y227-I231 PolarHBondContact O-N 3.32Å |
| 228 | F | 92 | Very high | 91.7 | Very high | 69 Ų | 69 | 56.9 Ų | 56.9 | 30% | 0.303 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 174.8 | -68.8 | -45.9 | 0 | 0 | 0 | 112.8 | L31 V224 K225 I226 G230 I231 I232 | L31-F228 HydrophobicContact CD1-CD1 3.35Å; L31-F228 HydrophobicContact CD1-CE1 3.43Å; L31-F228 VanDerWaalsContact CD1-CE1 3.43Å; L31-F228 HydrophobicContact CD1-CG 4.08Å; L31-F228 HydrophobicContact CD1-CZ 4.21Å; L31-F228 HydrophobicContact CD2-CB 4.11Å; L31-F228 HydrophobicContact CD2-CD1 3.79Å; L31-F228 HydrophobicContact CD2-CG 4.28Å; L31-F228 HydrophobicContact CG-CD1 4.22Å; V224-F228 HydrophobicContact CG1-CD2 3.98Å; V224-F228 HydrophobicContact CG1-CE2 3.35Å; V224-F228 HydrophobicContact CG1-CZ 3.86Å; V224-F228 VanDerWaalsContact O-CD2 3.23Å; V224-F228 WeakPolarHBondContact O-CD2 3.43Å; V224-F228 PolarHBondContact O-N 2.93Å; K225-F228 PolarHBondContact O-N 3.42Å; I226-F228 PolarHBondContact O-N 3.18Å; F228-G230 VanDerWaalsContact C-N 3.26Å; F228-G230 PolarHBondContact O-N 3.03Å; F228-I231 HydrophobicContact CD1-CD1 4.44Å; F228-I231 PolarHBondContact O-N 3.45Å; F228-I232 PolarHBondContact O-N 2.91Å; F228-I232 VanDerWaalsContact O-N 3.13Å |
| 229 | I | 93.6 | Very high | 91.6 | Very high | 29 Ų | 29 | 53 Ų | 53 | 15% | 0.149 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.2 | -42.3 | 173.8 | -65.6 | 167 | 0 | 0 | 0 | 110 | F162 Q165 F169 K225 I226 I232 W233 | F162-I229 HydrophobicContact CD2-CG2 4.42Å; F162-I229 HydrophobicContact CE2-CG2 3.74Å; Q165-I229 HydrophobicContact CB-CG1 3.9Å; F169-I229 HydrophobicContact CB-CD1 3.81Å; F169-I229 HydrophobicContact CG-CD1 4.16Å; K225-I229 WeakPolarHBondContact O-CG1 3.3Å; K225-I229 PolarHBondContact O-N 2.96Å; I226-I229 PolarHBondContact O-N 3.26Å; I229-I232 PolarHBondContact O-N 3.4Å; I229-W233 VanDerWaalsContact O-CB 3.31Å; I229-W233 WeakPolarHBondContact O-CB 3.18Å; I229-W233 PolarHBondContact O-N 3.18Å |
| 230 | G | 90.7 | Very high | 91.4 | Very high | 32 Ų | 32 | 54 Ų | 54 | 33% | 0.33 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58.9 | -45.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | I226 Y227 F228 I232 W233 S234 | I226-G230 PolarHBondContact O-N 3.29Å; Y227-G230 WeakPolarHBondContact O-CA 3.47Å; Y227-G230 PolarHBondContact O-N 2.92Å; F228-G230 VanDerWaalsContact C-N 3.26Å; F228-G230 PolarHBondContact O-N 3.03Å; G230-I232 PolarHBondContact O-N 3.35Å; G230-W233 PolarHBondContact O-N 3.01Å; G230-S234 WeakPolarHBondContact O-CB 3.24Å; G230-S234 PolarHBondContact O-N 3.09Å; G230-S234 PolarHBondContact O-OG 3.22Å |
| 231 | I | 90.1 | Very high | 91 | Very high | 20 Ų | 20 | 51.3 Ų | 51.3 | 10% | 0.103 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.4 | -47.1 | 176.5 | -70.4 | 166.1 | 0 | 0 | 0 | 111 | A28 L31 Y227 F228 W233 S234 C235 | A28-I231 HydrophobicContact CB-CG2 4.46Å; L31-I231 HydrophobicContact CD2-CG2 4.45Å; Y227-I231 HydrophobicContact CD1-CD1 3.81Å; Y227-I231 HydrophobicContact CE1-CD1 3.26Å; Y227-I231 HydrophobicContact CE1-CG1 4.14Å; Y227-I231 HydrophobicContact CE2-CD1 4.41Å; Y227-I231 HydrophobicContact CE2-CG1 4.48Å; Y227-I231 PolarHBondContact O-N 3.32Å; F228-I231 HydrophobicContact CD1-CD1 4.44Å; F228-I231 PolarHBondContact O-N 3.45Å; I231-W233 VanDerWaalsContact C-N 3.34Å; I231-S234 PolarHBondContact O-N 3.43Å; I231-C235 WeakPolarHBondContact O-CB 3.43Å; I231-C235 PolarHBondContact O-N 3.17Å |
| 232 | I | 91.4 | Very high | 90.7 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65.8 | -40.1 | 179.9 | -64 | -51.9 | 0 | 0 | 0 | 111 | A28 L31 M146 F161 F162 Q165 F228 I229 G230 C235 Y236 | A28-I232 HydrophobicContact CB-CD1 4.11Å; L31-I232 HydrophobicContact CD2-CD1 3.9Å; L31-I232 HydrophobicContact CD2-CG1 4.05Å; M146-I232 HydrophobicContact SD-CD1 3.62Å; F161-I232 HydrophobicContact CD1-CD1 4.29Å; F161-I232 HydrophobicContact CD1-CG1 4.21Å; F161-I232 HydrophobicContact CD1-CG2 4.41Å; F161-I232 HydrophobicContact CE1-CD1 3.88Å; F161-I232 HydrophobicContact CE1-CG1 3.84Å; F162-I232 HydrophobicContact CB-CG2 4.2Å; F162-I232 HydrophobicContact CD2-CG2 4.11Å; Q165-I232 VanDerWaalsContact OE1-CG1 3.31Å; F228-I232 PolarHBondContact O-N 2.91Å; F228-I232 VanDerWaalsContact O-N 3.13Å; I229-I232 PolarHBondContact O-N 3.4Å; G230-I232 PolarHBondContact O-N 3.35Å; I232-C235 PolarHBondContact O-N 3.42Å; I232-Y236 WeakPolarHBondContact O-CB 3.47Å; I232-Y236 PolarHBondContact O-N 3.24Å |
| 233 | W | 90.5 | Very high | 90.3 | Very high | 126 Ų | 126 | 48.9 Ų | 48.9 | 48% | 0.477 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.7 | -48.1 | 175.6 | 179.8 | -102.1 | 0 | 0 | 0 | 112.5 | F162 I229 G230 I231 C235 Y236 Q237 | F162-W233 HydrophobicContact CE1-CE3 4.22Å; F162-W233 HydrophobicContact CE1-CZ3 4.27Å; F162-W233 HydrophobicContact CE2-CB 4.3Å; F162-W233 AromaticContact CE2-CE3 3.9Å; F162-W233 HydrophobicContact CE2-CE3 3.9Å; F162-W233 AromaticContact CZ-CE3 3.57Å; F162-W233 HydrophobicContact CZ-CE3 3.57Å; F162-W233 HydrophobicContact CZ-CZ3 4.01Å; I229-W233 VanDerWaalsContact O-CB 3.31Å; I229-W233 WeakPolarHBondContact O-CB 3.18Å; I229-W233 PolarHBondContact O-N 3.18Å; G230-W233 PolarHBondContact O-N 3.01Å; I231-W233 VanDerWaalsContact C-N 3.34Å; W233-C235 VanDerWaalsContact C-N 3.28Å; W233-C235 PolarHBondContact O-N 3.09Å; W233-Y236 HydrophobicContact CE3-CD1 4.38Å; W233-Y236 HydrophobicContact CZ3-CD1 4.25Å; W233-Y236 WeakPolarHBondContact O-CB 3.36Å; W233-Y236 PolarHBondContact O-N 3.03Å; W233-Y236 VanDerWaalsContact O-N 3.13Å; W233-Q237 PolarHBondContact O-N 3.5Å |
| 234 | S | 88.6 | Confident | 90 | Very high | 32 Ų | 32 | 46 Ų | 46 | 22% | 0.224 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.2 | -39.7 | 175.4 | -66.5 | 0 | 0 | 0 | 0 | 111.6 | G230 I231 Y238 | G230-S234 WeakPolarHBondContact O-CB 3.24Å; G230-S234 PolarHBondContact O-N 3.09Å; G230-S234 PolarHBondContact O-OG 3.22Å; I231-S234 PolarHBondContact O-N 3.43Å; S234-Y238 VanDerWaalsContact O-CB 3.3Å; S234-Y238 WeakPolarHBondContact O-CB 3.4Å; S234-Y238 PolarHBondContact O-N 2.92Å |
| 235 | C | 89.3 | Confident | 89.7 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.2 | -41.9 | 174 | -176 | 0 | 0 | 0 | 0 | 111.9 | A28 L158 I231 I232 W233 Y238 L239 | A28-C235 HydrophobicContact CB-CB 3.7Å; A28-C235 VanDerWaalsContact CB-SG 3.54Å; L158-C235 HydrophobicContact CD2-CB 4.47Å; I231-C235 WeakPolarHBondContact O-CB 3.43Å; I231-C235 PolarHBondContact O-N 3.17Å; I232-C235 PolarHBondContact O-N 3.42Å; W233-C235 VanDerWaalsContact C-N 3.28Å; W233-C235 PolarHBondContact O-N 3.09Å; C235-Y238 PolarHBondContact O-N 2.95Å; C235-L239 WeakPolarHBondContact O-CB 3.46Å; C235-L239 PolarHBondContact O-N 3.08Å |
| 236 | Y | 89.5 | Confident | 89.3 | Confident | 50 Ų | 50 | 45.5 Ų | 45.5 | 20% | 0.196 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.1 | -48.3 | 176.5 | 174.8 | -97.3 | 0 | 0 | 0 | 111.4 | P155 L158 I159 I232 W233 Y238 L239 Q240 | P155-Y236 HydrophobicContact CB-CD2 3.89Å; P155-Y236 HydrophobicContact CB-CE2 3.68Å; P155-Y236 WeakPolarHBondContact O-CE2 3.39Å; L158-Y236 HydrophobicContact CB-CD2 4.29Å; I159-Y236 HydrophobicContact CG1-CE2 4.09Å; I232-Y236 WeakPolarHBondContact O-CB 3.47Å; I232-Y236 PolarHBondContact O-N 3.24Å; W233-Y236 HydrophobicContact CE3-CD1 4.38Å; W233-Y236 HydrophobicContact CZ3-CD1 4.25Å; W233-Y236 WeakPolarHBondContact O-CB 3.36Å; W233-Y236 PolarHBondContact O-N 3.03Å; W233-Y236 VanDerWaalsContact O-N 3.13Å; Y236-Y238 PolarHBondContact O-N 3.43Å; Y236-L239 PolarHBondContact O-N 3.13Å; Y236-Q240 WeakPolarHBondContact O-CB 3.5Å; Y236-Q240 PolarHBondContact O-N 3.37Å |
| 237 | Q | 87.4 | Confident | 89 | Confident | 74 Ų | 74 | 47 Ų | 47 | 35% | 0.346 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.3 | -44.1 | 177.5 | -172.5 | -174.8 | 5.9 | 0 | 0 | 111.6 | F16 W233 L239 Q240 A241 | F16-Q237 HydrophobicContact CE1-CB 4.16Å; F16-Q237 HydrophobicContact CE1-CG 3.91Å; F16-Q237 HydrophobicContact CZ-CG 4.36Å; W233-Q237 PolarHBondContact O-N 3.5Å; Q237-L239 VanDerWaalsContact C-N 3.33Å; Q237-L239 PolarHBondContact O-N 3.32Å; Q237-Q240 PolarHBondContact O-N 3.35Å; Q237-A241 PolarHBondContact O-N 2.98Å |
| 238 | Y | 86.7 | Confident | 88.7 | Confident | 1 Ų | 1 | 44.4 Ų | 44.4 | 0% | 0.004 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.1 | -48.1 | 174.4 | 173.3 | -98.7 | 0 | 0 | 0 | 111.4 | H7 F10 F16 H23 V24 S234 C235 Y236 Q240 A241 V242 | H7-Y238 PolarHBondContact CE1-OH 3.06Å; H7-Y238 PolarHBondContact ND1-OH 3.22Å; H7-Y238 PolarHBondContact NE2-OH 2.86Å; H7-Y238 VanDerWaalsContact NE2-OH 3.12Å; F10-Y238 HydrophobicContact CB-CE2 4.26Å; F16-Y238 HydrophobicContact CB-CD2 4.04Å; F16-Y238 HydrophobicContact CD1-CD2 4.08Å; F16-Y238 HydrophobicContact CD1-CG 4.35Å; F16-Y238 HydrophobicContact CD2-CD2 4.16Å; F16-Y238 AromaticContact CG-CD2 3.83Å; F16-Y238 HydrophobicContact CG-CD2 3.83Å; H23-Y238 AromaticContact CE1-CE1 3.44Å; H23-Y238 VanDerWaalsContact CE1-CE1 3.44Å; H23-Y238 WeakPolarHBondContact CE1-CE1 3.49Å; H23-Y238 AromaticContact CE1-CE2 3.75Å; H23-Y238 AromaticContact CE1-CZ 3.2Å; H23-Y238 PolarHBondContact CE1-OH 2.9Å; H23-Y238 AromaticContact NE2-CE2 3.53Å; H23-Y238 AromaticContact NE2-CZ 3.35Å; H23-Y238 VanDerWaalsContact NE2-CZ 3.35Å; H23-Y238 PolarHBondContact NE2-OH 3.47Å; V24-Y238 HydrophobicContact CG2-CD1 4.39Å; V24-Y238 HydrophobicContact CG2-CD2 4.26Å; V24-Y238 HydrophobicContact CG2-CG 3.89Å; S234-Y238 VanDerWaalsContact O-CB 3.3Å; S234-Y238 WeakPolarHBondContact O-CB 3.4Å; S234-Y238 PolarHBondContact O-N 2.92Å; C235-Y238 PolarHBondContact O-N 2.95Å; Y236-Y238 PolarHBondContact O-N 3.43Å; Y238-Q240 VanDerWaalsContact C-N 3.3Å; Y238-Q240 PolarHBondContact O-N 3.47Å; Y238-A241 PolarHBondContact O-N 2.98Å; Y238-V242 HydrophobicContact CD1-CG2 4.42Å; Y238-V242 HydrophobicContact CE1-CG2 3.86Å; Y238-V242 HydrophobicContact CE2-CG2 4.04Å; Y238-V242 WeakPolarHBondContact O-CG2 3.46Å; Y238-V242 PolarHBondContact O-N 3.22Å |
| 239 | L | 89 | Confident | 88.3 | Confident | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.005 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -66.1 | -35.6 | -178.1 | -149.7 | 61.2 | 0 | 0 | 0 | 112.2 | I153 P155 L158 C235 Y236 Q237 V242 C243 | I153-L239 HydrophobicContact CB-CD1 3.92Å; I153-L239 HydrophobicContact CG1-CD1 4.13Å; I153-L239 HydrophobicContact CG2-CD1 3.51Å; I153-L239 HydrophobicContact CG2-CG 4.05Å; P155-L239 HydrophobicContact CB-CB 4.25Å; P155-L239 HydrophobicContact CB-CD2 4.43Å; L158-L239 HydrophobicContact CD1-CD2 3.58Å; C235-L239 WeakPolarHBondContact O-CB 3.46Å; C235-L239 PolarHBondContact O-N 3.08Å; Y236-L239 PolarHBondContact O-N 3.13Å; Q237-L239 VanDerWaalsContact C-N 3.33Å; Q237-L239 PolarHBondContact O-N 3.32Å; L239-V242 PolarHBondContact O-N 3.27Å; L239-C243 WeakPolarHBondContact O-CB 3.33Å; L239-C243 PolarHBondContact O-N 3.38Å |
| 240 | Q | 89.1 | Confident | 87.9 | Confident | 99 Ų | 99 | 52.6 Ų | 52.6 | 46% | 0.463 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.3 | -44.9 | 173.8 | -168.2 | 177.3 | 25.1 | 0 | 0 | 111.5 | Y236 Q237 Y238 V242 C243 A244 | Y236-Q240 WeakPolarHBondContact O-CB 3.5Å; Y236-Q240 PolarHBondContact O-N 3.37Å; Q237-Q240 PolarHBondContact O-N 3.35Å; Y238-Q240 VanDerWaalsContact C-N 3.3Å; Y238-Q240 PolarHBondContact O-N 3.47Å; Q240-V242 PolarHBondContact O-N 3.13Å; Q240-C243 PolarHBondContact O-N 3.22Å; Q240-A244 WeakPolarHBondContact O-CB 3.3Å; Q240-A244 PolarHBondContact O-N 3.26Å |
| 241 | A | 87.1 | Confident | 87.6 | Confident | 23 Ų | 23 | 57.8 Ų | 57.8 | 19% | 0.19 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | F10 Q237 Y238 A244 A245 | F10-A241 HydrophobicContact CD1-CB 4.17Å; F10-A241 HydrophobicContact CE1-CB 4.09Å; Q237-A241 PolarHBondContact O-N 2.98Å; Y238-A241 PolarHBondContact O-N 2.98Å; A241-A244 PolarHBondContact O-N 3.08Å; A241-A245 WeakPolarHBondContact O-CB 3.38Å; A241-A245 PolarHBondContact O-N 3.06Å |
| 242 | V | 86.9 | Confident | 87.3 | Confident | 9 Ų | 9 | 64.8 Ų | 64.8 | 6% | 0.055 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.8 | -40.1 | 175.9 | 175.2 | 0 | 0 | 0 | 0 | 111.5 | I153 Y238 L239 Q240 A245 K246 | I153-V242 HydrophobicContact CG2-CB 4.24Å; I153-V242 HydrophobicContact CG2-CG1 3.71Å; Y238-V242 HydrophobicContact CD1-CG2 4.42Å; Y238-V242 HydrophobicContact CE1-CG2 3.86Å; Y238-V242 HydrophobicContact CE2-CG2 4.04Å; Y238-V242 WeakPolarHBondContact O-CG2 3.46Å; Y238-V242 PolarHBondContact O-N 3.22Å; L239-V242 PolarHBondContact O-N 3.27Å; Q240-V242 PolarHBondContact O-N 3.13Å; V242-A245 PolarHBondContact O-N 2.96Å; V242-K246 WeakPolarHBondContact O-CG 3.46Å; V242-K246 PolarHBondContact O-N 3.11Å |
| 243 | C | 87.4 | Confident | 86.7 | Confident | 33 Ų | 33 | 70.5 Ų | 70.5 | 22% | 0.223 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.9 | -45.6 | 177 | -168.4 | 0 | 0 | 0 | 0 | 111.7 | L239 Q240 A245 K246 L247 | L239-C243 WeakPolarHBondContact O-CB 3.33Å; L239-C243 PolarHBondContact O-N 3.38Å; Q240-C243 PolarHBondContact O-N 3.22Å; C243-A245 VanDerWaalsContact C-N 3.33Å; C243-A245 PolarHBondContact O-N 3.41Å; C243-K246 WeakPolarHBondContact O-CB 3.49Å; C243-K246 PolarHBondContact O-N 3.2Å; C243-K246 VanDerWaalsContact O-N 3.17Å; C243-L247 PolarHBondContact O-N 3.25Å; C243-L247 VanDerWaalsContact O-N 3.09Å |
| 244 | A | 87.5 | Confident | 86.3 | Confident | 58 Ų | 58 | 67.8 Ų | 67.8 | 48% | 0.479 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q240 A241 K246 L247 S248 | Q240-A244 WeakPolarHBondContact O-CB 3.3Å; Q240-A244 PolarHBondContact O-N 3.26Å; A241-A244 PolarHBondContact O-N 3.08Å; A244-K246 VanDerWaalsContact C-N 3.34Å; A244-K246 PolarHBondContact O-N 3.09Å; A244-L247 PolarHBondContact O-N 3.37Å; A244-S248 PolarHBondContact O-N 3.43Å; A244-S248 VanDerWaalsContact O-N 3.09Å |
| 245 | A | 86.4 | Confident | 85.8 | Confident | 28 Ų | 28 | 72.2 Ų | 72.2 | 23% | 0.231 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.3 | -37.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | F10 A241 V242 C243 Y249 | F10-A245 HydrophobicContact CE2-CB 4.25Å; A241-A245 WeakPolarHBondContact O-CB 3.38Å; A241-A245 PolarHBondContact O-N 3.06Å; V242-A245 PolarHBondContact O-N 2.96Å; C243-A245 VanDerWaalsContact C-N 3.33Å; C243-A245 PolarHBondContact O-N 3.41Å; A245-Y249 PolarHBondContact O-N 3.02Å |
| 246 | K | 85.9 | Confident | 85.3 | Confident | 76 Ų | 76 | 76.1 Ų | 76.1 | 33% | 0.33 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.9 | -39.1 | 175.4 | -76 | 178.2 | -179.2 | -177.9 | 0 | 112.4 | L3 V242 C243 A244 K250 | L3-K246 HydrophobicContact CD1-CG 4.43Å; L3-K246 HydrophobicContact CD2-CG 4.39Å; V242-K246 WeakPolarHBondContact O-CG 3.46Å; V242-K246 PolarHBondContact O-N 3.11Å; C243-K246 WeakPolarHBondContact O-CB 3.49Å; C243-K246 PolarHBondContact O-N 3.2Å; C243-K246 VanDerWaalsContact O-N 3.17Å; A244-K246 VanDerWaalsContact C-N 3.34Å; A244-K246 PolarHBondContact O-N 3.09Å; K246-K250 PolarHBondContact O-N 2.97Å; K246-K250 VanDerWaalsContact O-N 3.08Å |
| 247 | L | 87.1 | Confident | 84.6 | Confident | 113 Ų | 113 | 78.7 Ų | 78.7 | 59% | 0.592 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -66 | -47.9 | 177.2 | -69.1 | 174.1 | 0 | 0 | 0 | 111.3 | C243 A244 Y249 K250 E251 | C243-L247 PolarHBondContact O-N 3.25Å; C243-L247 VanDerWaalsContact O-N 3.09Å; A244-L247 PolarHBondContact O-N 3.37Å; L247-Y249 VanDerWaalsContact C-N 3.29Å; L247-Y249 PolarHBondContact O-N 2.99Å; L247-K250 PolarHBondContact O-N 3.06Å; L247-K250 VanDerWaalsContact O-N 3.07Å; L247-E251 PolarHBondContact O-N 3.05Å |
| 248 | S | 86.2 | Confident | 83.9 | Confident | 60 Ų | 60 | 79 Ų | 79 | 42% | 0.42 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.5 | -36.8 | 177 | -177.9 | 0 | 0 | 0 | 0 | 112.7 | A244 R252 | A244-S248 PolarHBondContact O-N 3.43Å; A244-S248 VanDerWaalsContact O-N 3.09Å; S248-R252 WeakPolarHBondContact O-CB 3.46Å; S248-R252 PolarHBondContact O-N 3.07Å |
| 249 | Y | 83.5 | Confident | 83.3 | Confident | 124 Ų | 124 | 83.2 Ų | 83.2 | 49% | 0.486 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.9 | -41.7 | 173.5 | 174.8 | -104.5 | 0 | 0 | 0 | 112.7 | L3 A245 L247 E251 R252 K253 | L3-Y249 HydrophobicContact CD1-CD1 4.35Å; L3-Y249 HydrophobicContact CD1-CG 4.24Å; A245-Y249 PolarHBondContact O-N 3.02Å; L247-Y249 VanDerWaalsContact C-N 3.29Å; L247-Y249 PolarHBondContact O-N 2.99Å; Y249-E251 VanDerWaalsContact C-N 3.35Å; Y249-R252 PolarHBondContact O-N 3.5Å; Y249-K253 WeakPolarHBondContact O-CB 3.35Å; Y249-K253 PolarHBondContact O-N 3.32Å |
| 250 | K | 85.5 | Confident | 82.1 | Confident | 146 Ų | 146 | 89.9 Ų | 89.9 | 64% | 0.635 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.7 | -43 | 178.4 | -173.5 | 178.4 | 178.3 | -176.3 | 0 | 111 | K246 L247 K253 V254 | K246-K250 PolarHBondContact O-N 2.97Å; K246-K250 VanDerWaalsContact O-N 3.08Å; L247-K250 PolarHBondContact O-N 3.06Å; L247-K250 VanDerWaalsContact O-N 3.07Å; K250-K253 PolarHBondContact O-N 3.43Å; K250-V254 WeakPolarHBondContact O-CG2 3.35Å; K250-V254 PolarHBondContact O-N 3.09Å; K250-V254 VanDerWaalsContact O-N 3.09Å |
| 251 | E | 85.3 | Confident | 80.8 | Confident | 141 Ų | 141 | 90.9 Ų | 90.9 | 66% | 0.659 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -61.3 | -50.1 | 176.9 | -173.1 | 168 | -160.3 | 0 | 0 | 111.7 | L247 Y249 K253 V254 E255 | L247-E251 PolarHBondContact O-N 3.05Å; Y249-E251 VanDerWaalsContact C-N 3.35Å; E251-K253 VanDerWaalsContact C-N 3.28Å; E251-K253 PolarHBondContact O-N 3.44Å; E251-V254 PolarHBondContact O-N 3.34Å; E251-V254 VanDerWaalsContact O-N 3.15Å; E251-E255 PolarHBondContact O-N 3.47Å |
| 252 | R | 83.3 | Confident | 79.4 | Confident | 167 Ų | 167 | 98.1 Ų | 98.1 | 63% | 0.63 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.5 | -36.4 | 176.5 | -168.6 | -176.8 | -60.1 | -153.7 | -0.3 | 112.9 | S248 Y249 E255 V256 | S248-R252 WeakPolarHBondContact O-CB 3.46Å; S248-R252 PolarHBondContact O-N 3.07Å; Y249-R252 PolarHBondContact O-N 3.5Å; R252-E255 PolarHBondContact O-N 3Å; R252-V256 WeakPolarHBondContact O-CG2 3.5Å; R252-V256 PolarHBondContact O-N 3.44Å; R252-V256 VanDerWaalsContact O-N 3.08Å |
| 253 | K | 79.7 | Confident | 77.8 | Confident | 119 Ų | 119 | 101.6 Ų | 101.6 | 52% | 0.517 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.4 | -43.1 | 177.4 | -172.4 | -175.4 | 173.2 | -167.2 | 0 | 111.1 | Y249 K250 E251 E255 V256 E257 | Y249-K253 WeakPolarHBondContact O-CB 3.35Å; Y249-K253 PolarHBondContact O-N 3.32Å; K250-K253 PolarHBondContact O-N 3.43Å; E251-K253 VanDerWaalsContact C-N 3.28Å; E251-K253 PolarHBondContact O-N 3.44Å; K253-E255 VanDerWaalsContact C-N 3.34Å; K253-V256 PolarHBondContact O-N 3.29Å; K253-E257 WeakPolarHBondContact O-CB 3.33Å; K253-E257 PolarHBondContact O-N 2.99Å |
| 254 | V | 81.3 | Confident | 76.2 | Confident | 70 Ų | 70 | 104 Ų | 104 | 42% | 0.424 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.1 | -40.6 | 177.2 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | K250 E251 E257 N258 | K250-V254 WeakPolarHBondContact O-CG2 3.35Å; K250-V254 PolarHBondContact O-N 3.09Å; K250-V254 VanDerWaalsContact O-N 3.09Å; E251-V254 PolarHBondContact O-N 3.34Å; E251-V254 VanDerWaalsContact O-N 3.15Å; V254-E257 PolarHBondContact O-N 3.28Å; V254-N258 WeakPolarHBondContact O-CB 3.41Å; V254-N258 VanDerWaalsContact O-CG 3.22Å; V254-N258 PolarHBondContact O-N 3.4Å; V254-N258 PolarHBondContact O-ND2 3.08Å |
| 255 | E | 78.9 | Confident | 74.4 | Confident | 125 Ų | 125 | 107 Ų | 107 | 58% | 0.584 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.1 | -48.8 | 175.8 | -172.6 | -176.7 | -178.8 | 0 | 0 | 112.1 | E251 R252 K253 E257 N258 V259 | E251-E255 PolarHBondContact O-N 3.47Å; R252-E255 PolarHBondContact O-N 3Å; K253-E255 VanDerWaalsContact C-N 3.34Å; E255-E257 VanDerWaalsContact C-N 3.34Å; E255-E257 PolarHBondContact O-N 3.15Å; E255-N258 PolarHBondContact O-N 2.98Å; E255-V259 VanDerWaalsContact O-CG2 3.27Å; E255-V259 WeakPolarHBondContact O-CG2 3.46Å; E255-V259 PolarHBondContact O-N 2.96Å |
| 256 | V | 78.8 | Confident | 72.5 | Confident | 81 Ų | 81 | 114 Ų | 114 | 49% | 0.491 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.1 | -40.7 | 178.5 | 174.5 | 0 | 0 | 0 | 0 | 111.6 | R252 K253 V259 Q260 | R252-V256 WeakPolarHBondContact O-CG2 3.5Å; R252-V256 PolarHBondContact O-N 3.44Å; R252-V256 VanDerWaalsContact O-N 3.08Å; K253-V256 PolarHBondContact O-N 3.29Å; V256-V259 PolarHBondContact O-N 3.33Å; V256-Q260 WeakPolarHBondContact O-CG 3.22Å; V256-Q260 PolarHBondContact O-N 2.91Å |
| 257 | E | 74.6 | Confident | 70.8 | Confident | 105 Ų | 105 | 114.9 Ų | 114.9 | 49% | 0.491 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.2 | -43.2 | 177.6 | -168.6 | 169 | 172.7 | 0 | 0 | 111.3 | K253 V254 E255 Q260 I261 | K253-E257 WeakPolarHBondContact O-CB 3.33Å; K253-E257 PolarHBondContact O-N 2.99Å; V254-E257 PolarHBondContact O-N 3.28Å; E255-E257 VanDerWaalsContact C-N 3.34Å; E255-E257 PolarHBondContact O-N 3.15Å; E257-Q260 PolarHBondContact O-N 3.36Å; E257-I261 HydrophobicContact CG-CD1 4.18Å; E257-I261 WeakPolarHBondContact O-CD1 3.27Å; E257-I261 WeakPolarHBondContact O-CG1 3.39Å; E257-I261 PolarHBondContact O-N 2.97Å |
| 258 | N | 72.7 | Confident | 68.6 | Low | 81 Ų | 81 | 117.9 Ų | 117.9 | 43% | 0.433 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.7 | -42 | 174.4 | -72.6 | -24.3 | 0 | 0 | 0 | 112.2 | V254 E255 Q260 I261 F262 | V254-N258 WeakPolarHBondContact O-CB 3.41Å; V254-N258 VanDerWaalsContact O-CG 3.22Å; V254-N258 PolarHBondContact O-N 3.4Å; V254-N258 PolarHBondContact O-ND2 3.08Å; E255-N258 PolarHBondContact O-N 2.98Å; N258-Q260 VanDerWaalsContact C-N 3.32Å; N258-Q260 PolarHBondContact O-N 3.24Å; N258-I261 PolarHBondContact O-N 3.46Å; N258-F262 WeakPolarHBondContact O-CD2 3.37Å; N258-F262 PolarHBondContact O-N 3.3Å |
| 259 | V | 72.9 | Confident | 66.8 | Low | 89 Ų | 89 | 123.3 Ų | 123.3 | 54% | 0.539 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -62.7 | -40 | 176.5 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | E255 V256 F262 T263 | E255-V259 VanDerWaalsContact O-CG2 3.27Å; E255-V259 WeakPolarHBondContact O-CG2 3.46Å; E255-V259 PolarHBondContact O-N 2.96Å; V256-V259 PolarHBondContact O-N 3.33Å; V259-F262 PolarHBondContact O-N 2.9Å; V259-T263 WeakPolarHBondContact O-CG2 3.14Å; V259-T263 PolarHBondContact O-N 2.81Å |
| 260 | Q | 63.6 | Low | 64.7 | Low | 140 Ų | 140 | 122.3 Ų | 122.3 | 65% | 0.654 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -69.1 | -31.9 | 175.4 | -73.7 | -167.8 | -75.6 | 0 | 0 | 113.5 | V256 E257 N258 T263 | V256-Q260 WeakPolarHBondContact O-CG 3.22Å; V256-Q260 PolarHBondContact O-N 2.91Å; E257-Q260 PolarHBondContact O-N 3.36Å; N258-Q260 VanDerWaalsContact C-N 3.32Å; N258-Q260 PolarHBondContact O-N 3.24Å; Q260-T263 WeakPolarHBondContact CA-OG1 3.49Å; Q260-T263 PolarHBondContact O-OG1 2.95Å |
| 261 | I | 61.8 | Low | 62.9 | Low | 120 Ų | 120 | 120.7 Ų | 120.7 | 62% | 0.615 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -70.9 | -34.9 | 174.5 | -64.5 | 160.1 | 0 | 0 | 0 | 110.7 | E257 N258 | E257-I261 HydrophobicContact CG-CD1 4.18Å; E257-I261 WeakPolarHBondContact O-CD1 3.27Å; E257-I261 WeakPolarHBondContact O-CG1 3.39Å; E257-I261 PolarHBondContact O-N 2.97Å; N258-I261 PolarHBondContact O-N 3.46Å |
| 262 | F | 58.6 | Low | 60.8 | Low | 176 Ų | 176 | 123 Ų | 123 | 77% | 0.772 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -81.7 | -16.3 | 177.3 | -88.8 | -81.9 | 0 | 0 | 0 | 114.4 | N258 V259 P264 | N258-F262 WeakPolarHBondContact O-CD2 3.37Å; N258-F262 PolarHBondContact O-N 3.3Å; V259-F262 PolarHBondContact O-N 2.9Å; F262-P264 WeakPolarHBondContact O-CD 3.49Å |
| 263 | T | 52.5 | Low | 58.7 | Low | 82 Ų | 82 | 118.7 Ų | 118.7 | 50% | 0.503 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -72.3 | 105.5 | 162.1 | 53.4 | 0 | 0 | 0 | 0 | 107.1 | V259 Q260 S265 | V259-T263 WeakPolarHBondContact O-CG2 3.14Å; V259-T263 PolarHBondContact O-N 2.81Å; Q260-T263 WeakPolarHBondContact CA-OG1 3.49Å; Q260-T263 PolarHBondContact O-OG1 2.95Å; T263-S265 PolarHBondContact O-N 2.98Å |
| 264 | P | 53.7 | Low | 56.9 | Low | 84 Ų | 84 | 118.2 Ų | 118.2 | 55% | 0.545 | 64% | 0.638 | S | S | . | * | trans | -66.8 | 111.8 | 174.9 | 9.1 | 6.6 | 0 | 0 | 0 | 105.7 | F262 E266 C267 | F262-P264 WeakPolarHBondContact O-CD 3.49Å; P264-E266 PolarHBondContact O-N 3.06Å; P264-C267 HydrophobicContact CB-CB 4.11Å; P264-C267 HydrophobicContact CG-CB 4.02Å; P264-C267 PolarHBondContact O-N 3.48Å | ||
| 265 | S | 50.6 | Low | 55.2 | Low | 120 Ų | 120 | 120.6 Ų | 120.6 | 84% | 0.839 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -5.1 | 168.2 | 50.3 | 0 | 0 | 0 | 0 | 112.5 | T263 | T263-S265 PolarHBondContact O-N 2.98Š|
| 266 | E | 46 | Very low | 53.3 | Low | 176 Ų | 176 | 118.9 Ų | 118.9 | 82% | 0.822 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.8 | 64.9 | 173.2 | -68.5 | 176.3 | 132.2 | 0 | 0 | 109.8 | P264 | P264-E266 PolarHBondContact O-N 3.06Š|
| 267 | C | 49.6 | Very low | 51.7 | Low | 94 Ų | 94 | 124.6 Ų | 124.6 | 64% | 0.635 | 68% | 0.677 | S | S | * | * | trans | -118.2 | 83.6 | 146.6 | -75.8 | 0 | 0 | 0 | 0 | 105.3 | P264 F269 | P264-C267 HydrophobicContact CB-CB 4.11Å; P264-C267 HydrophobicContact CG-CB 4.02Å; P264-C267 PolarHBondContact O-N 3.48Å; C267-F269 PolarHBondContact O-N 2.65Å | ||
| 268 | E | 42.3 | Very low | 50.3 | Low | 176 Ų | 176 | 129.4 Ų | 129.4 | 82% | 0.822 | 70% | 0.696 | S | S | * | * | trans | -41.1 | 70.5 | 145.2 | -161.6 | 178.5 | -166.2 | 0 | 0 | 108.6 | T270 | E268-T270 HydrophobicContact CG-CG2 4.22Å; E268-T270 PolarHBondContact O-N 2.82Å | ||
| 269 | F | 46.7 | Very low | 49.1 | Very low | 174 Ų | 174 | 133.4 Ų | 133.4 | 76% | 0.763 | 71% | 0.712 | S | S | * | * | trans | -70.9 | 89.4 | 157.8 | -157.6 | -95.2 | 0 | 0 | 0 | 101.8 | C267 V271 | C267-F269 PolarHBondContact O-N 2.65Å; F269-V271 HydrophobicContact CD1-CG2 3.69Å; F269-V271 HydrophobicContact CE1-CG2 4.25Å; F269-V271 PolarHBondContact O-N 2.81Å | ||
| 270 | T | 39.8 | Very low | 48.3 | Very low | 103 Ų | 103 | 134.4 Ų | 134.4 | 63% | 0.632 | 72% | 0.721 | S | S | * | * | trans | -43.9 | 75.9 | 150.6 | 49.5 | 0 | 0 | 0 | 0 | 107.1 | E268 K272 | E268-T270 HydrophobicContact CG-CG2 4.22Å; E268-T270 PolarHBondContact O-N 2.82Å; T270-K272 PolarHBondContact O-N 2.63Å | ||
| 271 | V | 48.4 | Very low | 48.3 | Very low | 111 Ų | 111 | 133.3 Ų | 133.3 | 67% | 0.673 | 73% | 0.725 | S | S | * | * | trans | -61.3 | 92.7 | 147 | 177.5 | 0 | 0 | 0 | 0 | 101.2 | F269 A273 | F269-V271 HydrophobicContact CD1-CG2 3.69Å; F269-V271 HydrophobicContact CE1-CG2 4.25Å; F269-V271 PolarHBondContact O-N 2.81Å; V271-A273 PolarHBondContact O-N 2.67Å | ||
| 272 | K | 40.7 | Very low | 48.4 | Very low | 190 Ų | 190 | 132.9 Ų | 132.9 | 83% | 0.826 | 73% | 0.73 | S | S | * | * | trans | -54.4 | 85.5 | 169.1 | -161.3 | -177.5 | -168.7 | -177 | 0 | 104.5 | T270 P274 | T270-K272 PolarHBondContact O-N 2.63Å; K272-P274 WeakPolarHBondContact O-CD 3.39Å; K272-P274 VanDerWaalsContact O-N 3.11Å | ||
| 273 | A | 39.2 | Very low | 48.3 | Very low | 77 Ų | 77 | 129.6 Ų | 129.6 | 64% | 0.636 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -57 | 121.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 104.8 | V271 | V271-A273 PolarHBondContact O-N 2.67Š|
| 274 | P | 42.5 | Very low | 48.8 | Very low | 108 Ų | 108 | 131.7 Ų | 131.7 | 70% | 0.701 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 143.5 | 178.6 | 20.5 | -29.5 | 0 | 0 | 0 | 108.7 | K272 A276 | K272-P274 WeakPolarHBondContact O-CD 3.39Å; K272-P274 VanDerWaalsContact O-N 3.11Å; P274-A276 PolarHBondContact O-N 3.18Å |
| 275 | P | 44.5 | Very low | 48.7 | Very low | 120 Ų | 120 | 138.7 Ų | 138.7 | 78% | 0.779 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 125.7 | -165.6 | 19.6 | -31.8 | 0 | 0 | 0 | 110.5 | Y277 | P275-Y277 PolarHBondContact O-N 2.82Š|
| 276 | A | 40.6 | Very low | 48.5 | Very low | 90 Ų | 90 | 136.9 Ų | 136.9 | 74% | 0.744 | 76% | 0.759 | S | S | * | * | trans | -48.6 | 108.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | P274 K278 | P274-A276 PolarHBondContact O-N 3.18Å; A276-K278 PolarHBondContact O-N 3.19Å | ||
| 277 | Y | 43.7 | Very low | 48.6 | Very low | 200 Ų | 200 | 131.8 Ų | 131.8 | 78% | 0.784 | 76% | 0.755 | S | S | * | * | trans | -50.6 | 122.8 | 165.8 | 23.7 | -86.3 | 0 | 0 | 0 | 106.5 | P275 E279 | P275-Y277 PolarHBondContact O-N 2.82Å; Y277-E279 VanDerWaalsContact C-N 3.27Å; Y277-E279 PolarHBondContact O-N 2.93Å | ||
| 278 | K | 45.4 | Very low | 48.3 | Very low | 206 Ų | 206 | 138 Ų | 138 | 90% | 0.896 | 79% | 0.789 | S | S | * | * | trans | -60.8 | 97.7 | 171.6 | -69.8 | -177.5 | 178.7 | -179.2 | 0 | 106.6 | A276 P280 | A276-K278 PolarHBondContact O-N 3.19Å; K278-P280 WeakPolarHBondContact O-CD 3.42Å | ||
| 279 | E | 47.3 | Very low | 48.6 | Very low | 166 Ų | 166 | 136.1 Ų | 136.1 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 121.6 | 174.8 | -134.2 | 173.7 | 174.9 | 0 | 0 | 107.2 | Y277 | Y277-E279 VanDerWaalsContact C-N 3.27Å; Y277-E279 PolarHBondContact O-N 2.93Å |
| 280 | P | 56.5 | Low | 48.8 | Very low | 110 Ų | 110 | 134.1 Ų | 134.1 | 71% | 0.714 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 142 | 179.2 | 15.2 | -18.7 | 0 | 0 | 0 | 109.7 | K278 | K278-P280 WeakPolarHBondContact O-CD 3.42Š|
| 281 | P | 62.9 | Low | 49.2 | Very low | 116 Ų | 116 | 135.8 Ų | 135.8 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 145.1 | -175.3 | 23.3 | -32.4 | 0 | 0 | 0 | 111.3 | ||
| 282 | P | 65 | Low | 49.3 | Very low | 111 Ų | 111 | 137.2 Ų | 137.2 | 72% | 0.721 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 146.8 | -177.4 | 23.4 | -32.5 | 0 | 0 | 0 | 111.5 | ||
| 283 | P | 56.7 | Low | 49.8 | Very low | 108 Ų | 108 | 133.9 Ų | 133.9 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 145.1 | -178.1 | 23.5 | -31.8 | 0 | 0 | 0 | 111.3 | Y285 | P283-Y285 PolarHBondContact O-N 2.98Š|
| 284 | P | 63.3 | Low | 50.5 | Low | 126 Ų | 126 | 137.7 Ų | 137.7 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 128.6 | -177.9 | 14.9 | -15 | 0 | 0 | 0 | 110 | G286 | P284-G286 PolarHBondContact O-N 2.89Š|
| 285 | Y | 51.9 | Low | 51.1 | Low | 230 Ų | 230 | 139.9 Ų | 139.9 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | trans | -61.5 | 98.7 | 171.6 | -77.7 | -92.5 | 0 | 0 | 0 | 108.6 | P283 G287 | P283-Y285 PolarHBondContact O-N 2.98Å; Y285-G287 PolarHBondContact O-N 3.32Å | ||
| 286 | G | 45.9 | Very low | 51.6 | Low | 82 Ų | 82 | 141.4 Ų | 141.4 | 85% | 0.845 | 83% | 0.825 | S | S | * | * | trans | -64.9 | 98.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | P284 | P284-G286 PolarHBondContact O-N 2.89Š| ||
| 287 | G | 46.8 | Very low | 52.5 | Low | 70 Ų | 70 | 145.7 Ų | 145.7 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | trans | -106.1 | 91.6 | 165 | 0 | 0 | 0 | 0 | 0 | 109.3 | Y285 | Y285-G287 PolarHBondContact O-N 3.32Š| ||
| 288 | V | 45.2 | Very low | 53.3 | Low | 223 Ų | 223 | 140.7 Ų | 140.7 | 100% | 1.352 | 84% | 0.836 | S | S | * | * | trans | -167.2 | 0 | 146.6 | -102 | 0 | 0 | 0 | 0 | 109.1 |
Retrieved 288 of 288 residues in 287.1 ms
(Link to these results)