| 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 | 38.7 | Very low | 64.6 | Low | 206 Ų | 206 | 80.3 Ų | 80.3 | 100% | 1.015 | 43% | 0.43 | S | S | * | . | 0 | 101.2 | 0 | -68.6 | 176.8 | -174 | 0 | 0 | 107.5 | F3 | M1-F3 PolarHBondContact O-N 3.35Š| |||
| 2 | P | 44.9 | Very low | 65.7 | Low | 93 Ų | 93 | 79.4 Ų | 79.4 | 60% | 0.604 | 43% | 0.43 | S | S | * | . | trans | -73.6 | 106 | 169.6 | 30.1 | -26.1 | 0 | 0 | 0 | 107.4 | H4 | P2-H4 PolarHBondContact O-N 3.43Å; P2-H4 VanDerWaalsContact O-N 3.11Å | ||
| 3 | F | 54.8 | Low | 66.7 | Low | 112 Ų | 112 | 80.2 Ų | 80.2 | 49% | 0.491 | 44% | 0.438 | S | S | . | . | trans | -62 | 113.8 | 170.1 | -164.1 | -96.6 | 0 | 0 | 0 | 107.4 | M1 V5 L8 V157 I159 | M1-F3 PolarHBondContact O-N 3.35Å; F3-V5 HydrophobicContact CD1-CG2 3.89Å; F3-V5 PolarHBondContact O-N 3.42Å; F3-L8 HydrophobicContact CE1-CD2 3.57Å; F3-L8 HydrophobicContact CZ-CD2 3.77Å; F3-V157 HydrophobicContact CE2-CG1 4.08Å; F3-V157 HydrophobicContact CZ-CG1 4.07Å; F3-I159 HydrophobicContact CE2-CG2 4.4Å | ||
| 4 | H | 66.8 | Low | 67.3 | Low | 66 Ų | 66 | 76.9 Ų | 76.9 | 31% | 0.306 | 42% | 0.418 | S | S | . | . | trans | -73 | 76.7 | 179.1 | -68.2 | -73.9 | 0 | 0 | 0 | 109.9 | P2 E6 G7 L8 | P2-H4 PolarHBondContact O-N 3.43Å; P2-H4 VanDerWaalsContact O-N 3.11Å; H4-E6 PolarHBondContact O-N 2.59Å; H4-G7 PolarHBondContact O-N 3.31Å; H4-L8 PolarHBondContact O-N 3.15Å | ||
| 5 | V | 72.3 | Confident | 67.8 | Low | 88 Ų | 88 | 73.2 Ų | 73.2 | 53% | 0.533 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -53.3 | -39.9 | -178.7 | 178.7 | 0 | 0 | 0 | 0 | 110.8 | F3 L8 V9 | F3-V5 HydrophobicContact CD1-CG2 3.89Å; F3-V5 PolarHBondContact O-N 3.42Å; V5-L8 PolarHBondContact O-N 2.91Å; V5-V9 HydrophobicContact CG1-CG2 4.33Å; V5-V9 WeakPolarHBondContact O-CB 3.01Å; V5-V9 VanDerWaalsContact O-CG2 3.24Å; V5-V9 WeakPolarHBondContact O-CG2 3.3Å; V5-V9 PolarHBondContact O-N 2.97Å |
| 6 | E | 71 | Confident | 68.6 | Low | 127 Ų | 127 | 75.1 Ų | 75.1 | 59% | 0.593 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -63.2 | -42.3 | 178.9 | -59.9 | -178.4 | 178.8 | 0 | 0 | 112.3 | H4 V9 A10 F334 | H4-E6 PolarHBondContact O-N 2.59Å; E6-V9 PolarHBondContact O-N 3.05Å; E6-A10 WeakPolarHBondContact O-CB 3.44Å; E6-A10 PolarHBondContact O-N 3.23Å; E6-F334 HydrophobicContact CB-CE2 3.77Å; E6-F334 HydrophobicContact CB-CZ 4.3Å |
| 7 | G | 68 | Low | 69.2 | Low | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -66 | -43.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | H4 V9 A10 I11 F334 | H4-G7 PolarHBondContact O-N 3.31Å; G7-V9 PolarHBondContact O-N 3.44Å; G7-A10 PolarHBondContact O-N 3.24Å; G7-I11 WeakPolarHBondContact O-CG1 3.46Å; G7-I11 PolarHBondContact O-N 2.67Å; G7-F334 VanDerWaalsContact CA-CE1 3.5Å |
| 8 | L | 73.3 | Confident | 69.6 | Low | 60 Ų | 60 | 70.1 Ų | 70.1 | 31% | 0.314 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -61.4 | -45.6 | 175.1 | -178.5 | 67.6 | 0 | 0 | 0 | 111.6 | F3 H4 V5 A10 I11 V12 V157 | F3-L8 HydrophobicContact CE1-CD2 3.57Å; F3-L8 HydrophobicContact CZ-CD2 3.77Å; H4-L8 PolarHBondContact O-N 3.15Å; V5-L8 PolarHBondContact O-N 2.91Å; L8-A10 VanDerWaalsContact C-N 3.33Å; L8-A10 PolarHBondContact O-N 3.14Å; L8-I11 PolarHBondContact O-N 3.13Å; L8-V12 HydrophobicContact CD1-CG2 4.24Å; L8-V12 HydrophobicContact CG-CG2 4.35Å; L8-V12 WeakPolarHBondContact O-CB 3.29Å; L8-V12 VanDerWaalsContact O-CG2 3.25Å; L8-V12 WeakPolarHBondContact O-CG2 3.36Å; L8-V12 PolarHBondContact O-N 3.13Å; L8-V157 HydrophobicContact CD1-CG1 4.19Å; L8-V157 HydrophobicContact CD1-CG2 4.15Å |
| 9 | V | 77.4 | Confident | 70 | Confident | 82 Ų | 82 | 70 Ų | 70 | 50% | 0.497 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61 | -43.6 | 178.2 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | V5 E6 G7 V12 V13 | V5-V9 HydrophobicContact CG1-CG2 4.33Å; V5-V9 WeakPolarHBondContact O-CB 3.01Å; V5-V9 VanDerWaalsContact O-CG2 3.24Å; V5-V9 WeakPolarHBondContact O-CG2 3.3Å; V5-V9 PolarHBondContact O-N 2.97Å; E6-V9 PolarHBondContact O-N 3.05Å; G7-V9 PolarHBondContact O-N 3.44Å; V9-V12 PolarHBondContact O-N 3.38Å; V9-V13 HydrophobicContact CG1-CG2 4.34Å; V9-V13 WeakPolarHBondContact O-CB 3.4Å; V9-V13 VanDerWaalsContact O-CG2 3.26Å; V9-V13 WeakPolarHBondContact O-CG2 3.48Å; V9-V13 PolarHBondContact O-N 3Å |
| 10 | A | 70.6 | Confident | 70.5 | Confident | 40 Ų | 40 | 69.4 Ų | 69.4 | 33% | 0.331 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.8 | -46.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | E6 G7 L8 V13 F14 F334 | E6-A10 WeakPolarHBondContact O-CB 3.44Å; E6-A10 PolarHBondContact O-N 3.23Å; G7-A10 PolarHBondContact O-N 3.24Å; L8-A10 VanDerWaalsContact C-N 3.33Å; L8-A10 PolarHBondContact O-N 3.14Å; A10-V13 PolarHBondContact O-N 3.26Å; A10-F14 VanDerWaalsContact O-CB 3.24Å; A10-F14 WeakPolarHBondContact O-CB 3.49Å; A10-F14 PolarHBondContact O-N 3.47Å; A10-F334 HydrophobicContact CB-CB 4.35Å |
| 11 | I | 72.6 | Confident | 70.9 | Confident | 9 Ų | 9 | 68.1 Ų | 68.1 | 5% | 0.046 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 176.6 | -65.6 | 169.3 | 0 | 0 | 0 | 110.9 | G7 L8 V13 F14 Y15 I156 V157 | G7-I11 WeakPolarHBondContact O-CG1 3.46Å; G7-I11 PolarHBondContact O-N 2.67Å; L8-I11 PolarHBondContact O-N 3.13Å; I11-V13 PolarHBondContact O-N 3.1Å; I11-F14 WeakPolarHBondContact O-CB 3.27Å; I11-F14 PolarHBondContact O-N 2.92Å; I11-Y15 HydrophobicContact CG2-CD1 4.22Å; I11-Y15 HydrophobicContact CG2-CD2 3.96Å; I11-Y15 HydrophobicContact CG2-CE1 4.03Å; I11-Y15 HydrophobicContact CG2-CE2 3.76Å; I11-Y15 HydrophobicContact CG2-CG 4.2Å; I11-Y15 WeakPolarHBondContact O-CB 3.15Å; I11-Y15 PolarHBondContact O-N 2.74Å; I11-I156 HydrophobicContact CD1-CB 3.9Å; I11-I156 HydrophobicContact CD1-CD1 3.49Å; I11-I156 VanDerWaalsContact CD1-CD1 3.49Å; I11-I156 HydrophobicContact CD1-CG1 4.27Å; I11-I156 HydrophobicContact CD1-CG2 3.6Å; I11-I156 HydrophobicContact CG1-CD1 4.17Å; I11-I156 HydrophobicContact CG1-CG2 4.38Å; I11-V157 HydrophobicContact CD1-CG2 4.02Å |
| 12 | V | 77.6 | Confident | 72.6 | Confident | 70 Ų | 70 | 58.5 Ų | 58.5 | 42% | 0.424 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.9 | -46.2 | -178.4 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | L8 V9 F14 Y15 L16 | L8-V12 HydrophobicContact CD1-CG2 4.24Å; L8-V12 HydrophobicContact CG-CG2 4.35Å; L8-V12 WeakPolarHBondContact O-CB 3.29Å; L8-V12 VanDerWaalsContact O-CG2 3.25Å; L8-V12 WeakPolarHBondContact O-CG2 3.36Å; L8-V12 PolarHBondContact O-N 3.13Å; V9-V12 PolarHBondContact O-N 3.38Å; V12-F14 VanDerWaalsContact C-N 3.29Å; V12-F14 PolarHBondContact O-N 3.03Å; V12-Y15 PolarHBondContact O-N 3.38Å; V12-L16 HydrophobicContact CG1-CD1 3.93Å; V12-L16 HydrophobicContact CG1-CG 4.39Å; V12-L16 WeakPolarHBondContact O-CB 3.33Å; V12-L16 VanDerWaalsContact O-CG 3.23Å; V12-L16 WeakPolarHBondContact O-CG 3.27Å; V12-L16 PolarHBondContact O-N 3.14Å |
| 13 | V | 79 | Confident | 74.1 | Confident | 89 Ų | 89 | 56.9 Ų | 56.9 | 54% | 0.539 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.9 | -43.2 | 176 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | V9 A10 I11 L16 A17 | V9-V13 HydrophobicContact CG1-CG2 4.34Å; V9-V13 WeakPolarHBondContact O-CB 3.4Å; V9-V13 VanDerWaalsContact O-CG2 3.26Å; V9-V13 WeakPolarHBondContact O-CG2 3.48Å; V9-V13 PolarHBondContact O-N 3Å; A10-V13 PolarHBondContact O-N 3.26Å; I11-V13 PolarHBondContact O-N 3.1Å; V13-L16 PolarHBondContact O-N 3.49Å; V13-A17 WeakPolarHBondContact O-CB 3.41Å; V13-A17 PolarHBondContact O-N 3.37Å |
| 14 | F | 75.8 | Confident | 75.3 | Confident | 35 Ų | 35 | 58.2 Ų | 58.2 | 15% | 0.154 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -64.6 | -45 | 179.4 | -174.9 | -106.6 | 0 | 0 | 0 | 112.6 | A10 I11 V12 A17 I18 C194 G338 A342 | A10-F14 VanDerWaalsContact O-CB 3.24Å; A10-F14 WeakPolarHBondContact O-CB 3.49Å; A10-F14 PolarHBondContact O-N 3.47Å; I11-F14 WeakPolarHBondContact O-CB 3.27Å; I11-F14 PolarHBondContact O-N 2.92Å; V12-F14 VanDerWaalsContact C-N 3.29Å; V12-F14 PolarHBondContact O-N 3.03Å; F14-A17 WeakPolarHBondContact O-CB 3.31Å; F14-A17 PolarHBondContact O-N 3.39Å; F14-I18 HydrophobicContact CD1-CD1 3.82Å; F14-I18 HydrophobicContact CE1-CD1 3.38Å; F14-I18 HydrophobicContact CE1-CG1 4.45Å; F14-I18 HydrophobicContact CE2-CD1 4.49Å; F14-I18 HydrophobicContact CZ-CD1 3.77Å; F14-I18 WeakPolarHBondContact O-CG1 3.26Å; F14-I18 PolarHBondContact O-N 3.33Å; F14-C194 HydrophobicContact CE2-CB 4.14Å; F14-C194 HydrophobicContact CZ-CB 4.05Å; F14-G338 WeakPolarHBondContact CE1-O 3.46Å; F14-A342 HydrophobicContact CE1-CB 3.29Å; F14-A342 HydrophobicContact CZ-CB 3.39Å |
| 15 | Y | 74.5 | Confident | 75.6 | Confident | 21 Ų | 21 | 55.1 Ų | 55.1 | 8% | 0.082 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.8 | -39.5 | 175.6 | -76.3 | 3.9 | 0 | 0 | 0 | 112.3 | I11 V12 A17 I18 L19 I153 I171 M345 | I11-Y15 HydrophobicContact CG2-CD1 4.22Å; I11-Y15 HydrophobicContact CG2-CD2 3.96Å; I11-Y15 HydrophobicContact CG2-CE1 4.03Å; I11-Y15 HydrophobicContact CG2-CE2 3.76Å; I11-Y15 HydrophobicContact CG2-CG 4.2Å; I11-Y15 WeakPolarHBondContact O-CB 3.15Å; I11-Y15 PolarHBondContact O-N 2.74Å; V12-Y15 PolarHBondContact O-N 3.38Å; Y15-A17 VanDerWaalsContact C-N 3.31Å; Y15-A17 PolarHBondContact O-N 3.31Å; Y15-I18 PolarHBondContact O-N 3.15Å; Y15-L19 VanDerWaalsContact O-CB 3.3Å; Y15-L19 WeakPolarHBondContact O-CB 3.47Å; Y15-L19 PolarHBondContact O-N 3.04Å; Y15-I153 HydrophobicContact CE2-CD1 4.31Å; Y15-I153 WeakPolarHBondContact OH-CD1 3.23Å; Y15-I171 HydrophobicContact CD2-CD1 3.86Å; Y15-I171 HydrophobicContact CD2-CG2 4.31Å; Y15-I171 HydrophobicContact CE2-CD1 3.99Å; Y15-M345 HydrophobicContact CD1-CE 4.15Å; Y15-M345 HydrophobicContact CD1-SD 3.85Å; Y15-M345 HydrophobicContact CD2-CE 3.91Å; Y15-M345 HydrophobicContact CE1-CE 3.74Å; Y15-M345 HydrophobicContact CE1-SD 3.42Å; Y15-M345 WeakPolarHBondContact CE1-SD 3.5Å; Y15-M345 HydrophobicContact CE2-CE 3.47Å; Y15-M345 VanDerWaalsContact CE2-CE 3.47Å; Y15-M345 HydrophobicContact CE2-SD 4.31Å; Y15-M345 HydrophobicContact CG-CE 4.22Å; Y15-M345 HydrophobicContact CG-SD 4.45Å |
| 16 | L | 79.9 | Confident | 75.3 | Confident | 103 Ų | 103 | 51.9 Ų | 51.9 | 54% | 0.539 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.7 | -37.3 | 173.7 | -72.3 | 173.8 | 0 | 0 | 0 | 111.8 | V12 V13 L19 A20 | V12-L16 HydrophobicContact CG1-CD1 3.93Å; V12-L16 HydrophobicContact CG1-CG 4.39Å; V12-L16 WeakPolarHBondContact O-CB 3.33Å; V12-L16 VanDerWaalsContact O-CG 3.23Å; V12-L16 WeakPolarHBondContact O-CG 3.27Å; V12-L16 PolarHBondContact O-N 3.14Å; V13-L16 PolarHBondContact O-N 3.49Å; L16-L19 PolarHBondContact O-N 3.18Å; L16-A20 VanDerWaalsContact O-CB 3.29Å; L16-A20 WeakPolarHBondContact O-CB 3.23Å; L16-A20 PolarHBondContact O-N 2.79Å |
| 17 | A | 79.5 | Confident | 75.3 | Confident | 53 Ų | 53 | 54.3 Ų | 54.3 | 44% | 0.438 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.6 | -45.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | V13 F14 Y15 A20 V21 | V13-A17 WeakPolarHBondContact O-CB 3.41Å; V13-A17 PolarHBondContact O-N 3.37Å; F14-A17 WeakPolarHBondContact O-CB 3.31Å; F14-A17 PolarHBondContact O-N 3.39Å; Y15-A17 VanDerWaalsContact C-N 3.31Å; Y15-A17 PolarHBondContact O-N 3.31Å; A17-A20 PolarHBondContact O-N 3.3Å; A17-V21 WeakPolarHBondContact O-CG2 3.37Å; A17-V21 PolarHBondContact O-N 3.49Å |
| 18 | I | 76.8 | Confident | 75.3 | Confident | 7 Ų | 7 | 59.5 Ų | 59.5 | 4% | 0.036 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62 | -45.8 | 175.9 | -67.3 | 168.4 | 0 | 0 | 0 | 110.6 | F14 Y15 A20 V21 G22 T187 Q191 A342 | F14-I18 HydrophobicContact CD1-CD1 3.82Å; F14-I18 HydrophobicContact CE1-CD1 3.38Å; F14-I18 HydrophobicContact CE1-CG1 4.45Å; F14-I18 HydrophobicContact CE2-CD1 4.49Å; F14-I18 HydrophobicContact CZ-CD1 3.77Å; F14-I18 WeakPolarHBondContact O-CG1 3.26Å; F14-I18 PolarHBondContact O-N 3.33Å; Y15-I18 PolarHBondContact O-N 3.15Å; I18-A20 VanDerWaalsContact C-N 3.3Å; I18-A20 PolarHBondContact O-N 2.91Å; I18-V21 PolarHBondContact O-N 3.42Å; I18-G22 PolarHBondContact O-N 3.44Å; I18-T187 HydrophobicContact CG2-CG2 3.88Å; I18-Q191 HydrophobicContact CD1-CG 3.92Å; I18-Q191 HydrophobicContact CG1-CG 4.32Å; I18-A342 HydrophobicContact CD1-CB 4.1Å |
| 19 | L | 76.1 | Confident | 74.7 | Confident | 69 Ų | 69 | 58.6 Ų | 58.6 | 36% | 0.361 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -57.9 | -44.6 | 176.4 | -171.2 | 91.1 | 0 | 0 | 0 | 111.1 | Y15 L16 G22 I23 | Y15-L19 VanDerWaalsContact O-CB 3.3Å; Y15-L19 WeakPolarHBondContact O-CB 3.47Å; Y15-L19 PolarHBondContact O-N 3.04Å; L16-L19 PolarHBondContact O-N 3.18Å; L19-G22 PolarHBondContact O-N 3.35Å; L19-I23 HydrophobicContact CD2-CD1 3.95Å; L19-I23 HydrophobicContact CG-CD1 3.87Å; L19-I23 HydrophobicContact CG-CG1 4.49Å; L19-I23 VanDerWaalsContact O-CG1 3.29Å; L19-I23 WeakPolarHBondContact O-CG1 3.47Å; L19-I23 PolarHBondContact O-N 3.21Å |
| 20 | A | 80.3 | Confident | 73.8 | Confident | 58 Ų | 58 | 61.8 Ų | 61.8 | 48% | 0.479 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L16 A17 I18 I23 W24 | L16-A20 VanDerWaalsContact O-CB 3.29Å; L16-A20 WeakPolarHBondContact O-CB 3.23Å; L16-A20 PolarHBondContact O-N 2.79Å; A17-A20 PolarHBondContact O-N 3.3Å; I18-A20 VanDerWaalsContact C-N 3.3Å; I18-A20 PolarHBondContact O-N 2.91Å; A20-I23 PolarHBondContact O-N 3.11Å; A20-W24 VanDerWaalsContact O-CB 3.22Å; A20-W24 WeakPolarHBondContact O-CB 3.46Å; A20-W24 PolarHBondContact O-N 2.76Å |
| 21 | V | 79.1 | Confident | 73 | Confident | 42 Ų | 42 | 66.7 Ų | 66.7 | 26% | 0.255 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.9 | -44.5 | 174.5 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | A17 I18 W24 A25 T187 V190 | A17-V21 WeakPolarHBondContact O-CG2 3.37Å; A17-V21 PolarHBondContact O-N 3.49Å; I18-V21 PolarHBondContact O-N 3.42Å; V21-W24 PolarHBondContact O-N 2.93Å; V21-A25 WeakPolarHBondContact O-CB 2.99Å; V21-A25 PolarHBondContact O-N 2.95Å; V21-T187 HydrophobicContact CG1-CG2 4.37Å; V21-V190 HydrophobicContact CG1-CG2 4.22Å |
| 22 | G | 73.6 | Confident | 71.9 | Confident | 5 Ų | 5 | 71.7 Ų | 71.7 | 5% | 0.052 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.6 | -47 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | I18 L19 W24 A25 A26 S183 | I18-G22 PolarHBondContact O-N 3.44Å; L19-G22 PolarHBondContact O-N 3.35Å; G22-W24 PolarHBondContact O-N 3.16Å; G22-A25 PolarHBondContact O-N 3.48Å; G22-A26 WeakPolarHBondContact O-CB 3.44Å; G22-A26 PolarHBondContact O-N 3.38Å; G22-S183 WeakPolarHBondContact CA-OG 3.41Å; G22-S183 PolarHBondContact O-OG 3.41Å |
| 23 | I | 77 | Confident | 70.5 | Confident | 59 Ų | 59 | 71.2 Ų | 71.2 | 30% | 0.303 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.7 | -44.6 | 176.1 | -68 | 168 | 0 | 0 | 0 | 110.6 | L19 A20 A26 W27 | L19-I23 HydrophobicContact CD2-CD1 3.95Å; L19-I23 HydrophobicContact CG-CD1 3.87Å; L19-I23 HydrophobicContact CG-CG1 4.49Å; L19-I23 VanDerWaalsContact O-CG1 3.29Å; L19-I23 WeakPolarHBondContact O-CG1 3.47Å; L19-I23 PolarHBondContact O-N 3.21Å; A20-I23 PolarHBondContact O-N 3.11Å; I23-A26 PolarHBondContact O-N 3.25Å; I23-W27 HydrophobicContact CG2-CD2 4.18Å; I23-W27 HydrophobicContact CG2-CZ2 4.13Å; I23-W27 WeakPolarHBondContact O-CB 3.45Å; I23-W27 PolarHBondContact O-N 3.44Å |
| 24 | W | 80.9 | Confident | 68.7 | Low | 140 Ų | 140 | 72.4 Ų | 72.4 | 53% | 0.53 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 177.2 | 171.7 | 83.5 | 0 | 0 | 0 | 112 | A20 V21 G22 W27 K28 Y186 | A20-W24 VanDerWaalsContact O-CB 3.22Å; A20-W24 WeakPolarHBondContact O-CB 3.46Å; A20-W24 PolarHBondContact O-N 2.76Å; V21-W24 PolarHBondContact O-N 2.93Å; G22-W24 PolarHBondContact O-N 3.16Å; W24-W27 PolarHBondContact O-N 3.24Å; W24-K28 HydrophobicContact CH2-CD 4.31Å; W24-K28 HydrophobicContact CZ2-CD 4.26Å; W24-K28 PolarHBondContact O-N 3.42Å; W24-Y186 HydrophobicContact CZ3-CD1 4.47Å |
| 25 | A | 71.7 | Confident | 67.3 | Low | 1 Ų | 1 | 78.7 Ų | 78.7 | 1% | 0.008 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | V21 G22 W27 K28 T29 Y186 | V21-A25 WeakPolarHBondContact O-CB 2.99Å; V21-A25 PolarHBondContact O-N 2.95Å; G22-A25 PolarHBondContact O-N 3.48Å; A25-W27 PolarHBondContact O-N 3.03Å; A25-K28 PolarHBondContact O-N 2.66Å; A25-T29 PolarHBondContact O-N 3.28Å; A25-T29 VanDerWaalsContact O-N 3.16Å; A25-T29 PolarHBondContact O-OG1 2.98Å; A25-T29 VanDerWaalsContact O-OG1 3.1Å; A25-Y186 HydrophobicContact CB-CD2 4.04Å; A25-Y186 HydrophobicContact CB-CG 4.16Å |
| 26 | A | 67.5 | Low | 65.9 | Low | 19 Ų | 19 | 80.6 Ų | 80.6 | 16% | 0.157 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -62.1 | -40 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G22 I23 K30 | G22-A26 WeakPolarHBondContact O-CB 3.44Å; G22-A26 PolarHBondContact O-N 3.38Å; I23-A26 PolarHBondContact O-N 3.25Å; A26-K30 PolarHBondContact O-N 3.23Å; A26-K30 VanDerWaalsContact O-N 3.15Å |
| 27 | W | 70.4 | Confident | 64.8 | Low | 179 Ų | 179 | 81 Ų | 81 | 68% | 0.678 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -67.3 | -40.6 | 176.3 | -78.2 | 7.6 | 0 | 0 | 0 | 112.7 | I23 W24 A25 T29 K30 N31 | I23-W27 HydrophobicContact CG2-CD2 4.18Å; I23-W27 HydrophobicContact CG2-CZ2 4.13Å; I23-W27 WeakPolarHBondContact O-CB 3.45Å; I23-W27 PolarHBondContact O-N 3.44Å; W24-W27 PolarHBondContact O-N 3.24Å; A25-W27 PolarHBondContact O-N 3.03Å; W27-T29 VanDerWaalsContact C-N 3.32Å; W27-T29 PolarHBondContact O-N 3.34Å; W27-K30 PolarHBondContact O-N 3.29Å; W27-N31 PolarHBondContact O-N 3.41Å |
| 28 | K | 67.8 | Low | 63.8 | Low | 108 Ų | 108 | 83.4 Ų | 83.4 | 47% | 0.47 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.3 | -44.6 | 176.9 | -170.5 | 177.9 | 179.7 | -176.2 | 0 | 111.3 | W24 A25 N31 T32 | W24-K28 HydrophobicContact CH2-CD 4.31Å; W24-K28 HydrophobicContact CZ2-CD 4.26Å; W24-K28 PolarHBondContact O-N 3.42Å; A25-K28 PolarHBondContact O-N 2.66Å; K28-N31 PolarHBondContact O-N 3.49Å; K28-T32 PolarHBondContact O-OG1 3.47Å; K28-T32 VanDerWaalsContact O-OG1 3.1Å |
| 29 | T | 60.4 | Low | 62.8 | Low | 42 Ų | 42 | 83.4 Ų | 83.4 | 26% | 0.258 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -69.2 | -35.2 | 180 | -51.3 | 0 | 0 | 0 | 0 | 112.9 | A25 W27 N31 T32 Y182 | A25-T29 PolarHBondContact O-N 3.28Å; A25-T29 VanDerWaalsContact O-N 3.16Å; A25-T29 PolarHBondContact O-OG1 2.98Å; A25-T29 VanDerWaalsContact O-OG1 3.1Å; W27-T29 VanDerWaalsContact C-N 3.32Å; W27-T29 PolarHBondContact O-N 3.34Å; T29-N31 PolarHBondContact O-N 3.23Å; T29-T32 PolarHBondContact O-N 3.39Å; T29-T32 PolarHBondContact O-OG1 2.79Å; T29-Y182 HydrophobicContact CG2-CD2 3.7Å; T29-Y182 HydrophobicContact CG2-CE2 4.07Å; T29-Y182 HydrophobicContact CG2-CG 4.28Å |
| 30 | K | 58.9 | Low | 62 | Low | 148 Ų | 148 | 82.5 Ų | 82.5 | 64% | 0.643 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -64.8 | -27.7 | 178.3 | -169.2 | -179.4 | 174.8 | -170 | 0 | 112.6 | A26 W27 | A26-K30 PolarHBondContact O-N 3.23Å; A26-K30 VanDerWaalsContact O-N 3.15Å; W27-K30 PolarHBondContact O-N 3.29Å |
| 31 | N | 54.6 | Low | 60.8 | Low | 143 Ų | 143 | 81.2 Ų | 81.2 | 77% | 0.765 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | -9.1 | -178.1 | -73.4 | -7 | 0 | 0 | 0 | 114 | W27 K28 T29 | W27-N31 PolarHBondContact O-N 3.41Å; K28-N31 PolarHBondContact O-N 3.49Å; T29-N31 PolarHBondContact O-N 3.23Å |
| 32 | T | 49.1 | Very low | 59.7 | Low | 115 Ų | 115 | 81 Ų | 81 | 71% | 0.706 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.3 | -9.3 | -176.6 | 39.2 | 0 | 0 | 0 | 0 | 115.1 | K28 T29 | K28-T32 PolarHBondContact O-OG1 3.47Å; K28-T32 VanDerWaalsContact O-OG1 3.1Å; T29-T32 PolarHBondContact O-N 3.39Å; T29-T32 PolarHBondContact O-OG1 2.79Å |
| 33 | G | 46.7 | Very low | 58.9 | Low | 60 Ų | 60 | 80.9 Ų | 80.9 | 62% | 0.619 | 43% | 0.432 | S | S | * | . | trans | -98.6 | 129.9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 34 | S | 42.8 | Very low | 58 | Low | 114 Ų | 114 | 78.1 Ų | 78.1 | 80% | 0.797 | 42% | 0.418 | S | S | * | . | trans | -67.2 | 146.7 | 165.2 | -61.7 | 0 | 0 | 0 | 0 | 111.5 | G36 | S34-G36 PolarHBondContact O-N 3.45Š| ||
| 35 | E | 45.1 | Very low | 56.8 | Low | 167 Ų | 167 | 71.4 Ų | 71.4 | 78% | 0.78 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -7.1 | -167.5 | -69.7 | -167.9 | 129.6 | 0 | 0 | 117.1 | ||
| 36 | G | 45.6 | Very low | 56.2 | Low | 61 Ų | 61 | 73.6 Ų | 73.6 | 63% | 0.629 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.2 | -20.5 | -170.2 | 0 | 0 | 0 | 0 | 0 | 118.1 | S34 | S34-G36 PolarHBondContact O-N 3.45Š|
| 37 | D | 55.8 | Low | 56.1 | Low | 110 Ų | 110 | 75.3 Ų | 75.3 | 59% | 0.588 | 42% | 0.417 | S | S | * | . | trans | -122.6 | 35.6 | -172.2 | -85.1 | -27.1 | 0 | 0 | 0 | 113 | S39 E40 A41 | D37-S39 PolarHBondContact O-N 2.93Å; D37-E40 PolarHBondContact O-N 3.18Å; D37-A41 VanDerWaalsContact O-CB 3.23Å; D37-A41 WeakPolarHBondContact O-CB 3.32Å; D37-A41 PolarHBondContact O-N 2.89Å | ||
| 38 | R | 60.4 | Low | 55.7 | Low | 104 Ų | 104 | 72.8 Ų | 72.8 | 39% | 0.392 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -71.5 | -33.3 | -168.3 | -157.5 | 171.9 | -172.1 | 154.6 | 2.5 | 112.3 | I42 D374 | R38-I42 HydrophobicContact CG-CD1 4.25Å; R38-I42 WeakPolarHBondContact O-CD1 3.38Å; R38-I42 VanDerWaalsContact O-CG1 3.23Å; R38-I42 WeakPolarHBondContact O-CG1 3.23Å; R38-I42 PolarHBondContact O-N 3.41Å; R38-D374 PolarHBondContact N-OD2 2.91Å; R38-D374 VanDerWaalsContact N-OD2 3.14Å |
| 39 | S | 54.3 | Low | 55.6 | Low | 7 Ų | 7 | 68 Ų | 68 | 5% | 0.049 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -72.4 | -43.7 | 176.9 | 63.6 | 0 | 0 | 0 | 0 | 112 | D37 I42 I43 D374 | D37-S39 PolarHBondContact O-N 2.93Å; S39-I42 PolarHBondContact O-N 3.13Å; S39-I43 VanDerWaalsContact O-CG1 3.27Å; S39-I43 WeakPolarHBondContact O-CG1 3.46Å; S39-I43 PolarHBondContact O-N 3.14Å; S39-D374 VanDerWaalsContact CB-OD1 3.3Å; S39-D374 WeakPolarHBondContact CB-OD1 3.45Å; S39-D374 PolarHBondContact N-OD2 3.42Å; S39-D374 VanDerWaalsContact OG-CG 3.24Å; S39-D374 PolarHBondContact OG-OD1 3.32Å; S39-D374 PolarHBondContact OG-OD2 3.28Å |
| 40 | E | 59 | Low | 56.1 | Low | 51 Ų | 51 | 67.8 Ų | 67.8 | 24% | 0.238 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -66.4 | -37.2 | 175.7 | -170.7 | 168.9 | 167.8 | 0 | 0 | 111.7 | D37 I42 I43 V44 G45 R47 | D37-E40 PolarHBondContact O-N 3.18Å; E40-I42 VanDerWaalsContact C-N 3.3Å; E40-I42 PolarHBondContact O-N 3.15Å; E40-I43 PolarHBondContact O-N 2.83Å; E40-V44 HydrophobicContact CG-CB 4.26Å; E40-V44 HydrophobicContact CG-CG2 4.37Å; E40-V44 CarbonylContact O-C 3.1Å; E40-V44 WeakPolarHBondContact O-CA 3.3Å; E40-V44 WeakPolarHBondContact O-CB 3.46Å; E40-V44 PolarHBondContact O-N 3Å; E40-G45 PolarHBondContact O-N 2.96Å; E40-R47 IonicContact OE1-CZ 2.67Å; E40-R47 IonicContact OE1-NE 3.82Å; E40-R47 PolarHBondContact OE1-NE 3.48Å; E40-R47 IonicContact OE1-NH1 3.57Å; E40-R47 PolarHBondContact OE1-NH1 3.02Å; E40-R47 IonicContact OE1-NH2 3.77Å |
| 41 | A | 56 | Low | 56.8 | Low | 31 Ų | 31 | 64.3 Ų | 64.3 | 26% | 0.256 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.2 | -34 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | D37 G45 | D37-A41 VanDerWaalsContact O-CB 3.23Å; D37-A41 WeakPolarHBondContact O-CB 3.32Å; D37-A41 PolarHBondContact O-N 2.89Å; A41-G45 WeakPolarHBondContact O-CA 3.31Å; A41-G45 PolarHBondContact O-N 2.83Å; A41-G45 VanDerWaalsContact O-N 3.07Å |
| 42 | I | 57 | Low | 57.8 | Low | 37 Ų | 37 | 63.4 Ų | 63.4 | 19% | 0.19 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -80.9 | -34.9 | 179.3 | -70.9 | 166.5 | 0 | 0 | 0 | 111.7 | R38 S39 E40 L181 V378 M381 | R38-I42 HydrophobicContact CG-CD1 4.25Å; R38-I42 WeakPolarHBondContact O-CD1 3.38Å; R38-I42 VanDerWaalsContact O-CG1 3.23Å; R38-I42 WeakPolarHBondContact O-CG1 3.23Å; R38-I42 PolarHBondContact O-N 3.41Å; S39-I42 PolarHBondContact O-N 3.13Å; E40-I42 VanDerWaalsContact C-N 3.3Å; E40-I42 PolarHBondContact O-N 3.15Å; I42-L181 VanDerWaalsContact O-CB 3.29Å; I42-L181 WeakPolarHBondContact O-CB 3.43Å; I42-L181 PolarHBondContact O-N 2.96Å; I42-V378 HydrophobicContact CD1-CB 4.36Å; I42-V378 HydrophobicContact CD1-CG1 3.92Å; I42-V378 HydrophobicContact CD1-CG2 3.42Å; I42-V378 VanDerWaalsContact CD1-CG2 3.42Å; I42-M381 HydrophobicContact CG2-CE 4.06Å; I42-M381 HydrophobicContact CG2-SD 3.75Å |
| 43 | I | 56.7 | Low | 59.2 | Low | 2 Ų | 2 | 59.4 Ų | 59.4 | 1% | 0.01 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -85.1 | -38.3 | -177.7 | -62.9 | 168.9 | 0 | 0 | 0 | 112.4 | S39 E40 V112 M381 | S39-I43 VanDerWaalsContact O-CG1 3.27Å; S39-I43 WeakPolarHBondContact O-CG1 3.46Å; S39-I43 PolarHBondContact O-N 3.14Å; E40-I43 PolarHBondContact O-N 2.83Å; I43-V112 HydrophobicContact CG2-CG1 3.78Å; I43-M381 HydrophobicContact CD1-CE 3.95Å; I43-M381 HydrophobicContact CG1-CE 3.41Å; I43-M381 VanDerWaalsContact CG1-CE 3.41Å |
| 44 | V | 56.5 | Low | 60.8 | Low | 1 Ų | 1 | 56.7 Ų | 56.7 | 1% | 0.006 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -125.5 | 0.8 | -168.2 | -168.4 | 0 | 0 | 0 | 0 | 111.6 | E40 G46 R47 V112 L262 S263 | E40-V44 HydrophobicContact CG-CB 4.26Å; E40-V44 HydrophobicContact CG-CG2 4.37Å; E40-V44 CarbonylContact O-C 3.1Å; E40-V44 WeakPolarHBondContact O-CA 3.3Å; E40-V44 WeakPolarHBondContact O-CB 3.46Å; E40-V44 PolarHBondContact O-N 3Å; V44-G46 VanDerWaalsContact C-N 3.27Å; V44-G46 PolarHBondContact O-N 3.44Å; V44-R47 HydrophobicContact CG1-CG 3.69Å; V44-R47 PolarHBondContact O-N 3.19Å; V44-V112 HydrophobicContact CG2-CG1 3.79Å; V44-L262 WeakPolarHBondContact CG1-O 3.38Å; V44-S263 VanDerWaalsContact CG1-CA 3.44Å; V44-S263 WeakPolarHBondContact O-CB 3.17Å |
| 45 | G | 57.3 | Low | 62.7 | Low | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 30% | 0.295 | C | S | . | . | G | 310 helix | trans | 63 | 33.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | E40 A41 R47 Y182 | E40-G45 PolarHBondContact O-N 2.96Å; A41-G45 WeakPolarHBondContact O-CA 3.31Å; A41-G45 PolarHBondContact O-N 2.83Å; A41-G45 VanDerWaalsContact O-N 3.07Å; G45-R47 PolarHBondContact O-N 3.28Å; G45-Y182 WeakPolarHBondContact O-CE2 3.37Å; G45-Y182 PolarHBondContact O-OH 3.44Å |
| 46 | G | 58.2 | Low | 64.6 | Low | 46 Ų | 46 | 47.5 Ų | 47.5 | 47% | 0.474 | 28% | 0.276 | S | S | . | . | G | 310 helix | trans | 63.4 | 6.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | V44 D48 | V44-G46 VanDerWaalsContact C-N 3.27Å; V44-G46 PolarHBondContact O-N 3.44Å; G46-D48 VanDerWaalsContact C-N 3.3Å; G46-D48 PolarHBondContact O-N 3.34Å |
| 47 | R | 64.6 | Low | 66.3 | Low | 55 Ų | 55 | 44.8 Ų | 44.8 | 21% | 0.208 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | 62.1 | 27.1 | 179.3 | -61.2 | 171.7 | 164 | 154.8 | -5.2 | 115.7 | E40 V44 G45 G110 Y111 S263 S265 | E40-R47 IonicContact OE1-CZ 2.67Å; E40-R47 IonicContact OE1-NE 3.82Å; E40-R47 PolarHBondContact OE1-NE 3.48Å; E40-R47 IonicContact OE1-NH1 3.57Å; E40-R47 PolarHBondContact OE1-NH1 3.02Å; E40-R47 IonicContact OE1-NH2 3.77Å; V44-R47 HydrophobicContact CG1-CG 3.69Å; V44-R47 PolarHBondContact O-N 3.19Å; G45-R47 PolarHBondContact O-N 3.28Å; R47-G110 PolarHBondContact NH2-O 3.08Å; R47-G110 VanDerWaalsContact NH2-O 3.15Å; R47-Y111 PolarHBondContact NH2-O 3.22Å; R47-S263 CarbonylContact C-O 3.43Å; R47-S263 VanDerWaalsContact CA-O 3.26Å; R47-S263 WeakPolarHBondContact CA-O 3.43Å; R47-S265 WeakPolarHBondContact O-CA 3.29Å |
| 48 | D | 63.2 | Low | 67.8 | Low | 126 Ų | 126 | 39.6 Ų | 39.6 | 67% | 0.674 | 22% | 0.219 | S | C | * | . | trans | -123.3 | 32.8 | -179 | -164.7 | 26.4 | 0 | 0 | 0 | 112.9 | G46 G50 | G46-D48 VanDerWaalsContact C-N 3.3Å; G46-D48 PolarHBondContact O-N 3.34Å; D48-G50 PolarHBondContact O-N 3Å | ||
| 49 | I | 66.3 | Low | 69.1 | Low | 9 Ų | 9 | 35 Ų | 35 | 5% | 0.046 | 20% | 0.202 | C | C | . | . | trans | -76.5 | 117.4 | 175.2 | -62 | -175.9 | 0 | 0 | 0 | 108.8 | V53 L181 Y182 Y269 | I49-V53 HydrophobicContact CG2-CB 4.01Å; I49-V53 HydrophobicContact CG2-CG1 3.93Å; I49-L181 HydrophobicContact CD1-CD2 4.45Å; I49-Y182 HydrophobicContact CG1-CE1 4.41Å; I49-Y269 WeakPolarHBondContact O-CE1 3.35Å; I49-Y269 PolarHBondContact O-OH 3.16Å | ||
| 50 | G | 69.9 | Low | 70.5 | Confident | 37 Ų | 37 | 34.7 Ų | 34.7 | 38% | 0.381 | 20% | 0.201 | S | C | . | . | trans | -66.5 | 167.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | D48 L52 V53 G54 Y269 | D48-G50 PolarHBondContact O-N 3Å; G50-L52 PolarHBondContact O-N 2.93Å; G50-V53 PolarHBondContact O-N 2.9Å; G50-G54 PolarHBondContact O-N 3.1Å; G50-Y269 WeakPolarHBondContact CA-OH 3.29Å | ||
| 51 | L | 74.3 | Confident | 71.5 | Confident | 74 Ų | 74 | 32.5 Ų | 32.5 | 39% | 0.387 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -72.7 | -39.4 | -157.5 | -178 | 70.8 | 0 | 0 | 0 | 110.8 | G55 Y269 V272 L273 | L51-G55 PolarHBondContact O-N 3.31Å; L51-Y269 VanDerWaalsContact CA-CZ 3.49Å; L51-Y269 WeakPolarHBondContact CA-OH 3.45Å; L51-Y269 HydrophobicContact CB-CE2 3.74Å; L51-Y269 VanDerWaalsContact CB-OH 3.24Å; L51-Y269 WeakPolarHBondContact CB-OH 3.26Å; L51-Y269 HydrophobicContact CD1-CD2 3.84Å; L51-Y269 HydrophobicContact CD1-CE1 4.29Å; L51-Y269 HydrophobicContact CD1-CE2 3.29Å; L51-Y269 HydrophobicContact CG-CE2 4.02Å; L51-Y269 PolarHBondContact N-OH 3.46Å; L51-V272 HydrophobicContact CD1-CG1 4.05Å; L51-L273 HydrophobicContact CD1-CD2 3.68Å; L51-L273 HydrophobicContact CD1-CG 4.39Å; L51-L273 WeakPolarHBondContact O-CD2 3.39Å |
| 52 | L | 75.7 | Confident | 72.7 | Confident | 125 Ų | 125 | 31.4 Ų | 31.4 | 65% | 0.654 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -63.7 | -54.3 | 176.1 | -64.3 | 175.1 | 0 | 0 | 0 | 110.2 | G50 G54 G55 F56 | G50-L52 PolarHBondContact O-N 2.93Å; L52-G54 VanDerWaalsContact C-N 3.33Å; L52-G54 PolarHBondContact O-N 3.44Å; L52-G55 PolarHBondContact O-N 3.47Å; L52-F56 HydrophobicContact CB-CD2 4.46Å; L52-F56 HydrophobicContact CB-CE2 4.44Å; L52-F56 WeakPolarHBondContact O-CD2 3.38Å; L52-F56 PolarHBondContact O-N 3.38Å |
| 53 | V | 78.9 | Confident | 73.8 | Confident | 31 Ų | 31 | 29.7 Ų | 29.7 | 19% | 0.188 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.7 | -45.8 | -179.4 | -178.9 | 0 | 0 | 0 | 0 | 110.5 | I49 G50 G55 T57 A185 V189 | I49-V53 HydrophobicContact CG2-CB 4.01Å; I49-V53 HydrophobicContact CG2-CG1 3.93Å; G50-V53 PolarHBondContact O-N 2.9Å; V53-G55 PolarHBondContact O-N 3.5Å; V53-T57 WeakPolarHBondContact O-CB 3.18Å; V53-T57 WeakPolarHBondContact O-CG2 3.27Å; V53-T57 PolarHBondContact O-N 3.34Å; V53-A185 HydrophobicContact CG1-CB 4.24Å; V53-V189 HydrophobicContact CB-CG2 4.39Å; V53-V189 HydrophobicContact CG1-CG2 4.06Å; V53-V189 HydrophobicContact CG2-CG2 4.48Å |
| 54 | G | 78.8 | Confident | 74.8 | Confident | 2 Ų | 2 | 29.6 Ų | 29.6 | 2% | 0.021 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.2 | -38.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | G50 L52 T57 M58 L273 | G50-G54 PolarHBondContact O-N 3.1Å; L52-G54 VanDerWaalsContact C-N 3.33Å; L52-G54 PolarHBondContact O-N 3.44Å; G54-T57 WeakPolarHBondContact O-CG2 3.27Å; G54-M58 WeakPolarHBondContact O-CB 3.1Å; G54-M58 PolarHBondContact O-N 3.33Å; G54-L273 VanDerWaalsContact C-CD2 3.48Å |
| 55 | G | 83.6 | Confident | 75.6 | Confident | 2 Ų | 2 | 29.6 Ų | 29.6 | 2% | 0.021 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -72.1 | -46.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L51 L52 V53 M58 T59 L273 | L51-G55 PolarHBondContact O-N 3.31Å; L52-G55 PolarHBondContact O-N 3.47Å; V53-G55 PolarHBondContact O-N 3.5Å; G55-M58 PolarHBondContact O-N 2.88Å; G55-T59 WeakPolarHBondContact O-CB 3.49Å; G55-T59 PolarHBondContact O-N 3.16Å; G55-T59 PolarHBondContact O-OG1 2.91Å; G55-L273 VanDerWaalsContact N-CD2 3.31Å |
| 56 | F | 84.2 | Confident | 76.4 | Confident | 87 Ų | 87 | 29.8 Ų | 29.8 | 38% | 0.382 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -65.3 | -47.2 | 177.2 | -75.5 | -62.9 | 0 | 0 | 0 | 111.5 | L52 M58 T59 A60 V189 L192 | L52-F56 HydrophobicContact CB-CD2 4.46Å; L52-F56 HydrophobicContact CB-CE2 4.44Å; L52-F56 WeakPolarHBondContact O-CD2 3.38Å; L52-F56 PolarHBondContact O-N 3.38Å; F56-M58 VanDerWaalsContact C-N 3.32Å; F56-M58 PolarHBondContact O-N 3.1Å; F56-T59 WeakPolarHBondContact O-CB 3.29Å; F56-T59 PolarHBondContact O-N 3.29Å; F56-A60 VanDerWaalsContact O-CB 3.29Å; F56-A60 WeakPolarHBondContact O-CB 3.47Å; F56-A60 PolarHBondContact O-N 3.07Å; F56-V189 HydrophobicContact CB-CB 4.46Å; F56-V189 HydrophobicContact CB-CG2 3.88Å; F56-V189 HydrophobicContact CD2-CG1 4.3Å; F56-L192 HydrophobicContact CB-CD2 4.05Å; F56-L192 HydrophobicContact CD1-CD2 3.65Å; F56-L192 HydrophobicContact CD1-CG 4.39Å; F56-L192 HydrophobicContact CG-CD2 4.35Å; F56-L192 WeakPolarHBondContact O-CD2 3.43Å |
| 57 | T | 82.7 | Confident | 77.7 | Confident | 4 Ų | 4 | 27.7 Ų | 27.7 | 3% | 0.025 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.9 | -39.6 | 177.4 | -173.2 | 0 | 0 | 0 | 0 | 111.3 | V53 G54 T59 A60 T61 A185 D188 R260 | V53-T57 WeakPolarHBondContact O-CB 3.18Å; V53-T57 WeakPolarHBondContact O-CG2 3.27Å; V53-T57 PolarHBondContact O-N 3.34Å; G54-T57 WeakPolarHBondContact O-CG2 3.27Å; T57-T59 VanDerWaalsContact C-N 3.32Å; T57-T59 PolarHBondContact O-N 3.07Å; T57-A60 PolarHBondContact O-N 3.43Å; T57-T61 PolarHBondContact O-N 2.97Å; T57-T61 VanDerWaalsContact O-N 3.13Å; T57-A185 HydrophobicContact CG2-CB 4.48Å; T57-D188 WeakPolarHBondContact CB-OD2 2.86Å; T57-D188 PolarHBondContact OG1-OD2 3.13Å; T57-R260 HydrophobicContact CG2-CG 4.4Å; T57-R260 PolarHBondContact O-NE 2.88Å; T57-R260 PolarHBondContact O-NH2 3.48Å; T57-R260 VanDerWaalsContact O-NH2 3.14Å; T57-R260 PolarHBondContact OG1-NE 3.4Å; T57-R260 PolarHBondContact OG1-NH2 2.92Å; T57-R260 VanDerWaalsContact OG1-NH2 3.13Å |
| 58 | M | 86 | Confident | 78.7 | Confident | 1 Ų | 1 | 25 Ų | 25 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -66.6 | -34.2 | 177.1 | -169.7 | 176.1 | -75.4 | 0 | 0 | 113.1 | G54 G55 F56 L95 Y257 R260 V261 L273 S274 A277 | G54-M58 WeakPolarHBondContact O-CB 3.1Å; G54-M58 PolarHBondContact O-N 3.33Å; G55-M58 PolarHBondContact O-N 2.88Å; F56-M58 VanDerWaalsContact C-N 3.32Å; F56-M58 PolarHBondContact O-N 3.1Å; M58-L95 HydrophobicContact CG-CD2 4.47Å; M58-Y257 HydrophobicContact CE-CE2 4.3Å; M58-Y257 HydrophobicContact SD-CD2 4.36Å; M58-Y257 HydrophobicContact SD-CE2 4.04Å; M58-R260 HydrophobicContact CE-CB 3.6Å; M58-V261 HydrophobicContact CE-CG2 3.89Å; M58-L273 HydrophobicContact CE-CB 3.81Å; M58-L273 HydrophobicContact CE-CD1 4.44Å; M58-L273 HydrophobicContact SD-CB 3.87Å; M58-S274 WeakPolarHBondContact SD-CA 3.39Å; M58-S274 PolarHBondContact SD-N 3.23Å; M58-S274 VanDerWaalsContact SD-N 3.4Å; M58-A277 HydrophobicContact CB-CB 3.84Å; M58-A277 HydrophobicContact CG-CB 3.55Å; M58-A277 HydrophobicContact SD-CB 3.98Å |
| 59 | T | 88.6 | Confident | 79.8 | Confident | 6 Ų | 6 | 19.4 Ų | 19.4 | 4% | 0.037 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -67.5 | -48.3 | 170.6 | -52.7 | 0 | 0 | 0 | 0 | 110.8 | G55 F56 T57 T61 W62 V63 L192 A277 M284 | G55-T59 WeakPolarHBondContact O-CB 3.49Å; G55-T59 PolarHBondContact O-N 3.16Å; G55-T59 PolarHBondContact O-OG1 2.91Å; F56-T59 WeakPolarHBondContact O-CB 3.29Å; F56-T59 PolarHBondContact O-N 3.29Å; T57-T59 VanDerWaalsContact C-N 3.32Å; T57-T59 PolarHBondContact O-N 3.07Å; T59-T61 VanDerWaalsContact C-N 3.25Å; T59-T61 PolarHBondContact O-N 3.35Å; T59-W62 PolarHBondContact O-N 2.79Å; T59-W62 VanDerWaalsContact O-N 3.13Å; T59-V63 HydrophobicContact CG2-CG2 3.83Å; T59-V63 WeakPolarHBondContact O-CG2 3.32Å; T59-V63 PolarHBondContact O-N 3.46Å; T59-L192 HydrophobicContact CG2-CD1 4.32Å; T59-L192 HydrophobicContact CG2-CD2 3.82Å; T59-A277 WeakPolarHBondContact OG1-CA 3.48Å; T59-M284 HydrophobicContact CG2-CG 4.31Å |
| 60 | A | 83.8 | Confident | 80.6 | Confident | 2 Ų | 2 | 19.3 Ų | 19.3 | 2% | 0.017 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -59.6 | -32.9 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F56 T57 W62 V63 D188 L192 S347 | F56-A60 VanDerWaalsContact O-CB 3.29Å; F56-A60 WeakPolarHBondContact O-CB 3.47Å; F56-A60 PolarHBondContact O-N 3.07Å; T57-A60 PolarHBondContact O-N 3.43Å; A60-W62 VanDerWaalsContact C-N 3.29Å; A60-W62 PolarHBondContact O-N 2.8Å; A60-V63 CarbonylContact O-C 3.59Å; A60-V63 PolarHBondContact O-N 3.11Å; A60-D188 HydrophobicContact CB-CB 3.81Å; A60-L192 HydrophobicContact CB-CB 4.32Å; A60-L192 HydrophobicContact CB-CD1 4.49Å; A60-L192 HydrophobicContact CB-CD2 4.2Å; A60-S347 PolarHBondContact O-OG 3.04Å |
| 61 | T | 79.8 | Confident | 81.5 | Confident | 5 Ų | 5 | 17.7 Ų | 17.7 | 3% | 0.031 | 9% | 0.094 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -28.3 | 178.6 | -110.7 | 0 | 0 | 0 | 0 | 115.4 | T57 T59 A256 R260 S350 | T57-T61 PolarHBondContact O-N 2.97Å; T57-T61 VanDerWaalsContact O-N 3.13Å; T59-T61 VanDerWaalsContact C-N 3.25Å; T59-T61 PolarHBondContact O-N 3.35Å; T61-A256 HydrophobicContact CG2-CB 3.98Å; T61-R260 PolarHBondContact OG1-NH1 3.29Å; T61-R260 PolarHBondContact OG1-NH2 2.81Å; T61-S350 WeakPolarHBondContact OG1-CB 3.23Å; T61-S350 PolarHBondContact OG1-OG 3.28Å; T61-S350 VanDerWaalsContact OG1-OG 3.04Å |
| 62 | W | 80.1 | Confident | 82.4 | Confident | 8 Ų | 8 | 14.1 Ų | 14.1 | 3% | 0.03 | 8% | 0.076 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.8 | -34.3 | 174.6 | -68.7 | 104.6 | 0 | 0 | 0 | 111 | T59 A60 G64 Y67 Y91 L95 G251 W254 | T59-W62 PolarHBondContact O-N 2.79Å; T59-W62 VanDerWaalsContact O-N 3.13Å; A60-W62 VanDerWaalsContact C-N 3.29Å; A60-W62 PolarHBondContact O-N 2.8Å; W62-G64 PolarHBondContact O-N 3.33Å; W62-Y67 WeakPolarHBondContact O-CB 3.16Å; W62-Y67 VanDerWaalsContact O-CG 3.31Å; W62-Y91 HydrophobicContact CD2-CD1 4.16Å; W62-Y91 HydrophobicContact CD2-CG 4.48Å; W62-Y91 AromaticContact CE3-CD1 3.31Å; W62-Y91 HydrophobicContact CE3-CD1 3.31Å; W62-Y91 AromaticContact CE3-CE1 3.68Å; W62-Y91 HydrophobicContact CE3-CE1 3.68Å; W62-Y91 AromaticContact CE3-CG 3.79Å; W62-Y91 HydrophobicContact CE3-CG 3.79Å; W62-Y91 AromaticContact CH2-CD1 3.82Å; W62-Y91 HydrophobicContact CH2-CD1 3.82Å; W62-Y91 AromaticContact CH2-CE1 3.93Å; W62-Y91 HydrophobicContact CH2-CE1 3.93Å; W62-Y91 AromaticContact CZ3-CD1 3.15Å; W62-Y91 HydrophobicContact CZ3-CD1 3.15Å; W62-Y91 AromaticContact CZ3-CE1 3.14Å; W62-Y91 HydrophobicContact CZ3-CE1 3.14Å; W62-Y91 HydrophobicContact CZ3-CG 4.09Å; W62-L95 HydrophobicContact CG-CD1 4.41Å; W62-G251 WeakPolarHBondContact CH2-O 3.16Å; W62-G251 VanDerWaalsContact CZ2-O 3.3Å; W62-G251 WeakPolarHBondContact CZ2-O 3.4Å; W62-W254 HydrophobicContact CH2-CB 3.94Å; W62-W254 HydrophobicContact CH2-CD2 4.2Å; W62-W254 HydrophobicContact CH2-CE3 4.26Å; W62-W254 HydrophobicContact CH2-CG 4.06Å; W62-W254 HydrophobicContact CZ2-CB 4.15Å |
| 63 | V | 81.3 | Confident | 83.1 | Confident | 1 Ų | 1 | 10 Ų | 10 | 1% | 0.006 | 5% | 0.053 | C | C | . | . | S | Bend | trans | -78.4 | 69.5 | 176.7 | -177.5 | 0 | 0 | 0 | 0 | 109.9 | T59 A60 Y67 I68 L192 C281 M284 | T59-V63 HydrophobicContact CG2-CG2 3.83Å; T59-V63 WeakPolarHBondContact O-CG2 3.32Å; T59-V63 PolarHBondContact O-N 3.46Å; A60-V63 CarbonylContact O-C 3.59Å; A60-V63 PolarHBondContact O-N 3.11Å; V63-Y67 HydrophobicContact CG2-CD1 4.48Å; V63-Y67 HydrophobicContact CG2-CE1 4.23Å; V63-I68 HydrophobicContact CG1-CD1 3.79Å; V63-I68 HydrophobicContact CG1-CG1 4.08Å; V63-L192 HydrophobicContact CB-CD1 4.26Å; V63-L192 HydrophobicContact CG1-CD1 4.09Å; V63-C281 HydrophobicContact CG2-CB 4.43Å; V63-M284 HydrophobicContact CG1-CB 3.8Å; V63-M284 HydrophobicContact CG1-CE 4.22Å; V63-M284 HydrophobicContact CG1-CG 4.28Å; V63-M284 HydrophobicContact CG2-CB 3.81Å; V63-M284 HydrophobicContact CG2-CG 4.17Å |
| 64 | G | 77.1 | Confident | 83.6 | Confident | 0 Ų | 0 | 8.9 Ų | 8.9 | 0% | 0 | 5% | 0.047 | C | C | . | . | S | Bend | trans | -105.4 | 179.8 | 177 | 0 | 0 | 0 | 0 | 0 | 114.2 | W62 G66 Y67 I68 S347 | W62-G64 PolarHBondContact O-N 3.33Å; G64-G66 PolarHBondContact O-N 3.08Å; G64-Y67 WeakPolarHBondContact O-CB 3.35Å; G64-Y67 PolarHBondContact O-N 3.36Å; G64-Y67 VanDerWaalsContact O-N 3.1Å; G64-I68 WeakPolarHBondContact O-CG1 3.43Å; G64-I68 PolarHBondContact O-N 3.43Å; G64-S347 WeakPolarHBondContact CA-OG 3.42Å |
| 65 | G | 72.7 | Confident | 84.3 | Confident | 0 Ų | 0 | 8.8 Ų | 8.8 | 0% | 0 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -57.4 | -45.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y67 I68 N69 | G65-Y67 VanDerWaalsContact C-N 3.29Å; G65-Y67 PolarHBondContact O-N 3.1Å; G65-I68 PolarHBondContact O-N 3.5Å; G65-N69 WeakPolarHBondContact O-CB 3.41Å; G65-N69 PolarHBondContact O-N 3.25Å |
| 66 | G | 75.3 | Confident | 84.8 | Confident | 4 Ų | 4 | 8.7 Ų | 8.7 | 4% | 0.041 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -63.9 | -33.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | G64 G70 | G64-G66 PolarHBondContact O-N 3.08Å; G66-G70 VanDerWaalsContact O-CA 3.29Å; G66-G70 WeakPolarHBondContact O-CA 3.22Å; G66-G70 PolarHBondContact O-N 2.87Å |
| 67 | Y | 84 | Confident | 85.1 | Confident | 2 Ų | 2 | 5.6 Ų | 5.6 | 1% | 0.008 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -71.5 | -48.5 | 178 | 179 | -90.9 | 0 | 0 | 0 | 111.8 | W62 V63 G64 G65 T71 A87 P88 Y91 C281 A285 | W62-Y67 WeakPolarHBondContact O-CB 3.16Å; W62-Y67 VanDerWaalsContact O-CG 3.31Å; V63-Y67 HydrophobicContact CG2-CD1 4.48Å; V63-Y67 HydrophobicContact CG2-CE1 4.23Å; G64-Y67 WeakPolarHBondContact O-CB 3.35Å; G64-Y67 PolarHBondContact O-N 3.36Å; G64-Y67 VanDerWaalsContact O-N 3.1Å; G65-Y67 VanDerWaalsContact C-N 3.29Å; G65-Y67 PolarHBondContact O-N 3.1Å; Y67-T71 WeakPolarHBondContact O-CB 3.32Å; Y67-T71 PolarHBondContact O-N 2.97Å; Y67-T71 VanDerWaalsContact O-N 3.13Å; Y67-T71 PolarHBondContact O-OG1 3.1Å; Y67-A87 HydrophobicContact CD2-CB 4.19Å; Y67-A87 HydrophobicContact CE2-CB 4.31Å; Y67-P88 HydrophobicContact CE2-CB 4.49Å; Y67-P88 HydrophobicContact CE2-CG 4.5Å; Y67-P88 VanDerWaalsContact OH-CA 3.23Å; Y67-P88 WeakPolarHBondContact OH-CA 3.26Å; Y67-P88 WeakPolarHBondContact OH-CB 3.28Å; Y67-Y91 HydrophobicContact CD2-CD2 4.08Å; Y67-Y91 HydrophobicContact CE2-CD2 4.13Å; Y67-C281 PolarHBondContact OH-O 3.26Å; Y67-A285 HydrophobicContact CE1-CB 3.86Å |
| 68 | I | 87.1 | Confident | 85.3 | Confident | 0 Ų | 0 | 7.8 Ų | 7.8 | 0% | 0 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -74.2 | -53.2 | -178 | -57.3 | 178.1 | 0 | 0 | 0 | 110.4 | V63 G64 G65 T71 A72 I195 L199 A288 L320 A343 | V63-I68 HydrophobicContact CG1-CD1 3.79Å; V63-I68 HydrophobicContact CG1-CG1 4.08Å; G64-I68 WeakPolarHBondContact O-CG1 3.43Å; G64-I68 PolarHBondContact O-N 3.43Å; G65-I68 PolarHBondContact O-N 3.5Å; I68-T71 PolarHBondContact O-N 3.41Å; I68-A72 PolarHBondContact O-N 2.84Å; I68-A72 VanDerWaalsContact O-N 3.08Å; I68-I195 HydrophobicContact CD1-CG2 3.68Å; I68-L199 HydrophobicContact CD1-CD1 4.15Å; I68-L199 HydrophobicContact CG2-CD1 3.73Å; I68-A288 HydrophobicContact CB-CB 4.47Å; I68-A288 HydrophobicContact CG2-CB 3.66Å; I68-L320 HydrophobicContact CB-CD1 4.47Å; I68-L320 HydrophobicContact CG2-CD1 3.32Å; I68-A343 HydrophobicContact CD1-CB 3.97Å |
| 69 | N | 85.6 | Confident | 85.2 | Confident | 7 Ų | 7 | 9.9 Ų | 9.9 | 4% | 0.037 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65.8 | -43.7 | -178.5 | -64.5 | 3.6 | 0 | 0 | 0 | 110.9 | G65 T71 A72 E73 | G65-N69 WeakPolarHBondContact O-CB 3.41Å; G65-N69 PolarHBondContact O-N 3.25Å; N69-T71 VanDerWaalsContact C-N 3.31Å; N69-T71 PolarHBondContact O-N 3.3Å; N69-A72 PolarHBondContact O-N 2.88Å; N69-E73 WeakPolarHBondContact O-CB 3.27Å; N69-E73 PolarHBondContact O-N 3.43Å |
| 70 | G | 82.8 | Confident | 85.1 | Confident | 8 Ų | 8 | 14.4 Ų | 14.4 | 8% | 0.082 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -65.5 | -32 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | G66 A74 | G66-G70 VanDerWaalsContact O-CA 3.29Å; G66-G70 WeakPolarHBondContact O-CA 3.22Å; G66-G70 PolarHBondContact O-N 2.87Å; G70-A74 VanDerWaalsContact O-CB 3.32Å; G70-A74 WeakPolarHBondContact O-CB 3.31Å; G70-A74 PolarHBondContact O-N 3.25Å |
| 71 | T | 90.2 | Very high | 85.4 | Confident | 2 Ų | 2 | 14.4 Ų | 14.4 | 1% | 0.012 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -67.2 | -44.2 | 172.2 | -63.9 | 0 | 0 | 0 | 0 | 111.1 | Y67 I68 N69 A74 V75 A85 P88 A288 I289 | Y67-T71 WeakPolarHBondContact O-CB 3.32Å; Y67-T71 PolarHBondContact O-N 2.97Å; Y67-T71 VanDerWaalsContact O-N 3.13Å; Y67-T71 PolarHBondContact O-OG1 3.1Å; I68-T71 PolarHBondContact O-N 3.41Å; N69-T71 VanDerWaalsContact C-N 3.31Å; N69-T71 PolarHBondContact O-N 3.3Å; T71-A74 PolarHBondContact O-N 2.91Å; T71-V75 VanDerWaalsContact O-CG2 3.31Å; T71-V75 WeakPolarHBondContact O-CG2 3.24Å; T71-V75 PolarHBondContact O-N 2.86Å; T71-A85 HydrophobicContact CG2-CB 4.42Å; T71-P88 HydrophobicContact CG2-CG 3.81Å; T71-A288 HydrophobicContact CG2-CB 4.24Å; T71-I289 HydrophobicContact CG2-CD1 4.37Å; T71-I289 HydrophobicContact CG2-CG1 3.47Å; T71-I289 VanDerWaalsContact CG2-CG1 3.47Å |
| 72 | A | 92.5 | Very high | 86 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.3 | -42.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | I68 N69 V75 Y76 A288 G292 I319 L320 | I68-A72 PolarHBondContact O-N 2.84Å; I68-A72 VanDerWaalsContact O-N 3.08Å; N69-A72 PolarHBondContact O-N 2.88Å; A72-V75 PolarHBondContact O-N 3.33Å; A72-Y76 WeakPolarHBondContact O-CB 3.34Å; A72-Y76 PolarHBondContact O-N 3.03Å; A72-A288 WeakPolarHBondContact CB-O 3.29Å; A72-G292 WeakPolarHBondContact O-CA 3.36Å; A72-I319 HydrophobicContact CB-CG2 4.03Å; A72-L320 HydrophobicContact CB-CB 3.9Å; A72-L320 HydrophobicContact CB-CD1 4.06Å; A72-L320 HydrophobicContact CB-CG 4.45Å |
| 73 | E | 90 | Very high | 86.5 | Confident | 37 Ų | 37 | 17.9 Ų | 17.9 | 17% | 0.173 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -57.2 | -52 | 173.8 | 177.5 | -175.4 | -170.9 | 0 | 0 | 110.9 | N69 V75 Y76 V77 A316 | N69-E73 WeakPolarHBondContact O-CB 3.27Å; N69-E73 PolarHBondContact O-N 3.43Å; E73-V75 VanDerWaalsContact C-N 3.27Å; E73-V75 PolarHBondContact O-N 3.5Å; E73-Y76 PolarHBondContact O-N 3.39Å; E73-V77 HydrophobicContact CG-CG2 4.09Å; E73-V77 WeakPolarHBondContact O-CG2 3.23Å; E73-V77 PolarHBondContact O-N 2.83Å; E73-A316 HydrophobicContact CG-CB 4.44Å |
| 74 | A | 89.1 | Confident | 86.9 | Confident | 8 Ų | 8 | 18.9 Ų | 18.9 | 7% | 0.066 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -59.3 | -37.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G70 T71 Y80 G81 A85 | G70-A74 VanDerWaalsContact O-CB 3.32Å; G70-A74 WeakPolarHBondContact O-CB 3.31Å; G70-A74 PolarHBondContact O-N 3.25Å; T71-A74 PolarHBondContact O-N 2.91Å; A74-Y80 WeakPolarHBondContact O-CB 3.19Å; A74-G81 CarbonylContact O-C 3.57Å; A74-G81 WeakPolarHBondContact O-CA 3.48Å; A74-G81 PolarHBondContact O-N 2.96Å; A74-A85 HydrophobicContact CB-CB 4.07Å |
| 75 | V | 94.4 | Very high | 87.4 | Confident | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -72 | -33.7 | 176 | 178.9 | 0 | 0 | 0 | 0 | 111.8 | T71 A72 E73 L82 A85 W228 I289 A293 | T71-V75 VanDerWaalsContact O-CG2 3.31Å; T71-V75 WeakPolarHBondContact O-CG2 3.24Å; T71-V75 PolarHBondContact O-N 2.86Å; A72-V75 PolarHBondContact O-N 3.33Å; E73-V75 VanDerWaalsContact C-N 3.27Å; E73-V75 PolarHBondContact O-N 3.5Å; V75-L82 HydrophobicContact CG2-CD1 4.31Å; V75-A85 HydrophobicContact CG2-CB 3.88Å; V75-W228 HydrophobicContact CG1-CB 4.29Å; V75-W228 HydrophobicContact CG1-CE3 3.98Å; V75-I289 HydrophobicContact CG2-CB 4.5Å; V75-I289 HydrophobicContact CG2-CG1 4.42Å; V75-I289 HydrophobicContact CG2-CG2 4.22Å; V75-A293 HydrophobicContact CG1-CB 4.07Å |
| 76 | Y | 93.7 | Very high | 88.2 | Confident | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -74.8 | -38.3 | 179.1 | 173.4 | -116.6 | 0 | 0 | 0 | 113.4 | A72 E73 P78 Q225 G295 A296 P310 M311 A316 I319 | A72-Y76 WeakPolarHBondContact O-CB 3.34Å; A72-Y76 PolarHBondContact O-N 3.03Å; E73-Y76 PolarHBondContact O-N 3.39Å; Y76-P78 WeakPolarHBondContact O-CD 3.35Å; Y76-Q225 PolarHBondContact O-NE2 3.49Å; Y76-G295 WeakPolarHBondContact CE2-O 3.31Å; Y76-A296 HydrophobicContact CD2-CB 4.23Å; Y76-P310 HydrophobicContact CE1-CB 4.14Å; Y76-P310 WeakPolarHBondContact OH-CD 3.45Å; Y76-M311 HydrophobicContact CE1-CB 4.06Å; Y76-M311 PolarHBondContact OH-N 3.23Å; Y76-M311 VanDerWaalsContact OH-N 3.12Å; Y76-A316 HydrophobicContact CD1-CB 3.9Å; Y76-A316 HydrophobicContact CE1-CB 3.96Å; Y76-I319 HydrophobicContact CD1-CB 3.87Å; Y76-I319 HydrophobicContact CD1-CD1 3.87Å; Y76-I319 HydrophobicContact CD1-CG1 3.75Å; Y76-I319 HydrophobicContact CD1-CG2 4.33Å; Y76-I319 HydrophobicContact CD2-CD1 3.77Å; Y76-I319 HydrophobicContact CD2-CG1 3.81Å; Y76-I319 HydrophobicContact CE1-CB 4.45Å; Y76-I319 HydrophobicContact CE1-CD1 3.8Å; Y76-I319 HydrophobicContact CE1-CG1 4.22Å; Y76-I319 HydrophobicContact CE2-CD1 3.72Å; Y76-I319 HydrophobicContact CE2-CG1 4.28Å; Y76-I319 HydrophobicContact CG-CB 4.05Å; Y76-I319 HydrophobicContact CG-CD1 3.86Å; Y76-I319 HydrophobicContact CG-CG1 3.53Å; Y76-I319 HydrophobicContact CG-CG2 4.3Å |
| 77 | V | 90.5 | Very high | 88.8 | Confident | 22 Ų | 22 | 19.9 Ų | 19.9 | 13% | 0.133 | 12% | 0.119 | C | C | . | . | S | Bend | trans | -63.3 | 124.2 | -172.7 | 169.3 | 0 | 0 | 0 | 0 | 111.2 | E73 G79 Y80 G81 M311 A316 | E73-V77 HydrophobicContact CG-CG2 4.09Å; E73-V77 WeakPolarHBondContact O-CG2 3.23Å; E73-V77 PolarHBondContact O-N 2.83Å; V77-G79 PolarHBondContact O-N 2.76Å; V77-Y80 HydrophobicContact CB-CG 4.49Å; V77-Y80 HydrophobicContact CG1-CD1 4.18Å; V77-Y80 HydrophobicContact CG1-CD2 4.47Å; V77-Y80 HydrophobicContact CG1-CG 4.07Å; V77-Y80 PolarHBondContact O-N 3.46Å; V77-G81 PolarHBondContact O-N 3.38Å; V77-M311 HydrophobicContact CG1-CE 4.32Å; V77-M311 HydrophobicContact CG2-SD 4.32Å; V77-A316 HydrophobicContact CG2-CB 4.05Å |
| 78 | P | 86.9 | Confident | 89.1 | Confident | 50 Ų | 50 | 20 Ų | 20 | 33% | 0.325 | 12% | 0.12 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | 132.6 | 178.2 | -25.7 | 34.5 | 0 | 0 | 0 | 112.6 | Y76 Y80 Q225 A226 M311 | Y76-P78 WeakPolarHBondContact O-CD 3.35Å; P78-Y80 VanDerWaalsContact C-N 3.28Å; P78-Y80 PolarHBondContact O-N 2.92Å; P78-Q225 HydrophobicContact CG-CB 4.27Å; P78-A226 HydrophobicContact CB-CB 4.09Å; P78-M311 HydrophobicContact CG-CG 4.39Å |
| 79 | G | 84.3 | Confident | 89.3 | Confident | 45 Ų | 45 | 24.5 Ų | 24.5 | 46% | 0.464 | 14% | 0.143 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 88.2 | -19.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | V77 | V77-G79 PolarHBondContact O-N 2.76Š|
| 80 | Y | 86.2 | Confident | 89.6 | Confident | 102 Ų | 102 | 24.2 Ų | 24.2 | 40% | 0.4 | 14% | 0.141 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -90.4 | -72.8 | 176 | -81 | 37.1 | 0 | 0 | 0 | 109.7 | A74 V77 P78 W84 G230 | A74-Y80 WeakPolarHBondContact O-CB 3.19Å; V77-Y80 HydrophobicContact CB-CG 4.49Å; V77-Y80 HydrophobicContact CG1-CD1 4.18Å; V77-Y80 HydrophobicContact CG1-CD2 4.47Å; V77-Y80 HydrophobicContact CG1-CG 4.07Å; V77-Y80 PolarHBondContact O-N 3.46Å; P78-Y80 VanDerWaalsContact C-N 3.28Å; P78-Y80 PolarHBondContact O-N 2.92Å; Y80-W84 HydrophobicContact CD2-CB 3.97Å; Y80-W84 HydrophobicContact CD2-CG 4.23Å; Y80-W84 HydrophobicContact CG-CB 4.07Å; Y80-W84 HydrophobicContact CG-CG 4.08Å; Y80-W84 VanDerWaalsContact O-CD1 3.24Å; Y80-G230 WeakPolarHBondContact O-CA 3.33Å |
| 81 | G | 89.8 | Confident | 89.9 | Confident | 1 Ų | 1 | 24 Ų | 24 | 1% | 0.01 | 14% | 0.138 | C | C | . | . | S | Bend | trans | 63.2 | -165.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | A74 V77 A83 W84 A85 W228 | A74-G81 CarbonylContact O-C 3.57Å; A74-G81 WeakPolarHBondContact O-CA 3.48Å; A74-G81 PolarHBondContact O-N 2.96Å; V77-G81 PolarHBondContact O-N 3.38Å; G81-A83 PolarHBondContact O-N 2.84Å; G81-A83 VanDerWaalsContact O-N 3.16Å; G81-W84 PolarHBondContact O-N 2.86Å; G81-A85 PolarHBondContact O-N 2.93Å; G81-W228 CarbonylContact C-O 3.36Å; G81-W228 WeakPolarHBondContact CA-O 3.24Å |
| 82 | L | 92.2 | Very high | 90.1 | Very high | 60 Ų | 60 | 24.1 Ų | 24.1 | 31% | 0.314 | 14% | 0.139 | S | C | . | . | G | 310 helix | trans | -55.4 | -33.9 | 179.5 | -177.5 | 62.9 | 0 | 0 | 0 | 112.6 | V75 W84 A85 W228 L229 I289 | V75-L82 HydrophobicContact CG2-CD1 4.31Å; L82-W84 PolarHBondContact O-N 3.03Å; L82-A85 HydrophobicContact CD1-CB 4.34Å; L82-A85 PolarHBondContact O-N 2.94Å; L82-A85 VanDerWaalsContact O-N 3.11Å; L82-W228 HydrophobicContact CB-CE3 4.4Å; L82-W228 HydrophobicContact CB-CZ3 4.37Å; L82-W228 HydrophobicContact CD2-CZ3 4.27Å; L82-W228 PolarHBondContact N-O 3.43Å; L82-L229 HydrophobicContact CB-CD1 4.46Å; L82-L229 HydrophobicContact CD2-CD1 3.94Å; L82-L229 PolarHBondContact N-O 3.49Å; L82-I289 HydrophobicContact CD1-CD1 3.97Å; L82-I289 HydrophobicContact CD1-CG1 4.18Å; L82-I289 HydrophobicContact CD1-CG2 3.74Å |
| 83 | A | 90.8 | Very high | 90.2 | Very high | 27 Ų | 27 | 27.1 Ų | 27.1 | 22% | 0.223 | 15% | 0.154 | C | C | . | . | G | 310 helix | trans | -56.9 | -29.9 | 178 | 0 | 0 | 0 | 0 | 0 | 113.6 | G81 L229 I232 W240 | G81-A83 PolarHBondContact O-N 2.84Å; G81-A83 VanDerWaalsContact O-N 3.16Å; A83-L229 PolarHBondContact N-O 2.83Å; A83-I232 HydrophobicContact CB-CG1 3.98Å; A83-W240 PolarHBondContact O-NE1 3.39Å |
| 84 | W | 88.8 | Confident | 90.4 | Very high | 22 Ų | 22 | 25.4 Ų | 25.4 | 8% | 0.083 | 15% | 0.147 | C | C | . | . | G | 310 helix | trans | -100.4 | -7 | 179 | -76.5 | 85.5 | 0 | 0 | 0 | 113.8 | Y80 G81 L82 Q86 E236 W240 | Y80-W84 HydrophobicContact CD2-CB 3.97Å; Y80-W84 HydrophobicContact CD2-CG 4.23Å; Y80-W84 HydrophobicContact CG-CB 4.07Å; Y80-W84 HydrophobicContact CG-CG 4.08Å; Y80-W84 VanDerWaalsContact O-CD1 3.24Å; G81-W84 PolarHBondContact O-N 2.86Å; L82-W84 PolarHBondContact O-N 3.03Å; W84-Q86 PolarHBondContact O-N 3.21Å; W84-E236 HydrophobicContact CH2-CB 4.16Å; W84-E236 HydrophobicContact CZ2-CB 3.94Å; W84-E236 WeakPolarHBondContact CZ2-OE2 3.46Å; W84-W240 AromaticContact CD2-CD1 3.97Å; W84-W240 AromaticContact CE3-CD1 3.99Å; W84-W240 HydrophobicContact CH2-CB 4.31Å |
| 85 | A | 89.6 | Confident | 90.6 | Very high | 8 Ų | 8 | 25.1 Ų | 25.1 | 7% | 0.066 | 14% | 0.144 | C | C | . | . | trans | -74 | 63 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | T71 A74 V75 G81 L82 A87 P88 | T71-A85 HydrophobicContact CG2-CB 4.42Å; A74-A85 HydrophobicContact CB-CB 4.07Å; V75-A85 HydrophobicContact CG2-CB 3.88Å; G81-A85 PolarHBondContact O-N 2.93Å; L82-A85 HydrophobicContact CD1-CB 4.34Å; L82-A85 PolarHBondContact O-N 2.94Å; L82-A85 VanDerWaalsContact O-N 3.11Å; A85-A87 VanDerWaalsContact C-N 3.35Å; A85-A87 PolarHBondContact O-N 3.37Å; A85-P88 VanDerWaalsContact O-CD 3.26Å; A85-P88 WeakPolarHBondContact O-CD 3.16Å | ||
| 86 | Q | 89.4 | Confident | 90.7 | Very high | 11 Ų | 11 | 28.1 Ų | 28.1 | 5% | 0.051 | 16% | 0.159 | C | C | . | . | trans | -72.8 | -25.1 | -174.8 | -67.7 | -177.7 | 0.6 | 0 | 0 | 113.7 | W84 I89 G90 W240 F244 L247 | W84-Q86 PolarHBondContact O-N 3.21Å; Q86-I89 PolarHBondContact O-N 3.48Å; Q86-G90 PolarHBondContact O-N 2.81Å; Q86-W240 HydrophobicContact CG-CZ2 3.93Å; Q86-W240 PolarHBondContact NE2-O 3.01Å; Q86-F244 HydrophobicContact CB-CD2 4.13Å; Q86-F244 HydrophobicContact CG-CD2 4.22Å; Q86-F244 VanDerWaalsContact OE1-CA 3.28Å; Q86-L247 HydrophobicContact CB-CD1 3.64Å | ||
| 87 | A | 86.6 | Confident | 90.8 | Very high | 5 Ų | 5 | 29.8 Ų | 29.8 | 4% | 0.041 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -48.4 | -52.5 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113 | Y67 A85 I89 G90 Y91 W406 | Y67-A87 HydrophobicContact CD2-CB 4.19Å; Y67-A87 HydrophobicContact CE2-CB 4.31Å; A85-A87 VanDerWaalsContact C-N 3.35Å; A85-A87 PolarHBondContact O-N 3.37Å; A87-I89 VanDerWaalsContact C-N 3.35Å; A87-I89 PolarHBondContact O-N 3.43Å; A87-G90 PolarHBondContact O-N 2.93Å; A87-Y91 HydrophobicContact CB-CD2 4.27Å; A87-Y91 HydrophobicContact CB-CE2 4.27Å; A87-Y91 WeakPolarHBondContact O-CD2 3.44Å; A87-Y91 PolarHBondContact O-N 2.91Å; A87-W406 HydrophobicContact CB-CH2 3.39Å; A87-W406 HydrophobicContact CB-CZ2 3.82Å |
| 88 | P | 90.7 | Very high | 90.9 | Very high | 5 Ų | 5 | 28.7 Ų | 28.7 | 3% | 0.032 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.2 | -43.9 | -173 | -26.7 | 38.9 | 0 | 0 | 0 | 113.2 | Y67 T71 A85 S92 L282 A285 | Y67-P88 HydrophobicContact CE2-CB 4.49Å; Y67-P88 HydrophobicContact CE2-CG 4.5Å; Y67-P88 VanDerWaalsContact OH-CA 3.23Å; Y67-P88 WeakPolarHBondContact OH-CA 3.26Å; Y67-P88 WeakPolarHBondContact OH-CB 3.28Å; T71-P88 HydrophobicContact CG2-CG 3.81Å; A85-P88 VanDerWaalsContact O-CD 3.26Å; A85-P88 WeakPolarHBondContact O-CD 3.16Å; P88-S92 VanDerWaalsContact O-CB 3.25Å; P88-S92 WeakPolarHBondContact O-CB 3.4Å; P88-S92 PolarHBondContact O-N 3.32Å; P88-S92 PolarHBondContact O-OG 2.84Å; P88-L282 HydrophobicContact CB-CD2 4.45Å; P88-L282 WeakPolarHBondContact O-CD2 3.42Å; P88-A285 HydrophobicContact CB-CB 3.53Å; P88-A285 HydrophobicContact CG-CB 3.6Å |
| 89 | I | 92.4 | Very high | 91.2 | Very high | 95 Ų | 95 | 26.3 Ų | 26.3 | 49% | 0.487 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -73.2 | -44.1 | -180 | -57.9 | 176.7 | 0 | 0 | 0 | 110.1 | Q86 A87 S92 L93 F244 | Q86-I89 PolarHBondContact O-N 3.48Å; A87-I89 VanDerWaalsContact C-N 3.35Å; A87-I89 PolarHBondContact O-N 3.43Å; I89-S92 PolarHBondContact O-N 3.15Å; I89-L93 HydrophobicContact CG2-CD1 3.98Å; I89-L93 HydrophobicContact CG2-CG 4.45Å; I89-L93 WeakPolarHBondContact O-CB 3.35Å; I89-L93 WeakPolarHBondContact O-CG 3.48Å; I89-L93 PolarHBondContact O-N 3.14Å; I89-F244 HydrophobicContact CB-CE2 4.28Å; I89-F244 HydrophobicContact CG2-CE2 4Å; I89-F244 HydrophobicContact CG2-CZ 3.92Å |
| 90 | G | 91.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59.3 | -51.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q86 A87 L93 S94 | Q86-G90 PolarHBondContact O-N 2.81Å; A87-G90 PolarHBondContact O-N 2.93Å; G90-L93 PolarHBondContact O-N 3.21Å; G90-S94 PolarHBondContact O-N 3.38Å |
| 91 | Y | 89.1 | Confident | 92.1 | Very high | 4 Ų | 4 | 29.1 Ų | 29.1 | 2% | 0.016 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -71.5 | -32.1 | 179.5 | -69.9 | -65.5 | 0 | 0 | 0 | 113.2 | W62 Y67 A87 L93 S94 L95 L247 W406 S410 | W62-Y91 HydrophobicContact CD2-CD1 4.16Å; W62-Y91 HydrophobicContact CD2-CG 4.48Å; W62-Y91 AromaticContact CE3-CD1 3.31Å; W62-Y91 HydrophobicContact CE3-CD1 3.31Å; W62-Y91 AromaticContact CE3-CE1 3.68Å; W62-Y91 HydrophobicContact CE3-CE1 3.68Å; W62-Y91 AromaticContact CE3-CG 3.79Å; W62-Y91 HydrophobicContact CE3-CG 3.79Å; W62-Y91 AromaticContact CH2-CD1 3.82Å; W62-Y91 HydrophobicContact CH2-CD1 3.82Å; W62-Y91 AromaticContact CH2-CE1 3.93Å; W62-Y91 HydrophobicContact CH2-CE1 3.93Å; W62-Y91 AromaticContact CZ3-CD1 3.15Å; W62-Y91 HydrophobicContact CZ3-CD1 3.15Å; W62-Y91 AromaticContact CZ3-CE1 3.14Å; W62-Y91 HydrophobicContact CZ3-CE1 3.14Å; W62-Y91 HydrophobicContact CZ3-CG 4.09Å; Y67-Y91 HydrophobicContact CD2-CD2 4.08Å; Y67-Y91 HydrophobicContact CE2-CD2 4.13Å; A87-Y91 HydrophobicContact CB-CD2 4.27Å; A87-Y91 HydrophobicContact CB-CE2 4.27Å; A87-Y91 WeakPolarHBondContact O-CD2 3.44Å; A87-Y91 PolarHBondContact O-N 2.91Å; Y91-L93 VanDerWaalsContact C-N 3.34Å; Y91-S94 VanDerWaalsContact O-CB 3.24Å; Y91-S94 WeakPolarHBondContact O-CB 3.47Å; Y91-S94 PolarHBondContact O-N 3.47Å; Y91-L95 WeakPolarHBondContact O-CG 3.29Å; Y91-L95 PolarHBondContact O-N 3.02Å; Y91-L247 HydrophobicContact CE2-CD2 3.71Å; Y91-L247 VanDerWaalsContact OH-CD2 3.31Å; Y91-L247 WeakPolarHBondContact OH-CD2 3.41Å; Y91-W406 HydrophobicContact CD2-CZ2 4.44Å; Y91-W406 HydrophobicContact CE2-CH2 4.16Å; Y91-W406 AromaticContact CE2-CZ2 3.39Å; Y91-W406 HydrophobicContact CE2-CZ2 3.39Å; Y91-W406 AromaticContact CZ-CZ2 3.97Å; Y91-W406 PolarHBondContact OH-NE1 3.21Å; Y91-S410 PolarHBondContact OH-OG 2.62Å |
| 92 | S | 92.9 | Very high | 92.4 | Very high | 4 Ų | 4 | 29.3 Ų | 29.3 | 3% | 0.028 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.4 | -41.4 | 174.8 | -57.5 | 0 | 0 | 0 | 0 | 111 | P88 I89 S94 L95 I96 A278 L282 | P88-S92 VanDerWaalsContact O-CB 3.25Å; P88-S92 WeakPolarHBondContact O-CB 3.4Å; P88-S92 PolarHBondContact O-N 3.32Å; P88-S92 PolarHBondContact O-OG 2.84Å; I89-S92 PolarHBondContact O-N 3.15Å; S92-S94 VanDerWaalsContact C-N 3.35Å; S92-L95 PolarHBondContact O-N 3.31Å; S92-I96 WeakPolarHBondContact O-CG1 3.38Å; S92-I96 PolarHBondContact O-N 3.07Å; S92-A278 WeakPolarHBondContact O-CB 3.43Å; S92-A278 PolarHBondContact OG-O 3.4Å; S92-L282 WeakPolarHBondContact OG-CD2 3.44Å; S92-L282 WeakPolarHBondContact OG-CG 3.02Å |
| 93 | L | 95.1 | Very high | 92.4 | Very high | 63 Ų | 63 | 26.4 Ų | 26.4 | 33% | 0.33 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -65.2 | -38.4 | 170.8 | -72.8 | 174.4 | 0 | 0 | 0 | 112 | I89 G90 Y91 L95 I96 V97 F244 I248 | I89-L93 HydrophobicContact CG2-CD1 3.98Å; I89-L93 HydrophobicContact CG2-CG 4.45Å; I89-L93 WeakPolarHBondContact O-CB 3.35Å; I89-L93 WeakPolarHBondContact O-CG 3.48Å; I89-L93 PolarHBondContact O-N 3.14Å; G90-L93 PolarHBondContact O-N 3.21Å; Y91-L93 VanDerWaalsContact C-N 3.34Å; L93-L95 VanDerWaalsContact C-N 3.32Å; L93-L95 PolarHBondContact O-N 3.41Å; L93-I96 HydrophobicContact CD2-CD1 4.49Å; L93-I96 PolarHBondContact O-N 2.99Å; L93-V97 WeakPolarHBondContact O-CB 3.11Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.31Å; L93-V97 PolarHBondContact O-N 3.3Å; L93-F244 HydrophobicContact CD1-CE1 4.32Å; L93-F244 HydrophobicContact CD1-CZ 3.79Å; L93-I248 HydrophobicContact CB-CD1 4.28Å; L93-I248 HydrophobicContact CB-CG1 4.03Å; L93-I248 HydrophobicContact CB-CG2 4.37Å; L93-I248 HydrophobicContact CD1-CD1 3.83Å; L93-I248 HydrophobicContact CD1-CG1 4.35Å |
| 94 | S | 94.1 | Very high | 92.4 | Very high | 2 Ų | 2 | 31 Ų | 31 | 1% | 0.014 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -55.6 | -47 | 173.8 | -165.5 | 0 | 0 | 0 | 0 | 111.9 | G90 Y91 S92 V97 G98 I248 G251 I252 | G90-S94 PolarHBondContact O-N 3.38Å; Y91-S94 VanDerWaalsContact O-CB 3.24Å; Y91-S94 WeakPolarHBondContact O-CB 3.47Å; Y91-S94 PolarHBondContact O-N 3.47Å; S92-S94 VanDerWaalsContact C-N 3.35Å; S94-V97 PolarHBondContact O-N 3.3Å; S94-G98 WeakPolarHBondContact O-CA 3.42Å; S94-G98 PolarHBondContact O-N 2.91Å; S94-I248 WeakPolarHBondContact CA-O 3.22Å; S94-I248 WeakPolarHBondContact CB-O 3.4Å; S94-I248 PolarHBondContact OG-O 3.26Å; S94-G251 VanDerWaalsContact OG-CA 3.27Å; S94-G251 WeakPolarHBondContact OG-CA 3.25Å; S94-I252 PolarHBondContact OG-N 3.47Å; S94-I252 VanDerWaalsContact OG-N 3.11Å |
| 95 | L | 93.6 | Very high | 92.5 | Very high | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.5 | -40.7 | 176.6 | -76.2 | 171.3 | 0 | 0 | 0 | 112.4 | M58 W62 Y91 S92 L93 G99 Y257 S274 A277 A278 | M58-L95 HydrophobicContact CG-CD2 4.47Å; W62-L95 HydrophobicContact CG-CD1 4.41Å; Y91-L95 WeakPolarHBondContact O-CG 3.29Å; Y91-L95 PolarHBondContact O-N 3.02Å; S92-L95 PolarHBondContact O-N 3.31Å; L93-L95 VanDerWaalsContact C-N 3.32Å; L93-L95 PolarHBondContact O-N 3.41Å; L95-G99 PolarHBondContact O-N 3.27Å; L95-Y257 HydrophobicContact CD2-CD2 3.56Å; L95-Y257 HydrophobicContact CD2-CE2 3.53Å; L95-S274 WeakPolarHBondContact O-CB 2.99Å; L95-A277 HydrophobicContact CD1-CB 3.89Å; L95-A278 HydrophobicContact CB-CB 3.8Å; L95-A278 HydrophobicContact CD1-CB 4.4Å |
| 96 | I | 95.4 | Very high | 92.6 | Very high | 63 Ų | 63 | 30.8 Ų | 30.8 | 32% | 0.323 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -63.7 | -51.2 | 176.1 | -68.6 | 165 | 0 | 0 | 0 | 110.7 | S92 L93 G99 L100 F275 A278 | S92-I96 WeakPolarHBondContact O-CG1 3.38Å; S92-I96 PolarHBondContact O-N 3.07Å; L93-I96 HydrophobicContact CD2-CD1 4.49Å; L93-I96 PolarHBondContact O-N 2.99Å; I96-G99 PolarHBondContact O-N 2.91Å; I96-L100 HydrophobicContact CG2-CD1 3.83Å; I96-L100 HydrophobicContact CG2-CG 4.49Å; I96-L100 WeakPolarHBondContact O-CB 3.14Å; I96-L100 WeakPolarHBondContact O-CG 3.26Å; I96-L100 PolarHBondContact O-N 3.36Å; I96-F275 HydrophobicContact CG1-CD1 4.38Å; I96-F275 HydrophobicContact CG2-CE1 4.3Å; I96-A278 HydrophobicContact CD1-CB 4.14Å; I96-A278 HydrophobicContact CG1-CB 3.63Å |
| 97 | V | 96 | Very high | 92.6 | Very high | 35 Ų | 35 | 32 Ų | 32 | 21% | 0.212 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.7 | -44.2 | -179.3 | 176.2 | 0 | 0 | 0 | 0 | 110.5 | L93 S94 G99 L100 F101 F102 I252 | L93-V97 WeakPolarHBondContact O-CB 3.11Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.31Å; L93-V97 PolarHBondContact O-N 3.3Å; S94-V97 PolarHBondContact O-N 3.3Å; V97-G99 VanDerWaalsContact C-N 3.33Å; V97-G99 PolarHBondContact O-N 3.4Å; V97-L100 PolarHBondContact O-N 2.98Å; V97-F101 HydrophobicContact CG1-CD2 3.95Å; V97-F101 HydrophobicContact CG1-CE2 4.46Å; V97-F101 WeakPolarHBondContact O-CD2 3.37Å; V97-F101 PolarHBondContact O-N 3.34Å; V97-F102 HydrophobicContact CG1-CE2 4.39Å; V97-I252 HydrophobicContact CB-CD1 4.09Å; V97-I252 HydrophobicContact CG1-CD1 3.62Å |
| 98 | G | 94.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.183 | C | C | . | . | I | π-helix | trans | -57.2 | -44.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S94 F102 A103 Y257 | S94-G98 WeakPolarHBondContact O-CA 3.42Å; S94-G98 PolarHBondContact O-N 2.91Å; G98-F102 CarbonylContact O-C 3.51Å; G98-F102 WeakPolarHBondContact O-CA 3.23Å; G98-F102 WeakPolarHBondContact O-CB 3.39Å; G98-F102 PolarHBondContact O-N 3.49Å; G98-A103 PolarHBondContact O-N 3.04Å; G98-Y257 PolarHBondContact O-OH 3Å |
| 99 | G | 93.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 20% | 0.203 | C | C | . | . | I | π-helix | trans | -67.1 | -45.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | L95 I96 V97 Y257 Q271 | L95-G99 PolarHBondContact O-N 3.27Å; I96-G99 PolarHBondContact O-N 2.91Å; V97-G99 VanDerWaalsContact C-N 3.33Å; V97-G99 PolarHBondContact O-N 3.4Å; G99-Y257 PolarHBondContact N-OH 3.41Å; G99-Q271 VanDerWaalsContact O-CG 3.28Å; G99-Q271 WeakPolarHBondContact O-CG 3.17Å; G99-Q271 PolarHBondContact O-NE2 3.36Å |
| 100 | L | 94.2 | Very high | 92 | Very high | 85 Ų | 85 | 37.5 Ų | 37.5 | 45% | 0.445 | 20% | 0.197 | S | C | . | . | I | π-helix | trans | -64.3 | -49.9 | -179.5 | -76.6 | 168 | 0 | 0 | 0 | 112.2 | I96 V97 Q271 F275 | I96-L100 HydrophobicContact CG2-CD1 3.83Å; I96-L100 HydrophobicContact CG2-CG 4.49Å; I96-L100 WeakPolarHBondContact O-CB 3.14Å; I96-L100 WeakPolarHBondContact O-CG 3.26Å; I96-L100 PolarHBondContact O-N 3.36Å; V97-L100 PolarHBondContact O-N 2.98Å; L100-Q271 PolarHBondContact O-NE2 2.98Å; L100-F275 HydrophobicContact CD2-CE1 4.14Å; L100-F275 HydrophobicContact CD2-CZ 3.59Å; L100-F275 HydrophobicContact CG-CE1 3.79Å; L100-F275 HydrophobicContact CG-CZ 3.71Å |
| 101 | F | 95 | Very high | 91.8 | Very high | 121 Ų | 121 | 38 Ų | 38 | 53% | 0.531 | 20% | 0.199 | S | C | . | . | I | π-helix | trans | -104.7 | -33.7 | -166.7 | -60.9 | -72.3 | 0 | 0 | 0 | 113.9 | V97 P105 F426 | V97-F101 HydrophobicContact CG1-CD2 3.95Å; V97-F101 HydrophobicContact CG1-CE2 4.46Å; V97-F101 WeakPolarHBondContact O-CD2 3.37Å; V97-F101 PolarHBondContact O-N 3.34Å; F101-P105 WeakPolarHBondContact O-CD 3.09Å; F101-P105 WeakPolarHBondContact O-CG 3.38Å; F101-F426 HydrophobicContact CB-CZ 4.22Å; F101-F426 WeakPolarHBondContact O-CZ 3.13Å |
| 102 | F | 94.9 | Very high | 91.3 | Very high | 4 Ų | 4 | 38.2 Ų | 38.2 | 2% | 0.018 | 20% | 0.201 | C | C | . | . | I | π-helix | trans | -107.1 | -32.3 | -167.7 | -60.6 | -99.9 | 0 | 0 | 0 | 114 | V97 G98 K104 P105 M106 I252 F258 F418 L421 L422 L425 F426 | V97-F102 HydrophobicContact CG1-CE2 4.39Å; G98-F102 CarbonylContact O-C 3.51Å; G98-F102 WeakPolarHBondContact O-CA 3.23Å; G98-F102 WeakPolarHBondContact O-CB 3.39Å; G98-F102 PolarHBondContact O-N 3.49Å; F102-K104 PolarHBondContact O-N 3.13Å; F102-P105 VanDerWaalsContact O-CD 3.26Å; F102-P105 WeakPolarHBondContact O-CD 3.48Å; F102-P105 WeakPolarHBondContact O-CG 3.3Å; F102-M106 VanDerWaalsContact O-CB 3.26Å; F102-M106 WeakPolarHBondContact O-CB 3.38Å; F102-M106 WeakPolarHBondContact O-CG 3.47Å; F102-M106 PolarHBondContact O-N 2.88Å; F102-M106 VanDerWaalsContact O-N 3.14Å; F102-I252 HydrophobicContact CB-CG2 4.39Å; F102-I252 HydrophobicContact CD1-CG2 4.04Å; F102-I252 HydrophobicContact CD2-CD1 4.49Å; F102-I252 HydrophobicContact CD2-CG2 3.68Å; F102-I252 HydrophobicContact CE1-CG2 4.19Å; F102-I252 HydrophobicContact CE2-CD1 3.99Å; F102-I252 HydrophobicContact CE2-CG2 3.85Å; F102-I252 HydrophobicContact CG-CG2 3.78Å; F102-I252 HydrophobicContact CZ-CG2 4.09Å; F102-F258 HydrophobicContact CB-CE1 4.18Å; F102-F258 HydrophobicContact CB-CZ 3.8Å; F102-F418 AromaticContact CZ-CE2 3.95Å; F102-F418 HydrophobicContact CZ-CE2 3.95Å; F102-L421 HydrophobicContact CD1-CD2 3.4Å; F102-L421 VanDerWaalsContact CD1-CD2 3.4Å; F102-L421 HydrophobicContact CD1-CG 3.9Å; F102-L421 HydrophobicContact CE1-CD2 3.42Å; F102-L421 VanDerWaalsContact CE1-CD2 3.42Å; F102-L421 HydrophobicContact CE1-CG 3.8Å; F102-L421 HydrophobicContact CG-CD2 4.44Å; F102-L421 HydrophobicContact CZ-CD2 4.46Å; F102-L422 HydrophobicContact CE1-CD2 4.06Å; F102-L422 HydrophobicContact CZ-CD2 3.62Å; F102-L425 HydrophobicContact CD1-CD1 3.77Å; F102-L425 HydrophobicContact CE1-CD1 4.41Å; F102-F426 AromaticContact CD1-CE2 3.95Å; F102-F426 HydrophobicContact CD1-CE2 3.95Å; F102-F426 HydrophobicContact CD1-CZ 4.28Å; F102-F426 AromaticContact CE1-CE2 3.54Å; F102-F426 HydrophobicContact CE1-CE2 3.54Å; F102-F426 HydrophobicContact CE1-CZ 4.27Å; F102-F426 AromaticContact CZ-CE2 3.87Å; F102-F426 HydrophobicContact CZ-CE2 3.87Å |
| 103 | A | 92 | Very high | 91.1 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.2 | C | C | . | . | I | π-helix | trans | -60.7 | -45.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G98 R107 V261 A270 Q271 | G98-A103 PolarHBondContact O-N 3.04Å; A103-R107 VanDerWaalsContact O-CB 3.25Å; A103-R107 WeakPolarHBondContact O-CB 3.31Å; A103-R107 PolarHBondContact O-N 2.73Å; A103-V261 HydrophobicContact CB-CG1 3.84Å; A103-V261 HydrophobicContact CB-CG2 4.3Å; A103-A270 HydrophobicContact CB-CB 4.24Å; A103-Q271 HydrophobicContact CB-CG 4.24Å |
| 104 | K | 91.1 | Very high | 90.9 | Very high | 122 Ų | 122 | 35.1 Ų | 35.1 | 53% | 0.53 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -61.2 | -57.4 | 178.8 | -179.2 | 173.7 | -177 | 178.2 | 0 | 113.5 | F102 M106 R107 S108 A267 | F102-K104 PolarHBondContact O-N 3.13Å; K104-M106 VanDerWaalsContact C-N 3.28Å; K104-M106 PolarHBondContact O-N 3.32Å; K104-R107 PolarHBondContact O-N 2.95Å; K104-S108 VanDerWaalsContact O-CB 3.28Å; K104-S108 WeakPolarHBondContact O-CB 3.16Å; K104-S108 PolarHBondContact O-N 3.17Å; K104-S108 PolarHBondContact O-OG 3.18Å; K104-S108 VanDerWaalsContact O-OG 3.05Å; K104-A267 HydrophobicContact CB-CB 4.46Å; K104-A267 HydrophobicContact CG-CB 4.1Å |
| 105 | P | 91.5 | Very high | 90.8 | Very high | 27 Ų | 27 | 35.1 Ų | 35.1 | 18% | 0.175 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.4 | -32.8 | -178.1 | 24.2 | -34.4 | 0 | 0 | 0 | 113 | F101 F102 S108 K109 | F101-P105 WeakPolarHBondContact O-CD 3.09Å; F101-P105 WeakPolarHBondContact O-CG 3.38Å; F102-P105 VanDerWaalsContact O-CD 3.26Å; F102-P105 WeakPolarHBondContact O-CD 3.48Å; F102-P105 WeakPolarHBondContact O-CG 3.3Å; P105-S108 PolarHBondContact O-OG 2.93Å; P105-K109 WeakPolarHBondContact O-CG 3.16Å |
| 106 | M | 92.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -68.6 | -47 | 177.1 | -71.1 | -70.4 | -71 | 0 | 0 | 111.2 | F102 K104 Y111 M114 P117 F258 L262 L425 | F102-M106 VanDerWaalsContact O-CB 3.26Å; F102-M106 WeakPolarHBondContact O-CB 3.38Å; F102-M106 WeakPolarHBondContact O-CG 3.47Å; F102-M106 PolarHBondContact O-N 2.88Å; F102-M106 VanDerWaalsContact O-N 3.14Å; K104-M106 VanDerWaalsContact C-N 3.28Å; K104-M106 PolarHBondContact O-N 3.32Å; M106-Y111 HydrophobicContact CE-CD2 4.1Å; M106-Y111 WeakPolarHBondContact O-CD2 3.16Å; M106-Y111 HydrophobicContact SD-CD2 3.7Å; M106-Y111 HydrophobicContact SD-CE2 3.97Å; M106-M114 HydrophobicContact CE-SD 3.59Å; M106-M114 VanDerWaalsContact CE-SD 3.59Å; M106-P117 HydrophobicContact CE-CG 4.02Å; M106-P117 HydrophobicContact SD-CG 3.89Å; M106-F258 HydrophobicContact CB-CD1 4.1Å; M106-F258 HydrophobicContact CB-CE1 3.88Å; M106-F258 HydrophobicContact CE-CD1 3.95Å; M106-F258 HydrophobicContact CE-CE1 4.16Å; M106-F258 HydrophobicContact CE-CG 4.19Å; M106-F258 HydrophobicContact CG-CD1 4.04Å; M106-F258 HydrophobicContact CG-CE1 3.49Å; M106-F258 VanDerWaalsContact CG-CE1 3.49Å; M106-F258 HydrophobicContact CG-CZ 4.05Å; M106-L262 HydrophobicContact CB-CD2 4.17Å; M106-L262 WeakPolarHBondContact O-CD2 3.19Å; M106-L425 HydrophobicContact CG-CD1 4.1Å; M106-L425 HydrophobicContact SD-CD1 3.99Å; M106-L425 HydrophobicContact SD-CD2 4.05Å |
| 107 | R | 88.8 | Confident | 90.4 | Very high | 35 Ų | 35 | 32.7 Ų | 32.7 | 13% | 0.132 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -73 | -37.8 | -178.3 | -177 | 57 | -174.8 | 83.6 | 0.3 | 113.3 | A103 K104 K109 G110 L262 S264 S265 A267 | A103-R107 VanDerWaalsContact O-CB 3.25Å; A103-R107 WeakPolarHBondContact O-CB 3.31Å; A103-R107 PolarHBondContact O-N 2.73Å; K104-R107 PolarHBondContact O-N 2.95Å; R107-K109 VanDerWaalsContact C-N 3.26Å; R107-K109 PolarHBondContact O-N 3.28Å; R107-G110 PolarHBondContact O-N 3.37Å; R107-L262 PolarHBondContact NE-O 3.05Å; R107-S264 VanDerWaalsContact CZ-O 3.22Å; R107-S264 PolarHBondContact NE-O 2.81Å; R107-S264 PolarHBondContact NH2-O 3.35Å; R107-S265 PolarHBondContact NH2-O 3.48Å; R107-A267 HydrophobicContact CB-CB 4.35Å; R107-A267 HydrophobicContact CG-CB 4.38Å |
| 108 | S | 87.5 | Confident | 90.2 | Very high | 80 Ų | 80 | 31 Ų | 31 | 56% | 0.559 | 16% | 0.162 | S | C | * | . | H | α-helix | trans | -67.6 | -27.1 | -177.6 | 65.9 | 0 | 0 | 0 | 0 | 113 | K104 P105 G110 | K104-S108 VanDerWaalsContact O-CB 3.28Å; K104-S108 WeakPolarHBondContact O-CB 3.16Å; K104-S108 PolarHBondContact O-N 3.17Å; K104-S108 PolarHBondContact O-OG 3.18Å; K104-S108 VanDerWaalsContact O-OG 3.05Å; P105-S108 PolarHBondContact O-OG 2.93Å; S108-G110 VanDerWaalsContact C-N 3.28Å |
| 109 | K | 86.5 | Confident | 90 | Very high | 107 Ų | 107 | 31.8 Ų | 31.8 | 47% | 0.465 | 17% | 0.165 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 0.3 | 176.9 | -68.8 | -176.5 | -176.8 | 177.5 | 0 | 113.6 | P105 R107 Y111 | P105-K109 WeakPolarHBondContact O-CG 3.16Å; R107-K109 VanDerWaalsContact C-N 3.26Å; R107-K109 PolarHBondContact O-N 3.28Å; K109-Y111 VanDerWaalsContact C-N 3.29Å; K109-Y111 HydrophobicContact CB-CD1 4.45Å; K109-Y111 HydrophobicContact CB-CD2 4.05Å; K109-Y111 HydrophobicContact CB-CE1 4.1Å; K109-Y111 HydrophobicContact CB-CE2 3.68Å; K109-Y111 HydrophobicContact CB-CG 4.42Å; K109-Y111 HydrophobicContact CD-CE2 3.66Å; K109-Y111 WeakPolarHBondContact CD-OH 3.09Å; K109-Y111 HydrophobicContact CG-CE2 4.29Å; K109-Y111 PolarHBondContact O-N 3.34Å |
| 110 | G | 83.1 | Confident | 89.8 | Confident | 34 Ų | 34 | 38.3 Ų | 38.3 | 35% | 0.351 | 20% | 0.196 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 69.6 | 23 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | R47 R107 S108 | R47-G110 PolarHBondContact NH2-O 3.08Å; R47-G110 VanDerWaalsContact NH2-O 3.15Å; R107-G110 PolarHBondContact O-N 3.37Å; S108-G110 VanDerWaalsContact C-N 3.28Å |
| 111 | Y | 87 | Confident | 89.5 | Confident | 10 Ų | 10 | 36 Ų | 36 | 4% | 0.039 | 18% | 0.184 | C | C | . | . | trans | -59 | 153.1 | 175.9 | -61.8 | -43.4 | 0 | 0 | 0 | 111.8 | R47 M106 K109 D116 P117 Q120 L262 | R47-Y111 PolarHBondContact NH2-O 3.22Å; M106-Y111 HydrophobicContact CE-CD2 4.1Å; M106-Y111 WeakPolarHBondContact O-CD2 3.16Å; M106-Y111 HydrophobicContact SD-CD2 3.7Å; M106-Y111 HydrophobicContact SD-CE2 3.97Å; K109-Y111 VanDerWaalsContact C-N 3.29Å; K109-Y111 HydrophobicContact CB-CD1 4.45Å; K109-Y111 HydrophobicContact CB-CD2 4.05Å; K109-Y111 HydrophobicContact CB-CE1 4.1Å; K109-Y111 HydrophobicContact CB-CE2 3.68Å; K109-Y111 HydrophobicContact CB-CG 4.42Å; K109-Y111 HydrophobicContact CD-CE2 3.66Å; K109-Y111 WeakPolarHBondContact CD-OH 3.09Å; K109-Y111 HydrophobicContact CG-CE2 4.29Å; K109-Y111 PolarHBondContact O-N 3.34Å; Y111-D116 HydrophobicContact CD1-CB 3.54Å; Y111-D116 HydrophobicContact CE1-CB 4.21Å; Y111-D116 HydrophobicContact CG-CB 4Å; Y111-P117 HydrophobicContact CD2-CB 4.49Å; Y111-P117 HydrophobicContact CD2-CG 4.41Å; Y111-P117 HydrophobicContact CE2-CB 3.8Å; Y111-P117 HydrophobicContact CE2-CG 4.19Å; Y111-Q120 PolarHBondContact OH-OE1 2.92Å; Y111-L262 WeakPolarHBondContact O-CD2 3.46Å | ||
| 112 | V | 80.2 | Confident | 89.3 | Confident | 10 Ų | 10 | 30.5 Ų | 30.5 | 6% | 0.061 | 16% | 0.16 | C | C | . | . | S | Bend | trans | -108 | -33.8 | 177.7 | 176.1 | 0 | 0 | 0 | 0 | 110.1 | I43 V44 D116 | I43-V112 HydrophobicContact CG2-CG1 3.78Å; V44-V112 HydrophobicContact CG2-CG1 3.79Å; V112-D116 PolarHBondContact N-OD2 2.99Å |
| 113 | T | 87.9 | Confident | 88.9 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -130.3 | 162.7 | 175.9 | 77.6 | 0 | 0 | 0 | 0 | 111.8 | L115 D116 R361 N362 | T113-L115 PolarHBondContact O-N 2.77Å; T113-L115 PolarHBondContact OG1-N 3.34Å; T113-D116 PolarHBondContact N-OD2 3Å; T113-D116 WeakPolarHBondContact O-CB 3.27Å; T113-D116 PolarHBondContact O-N 3.48Å; T113-D116 VanDerWaalsContact OG1-CG 3.31Å; T113-D116 PolarHBondContact OG1-N 2.89Å; T113-D116 PolarHBondContact OG1-OD1 3.33Å; T113-R361 HydrophobicContact CG2-CB 4Å; T113-R361 HydrophobicContact CG2-CG 3.86Å; T113-N362 WeakPolarHBondContact CB-OD1 3.16Å; T113-N362 WeakPolarHBondContact CG2-OD1 3.46Å; T113-N362 PolarHBondContact OG1-ND2 3.09Å; T113-N362 PolarHBondContact OG1-OD1 3.41Å |
| 114 | M | 90.3 | Very high | 88.6 | Confident | 2 Ų | 2 | 35.8 Ų | 35.8 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61 | -24.5 | 171 | -179.8 | 50 | -179.9 | 0 | 0 | 113 | M106 P117 F118 P253 Q255 F258 I417 L421 | M106-M114 HydrophobicContact CE-SD 3.59Å; M106-M114 VanDerWaalsContact CE-SD 3.59Å; M114-P117 WeakPolarHBondContact O-CD 3.42Å; M114-P117 VanDerWaalsContact O-CG 3.27Å; M114-P117 WeakPolarHBondContact O-CG 3.33Å; M114-F118 HydrophobicContact CE-CE2 4.25Å; M114-F118 HydrophobicContact CE-CZ 4.15Å; M114-F118 WeakPolarHBondContact O-CE2 3.16Å; M114-P253 HydrophobicContact CE-CB 3.41Å; M114-P253 VanDerWaalsContact CE-CB 3.41Å; M114-Q255 HydrophobicContact CB-CB 4.36Å; M114-F258 HydrophobicContact CB-CB 4.23Å; M114-F258 HydrophobicContact CB-CD2 4.22Å; M114-F258 HydrophobicContact CE-CD2 4.06Å; M114-F258 HydrophobicContact CE-CE2 3.72Å; M114-F258 HydrophobicContact CG-CD2 3.9Å; M114-F258 HydrophobicContact CG-CE2 4.46Å; M114-F258 HydrophobicContact SD-CD2 3.21Å; M114-F258 WeakPolarHBondContact SD-CD2 3.27Å; M114-F258 HydrophobicContact SD-CE2 3.33Å; M114-F258 WeakPolarHBondContact SD-CE2 3.37Å; M114-F258 HydrophobicContact SD-CG 3.94Å; M114-F258 HydrophobicContact SD-CZ 4.17Å; M114-I417 HydrophobicContact CE-CG2 4.28Å; M114-L421 HydrophobicContact CE-CB 4.16Å; M114-L421 HydrophobicContact CE-CD1 3.31Å; M114-L421 HydrophobicContact CE-CD2 3.44Å; M114-L421 VanDerWaalsContact CE-CD2 3.44Å; M114-L421 HydrophobicContact CE-CG 3.77Å; M114-L421 HydrophobicContact SD-CD1 3.96Å |
| 115 | L | 91.8 | Very high | 88.5 | Confident | 1 Ų | 1 | 39.8 Ų | 39.8 | 1% | 0.005 | 20% | 0.203 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | -16.6 | -178.2 | -64.3 | 178.5 | 0 | 0 | 0 | 114.3 | T113 F118 Q119 L130 F131 M358 N362 | T113-L115 PolarHBondContact O-N 2.77Å; T113-L115 PolarHBondContact OG1-N 3.34Å; L115-F118 HydrophobicContact CB-CD2 4.47Å; L115-F118 HydrophobicContact CD2-CD2 3.67Å; L115-F118 HydrophobicContact CD2-CE2 4.01Å; L115-F118 WeakPolarHBondContact O-CB 3.36Å; L115-F118 PolarHBondContact O-N 3.38Å; L115-F118 VanDerWaalsContact O-N 3.11Å; L115-Q119 PolarHBondContact O-N 3.47Å; L115-L130 HydrophobicContact CD2-CB 4.42Å; L115-F131 HydrophobicContact CD1-CB 3.71Å; L115-F131 HydrophobicContact CD1-CD2 3.77Å; L115-F131 HydrophobicContact CD1-CG 4.22Å; L115-M358 HydrophobicContact CD1-CB 4.16Å; L115-M358 HydrophobicContact CD1-CG 4.24Å; L115-M358 HydrophobicContact CD1-SD 3.98Å; L115-M358 HydrophobicContact CG-SD 4.13Å; L115-N362 HydrophobicContact CB-CB 4.26Å; L115-N362 HydrophobicContact CD1-CB 4.12Å |
| 116 | D | 89.3 | Confident | 88.4 | Confident | 13 Ų | 13 | 38.7 Ų | 38.7 | 7% | 0.07 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -53.2 | -48.7 | 178.4 | -65.6 | -0.9 | 0 | 0 | 0 | 113.5 | Y111 V112 T113 F118 Q119 Q120 N362 | Y111-D116 HydrophobicContact CD1-CB 3.54Å; Y111-D116 HydrophobicContact CE1-CB 4.21Å; Y111-D116 HydrophobicContact CG-CB 4Å; V112-D116 PolarHBondContact N-OD2 2.99Å; T113-D116 PolarHBondContact N-OD2 3Å; T113-D116 WeakPolarHBondContact O-CB 3.27Å; T113-D116 PolarHBondContact O-N 3.48Å; T113-D116 VanDerWaalsContact OG1-CG 3.31Å; T113-D116 PolarHBondContact OG1-N 2.89Å; T113-D116 PolarHBondContact OG1-OD1 3.33Å; D116-F118 VanDerWaalsContact C-N 3.28Å; D116-F118 PolarHBondContact O-N 2.87Å; D116-Q119 PolarHBondContact O-N 3.24Å; D116-Q120 WeakPolarHBondContact O-CB 3.23Å; D116-Q120 WeakPolarHBondContact O-CG 3.34Å; D116-Q120 PolarHBondContact O-N 2.99Å; D116-N362 PolarHBondContact OD1-ND2 2.88Å |
| 117 | P | 91.8 | Very high | 88.3 | Confident | 1 Ų | 1 | 38.7 Ų | 38.7 | 1% | 0.006 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -57.2 | -40.2 | 176.3 | 22 | -35.6 | 0 | 0 | 0 | 112.5 | M106 Y111 M114 L121 V424 L425 | M106-P117 HydrophobicContact CE-CG 4.02Å; M106-P117 HydrophobicContact SD-CG 3.89Å; Y111-P117 HydrophobicContact CD2-CB 4.49Å; Y111-P117 HydrophobicContact CD2-CG 4.41Å; Y111-P117 HydrophobicContact CE2-CB 3.8Å; Y111-P117 HydrophobicContact CE2-CG 4.19Å; M114-P117 WeakPolarHBondContact O-CD 3.42Å; M114-P117 VanDerWaalsContact O-CG 3.27Å; M114-P117 WeakPolarHBondContact O-CG 3.33Å; P117-L121 WeakPolarHBondContact O-CB 3.29Å; P117-L121 PolarHBondContact O-N 3.4Å; P117-V424 HydrophobicContact CB-CG1 3.64Å; P117-V424 WeakPolarHBondContact O-CG1 3.44Å; P117-L425 HydrophobicContact CB-CD2 4.35Å |
| 118 | F | 92.6 | Very high | 88.3 | Confident | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.9 | -44.8 | 177.1 | -54 | -57.3 | 0 | 0 | 0 | 111.9 | M114 L115 D116 Q120 L121 Y122 L130 I417 Q420 L421 V424 | M114-F118 HydrophobicContact CE-CE2 4.25Å; M114-F118 HydrophobicContact CE-CZ 4.15Å; M114-F118 WeakPolarHBondContact O-CE2 3.16Å; L115-F118 HydrophobicContact CB-CD2 4.47Å; L115-F118 HydrophobicContact CD2-CD2 3.67Å; L115-F118 HydrophobicContact CD2-CE2 4.01Å; L115-F118 WeakPolarHBondContact O-CB 3.36Å; L115-F118 PolarHBondContact O-N 3.38Å; L115-F118 VanDerWaalsContact O-N 3.11Å; D116-F118 VanDerWaalsContact C-N 3.28Å; D116-F118 PolarHBondContact O-N 2.87Å; F118-Q120 VanDerWaalsContact C-N 3.34Å; F118-Q120 PolarHBondContact O-N 3.27Å; F118-L121 PolarHBondContact O-N 2.9Å; F118-Y122 HydrophobicContact CB-CD2 4.44Å; F118-Y122 HydrophobicContact CD1-CD2 4.36Å; F118-Y122 HydrophobicContact CD1-CE2 4.22Å; F118-Y122 WeakPolarHBondContact O-CA 3.45Å; F118-Y122 WeakPolarHBondContact O-CB 3.34Å; F118-Y122 PolarHBondContact O-N 3.38Å; F118-L130 HydrophobicContact CB-CD1 3.76Å; F118-L130 HydrophobicContact CD1-CD1 3.78Å; F118-L130 HydrophobicContact CD2-CD1 4.12Å; F118-L130 HydrophobicContact CE1-CD1 4.48Å; F118-L130 HydrophobicContact CG-CD1 3.63Å; F118-I417 HydrophobicContact CE2-CG2 4.03Å; F118-I417 HydrophobicContact CZ-CG2 3.94Å; F118-Q420 HydrophobicContact CD1-CB 4.42Å; F118-Q420 HydrophobicContact CE1-CB 3.89Å; F118-L421 HydrophobicContact CE1-CB 4.28Å; F118-L421 HydrophobicContact CZ-CB 3.99Å; F118-L421 HydrophobicContact CZ-CD1 4.06Å; F118-V424 HydrophobicContact CD1-CB 4.44Å; F118-V424 HydrophobicContact CD1-CG2 3.64Å; F118-V424 HydrophobicContact CE1-CG2 4.03Å |
| 119 | Q | 89.7 | Confident | 88.5 | Confident | 15 Ų | 15 | 36.8 Ų | 36.8 | 7% | 0.07 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.4 | -35.4 | -179.3 | -76.4 | -172.2 | -38.5 | 0 | 0 | 112.7 | L115 D116 G123 N362 | L115-Q119 PolarHBondContact O-N 3.47Å; D116-Q119 PolarHBondContact O-N 3.24Å; Q119-G123 CarbonylContact O-C 3.57Å; Q119-G123 WeakPolarHBondContact O-CA 3.45Å; Q119-G123 PolarHBondContact O-N 3.27Å; Q119-G123 VanDerWaalsContact O-N 3.14Å; Q119-N362 PolarHBondContact NE2-O 3.5Å; Q119-N362 PolarHBondContact OE1-ND2 3.47Å |
| 120 | Q | 88.3 | Confident | 88.8 | Confident | 137 Ų | 137 | 31.7 Ų | 31.7 | 64% | 0.64 | 16% | 0.164 | S | C | * | . | H | α-helix | trans | -69.8 | -40.7 | 175.7 | -72.1 | -176 | 8.7 | 0 | 0 | 112.2 | Y111 D116 F118 | Y111-Q120 PolarHBondContact OH-OE1 2.92Å; D116-Q120 WeakPolarHBondContact O-CB 3.23Å; D116-Q120 WeakPolarHBondContact O-CG 3.34Å; D116-Q120 PolarHBondContact O-N 2.99Å; F118-Q120 VanDerWaalsContact C-N 3.34Å; F118-Q120 PolarHBondContact O-N 3.27Å |
| 121 | L | 88.8 | Confident | 89.3 | Confident | 38 Ų | 38 | 30.8 Ų | 30.8 | 20% | 0.199 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -86.5 | -45.6 | -175.9 | -162.7 | 74.9 | 0 | 0 | 0 | 113.8 | P117 F118 V424 T430 | P117-L121 WeakPolarHBondContact O-CB 3.29Å; P117-L121 PolarHBondContact O-N 3.4Å; F118-L121 PolarHBondContact O-N 2.9Å; L121-V424 HydrophobicContact CB-CG1 4.07Å; L121-V424 HydrophobicContact CB-CG2 4.34Å; L121-V424 HydrophobicContact CD2-CB 4.08Å; L121-V424 HydrophobicContact CD2-CG1 3.97Å; L121-V424 HydrophobicContact CD2-CG2 3.82Å; L121-T430 WeakPolarHBondContact CD2-OG1 3.38Å |
| 122 | Y | 89.9 | Confident | 89.6 | Confident | 5 Ų | 5 | 34.1 Ų | 34.1 | 2% | 0.02 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -100.9 | -6 | -173.9 | -55.8 | -34.9 | 0 | 0 | 0 | 113.5 | F118 M126 L130 C423 V424 T430 T432 A435 N491 | F118-Y122 HydrophobicContact CB-CD2 4.44Å; F118-Y122 HydrophobicContact CD1-CD2 4.36Å; F118-Y122 HydrophobicContact CD1-CE2 4.22Å; F118-Y122 WeakPolarHBondContact O-CA 3.45Å; F118-Y122 WeakPolarHBondContact O-CB 3.34Å; F118-Y122 PolarHBondContact O-N 3.38Å; Y122-M126 HydrophobicContact CD2-CG 4.17Å; Y122-M126 HydrophobicContact CG-CG 4.3Å; Y122-L130 HydrophobicContact CD2-CD1 4.35Å; Y122-C423 WeakPolarHBondContact OH-CB 3.47Å; Y122-V424 HydrophobicContact CD2-CG2 4Å; Y122-V424 HydrophobicContact CE1-CG2 4.12Å; Y122-V424 HydrophobicContact CE2-CG2 3.25Å; Y122-V424 WeakPolarHBondContact OH-CG2 3.4Å; Y122-T430 PolarHBondContact OH-OG1 3.03Å; Y122-T432 WeakPolarHBondContact CA-OG1 3.35Å; Y122-T432 VanDerWaalsContact O-CG2 3.28Å; Y122-T432 WeakPolarHBondContact O-CG2 3.27Å; Y122-T432 PolarHBondContact O-OG1 2.99Å; Y122-A435 HydrophobicContact CD1-CB 4.04Å; Y122-A435 HydrophobicContact CD2-CB 3.61Å; Y122-A435 HydrophobicContact CE1-CB 4.06Å; Y122-A435 HydrophobicContact CE2-CB 3.61Å; Y122-A435 HydrophobicContact CG-CB 3.82Å; Y122-N491 PolarHBondContact OH-ND2 3.21Å |
| 123 | G | 87.8 | Confident | 90.1 | Very high | 31 Ų | 31 | 33.7 Ų | 33.7 | 32% | 0.32 | 17% | 0.166 | S | C | . | . | trans | 86.9 | 168.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q119 R125 M126 G127 | Q119-G123 CarbonylContact O-C 3.57Å; Q119-G123 WeakPolarHBondContact O-CA 3.45Å; Q119-G123 PolarHBondContact O-N 3.27Å; Q119-G123 VanDerWaalsContact O-N 3.14Å; G123-R125 PolarHBondContact O-N 3.33Å; G123-M126 PolarHBondContact O-N 2.88Å; G123-G127 PolarHBondContact O-N 3.49Å | ||
| 124 | K | 85.9 | Confident | 90.4 | Very high | 83 Ų | 83 | 34.2 Ų | 34.2 | 36% | 0.361 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -60.6 | -40.2 | -171.4 | -59.8 | 179.5 | 177.7 | -155.2 | 0 | 113.3 | G127 G128 L366 | K124-G127 PolarHBondContact O-N 3.07Å; K124-G128 PolarHBondContact O-N 3.45Å; K124-L366 VanDerWaalsContact CD-O 3.29Å; K124-L366 WeakPolarHBondContact CD-O 3.31Å; K124-L366 WeakPolarHBondContact CE-O 3.16Å; K124-L366 PolarHBondContact NZ-O 3.1Å |
| 125 | R | 88.1 | Confident | 90.5 | Very high | 206 Ų | 206 | 35.7 Ų | 35.7 | 78% | 0.777 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -62.9 | -49.1 | -179.7 | -66.5 | -178.3 | -179 | 165.5 | 1.2 | 111.6 | G123 G128 L129 | G123-R125 PolarHBondContact O-N 3.33Å; R125-G128 PolarHBondContact O-N 2.86Å; R125-L129 PolarHBondContact O-N 3.44Å |
| 126 | M | 90.1 | Very high | 90.4 | Very high | 4 Ų | 4 | 39.2 Ų | 39.2 | 2% | 0.02 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -68.8 | -39.3 | 179.5 | -172.3 | 64.8 | -160.3 | 0 | 0 | 111.8 | Y122 G123 G128 L129 L130 T432 A435 I436 Y439 | Y122-M126 HydrophobicContact CD2-CG 4.17Å; Y122-M126 HydrophobicContact CG-CG 4.3Å; G123-M126 PolarHBondContact O-N 2.88Å; M126-G128 VanDerWaalsContact C-N 3.27Å; M126-G128 PolarHBondContact O-N 2.91Å; M126-L129 HydrophobicContact CE-CD2 4.05Å; M126-L129 WeakPolarHBondContact O-CB 3.46Å; M126-L129 PolarHBondContact O-N 2.88Å; M126-L129 VanDerWaalsContact O-N 3.11Å; M126-L129 HydrophobicContact SD-CB 4.4Å; M126-L129 HydrophobicContact SD-CD2 3.88Å; M126-L130 HydrophobicContact CE-CD1 4.11Å; M126-L130 HydrophobicContact CE-CD2 3.91Å; M126-L130 HydrophobicContact CE-CG 3.82Å; M126-L130 HydrophobicContact CG-CD1 4.22Å; M126-L130 WeakPolarHBondContact O-CG 3.44Å; M126-L130 PolarHBondContact O-N 3.22Å; M126-T432 HydrophobicContact CB-CG2 3.94Å; M126-T432 HydrophobicContact CG-CG2 4.43Å; M126-A435 HydrophobicContact CE-CB 3.94Å; M126-A435 WeakPolarHBondContact CE-O 3.1Å; M126-A435 HydrophobicContact CG-CB 4.03Å; M126-A435 HydrophobicContact SD-CB 4.23Å; M126-I436 HydrophobicContact CE-CG1 4.49Å; M126-I436 HydrophobicContact SD-CG1 3.5Å; M126-I436 VanDerWaalsContact SD-CG1 3.5Å; M126-Y439 HydrophobicContact CE-CD2 4.21Å; M126-Y439 HydrophobicContact CE-CG 4.38Å |
| 127 | G | 88.2 | Confident | 90.4 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.1 | -34.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | G123 K124 L130 F131 | G123-G127 PolarHBondContact O-N 3.49Å; K124-G127 PolarHBondContact O-N 3.07Å; G127-L130 PolarHBondContact O-N 3.38Å; G127-F131 PolarHBondContact O-N 3.21Å |
| 128 | G | 89.6 | Confident | 90.4 | Very high | 19 Ų | 19 | 38.7 Ų | 38.7 | 20% | 0.196 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.6 | -35.4 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | K124 R125 M126 F131 | K124-G128 PolarHBondContact O-N 3.45Å; R125-G128 PolarHBondContact O-N 2.86Å; M126-G128 VanDerWaalsContact C-N 3.27Å; M126-G128 PolarHBondContact O-N 2.91Å; G128-F131 WeakPolarHBondContact O-CB 3.45Å; G128-F131 PolarHBondContact O-N 2.85Å |
| 129 | L | 92.2 | Very high | 90.2 | Very high | 57 Ų | 57 | 39.2 Ų | 39.2 | 30% | 0.298 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -66.9 | -42.8 | 173.1 | -174.1 | 66.4 | 0 | 0 | 0 | 111.5 | R125 M126 F131 I132 P133 Y439 | R125-L129 PolarHBondContact O-N 3.44Å; M126-L129 HydrophobicContact CE-CD2 4.05Å; M126-L129 WeakPolarHBondContact O-CB 3.46Å; M126-L129 PolarHBondContact O-N 2.88Å; M126-L129 VanDerWaalsContact O-N 3.11Å; M126-L129 HydrophobicContact SD-CB 4.4Å; M126-L129 HydrophobicContact SD-CD2 3.88Å; L129-F131 VanDerWaalsContact C-N 3.26Å; L129-F131 PolarHBondContact O-N 3.34Å; L129-I132 HydrophobicContact CD1-CD1 4.26Å; L129-I132 WeakPolarHBondContact O-CB 3.35Å; L129-I132 PolarHBondContact O-N 3.18Å; L129-P133 VanDerWaalsContact O-CD 3.26Å; L129-P133 WeakPolarHBondContact O-CD 3.48Å; L129-Y439 HydrophobicContact CD1-CE1 4.37Å; L129-Y439 HydrophobicContact CD2-CD1 4.14Å; L129-Y439 HydrophobicContact CD2-CD2 4.22Å; L129-Y439 HydrophobicContact CD2-CE1 4.27Å; L129-Y439 HydrophobicContact CD2-CE2 4.32Å; L129-Y439 HydrophobicContact CD2-CG 4.16Å; L129-Y439 HydrophobicContact CG-CD2 4.25Å; L129-Y439 HydrophobicContact CG-CE1 4.33Å; L129-Y439 HydrophobicContact CG-CE2 3.91Å |
| 130 | L | 93.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -70.3 | -20.6 | 177.5 | -68.6 | 168.9 | 0 | 0 | 0 | 113.1 | L115 F118 Y122 M126 G127 I132 P133 A134 I416 I417 Q420 Y439 | L115-L130 HydrophobicContact CD2-CB 4.42Å; F118-L130 HydrophobicContact CB-CD1 3.76Å; F118-L130 HydrophobicContact CD1-CD1 3.78Å; F118-L130 HydrophobicContact CD2-CD1 4.12Å; F118-L130 HydrophobicContact CE1-CD1 4.48Å; F118-L130 HydrophobicContact CG-CD1 3.63Å; Y122-L130 HydrophobicContact CD2-CD1 4.35Å; M126-L130 HydrophobicContact CE-CD1 4.11Å; M126-L130 HydrophobicContact CE-CD2 3.91Å; M126-L130 HydrophobicContact CE-CG 3.82Å; M126-L130 HydrophobicContact CG-CD1 4.22Å; M126-L130 WeakPolarHBondContact O-CG 3.44Å; M126-L130 PolarHBondContact O-N 3.22Å; G127-L130 PolarHBondContact O-N 3.38Å; L130-I132 VanDerWaalsContact C-N 3.25Å; L130-I132 PolarHBondContact O-N 3.37Å; L130-P133 WeakPolarHBondContact O-CD 3.31Å; L130-P133 WeakPolarHBondContact O-CG 3.31Å; L130-A134 PolarHBondContact O-N 3.28Å; L130-I416 HydrophobicContact CD2-CG2 4.02Å; L130-I417 HydrophobicContact CB-CD1 4.07Å; L130-I417 HydrophobicContact CD2-CD1 3.81Å; L130-I417 WeakPolarHBondContact O-CD1 3.32Å; L130-Q420 HydrophobicContact CD2-CG 4.09Å; L130-Y439 HydrophobicContact CD2-CD2 3.94Å; L130-Y439 HydrophobicContact CD2-CE2 4.45Å |
| 131 | F | 93.2 | Very high | 90.1 | Very high | 14 Ų | 14 | 33.9 Ų | 33.9 | 6% | 0.061 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63 | -31.8 | 170.7 | 169.5 | -105.7 | 0 | 0 | 0 | 112.6 | L115 G127 G128 L129 A134 L135 M358 F359 I363 | L115-F131 HydrophobicContact CD1-CB 3.71Å; L115-F131 HydrophobicContact CD1-CD2 3.77Å; L115-F131 HydrophobicContact CD1-CG 4.22Å; G127-F131 PolarHBondContact O-N 3.21Å; G128-F131 WeakPolarHBondContact O-CB 3.45Å; G128-F131 PolarHBondContact O-N 2.85Å; L129-F131 VanDerWaalsContact C-N 3.26Å; L129-F131 PolarHBondContact O-N 3.34Å; F131-A134 PolarHBondContact O-N 3.15Å; F131-L135 HydrophobicContact CD2-CB 4.49Å; F131-L135 HydrophobicContact CE1-CB 4.11Å; F131-L135 HydrophobicContact CE1-CD2 3.74Å; F131-L135 HydrophobicContact CE1-CG 4.42Å; F131-L135 HydrophobicContact CE2-CB 4.04Å; F131-L135 HydrophobicContact CE2-CD1 4.48Å; F131-L135 HydrophobicContact CZ-CB 3.83Å; F131-L135 HydrophobicContact CZ-CD1 4.03Å; F131-L135 HydrophobicContact CZ-CD2 3.75Å; F131-L135 HydrophobicContact CZ-CG 4.07Å; F131-L135 VanDerWaalsContact O-CB 3.29Å; F131-L135 WeakPolarHBondContact O-CB 3.36Å; F131-L135 PolarHBondContact O-N 3.29Å; F131-M358 HydrophobicContact CD2-CB 3.84Å; F131-M358 HydrophobicContact CE2-CB 3.69Å; F131-F359 AromaticContact CE1-CD2 3.81Å; F131-F359 HydrophobicContact CE1-CD2 3.81Å; F131-F359 HydrophobicContact CE2-CB 4.18Å; F131-F359 HydrophobicContact CZ-CB 3.81Å; F131-F359 AromaticContact CZ-CD2 3.73Å; F131-F359 HydrophobicContact CZ-CD2 3.73Å; F131-F359 HydrophobicContact CZ-CG 4.28Å; F131-I363 HydrophobicContact CB-CD1 3.71Å; F131-I363 HydrophobicContact CB-CG1 4.25Å; F131-I363 HydrophobicContact CD1-CD1 3.75Å; F131-I363 HydrophobicContact CD1-CG1 3.56Å; F131-I363 HydrophobicContact CD2-CG1 4.13Å; F131-I363 HydrophobicContact CE1-CG1 3.87Å; F131-I363 HydrophobicContact CE2-CG1 4.41Å; F131-I363 HydrophobicContact CG-CD1 3.73Å; F131-I363 HydrophobicContact CG-CG1 3.7Å; F131-I363 HydrophobicContact CZ-CG1 4.29Å |
| 132 | I | 92.5 | Very high | 90.1 | Very high | 80 Ų | 80 | 32.1 Ų | 32.1 | 41% | 0.41 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -60.3 | -57.6 | -177.2 | -59.1 | 175.3 | 0 | 0 | 0 | 111.8 | L129 L130 A134 L135 M136 | L129-I132 HydrophobicContact CD1-CD1 4.26Å; L129-I132 WeakPolarHBondContact O-CB 3.35Å; L129-I132 PolarHBondContact O-N 3.18Å; L130-I132 VanDerWaalsContact C-N 3.25Å; L130-I132 PolarHBondContact O-N 3.37Å; I132-A134 VanDerWaalsContact C-N 3.28Å; I132-A134 PolarHBondContact O-N 3.43Å; I132-L135 PolarHBondContact O-N 3.32Å; I132-M136 HydrophobicContact CG2-SD 4.13Å; I132-M136 WeakPolarHBondContact O-CG 3.41Å; I132-M136 PolarHBondContact O-N 3.42Å |
| 133 | P | 92.2 | Very high | 90 | Very high | 2 Ų | 2 | 31.9 Ų | 31.9 | 1% | 0.013 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.4 | -31.6 | 177.3 | 23.6 | -33.3 | 0 | 0 | 0 | 113 | L129 L130 M136 G137 L412 I416 I417 Y439 | L129-P133 VanDerWaalsContact O-CD 3.26Å; L129-P133 WeakPolarHBondContact O-CD 3.48Å; L130-P133 WeakPolarHBondContact O-CD 3.31Å; L130-P133 WeakPolarHBondContact O-CG 3.31Å; P133-M136 PolarHBondContact O-N 2.87Å; P133-G137 PolarHBondContact O-N 3.48Å; P133-L412 HydrophobicContact CB-CB 3.99Å; P133-I416 HydrophobicContact CB-CD1 4.38Å; P133-I416 HydrophobicContact CG-CB 4.49Å; P133-I416 HydrophobicContact CG-CG2 4.09Å; P133-I417 HydrophobicContact CB-CD1 4.36Å; P133-I417 HydrophobicContact CG-CD1 3.65Å; P133-I417 HydrophobicContact CG-CG1 4.3Å; P133-Y439 HydrophobicContact CG-CE2 4.03Å |
| 134 | A | 92.6 | Very high | 89.9 | Confident | 11 Ų | 11 | 30.4 Ų | 30.4 | 9% | 0.091 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.3 | -43.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L130 F131 I132 G137 E138 M358 | L130-A134 PolarHBondContact O-N 3.28Å; F131-A134 PolarHBondContact O-N 3.15Å; I132-A134 VanDerWaalsContact C-N 3.28Å; I132-A134 PolarHBondContact O-N 3.43Å; A134-G137 PolarHBondContact O-N 2.71Å; A134-E138 PolarHBondContact O-N 2.76Å; A134-M358 HydrophobicContact CB-CE 4.26Å; A134-M358 HydrophobicContact CB-SD 4.17Å |
| 135 | L | 92.9 | Very high | 89.9 | Confident | 33 Ų | 33 | 26.4 Ų | 26.4 | 17% | 0.173 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -64 | -45.2 | 174.9 | 176.2 | 65.3 | 0 | 0 | 0 | 111 | F131 I132 G137 E138 M139 A355 F388 | F131-L135 HydrophobicContact CD2-CB 4.49Å; F131-L135 HydrophobicContact CE1-CB 4.11Å; F131-L135 HydrophobicContact CE1-CD2 3.74Å; F131-L135 HydrophobicContact CE1-CG 4.42Å; F131-L135 HydrophobicContact CE2-CB 4.04Å; F131-L135 HydrophobicContact CE2-CD1 4.48Å; F131-L135 HydrophobicContact CZ-CB 3.83Å; F131-L135 HydrophobicContact CZ-CD1 4.03Å; F131-L135 HydrophobicContact CZ-CD2 3.75Å; F131-L135 HydrophobicContact CZ-CG 4.07Å; F131-L135 VanDerWaalsContact O-CB 3.29Å; F131-L135 WeakPolarHBondContact O-CB 3.36Å; F131-L135 PolarHBondContact O-N 3.29Å; I132-L135 PolarHBondContact O-N 3.32Å; L135-G137 VanDerWaalsContact C-N 3.29Å; L135-G137 PolarHBondContact O-N 2.83Å; L135-E138 PolarHBondContact O-N 3.5Å; L135-M139 HydrophobicContact CD1-CE 4.36Å; L135-M139 HydrophobicContact CD1-CG 4.08Å; L135-M139 HydrophobicContact CD1-SD 4.5Å; L135-M139 HydrophobicContact CG-CG 4.25Å; L135-M139 WeakPolarHBondContact O-CG 3.5Å; L135-M139 PolarHBondContact O-N 2.95Å; L135-A355 HydrophobicContact CD1-CB 3.74Å; L135-F388 HydrophobicContact CD1-CD1 4.26Å; L135-F388 HydrophobicContact CD1-CD2 4.23Å; L135-F388 HydrophobicContact CD1-CE1 3.94Å; L135-F388 HydrophobicContact CD1-CE2 3.88Å; L135-F388 HydrophobicContact CD1-CG 4.42Å; L135-F388 HydrophobicContact CD1-CZ 3.74Å; L135-F388 HydrophobicContact CD2-CE1 4.1Å; L135-F388 HydrophobicContact CD2-CZ 4.18Å |
| 136 | M | 90.2 | Very high | 89.8 | Confident | 75 Ų | 75 | 16.6 Ų | 16.6 | 37% | 0.369 | 9% | 0.089 | S | C | . | . | H | α-helix | trans | -59.4 | -42.1 | 178.1 | -72 | 179.6 | 71.3 | 0 | 0 | 111.5 | I132 P133 M139 F140 L412 | I132-M136 HydrophobicContact CG2-SD 4.13Å; I132-M136 WeakPolarHBondContact O-CG 3.41Å; I132-M136 PolarHBondContact O-N 3.42Å; P133-M136 PolarHBondContact O-N 2.87Å; M136-M139 PolarHBondContact O-N 3.37Å; M136-F140 HydrophobicContact CB-CD2 4.43Å; M136-F140 HydrophobicContact CB-CE2 4.09Å; M136-F140 HydrophobicContact CE-CE2 3.86Å; M136-F140 HydrophobicContact CE-CZ 3.71Å; M136-F140 WeakPolarHBondContact O-CB 3.45Å; M136-F140 WeakPolarHBondContact O-CD2 3.3Å; M136-F140 VanDerWaalsContact O-CG 3.27Å; M136-F140 WeakPolarHBondContact O-CG 3.46Å; M136-F140 PolarHBondContact O-N 2.97Å; M136-L412 HydrophobicContact CB-CD1 4.11Å; M136-L412 HydrophobicContact CE-CD1 3.68Å; M136-L412 HydrophobicContact SD-CD1 3.77Å |
| 137 | G | 89.9 | Confident | 89.5 | Confident | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.8 | -47.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | P133 A134 L135 M139 F140 W141 S409 | P133-G137 PolarHBondContact O-N 3.48Å; A134-G137 PolarHBondContact O-N 2.71Å; L135-G137 VanDerWaalsContact C-N 3.29Å; L135-G137 PolarHBondContact O-N 2.83Å; G137-M139 PolarHBondContact O-N 3.47Å; G137-F140 PolarHBondContact O-N 3.06Å; G137-W141 WeakPolarHBondContact O-CB 3.29Å; G137-W141 PolarHBondContact O-N 2.71Å; G137-S409 VanDerWaalsContact CA-O 3.32Å; G137-S409 WeakPolarHBondContact CA-O 3.09Å; G137-S409 VanDerWaalsContact O-CB 3.31Å; G137-S409 WeakPolarHBondContact O-CB 3.32Å |
| 138 | E | 90.1 | Very high | 89.2 | Confident | 2 Ų | 2 | 17.5 Ų | 17.5 | 1% | 0.009 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.3 | -39.5 | 175.5 | -64.6 | -68.8 | -174.6 | 0 | 0 | 112.2 | A134 L135 W141 A142 W254 S351 S354 A355 M358 | A134-E138 PolarHBondContact O-N 2.76Å; L135-E138 PolarHBondContact O-N 3.5Å; E138-W141 PolarHBondContact O-N 3.05Å; E138-A142 VanDerWaalsContact O-CB 3.28Å; E138-A142 WeakPolarHBondContact O-CB 3.26Å; E138-A142 PolarHBondContact O-N 2.88Å; E138-W254 VanDerWaalsContact CD-NE1 3.28Å; E138-W254 VanDerWaalsContact OE1-CD1 3.31Å; E138-W254 PolarHBondContact OE1-NE1 3.37Å; E138-W254 VanDerWaalsContact OE1-NE1 3.07Å; E138-W254 PolarHBondContact OE2-NE1 3.49Å; E138-W254 VanDerWaalsContact OE2-NE1 3.11Å; E138-S351 PolarHBondContact O-OG 2.82Å; E138-S351 WeakPolarHBondContact OE2-CA 3.4Å; E138-S351 WeakPolarHBondContact OE2-CB 3.27Å; E138-S351 PolarHBondContact OE2-OG 2.92Å; E138-S354 VanDerWaalsContact CD-OG 3.25Å; E138-S354 WeakPolarHBondContact OE1-CB 3.46Å; E138-S354 PolarHBondContact OE1-OG 3.21Å; E138-A355 HydrophobicContact CB-CB 3.97Å; E138-A355 HydrophobicContact CG-CB 4.37Å; E138-M358 HydrophobicContact CG-CE 4Å |
| 139 | M | 89.5 | Confident | 88.9 | Confident | 11 Ų | 11 | 16.6 Ų | 16.6 | 5% | 0.054 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -69 | -40.8 | 179 | -66.5 | -57.3 | 88.3 | 0 | 0 | 113.1 | L135 M136 G137 W141 A143 A355 F388 A392 M395 | L135-M139 HydrophobicContact CD1-CE 4.36Å; L135-M139 HydrophobicContact CD1-CG 4.08Å; L135-M139 HydrophobicContact CD1-SD 4.5Å; L135-M139 HydrophobicContact CG-CG 4.25Å; L135-M139 WeakPolarHBondContact O-CG 3.5Å; L135-M139 PolarHBondContact O-N 2.95Å; M136-M139 PolarHBondContact O-N 3.37Å; G137-M139 PolarHBondContact O-N 3.47Å; M139-W141 VanDerWaalsContact C-N 3.32Å; M139-A143 VanDerWaalsContact O-CB 3.23Å; M139-A143 WeakPolarHBondContact O-CB 3.32Å; M139-A143 PolarHBondContact O-N 2.96Å; M139-A355 HydrophobicContact CE-CB 3.7Å; M139-F388 HydrophobicContact CE-CB 3.84Å; M139-F388 HydrophobicContact CE-CG 4.3Å; M139-F388 HydrophobicContact SD-CB 3.69Å; M139-F388 HydrophobicContact SD-CD1 4.25Å; M139-F388 HydrophobicContact SD-CG 4.11Å; M139-A392 HydrophobicContact SD-CB 4.41Å; M139-M395 HydrophobicContact CB-CE 4.13Å; M139-M395 HydrophobicContact CB-SD 4.07Å |
| 140 | F | 88.1 | Confident | 88.5 | Confident | 29 Ų | 29 | 13.9 Ų | 13.9 | 13% | 0.127 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -64.5 | -39.8 | 174.6 | -68.8 | -37.6 | 0 | 0 | 0 | 111.4 | M136 G137 A143 A144 M395 L405 L408 | M136-F140 HydrophobicContact CB-CD2 4.43Å; M136-F140 HydrophobicContact CB-CE2 4.09Å; M136-F140 HydrophobicContact CE-CE2 3.86Å; M136-F140 HydrophobicContact CE-CZ 3.71Å; M136-F140 WeakPolarHBondContact O-CB 3.45Å; M136-F140 WeakPolarHBondContact O-CD2 3.3Å; M136-F140 VanDerWaalsContact O-CG 3.27Å; M136-F140 WeakPolarHBondContact O-CG 3.46Å; M136-F140 PolarHBondContact O-N 2.97Å; G137-F140 PolarHBondContact O-N 3.06Å; F140-A143 PolarHBondContact O-N 3.35Å; F140-A144 PolarHBondContact O-N 3.33Å; F140-M395 HydrophobicContact CD1-CE 3.13Å; F140-M395 HydrophobicContact CE1-CE 3.38Å; F140-M395 HydrophobicContact CG-CE 4.22Å; F140-L405 WeakPolarHBondContact CB-O 3.46Å; F140-L405 HydrophobicContact CD1-CD2 3.99Å; F140-L408 HydrophobicContact CD2-CB 4Å; F140-L408 HydrophobicContact CE2-CB 4.32Å; F140-L408 HydrophobicContact CG-CB 4.29Å |
| 141 | W | 87 | Confident | 87.9 | Confident | 12 Ų | 12 | 14 Ų | 14 | 5% | 0.045 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -66.6 | -49.8 | 176.4 | -177.5 | -131.6 | 0 | 0 | 0 | 112.2 | G137 E138 M139 A143 A144 I145 W254 W406 | G137-W141 WeakPolarHBondContact O-CB 3.29Å; G137-W141 PolarHBondContact O-N 2.71Å; E138-W141 PolarHBondContact O-N 3.05Å; M139-W141 VanDerWaalsContact C-N 3.32Å; W141-A143 VanDerWaalsContact C-N 3.27Å; W141-A143 PolarHBondContact O-N 2.94Å; W141-A144 HydrophobicContact CE3-CB 4.42Å; W141-A144 WeakPolarHBondContact O-CB 3.5Å; W141-A144 PolarHBondContact O-N 2.88Å; W141-A144 VanDerWaalsContact O-N 3.17Å; W141-I145 HydrophobicContact CD2-CD1 3.67Å; W141-I145 HydrophobicContact CD2-CG1 4.1Å; W141-I145 VanDerWaalsContact CE2-CD1 3.47Å; W141-I145 HydrophobicContact CE3-CD1 4.32Å; W141-I145 HydrophobicContact CE3-CG1 4.25Å; W141-I145 HydrophobicContact CG-CD1 3.83Å; W141-I145 HydrophobicContact CZ2-CD1 4.06Å; W141-I145 HydrophobicContact CZ2-CG1 4.39Å; W141-I145 HydrophobicContact CZ3-CG1 4.46Å; W141-I145 WeakPolarHBondContact O-CB 3.45Å; W141-I145 WeakPolarHBondContact O-CD1 3.28Å; W141-I145 VanDerWaalsContact O-CG1 3.24Å; W141-I145 WeakPolarHBondContact O-CG1 3.44Å; W141-I145 PolarHBondContact O-N 3.37Å; W141-W254 HydrophobicContact CB-CH2 4.36Å; W141-W254 HydrophobicContact CB-CZ2 3.82Å; W141-W254 HydrophobicContact CG-CZ2 4.01Å; W141-W406 HydrophobicContact CE3-CB 4.4Å; W141-W406 AromaticContact CE3-CD1 3.14Å; W141-W406 HydrophobicContact CE3-CG 4.01Å; W141-W406 AromaticContact CE3-NE1 3.71Å; W141-W406 AromaticContact CH2-CD1 3.87Å; W141-W406 AromaticContact CH2-NE1 3.58Å; W141-W406 HydrophobicContact CZ3-CB 4.28Å; W141-W406 AromaticContact CZ3-CD1 2.92Å; W141-W406 HydrophobicContact CZ3-CD2 4.41Å; W141-W406 AromaticContact CZ3-CG 3.64Å; W141-W406 HydrophobicContact CZ3-CG 3.64Å; W141-W406 AromaticContact CZ3-NE1 3.11Å |
| 142 | A | 89.1 | Confident | 87.3 | Confident | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -57.9 | -39 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | E138 I145 F146 I352 A392 | E138-A142 VanDerWaalsContact O-CB 3.28Å; E138-A142 WeakPolarHBondContact O-CB 3.26Å; E138-A142 PolarHBondContact O-N 2.88Å; A142-I145 PolarHBondContact O-N 2.92Å; A142-F146 WeakPolarHBondContact O-CG 3.45Å; A142-F146 PolarHBondContact O-N 3.41Å; A142-I352 HydrophobicContact CB-CG1 4.26Å; A142-A392 HydrophobicContact CB-CB 3.71Å |
| 143 | A | 88.1 | Confident | 86.8 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -65.4 | -44.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | M139 F140 W141 I145 F146 S147 A392 M395 A396 L405 | M139-A143 VanDerWaalsContact O-CB 3.23Å; M139-A143 WeakPolarHBondContact O-CB 3.32Å; M139-A143 PolarHBondContact O-N 2.96Å; F140-A143 PolarHBondContact O-N 3.35Å; W141-A143 VanDerWaalsContact C-N 3.27Å; W141-A143 PolarHBondContact O-N 2.94Å; A143-I145 VanDerWaalsContact C-N 3.3Å; A143-I145 PolarHBondContact O-N 3.11Å; A143-F146 PolarHBondContact O-N 3.25Å; A143-S147 PolarHBondContact O-N 2.9Å; A143-A392 WeakPolarHBondContact CB-O 3.49Å; A143-M395 HydrophobicContact CB-CB 3.73Å; A143-M395 HydrophobicContact CB-CE 4.49Å; A143-A396 HydrophobicContact CB-CB 4.3Å; A143-A396 VanDerWaalsContact O-CB 3.3Å; A143-A396 WeakPolarHBondContact O-CB 3.29Å; A143-L405 HydrophobicContact CB-CD1 3.77Å |
| 144 | A | 84.3 | Confident | 86.4 | Confident | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -59.3 | -44.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111 | F140 W141 S147 A148 V402 L405 W406 | F140-A144 PolarHBondContact O-N 3.33Å; W141-A144 HydrophobicContact CE3-CB 4.42Å; W141-A144 WeakPolarHBondContact O-CB 3.5Å; W141-A144 PolarHBondContact O-N 2.88Å; W141-A144 VanDerWaalsContact O-N 3.17Å; A144-S147 PolarHBondContact O-N 3.24Å; A144-A148 WeakPolarHBondContact O-CB 3.42Å; A144-A148 PolarHBondContact O-N 3.18Å; A144-V402 HydrophobicContact CB-CG1 4.04Å; A144-V402 WeakPolarHBondContact O-CG1 3.26Å; A144-L405 HydrophobicContact CB-CB 3.94Å; A144-W406 HydrophobicContact CB-CB 4.14Å |
| 145 | I | 85.9 | Confident | 85.7 | Confident | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -61.3 | -48.7 | 177.3 | -70.7 | 165.8 | 0 | 0 | 0 | 111.3 | W141 A142 A143 S147 A148 L149 V344 S347 A348 | W141-I145 HydrophobicContact CD2-CD1 3.67Å; W141-I145 HydrophobicContact CD2-CG1 4.1Å; W141-I145 VanDerWaalsContact CE2-CD1 3.47Å; W141-I145 HydrophobicContact CE3-CD1 4.32Å; W141-I145 HydrophobicContact CE3-CG1 4.25Å; W141-I145 HydrophobicContact CG-CD1 3.83Å; W141-I145 HydrophobicContact CZ2-CD1 4.06Å; W141-I145 HydrophobicContact CZ2-CG1 4.39Å; W141-I145 HydrophobicContact CZ3-CG1 4.46Å; W141-I145 WeakPolarHBondContact O-CB 3.45Å; W141-I145 WeakPolarHBondContact O-CD1 3.28Å; W141-I145 VanDerWaalsContact O-CG1 3.24Å; W141-I145 WeakPolarHBondContact O-CG1 3.44Å; W141-I145 PolarHBondContact O-N 3.37Å; A142-I145 PolarHBondContact O-N 2.92Å; A143-I145 VanDerWaalsContact C-N 3.3Å; A143-I145 PolarHBondContact O-N 3.11Å; I145-S147 VanDerWaalsContact C-N 3.29Å; I145-S147 PolarHBondContact O-N 3.46Å; I145-A148 PolarHBondContact O-N 2.75Å; I145-L149 WeakPolarHBondContact O-CB 3.34Å; I145-L149 PolarHBondContact O-N 2.64Å; I145-V344 HydrophobicContact CB-CG1 4.19Å; I145-V344 HydrophobicContact CG2-CB 4.38Å; I145-V344 HydrophobicContact CG2-CG1 3.3Å; I145-V344 WeakPolarHBondContact CG2-O 3.18Å; I145-V344 WeakPolarHBondContact O-CG1 3.37Å; I145-S347 VanDerWaalsContact CD1-CB 3.45Å; I145-A348 HydrophobicContact CG2-CB 3.68Å |
| 146 | F | 87.6 | Confident | 84.9 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -62.6 | -36.5 | 178.5 | -73.1 | -27.6 | 0 | 0 | 0 | 113.2 | A142 A143 L149 G150 V165 A169 A172 A348 I352 A392 A396 | A142-F146 WeakPolarHBondContact O-CG 3.45Å; A142-F146 PolarHBondContact O-N 3.41Å; A143-F146 PolarHBondContact O-N 3.25Å; F146-L149 PolarHBondContact O-N 3.28Å; F146-G150 PolarHBondContact O-N 2.92Å; F146-V165 HydrophobicContact CB-CG1 4.31Å; F146-A169 HydrophobicContact CD1-CB 3.95Å; F146-A169 HydrophobicContact CD2-CB 3.78Å; F146-A169 HydrophobicContact CE1-CB 3.9Å; F146-A169 HydrophobicContact CE2-CB 3.71Å; F146-A169 HydrophobicContact CG-CB 3.89Å; F146-A169 HydrophobicContact CZ-CB 3.75Å; F146-A172 HydrophobicContact CE1-CB 3.74Å; F146-A172 HydrophobicContact CZ-CB 4.34Å; F146-A348 HydrophobicContact CD1-CB 4.13Å; F146-A348 HydrophobicContact CE1-CB 3.55Å; F146-A348 HydrophobicContact CZ-CB 4.24Å; F146-I352 HydrophobicContact CE1-CD1 4.5Å; F146-I352 HydrophobicContact CE2-CD1 4.01Å; F146-I352 HydrophobicContact CZ-CD1 3.52Å; F146-A392 HydrophobicContact CD2-CB 4.08Å; F146-A392 HydrophobicContact CE2-CB 3.97Å; F146-A396 HydrophobicContact CB-CB 4Å |
| 147 | S | 83.9 | Confident | 84.3 | Confident | 19 Ų | 19 | 6.7 Ų | 6.7 | 13% | 0.133 | 4% | 0.038 | C | C | . | . | H | α-helix | trans | -66.1 | -45.9 | 174.5 | -171.4 | 0 | 0 | 0 | 0 | 111.7 | A143 A144 I145 L149 G150 A151 V402 | A143-S147 PolarHBondContact O-N 2.9Å; A144-S147 PolarHBondContact O-N 3.24Å; I145-S147 VanDerWaalsContact C-N 3.29Å; I145-S147 PolarHBondContact O-N 3.46Å; S147-L149 VanDerWaalsContact C-N 3.32Å; S147-L149 PolarHBondContact O-N 3.34Å; S147-G150 PolarHBondContact O-N 2.98Å; S147-A151 PolarHBondContact O-N 3.49Å; S147-V402 VanDerWaalsContact OG-CG2 3.29Å; S147-V402 WeakPolarHBondContact OG-CG2 3.35Å |
| 148 | A | 81.3 | Confident | 83.7 | Confident | 3 Ų | 3 | 10.7 Ų | 10.7 | 3% | 0.025 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -60.8 | -37.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A144 I145 A151 T152 V344 V402 | A144-A148 WeakPolarHBondContact O-CB 3.42Å; A144-A148 PolarHBondContact O-N 3.18Å; I145-A148 PolarHBondContact O-N 2.75Å; A148-A151 PolarHBondContact O-N 3.28Å; A148-T152 PolarHBondContact O-N 3.07Å; A148-T152 VanDerWaalsContact O-N 3.09Å; A148-T152 PolarHBondContact O-OG1 2.69Å; A148-V344 HydrophobicContact CB-CG1 4.36Å; A148-V402 HydrophobicContact CB-CG1 4.25Å |
| 149 | L | 83.6 | Confident | 83.4 | Confident | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -67.7 | -44.7 | 175.8 | -171 | 45.4 | 0 | 0 | 0 | 110.9 | I145 F146 S147 A151 T152 I153 S168 V344 M345 | I145-L149 WeakPolarHBondContact O-CB 3.34Å; I145-L149 PolarHBondContact O-N 2.64Å; F146-L149 PolarHBondContact O-N 3.28Å; S147-L149 VanDerWaalsContact C-N 3.32Å; S147-L149 PolarHBondContact O-N 3.34Å; L149-A151 VanDerWaalsContact C-N 3.28Å; L149-A151 PolarHBondContact O-N 3.22Å; L149-T152 PolarHBondContact O-N 3.32Å; L149-I153 HydrophobicContact CD1-CD1 4.44Å; L149-I153 HydrophobicContact CD1-CG1 4.44Å; L149-I153 WeakPolarHBondContact O-CG1 3.12Å; L149-I153 PolarHBondContact O-N 3.39Å; L149-S168 WeakPolarHBondContact CG-OG 3.42Å; L149-V344 HydrophobicContact CB-CB 4.06Å; L149-V344 HydrophobicContact CB-CG1 3.57Å; L149-V344 HydrophobicContact CD1-CB 4.04Å; L149-V344 HydrophobicContact CD1-CG2 4.41Å; L149-V344 HydrophobicContact CD2-CB 4.45Å; L149-V344 HydrophobicContact CD2-CG1 4.47Å; L149-V344 HydrophobicContact CG-CB 4.39Å; L149-V344 HydrophobicContact CG-CG1 4.38Å; L149-M345 HydrophobicContact CD2-CG 3.69Å |
| 150 | G | 84.3 | Confident | 83.2 | Confident | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -56.5 | -44.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F146 S147 T152 I153 S154 I161 S164 | F146-G150 PolarHBondContact O-N 2.92Å; S147-G150 PolarHBondContact O-N 2.98Å; G150-T152 PolarHBondContact O-N 2.98Å; G150-I153 PolarHBondContact O-N 2.91Å; G150-S154 WeakPolarHBondContact O-CB 3.34Å; G150-S154 PolarHBondContact O-N 3.38Å; G150-S154 PolarHBondContact O-OG 3.11Å; G150-I161 WeakPolarHBondContact O-CD1 3.48Å; G150-S164 WeakPolarHBondContact O-CB 3.21Å |
| 151 | A | 79.9 | Confident | 83 | Confident | 4 Ų | 4 | 18.3 Ų | 18.3 | 3% | 0.033 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.2 | -43.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S147 A148 L149 I153 S154 V155 I161 M318 | S147-A151 PolarHBondContact O-N 3.49Å; A148-A151 PolarHBondContact O-N 3.28Å; L149-A151 VanDerWaalsContact C-N 3.28Å; L149-A151 PolarHBondContact O-N 3.22Å; A151-I153 PolarHBondContact O-N 3.44Å; A151-S154 WeakPolarHBondContact CA-OG 3.47Å; A151-S154 PolarHBondContact O-N 2.79Å; A151-S154 PolarHBondContact O-OG 3.2Å; A151-V155 WeakPolarHBondContact O-CG2 3.26Å; A151-V155 PolarHBondContact O-N 3.25Å; A151-V155 VanDerWaalsContact O-N 3.15Å; A151-I161 VanDerWaalsContact CA-CD1 3.42Å; A151-I161 HydrophobicContact CB-CD1 4.08Å; A151-M318 HydrophobicContact CB-CG 3.91Å; A151-M318 HydrophobicContact CB-SD 3.94Å |
| 152 | T | 80.4 | Confident | 83.1 | Confident | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -62 | -46.2 | 176.9 | -53.9 | 0 | 0 | 0 | 0 | 110.8 | A148 L149 G150 V155 I156 L337 V340 S341 | A148-T152 PolarHBondContact O-N 3.07Å; A148-T152 VanDerWaalsContact O-N 3.09Å; A148-T152 PolarHBondContact O-OG1 2.69Å; L149-T152 PolarHBondContact O-N 3.32Å; G150-T152 PolarHBondContact O-N 2.98Å; T152-V155 PolarHBondContact O-N 2.94Å; T152-I156 HydrophobicContact CG2-CD1 4.02Å; T152-I156 VanDerWaalsContact O-CD1 3.28Å; T152-I156 WeakPolarHBondContact O-CD1 3.47Å; T152-I156 VanDerWaalsContact O-CG1 3.24Å; T152-I156 WeakPolarHBondContact O-CG1 3.45Å; T152-I156 PolarHBondContact O-N 3.43Å; T152-L337 HydrophobicContact CG2-CD2 4.22Å; T152-V340 HydrophobicContact CG2-CB 4.27Å; T152-V340 HydrophobicContact CG2-CG1 4.02Å; T152-S341 WeakPolarHBondContact CG2-OG 3.46Å |
| 153 | I | 82.4 | Confident | 83 | Confident | 10 Ų | 10 | 26 Ų | 26 | 5% | 0.051 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -69.8 | -37.6 | 179.2 | -64.3 | -174.1 | 0 | 0 | 0 | 112.4 | Y15 L149 G150 A151 V155 I156 V157 I159 S168 | Y15-I153 HydrophobicContact CE2-CD1 4.31Å; Y15-I153 WeakPolarHBondContact OH-CD1 3.23Å; L149-I153 HydrophobicContact CD1-CD1 4.44Å; L149-I153 HydrophobicContact CD1-CG1 4.44Å; L149-I153 WeakPolarHBondContact O-CG1 3.12Å; L149-I153 PolarHBondContact O-N 3.39Å; G150-I153 PolarHBondContact O-N 2.91Å; A151-I153 PolarHBondContact O-N 3.44Å; I153-V155 VanDerWaalsContact C-N 3.28Å; I153-V155 PolarHBondContact O-N 2.92Å; I153-I156 PolarHBondContact O-N 2.87Å; I153-V157 HydrophobicContact CG2-CG2 3.96Å; I153-V157 PolarHBondContact O-N 3.36Å; I153-I159 HydrophobicContact CG2-CD1 4.35Å; I153-S168 WeakPolarHBondContact CD1-OG 3.32Å |
| 154 | S | 83.6 | Confident | 83 | Confident | 16 Ų | 16 | 26 Ų | 26 | 11% | 0.112 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.2 | -38.1 | 177.8 | 54.2 | 0 | 0 | 0 | 0 | 111.7 | G150 A151 D158 I159 S164 | G150-S154 WeakPolarHBondContact O-CB 3.34Å; G150-S154 PolarHBondContact O-N 3.38Å; G150-S154 PolarHBondContact O-OG 3.11Å; A151-S154 WeakPolarHBondContact CA-OG 3.47Å; A151-S154 PolarHBondContact O-N 2.79Å; A151-S154 PolarHBondContact O-OG 3.2Å; S154-D158 WeakPolarHBondContact O-CA 3.43Å; S154-D158 PolarHBondContact O-N 2.92Å; S154-I159 WeakPolarHBondContact CB-O 3.2Å; S154-I159 PolarHBondContact O-N 3.4Å; S154-S164 PolarHBondContact N-OG 3.4Å |
| 155 | V | 78.1 | Confident | 83.2 | Confident | 28 Ų | 28 | 26 Ų | 26 | 17% | 0.17 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -67.9 | -41.2 | 176.3 | 174.3 | 0 | 0 | 0 | 0 | 111.5 | A151 T152 I153 M318 P321 Q325 | A151-V155 WeakPolarHBondContact O-CG2 3.26Å; A151-V155 PolarHBondContact O-N 3.25Å; A151-V155 VanDerWaalsContact O-N 3.15Å; T152-V155 PolarHBondContact O-N 2.94Å; I153-V155 VanDerWaalsContact C-N 3.28Å; I153-V155 PolarHBondContact O-N 2.92Å; V155-M318 HydrophobicContact CG2-SD 4.15Å; V155-P321 HydrophobicContact CB-CB 4.18Å; V155-P321 HydrophobicContact CG1-CB 4.19Å; V155-P321 HydrophobicContact CG2-CB 4.27Å; V155-P321 HydrophobicContact CG2-CG 4.35Å; V155-Q325 HydrophobicContact CG1-CB 3.96Å; V155-Q325 HydrophobicContact CG1-CG 4.21Å |
| 156 | I | 76.4 | Confident | 83.4 | Confident | 2 Ų | 2 | 30.1 Ų | 30.1 | 1% | 0.01 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -71.8 | -45.6 | -177.6 | -57.1 | 153.2 | 0 | 0 | 0 | 112.2 | I11 T152 I153 F334 L337 | I11-I156 HydrophobicContact CD1-CB 3.9Å; I11-I156 HydrophobicContact CD1-CD1 3.49Å; I11-I156 VanDerWaalsContact CD1-CD1 3.49Å; I11-I156 HydrophobicContact CD1-CG1 4.27Å; I11-I156 HydrophobicContact CD1-CG2 3.6Å; I11-I156 HydrophobicContact CG1-CD1 4.17Å; I11-I156 HydrophobicContact CG1-CG2 4.38Å; T152-I156 HydrophobicContact CG2-CD1 4.02Å; T152-I156 VanDerWaalsContact O-CD1 3.28Å; T152-I156 WeakPolarHBondContact O-CD1 3.47Å; T152-I156 VanDerWaalsContact O-CG1 3.24Å; T152-I156 WeakPolarHBondContact O-CG1 3.45Å; T152-I156 PolarHBondContact O-N 3.43Å; I153-I156 PolarHBondContact O-N 2.87Å; I156-F334 HydrophobicContact CG2-CD1 4.34Å; I156-F334 HydrophobicContact CG2-CE1 4.39Å; I156-L337 HydrophobicContact CD1-CB 3.62Å; I156-L337 HydrophobicContact CD1-CD2 4.48Å; I156-L337 HydrophobicContact CD1-CG 4.41Å; I156-L337 HydrophobicContact CG1-CB 3.71Å; I156-L337 HydrophobicContact CG1-CD1 3.63Å; I156-L337 HydrophobicContact CG1-CD2 4.15Å; I156-L337 HydrophobicContact CG1-CG 4.03Å |
| 157 | V | 76.5 | Confident | 83.2 | Confident | 5 Ų | 5 | 33.7 Ų | 33.7 | 3% | 0.03 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -94.8 | -9.1 | -170.5 | -168.2 | 0 | 0 | 0 | 0 | 111.5 | F3 L8 I11 I153 I159 | F3-V157 HydrophobicContact CE2-CG1 4.08Å; F3-V157 HydrophobicContact CZ-CG1 4.07Å; L8-V157 HydrophobicContact CD1-CG1 4.19Å; L8-V157 HydrophobicContact CD1-CG2 4.15Å; I11-V157 HydrophobicContact CD1-CG2 4.02Å; I153-V157 HydrophobicContact CG2-CG2 3.96Å; I153-V157 PolarHBondContact O-N 3.36Å; V157-I159 VanDerWaalsContact C-N 3.35Å; V157-I159 HydrophobicContact CB-CD1 4.31Å; V157-I159 HydrophobicContact CB-CG1 4.13Å; V157-I159 HydrophobicContact CB-CG2 4.28Å; V157-I159 HydrophobicContact CG1-CD1 4.26Å; V157-I159 HydrophobicContact CG1-CG1 4.37Å; V157-I159 HydrophobicContact CG1-CG2 3.78Å |
| 158 | D | 78.2 | Confident | 83.2 | Confident | 84 Ų | 84 | 32.8 Ų | 32.8 | 45% | 0.449 | 18% | 0.175 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.1 | 47.8 | -175.1 | -166.3 | 31.9 | 0 | 0 | 0 | 111.8 | S154 | S154-D158 WeakPolarHBondContact O-CA 3.43Å; S154-D158 PolarHBondContact O-N 2.92Å |
| 159 | I | 83.1 | Confident | 83.5 | Confident | 52 Ų | 52 | 32.7 Ų | 32.7 | 27% | 0.267 | 17% | 0.174 | S | C | . | . | trans | -120.5 | 162.9 | 179.6 | 64.6 | 174 | 0 | 0 | 0 | 111.7 | F3 I153 S154 V157 I161 S164 | F3-I159 HydrophobicContact CE2-CG2 4.4Å; I153-I159 HydrophobicContact CG2-CD1 4.35Å; S154-I159 WeakPolarHBondContact CB-O 3.2Å; S154-I159 PolarHBondContact O-N 3.4Å; V157-I159 VanDerWaalsContact C-N 3.35Å; V157-I159 HydrophobicContact CB-CD1 4.31Å; V157-I159 HydrophobicContact CB-CG1 4.13Å; V157-I159 HydrophobicContact CB-CG2 4.28Å; V157-I159 HydrophobicContact CG1-CD1 4.26Å; V157-I159 HydrophobicContact CG1-CG1 4.37Å; V157-I159 HydrophobicContact CG1-CG2 3.78Å; I159-I161 PolarHBondContact O-N 3.21Å; I159-S164 WeakPolarHBondContact CD1-OG 3.35Å; I159-S164 VanDerWaalsContact CG1-OG 3.24Å; I159-S164 WeakPolarHBondContact CG1-OG 3.5Å | ||
| 160 | N | 86.4 | Confident | 83.6 | Confident | 88 Ų | 88 | 37.2 Ų | 37.2 | 47% | 0.471 | 20% | 0.198 | S | C | . | . | trans | -56.9 | 129.7 | 179.8 | -176.4 | -85.5 | 0 | 0 | 0 | 112.2 | N162 I163 S164 | N160-N162 VanDerWaalsContact C-N 3.28Å; N160-N162 PolarHBondContact O-N 3.33Å; N160-N162 VanDerWaalsContact OD1-CB 3.26Å; N160-N162 WeakPolarHBondContact OD1-CB 3.39Å; N160-N162 PolarHBondContact OD1-N 3.45Å; N160-I163 HydrophobicContact CB-CD1 4.12Å; N160-I163 HydrophobicContact CB-CG1 4.23Å; N160-I163 WeakPolarHBondContact O-CB 3.39Å; N160-I163 PolarHBondContact O-N 3.4Å; N160-S164 PolarHBondContact O-N 3.44Å; N160-S164 PolarHBondContact O-OG 3.01Å | ||
| 161 | I | 82.6 | Confident | 83.4 | Confident | 62 Ų | 62 | 40 Ų | 40 | 32% | 0.318 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -50 | -42.9 | 180 | -178 | 59.5 | 0 | 0 | 0 | 113.5 | G150 A151 I159 I163 S164 V165 | G150-I161 WeakPolarHBondContact O-CD1 3.48Å; A151-I161 VanDerWaalsContact CA-CD1 3.42Å; A151-I161 HydrophobicContact CB-CD1 4.08Å; I159-I161 PolarHBondContact O-N 3.21Å; I161-I163 VanDerWaalsContact C-N 3.32Å; I161-I163 PolarHBondContact O-N 2.9Å; I161-S164 WeakPolarHBondContact O-CB 3.24Å; I161-S164 PolarHBondContact O-N 3.11Å; I161-V165 HydrophobicContact CD1-CG2 4.28Å; I161-V165 HydrophobicContact CG1-CG2 4.45Å; I161-V165 WeakPolarHBondContact O-CG2 3.38Å; I161-V165 PolarHBondContact O-N 2.81Å |
| 162 | N | 88.4 | Confident | 83.4 | Confident | 81 Ų | 81 | 39.8 Ų | 39.8 | 43% | 0.433 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -66.1 | -37.9 | -177.9 | -62.4 | -20.3 | 0 | 0 | 0 | 111.4 | N160 V165 I166 L397 | N160-N162 VanDerWaalsContact C-N 3.28Å; N160-N162 PolarHBondContact O-N 3.33Å; N160-N162 VanDerWaalsContact OD1-CB 3.26Å; N160-N162 WeakPolarHBondContact OD1-CB 3.39Å; N160-N162 PolarHBondContact OD1-N 3.45Å; N162-V165 PolarHBondContact O-N 2.95Å; N162-I166 WeakPolarHBondContact O-CD1 3.46Å; N162-I166 VanDerWaalsContact O-CG1 3.29Å; N162-I166 WeakPolarHBondContact O-CG1 3.44Å; N162-I166 PolarHBondContact O-N 3.34Å; N162-I166 VanDerWaalsContact O-N 3.12Å; N162-L397 HydrophobicContact CB-CD2 3.84Å |
| 163 | I | 88.2 | Confident | 83.4 | Confident | 91 Ų | 91 | 40.1 Ų | 40.1 | 47% | 0.467 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -67.4 | -43.7 | 175.7 | -61 | 177.5 | 0 | 0 | 0 | 109.6 | N160 I161 V165 I166 I167 | N160-I163 HydrophobicContact CB-CD1 4.12Å; N160-I163 HydrophobicContact CB-CG1 4.23Å; N160-I163 WeakPolarHBondContact O-CB 3.39Å; N160-I163 PolarHBondContact O-N 3.4Å; I161-I163 VanDerWaalsContact C-N 3.32Å; I161-I163 PolarHBondContact O-N 2.9Å; I163-V165 VanDerWaalsContact C-N 3.35Å; I163-V165 PolarHBondContact O-N 2.97Å; I163-I166 PolarHBondContact O-N 3.35Å; I163-I167 HydrophobicContact CG2-CD1 3.68Å; I163-I167 HydrophobicContact CG2-CG1 4.3Å; I163-I167 WeakPolarHBondContact O-CG1 3.48Å; I163-I167 PolarHBondContact O-N 2.94Å |
| 164 | S | 87.1 | Confident | 83.3 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57.3 | -45.7 | 175.5 | -63.8 | 0 | 0 | 0 | 0 | 112.3 | G150 S154 I159 N160 I161 S168 | G150-S164 WeakPolarHBondContact O-CB 3.21Å; S154-S164 PolarHBondContact N-OG 3.4Å; I159-S164 WeakPolarHBondContact CD1-OG 3.35Å; I159-S164 VanDerWaalsContact CG1-OG 3.24Å; I159-S164 WeakPolarHBondContact CG1-OG 3.5Å; N160-S164 PolarHBondContact O-N 3.44Å; N160-S164 PolarHBondContact O-OG 3.01Å; I161-S164 WeakPolarHBondContact O-CB 3.24Å; I161-S164 PolarHBondContact O-N 3.11Å; S164-S168 WeakPolarHBondContact O-CB 3.48Å; S164-S168 PolarHBondContact O-N 3.45Å; S164-S168 PolarHBondContact O-OG 2.92Å |
| 165 | V | 88.5 | Confident | 82.8 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.012 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.7 | -47.8 | 177 | 172.4 | 0 | 0 | 0 | 0 | 111 | F146 I161 N162 I163 S168 A169 T393 A396 L397 | F146-V165 HydrophobicContact CB-CG1 4.31Å; I161-V165 HydrophobicContact CD1-CG2 4.28Å; I161-V165 HydrophobicContact CG1-CG2 4.45Å; I161-V165 WeakPolarHBondContact O-CG2 3.38Å; I161-V165 PolarHBondContact O-N 2.81Å; N162-V165 PolarHBondContact O-N 2.95Å; I163-V165 VanDerWaalsContact C-N 3.35Å; I163-V165 PolarHBondContact O-N 2.97Å; V165-S168 WeakPolarHBondContact O-CB 3.48Å; V165-S168 PolarHBondContact O-N 3.08Å; V165-A169 WeakPolarHBondContact O-CB 3.27Å; V165-A169 PolarHBondContact O-N 3.28Å; V165-T393 HydrophobicContact CG1-CG2 4.39Å; V165-A396 HydrophobicContact CG1-CB 3.94Å; V165-L397 HydrophobicContact CB-CD2 3.97Å; V165-L397 HydrophobicContact CG1-CD2 3.91Å; V165-L397 HydrophobicContact CG1-CG 4.24Å |
| 166 | I | 90.4 | Very high | 82.8 | Confident | 85 Ų | 85 | 43 Ų | 43 | 44% | 0.436 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.9 | -47.7 | -178.6 | -68.3 | 165.7 | 0 | 0 | 0 | 111.5 | N162 I163 S168 A169 L170 T393 L397 | N162-I166 WeakPolarHBondContact O-CD1 3.46Å; N162-I166 VanDerWaalsContact O-CG1 3.29Å; N162-I166 WeakPolarHBondContact O-CG1 3.44Å; N162-I166 PolarHBondContact O-N 3.34Å; N162-I166 VanDerWaalsContact O-N 3.12Å; I163-I166 PolarHBondContact O-N 3.35Å; I166-S168 VanDerWaalsContact C-N 3.32Å; I166-S168 PolarHBondContact O-N 3.35Å; I166-A169 PolarHBondContact O-N 3.19Å; I166-L170 WeakPolarHBondContact O-CB 3.25Å; I166-L170 PolarHBondContact O-N 3.33Å; I166-T393 HydrophobicContact CG1-CG2 4.44Å; I166-L397 HydrophobicContact CD1-CD1 4.11Å; I166-L397 HydrophobicContact CG1-CD1 3.92Å; I166-L397 HydrophobicContact CG1-CD2 4.37Å |
| 167 | I | 84.6 | Confident | 82.7 | Confident | 75 Ų | 75 | 44.5 Ų | 44.5 | 39% | 0.385 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61.5 | -45.6 | 179.6 | -68.4 | 172.4 | 0 | 0 | 0 | 110 | I163 L170 I171 | I163-I167 HydrophobicContact CG2-CD1 3.68Å; I163-I167 HydrophobicContact CG2-CG1 4.3Å; I163-I167 WeakPolarHBondContact O-CG1 3.48Å; I163-I167 PolarHBondContact O-N 2.94Å; I167-L170 PolarHBondContact O-N 3.36Å; I167-I171 HydrophobicContact CG2-CD1 3.83Å; I167-I171 VanDerWaalsContact O-CG1 3.31Å; I167-I171 WeakPolarHBondContact O-CG1 3.28Å; I167-I171 PolarHBondContact O-N 3.39Å |
| 168 | S | 82.8 | Confident | 82.2 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58.8 | -49.7 | 178.8 | -63.2 | 0 | 0 | 0 | 0 | 112.4 | L149 I153 S164 V165 I166 L170 I171 A172 | L149-S168 WeakPolarHBondContact CG-OG 3.42Å; I153-S168 WeakPolarHBondContact CD1-OG 3.32Å; S164-S168 WeakPolarHBondContact O-CB 3.48Å; S164-S168 PolarHBondContact O-N 3.45Å; S164-S168 PolarHBondContact O-OG 2.92Å; V165-S168 WeakPolarHBondContact O-CB 3.48Å; V165-S168 PolarHBondContact O-N 3.08Å; I166-S168 VanDerWaalsContact C-N 3.32Å; I166-S168 PolarHBondContact O-N 3.35Å; S168-L170 VanDerWaalsContact C-N 3.34Å; S168-L170 PolarHBondContact O-N 3.18Å; S168-I171 PolarHBondContact O-N 2.93Å; S168-A172 WeakPolarHBondContact O-CB 3.25Å; S168-A172 PolarHBondContact O-N 3.4Å |
| 169 | A | 87.2 | Confident | 81.4 | Confident | 2 Ų | 2 | 45.1 Ų | 45.1 | 2% | 0.017 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.3 | -37.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F146 V165 I166 A172 T173 T393 | F146-A169 HydrophobicContact CD1-CB 3.95Å; F146-A169 HydrophobicContact CD2-CB 3.78Å; F146-A169 HydrophobicContact CE1-CB 3.9Å; F146-A169 HydrophobicContact CE2-CB 3.71Å; F146-A169 HydrophobicContact CG-CB 3.89Å; F146-A169 HydrophobicContact CZ-CB 3.75Å; V165-A169 WeakPolarHBondContact O-CB 3.27Å; V165-A169 PolarHBondContact O-N 3.28Å; I166-A169 PolarHBondContact O-N 3.19Å; A169-A172 PolarHBondContact O-N 3.02Å; A169-T173 VanDerWaalsContact O-CB 3.23Å; A169-T173 WeakPolarHBondContact O-CB 3.22Å; A169-T173 PolarHBondContact O-N 3.33Å; A169-T173 PolarHBondContact O-OG1 3.36Å; A169-T393 HydrophobicContact CB-CG2 3.9Å; A169-T393 WeakPolarHBondContact CB-OG1 3.34Å |
| 170 | L | 85.9 | Confident | 80.7 | Confident | 95 Ų | 95 | 43.3 Ų | 43.3 | 50% | 0.497 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62.5 | -47.7 | 175.8 | -176.7 | 67.6 | 0 | 0 | 0 | 111.2 | I166 I167 S168 M174 | I166-L170 WeakPolarHBondContact O-CB 3.25Å; I166-L170 PolarHBondContact O-N 3.33Å; I167-L170 PolarHBondContact O-N 3.36Å; S168-L170 VanDerWaalsContact C-N 3.34Å; S168-L170 PolarHBondContact O-N 3.18Å; L170-M174 HydrophobicContact CD1-CE 4.05Å; L170-M174 HydrophobicContact CD1-CG 4.34Å; L170-M174 WeakPolarHBondContact O-CB 3.41Å; L170-M174 WeakPolarHBondContact O-CG 3.42Å; L170-M174 PolarHBondContact O-N 3.38Å |
| 171 | I | 79.6 | Confident | 79.8 | Confident | 57 Ų | 57 | 39.6 Ų | 39.6 | 29% | 0.292 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.5 | -49.1 | 178.6 | -64.7 | 168.8 | 0 | 0 | 0 | 109.8 | Y15 I167 S168 T173 M174 Y175 M345 | Y15-I171 HydrophobicContact CD2-CD1 3.86Å; Y15-I171 HydrophobicContact CD2-CG2 4.31Å; Y15-I171 HydrophobicContact CE2-CD1 3.99Å; I167-I171 HydrophobicContact CG2-CD1 3.83Å; I167-I171 VanDerWaalsContact O-CG1 3.31Å; I167-I171 WeakPolarHBondContact O-CG1 3.28Å; I167-I171 PolarHBondContact O-N 3.39Å; S168-I171 PolarHBondContact O-N 2.93Å; I171-T173 PolarHBondContact O-N 3.2Å; I171-M174 PolarHBondContact O-N 3.48Å; I171-Y175 WeakPolarHBondContact O-CD1 3.36Å; I171-Y175 PolarHBondContact O-N 2.85Å; I171-M345 HydrophobicContact CB-CE 4.01Å; I171-M345 HydrophobicContact CG2-CE 3.49Å; I171-M345 VanDerWaalsContact CG2-CE 3.49Å |
| 172 | A | 79.9 | Confident | 79.1 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -57.1 | -47.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | F146 S168 A169 Y175 T176 A348 | F146-A172 HydrophobicContact CE1-CB 3.74Å; F146-A172 HydrophobicContact CZ-CB 4.34Å; S168-A172 WeakPolarHBondContact O-CB 3.25Å; S168-A172 PolarHBondContact O-N 3.4Å; A169-A172 PolarHBondContact O-N 3.02Å; A172-Y175 VanDerWaalsContact CA-CE1 3.41Å; A172-Y175 HydrophobicContact CB-CE1 4.26Å; A172-T176 WeakPolarHBondContact O-CB 3.48Å; A172-T176 PolarHBondContact O-N 3.17Å; A172-T176 PolarHBondContact O-OG1 3.22Å; A172-A348 HydrophobicContact CB-CB 4.42Å |
| 173 | T | 82.4 | Confident | 78.3 | Confident | 7 Ų | 7 | 35 Ų | 35 | 4% | 0.043 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -65.6 | -43 | 179.6 | -55.7 | 0 | 0 | 0 | 0 | 111.1 | A169 I171 Y175 T176 L177 V385 F386 | A169-T173 VanDerWaalsContact O-CB 3.23Å; A169-T173 WeakPolarHBondContact O-CB 3.22Å; A169-T173 PolarHBondContact O-N 3.33Å; A169-T173 PolarHBondContact O-OG1 3.36Å; I171-T173 PolarHBondContact O-N 3.2Å; T173-Y175 PolarHBondContact O-N 3.15Å; T173-T176 PolarHBondContact O-N 3.28Å; T173-L177 HydrophobicContact CG2-CD1 4.48Å; T173-L177 WeakPolarHBondContact O-CG 3.49Å; T173-L177 PolarHBondContact O-N 3.48Å; T173-L177 VanDerWaalsContact O-N 3.1Å; T173-V385 HydrophobicContact CG2-CG1 4.17Å; T173-F386 HydrophobicContact CG2-CD2 4.28Å |
| 174 | M | 79.3 | Confident | 77.6 | Confident | 93 Ų | 93 | 30.7 Ų | 30.7 | 46% | 0.458 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -63.5 | -44 | -176 | -79.3 | -67.3 | 174 | 0 | 0 | 113.4 | L170 I171 L177 | L170-M174 HydrophobicContact CD1-CE 4.05Å; L170-M174 HydrophobicContact CD1-CG 4.34Å; L170-M174 WeakPolarHBondContact O-CB 3.41Å; L170-M174 WeakPolarHBondContact O-CG 3.42Å; L170-M174 PolarHBondContact O-N 3.38Å; I171-M174 PolarHBondContact O-N 3.48Å; M174-L177 WeakPolarHBondContact O-CB 3.21Å; M174-L177 PolarHBondContact O-N 3.43Å; M174-L177 HydrophobicContact SD-CD1 4.14Å |
| 175 | Y | 73.2 | Confident | 76.9 | Confident | 16 Ų | 16 | 30.8 Ų | 30.8 | 6% | 0.063 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -74 | -31.4 | 178.7 | 78.3 | -107.6 | 0 | 0 | 0 | 112 | I171 A172 T173 L177 V178 G179 M345 D349 | I171-Y175 WeakPolarHBondContact O-CD1 3.36Å; I171-Y175 PolarHBondContact O-N 2.85Å; A172-Y175 VanDerWaalsContact CA-CE1 3.41Å; A172-Y175 HydrophobicContact CB-CE1 4.26Å; T173-Y175 PolarHBondContact O-N 3.15Å; Y175-L177 VanDerWaalsContact C-N 3.26Å; Y175-L177 PolarHBondContact O-N 3.27Å; Y175-V178 PolarHBondContact O-N 3.45Å; Y175-V178 VanDerWaalsContact O-N 3.11Å; Y175-G179 PolarHBondContact O-N 3.21Å; Y175-M345 PolarHBondContact OH-O 2.86Å; Y175-M345 VanDerWaalsContact OH-O 3.09Å; Y175-D349 HydrophobicContact CE2-CB 3.78Å; Y175-D349 WeakPolarHBondContact CE2-OD2 3.05Å; Y175-D349 VanDerWaalsContact CZ-OD2 3.27Å; Y175-D349 WeakPolarHBondContact OH-CB 3.49Å; Y175-D349 PolarHBondContact OH-OD2 2.83Å |
| 176 | T | 77.4 | Confident | 76.3 | Confident | 5 Ų | 5 | 34.1 Ų | 34.1 | 3% | 0.031 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59.6 | -38.6 | 174.2 | -55.8 | 0 | 0 | 0 | 0 | 111.3 | A172 T173 V178 D349 L353 V385 | A172-T176 WeakPolarHBondContact O-CB 3.48Å; A172-T176 PolarHBondContact O-N 3.17Å; A172-T176 PolarHBondContact O-OG1 3.22Å; T173-T176 PolarHBondContact O-N 3.28Å; T176-V178 VanDerWaalsContact C-N 3.27Å; T176-V178 PolarHBondContact O-N 3.43Å; T176-D349 HydrophobicContact CG2-CB 4.29Å; T176-D349 WeakPolarHBondContact OG1-CB 3.49Å; T176-L353 HydrophobicContact CG2-CB 4.38Å; T176-V385 HydrophobicContact CG2-CG1 3.89Å; T176-V385 HydrophobicContact CG2-CG2 4.36Å |
| 177 | L | 74.9 | Confident | 75.8 | Confident | 35 Ų | 35 | 30.1 Ų | 30.1 | 18% | 0.183 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.1 | -33.3 | 176.2 | -70.8 | 169.7 | 0 | 0 | 0 | 113.5 | T173 M174 Y175 R382 V385 | T173-L177 HydrophobicContact CG2-CD1 4.48Å; T173-L177 WeakPolarHBondContact O-CG 3.49Å; T173-L177 PolarHBondContact O-N 3.48Å; T173-L177 VanDerWaalsContact O-N 3.1Å; M174-L177 WeakPolarHBondContact O-CB 3.21Å; M174-L177 PolarHBondContact O-N 3.43Å; M174-L177 HydrophobicContact SD-CD1 4.14Å; Y175-L177 VanDerWaalsContact C-N 3.26Å; Y175-L177 PolarHBondContact O-N 3.27Å; L177-R382 HydrophobicContact CD2-CB 4.07Å; L177-R382 HydrophobicContact CD2-CG 4.48Å; L177-R382 WeakPolarHBondContact CD2-O 3.25Å; L177-R382 PolarHBondContact O-NE 3.14Å; L177-V385 HydrophobicContact CD2-CB 3.74Å; L177-V385 HydrophobicContact CD2-CG1 3.55Å; L177-V385 HydrophobicContact CG-CG1 3.83Å |
| 178 | V | 65.9 | Low | 75.8 | Confident | 92 Ų | 92 | 26.6 Ų | 26.6 | 56% | 0.558 | 14% | 0.14 | S | C | * | . | H | α-helix | trans | -87.1 | -34.8 | -174.4 | 179.3 | 0 | 0 | 0 | 0 | 111.7 | Y175 T176 | Y175-V178 PolarHBondContact O-N 3.45Å; Y175-V178 VanDerWaalsContact O-N 3.11Å; T176-V178 VanDerWaalsContact C-N 3.27Å; T176-V178 PolarHBondContact O-N 3.43Å |
| 179 | G | 62.1 | Low | 75.8 | Confident | 10 Ų | 10 | 28.4 Ų | 28.4 | 10% | 0.103 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -91.3 | -35.6 | -159.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | Y175 S183 | Y175-G179 PolarHBondContact O-N 3.21Å; G179-S183 WeakPolarHBondContact CA-OG 3.5Å; G179-S183 WeakPolarHBondContact O-CB 3.09Å; G179-S183 PolarHBondContact O-N 3.42Å |
| 180 | G | 67.5 | Low | 75.6 | Confident | 13 Ų | 13 | 31.1 Ų | 31.1 | 13% | 0.134 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | 60.9 | -177.9 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y182 S183 V184 | G180-Y182 VanDerWaalsContact C-N 3.3Å; G180-Y182 PolarHBondContact O-N 3.17Å; G180-S183 PolarHBondContact O-N 2.96Å; G180-V184 WeakPolarHBondContact O-CG2 3.08Å; G180-V184 PolarHBondContact O-N 3.47Å |
| 181 | L | 68.3 | Low | 75.6 | Confident | 10 Ų | 10 | 26.6 Ų | 26.6 | 5% | 0.052 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.7 | -37.4 | -172.5 | -172.7 | 72.5 | 0 | 0 | 0 | 113.7 | I42 I49 V184 A185 L353 | I42-L181 VanDerWaalsContact O-CB 3.29Å; I42-L181 WeakPolarHBondContact O-CB 3.43Å; I42-L181 PolarHBondContact O-N 2.96Å; I49-L181 HydrophobicContact CD1-CD2 4.45Å; L181-V184 PolarHBondContact O-N 3.38Å; L181-A185 WeakPolarHBondContact O-CB 3.5Å; L181-A185 PolarHBondContact O-N 2.71Å; L181-L353 HydrophobicContact CB-CD2 4.25Å; L181-L353 HydrophobicContact CD1-CD2 4.01Å |
| 182 | Y | 67.7 | Low | 75.9 | Confident | 44 Ų | 44 | 24.1 Ų | 24.1 | 17% | 0.173 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.7 | -44 | 179.4 | -91.2 | -72.4 | 0 | 0 | 0 | 112.9 | T29 G45 I49 G180 V184 A185 Y186 | T29-Y182 HydrophobicContact CG2-CD2 3.7Å; T29-Y182 HydrophobicContact CG2-CE2 4.07Å; T29-Y182 HydrophobicContact CG2-CG 4.28Å; G45-Y182 WeakPolarHBondContact O-CE2 3.37Å; G45-Y182 PolarHBondContact O-OH 3.44Å; I49-Y182 HydrophobicContact CG1-CE1 4.41Å; G180-Y182 VanDerWaalsContact C-N 3.3Å; G180-Y182 PolarHBondContact O-N 3.17Å; Y182-V184 VanDerWaalsContact C-N 3.28Å; Y182-V184 PolarHBondContact O-N 3.28Å; Y182-A185 PolarHBondContact O-N 3.43Å; Y182-Y186 HydrophobicContact CD1-CE2 4.1Å; Y182-Y186 VanDerWaalsContact O-CD2 3.31Å; Y182-Y186 WeakPolarHBondContact O-CD2 3.19Å; Y182-Y186 PolarHBondContact O-N 3.28Å; Y182-Y186 VanDerWaalsContact O-N 3.07Å |
| 183 | S | 70.6 | Confident | 76.2 | Confident | 3 Ų | 3 | 29.9 Ų | 29.9 | 2% | 0.021 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.7 | -45.1 | 175.8 | 178.2 | 0 | 0 | 0 | 0 | 110.6 | G22 G179 G180 Y186 T187 | G22-S183 WeakPolarHBondContact CA-OG 3.41Å; G22-S183 PolarHBondContact O-OG 3.41Å; G179-S183 WeakPolarHBondContact CA-OG 3.5Å; G179-S183 WeakPolarHBondContact O-CB 3.09Å; G179-S183 PolarHBondContact O-N 3.42Å; G180-S183 PolarHBondContact O-N 2.96Å; S183-Y186 PolarHBondContact O-N 3.49Å; S183-T187 WeakPolarHBondContact O-CG2 3.14Å; S183-T187 PolarHBondContact O-N 2.94Å; S183-T187 PolarHBondContact O-OG1 3.47Å |
| 184 | V | 73.6 | Confident | 76.5 | Confident | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.006 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.2 | -48.5 | 177.7 | 177.5 | 0 | 0 | 0 | 0 | 110.2 | G180 L181 Y182 Y186 T187 D188 D349 L353 | G180-V184 WeakPolarHBondContact O-CG2 3.08Å; G180-V184 PolarHBondContact O-N 3.47Å; L181-V184 PolarHBondContact O-N 3.38Å; Y182-V184 VanDerWaalsContact C-N 3.28Å; Y182-V184 PolarHBondContact O-N 3.28Å; V184-Y186 VanDerWaalsContact C-N 3.32Å; V184-Y186 PolarHBondContact O-N 3.36Å; V184-T187 WeakPolarHBondContact CA-OG1 3.26Å; V184-T187 PolarHBondContact O-N 3.2Å; V184-T187 PolarHBondContact O-OG1 2.85Å; V184-D188 WeakPolarHBondContact O-CB 3.35Å; V184-D188 PolarHBondContact O-N 2.56Å; V184-D349 HydrophobicContact CG2-CB 4.31Å; V184-L353 HydrophobicContact CG2-CD2 4.23Å |
| 185 | A | 73.6 | Confident | 76.9 | Confident | 2 Ų | 2 | 26.1 Ų | 26.1 | 2% | 0.017 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.9 | -37.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V53 T57 L181 Y182 V189 | V53-A185 HydrophobicContact CG1-CB 4.24Å; T57-A185 HydrophobicContact CG2-CB 4.48Å; L181-A185 WeakPolarHBondContact O-CB 3.5Å; L181-A185 PolarHBondContact O-N 2.71Å; Y182-A185 PolarHBondContact O-N 3.43Å; A185-V189 WeakPolarHBondContact O-CG2 3.49Å; A185-V189 PolarHBondContact O-N 3.42Å |
| 186 | Y | 75.6 | Confident | 77.6 | Confident | 71 Ų | 71 | 29.1 Ų | 29.1 | 28% | 0.278 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -76.9 | -36.3 | 177.1 | -84.1 | -83.7 | 0 | 0 | 0 | 112.6 | W24 A25 Y182 S183 V184 D188 V189 V190 | W24-Y186 HydrophobicContact CZ3-CD1 4.47Å; A25-Y186 HydrophobicContact CB-CD2 4.04Å; A25-Y186 HydrophobicContact CB-CG 4.16Å; Y182-Y186 HydrophobicContact CD1-CE2 4.1Å; Y182-Y186 VanDerWaalsContact O-CD2 3.31Å; Y182-Y186 WeakPolarHBondContact O-CD2 3.19Å; Y182-Y186 PolarHBondContact O-N 3.28Å; Y182-Y186 VanDerWaalsContact O-N 3.07Å; S183-Y186 PolarHBondContact O-N 3.49Å; V184-Y186 VanDerWaalsContact C-N 3.32Å; V184-Y186 PolarHBondContact O-N 3.36Å; Y186-D188 VanDerWaalsContact C-N 3.32Å; Y186-V189 PolarHBondContact O-N 2.93Å; Y186-V190 PolarHBondContact O-N 2.82Å |
| 187 | T | 80 | Confident | 78.3 | Confident | 2 Ų | 2 | 31.5 Ų | 31.5 | 1% | 0.012 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.9 | -40 | 173.2 | 50.1 | 0 | 0 | 0 | 0 | 110.9 | I18 V21 S183 V184 V189 V190 Q191 | I18-T187 HydrophobicContact CG2-CG2 3.88Å; V21-T187 HydrophobicContact CG1-CG2 4.37Å; S183-T187 WeakPolarHBondContact O-CG2 3.14Å; S183-T187 PolarHBondContact O-N 2.94Å; S183-T187 PolarHBondContact O-OG1 3.47Å; V184-T187 WeakPolarHBondContact CA-OG1 3.26Å; V184-T187 PolarHBondContact O-N 3.2Å; V184-T187 PolarHBondContact O-OG1 2.85Å; T187-V189 VanDerWaalsContact C-N 3.28Å; T187-V189 PolarHBondContact O-N 2.95Å; T187-V190 PolarHBondContact O-N 3.5Å; T187-V190 VanDerWaalsContact O-N 3.15Å; T187-Q191 WeakPolarHBondContact O-CB 3.38Å; T187-Q191 WeakPolarHBondContact O-CG 3.35Å; T187-Q191 PolarHBondContact O-N 3.36Å; T187-Q191 PolarHBondContact O-OE1 2.88Å |
| 188 | D | 83.3 | Confident | 79.1 | Confident | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -55.2 | -42.2 | 176.7 | -71.6 | 0.3 | 0 | 0 | 0 | 112.1 | T57 A60 V184 Y186 Q191 L192 R260 S346 | T57-D188 WeakPolarHBondContact CB-OD2 2.86Å; T57-D188 PolarHBondContact OG1-OD2 3.13Å; A60-D188 HydrophobicContact CB-CB 3.81Å; V184-D188 WeakPolarHBondContact O-CB 3.35Å; V184-D188 PolarHBondContact O-N 2.56Å; Y186-D188 VanDerWaalsContact C-N 3.32Å; D188-Q191 PolarHBondContact O-N 3.35Å; D188-L192 WeakPolarHBondContact O-CB 3.35Å; D188-L192 PolarHBondContact O-N 2.58Å; D188-R260 IonicContact OD2-CZ 3.78Å; D188-R260 IonicContact OD2-NH2 3.08Å; D188-R260 PolarHBondContact OD2-NH2 3.14Å; D188-S346 PolarHBondContact OD1-OG 2.85Å |
| 189 | V | 82.6 | Confident | 80.3 | Confident | 38 Ų | 38 | 25.5 Ų | 25.5 | 23% | 0.23 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.7 | -47.1 | 179.8 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | V53 F56 A185 Y186 T187 F193 | V53-V189 HydrophobicContact CB-CG2 4.39Å; V53-V189 HydrophobicContact CG1-CG2 4.06Å; V53-V189 HydrophobicContact CG2-CG2 4.48Å; F56-V189 HydrophobicContact CB-CB 4.46Å; F56-V189 HydrophobicContact CB-CG2 3.88Å; F56-V189 HydrophobicContact CD2-CG1 4.3Å; A185-V189 WeakPolarHBondContact O-CG2 3.49Å; A185-V189 PolarHBondContact O-N 3.42Å; Y186-V189 PolarHBondContact O-N 2.93Å; T187-V189 VanDerWaalsContact C-N 3.28Å; T187-V189 PolarHBondContact O-N 2.95Å; V189-F193 PolarHBondContact O-N 2.79Å; V189-F193 VanDerWaalsContact O-N 3.16Å |
| 190 | V | 83.8 | Confident | 81.8 | Confident | 60 Ų | 60 | 29.5 Ų | 29.5 | 36% | 0.364 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -66.6 | -45.5 | 179.9 | 177.7 | 0 | 0 | 0 | 0 | 110.1 | V21 Y186 T187 L192 F193 C194 | V21-V190 HydrophobicContact CG1-CG2 4.22Å; Y186-V190 PolarHBondContact O-N 2.82Å; T187-V190 PolarHBondContact O-N 3.5Å; T187-V190 VanDerWaalsContact O-N 3.15Å; V190-L192 PolarHBondContact O-N 3.07Å; V190-F193 PolarHBondContact O-N 2.82Å; V190-C194 PolarHBondContact O-N 2.71Å; V190-C194 PolarHBondContact O-SG 3.38Å |
| 191 | Q | 85.6 | Confident | 83.1 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.4 | -45.9 | 179.5 | -71 | 166.1 | -41.6 | 0 | 0 | 110.9 | I18 T187 D188 F193 C194 I195 A342 S346 | I18-Q191 HydrophobicContact CD1-CG 3.92Å; I18-Q191 HydrophobicContact CG1-CG 4.32Å; T187-Q191 WeakPolarHBondContact O-CB 3.38Å; T187-Q191 WeakPolarHBondContact O-CG 3.35Å; T187-Q191 PolarHBondContact O-N 3.36Å; T187-Q191 PolarHBondContact O-OE1 2.88Å; D188-Q191 PolarHBondContact O-N 3.35Å; Q191-F193 VanDerWaalsContact C-N 3.32Å; Q191-F193 PolarHBondContact O-N 3.15Å; Q191-C194 WeakPolarHBondContact O-CB 3.36Å; Q191-C194 PolarHBondContact O-N 2.78Å; Q191-C194 VanDerWaalsContact O-N 3.14Å; Q191-I195 WeakPolarHBondContact O-CD1 3.34Å; Q191-I195 WeakPolarHBondContact O-CG1 3.1Å; Q191-I195 PolarHBondContact O-N 3.14Å; Q191-A342 HydrophobicContact CB-CB 3.88Å; Q191-A342 HydrophobicContact CG-CB 3.7Å; Q191-A342 PolarHBondContact NE2-O 3.28Å; Q191-S346 PolarHBondContact OE1-OG 3.27Å |
| 192 | L | 86.1 | Confident | 84.3 | Confident | 5 Ų | 5 | 31.8 Ų | 31.8 | 3% | 0.026 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.8 | -38.9 | 179.3 | -168.8 | 61.3 | 0 | 0 | 0 | 112.8 | F56 T59 A60 V63 D188 V190 I195 F196 M284 | F56-L192 HydrophobicContact CB-CD2 4.05Å; F56-L192 HydrophobicContact CD1-CD2 3.65Å; F56-L192 HydrophobicContact CD1-CG 4.39Å; F56-L192 HydrophobicContact CG-CD2 4.35Å; F56-L192 WeakPolarHBondContact O-CD2 3.43Å; T59-L192 HydrophobicContact CG2-CD1 4.32Å; T59-L192 HydrophobicContact CG2-CD2 3.82Å; A60-L192 HydrophobicContact CB-CB 4.32Å; A60-L192 HydrophobicContact CB-CD1 4.49Å; A60-L192 HydrophobicContact CB-CD2 4.2Å; V63-L192 HydrophobicContact CB-CD1 4.26Å; V63-L192 HydrophobicContact CG1-CD1 4.09Å; D188-L192 WeakPolarHBondContact O-CB 3.35Å; D188-L192 PolarHBondContact O-N 2.58Å; V190-L192 PolarHBondContact O-N 3.07Å; L192-I195 HydrophobicContact CD1-CD1 4.38Å; L192-I195 PolarHBondContact O-N 3.39Å; L192-F196 WeakPolarHBondContact O-CB 3.05Å; L192-F196 PolarHBondContact O-N 2.96Å; L192-M284 HydrophobicContact CD1-CE 3.64Å; L192-M284 HydrophobicContact CD1-CG 4.12Å; L192-M284 HydrophobicContact CD1-SD 4.1Å; L192-M284 HydrophobicContact CG-CE 4.49Å |
| 193 | F | 87.1 | Confident | 85.7 | Confident | 121 Ų | 121 | 30 Ų | 30 | 53% | 0.531 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -64.6 | -43.4 | 173.3 | -175.3 | -101 | 0 | 0 | 0 | 112.1 | V189 V190 Q191 I195 F196 L197 | V189-F193 PolarHBondContact O-N 2.79Å; V189-F193 VanDerWaalsContact O-N 3.16Å; V190-F193 PolarHBondContact O-N 2.82Å; Q191-F193 VanDerWaalsContact C-N 3.32Å; Q191-F193 PolarHBondContact O-N 3.15Å; F193-I195 PolarHBondContact O-N 3.28Å; F193-F196 PolarHBondContact O-N 3.34Å; F193-L197 HydrophobicContact CD1-CD1 4Å; F193-L197 HydrophobicContact CE1-CD1 3.28Å; F193-L197 HydrophobicContact CE1-CG 4.13Å; F193-L197 HydrophobicContact CE2-CD1 4.25Å; F193-L197 HydrophobicContact CE2-CG 4.44Å; F193-L197 HydrophobicContact CZ-CD1 3.44Å; F193-L197 VanDerWaalsContact CZ-CD1 3.44Å; F193-L197 HydrophobicContact CZ-CG 4.09Å; F193-L197 PolarHBondContact O-N 2.93Å |
| 194 | C | 87.3 | Confident | 86.8 | Confident | 19 Ų | 19 | 33.2 Ų | 33.2 | 13% | 0.128 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61 | -42.8 | 175.6 | -69.3 | 0 | 0 | 0 | 0 | 111.9 | F14 V190 Q191 G198 A339 | F14-C194 HydrophobicContact CE2-CB 4.14Å; F14-C194 HydrophobicContact CZ-CB 4.05Å; V190-C194 PolarHBondContact O-N 2.71Å; V190-C194 PolarHBondContact O-SG 3.38Å; Q191-C194 WeakPolarHBondContact O-CB 3.36Å; Q191-C194 PolarHBondContact O-N 2.78Å; Q191-C194 VanDerWaalsContact O-N 3.14Å; C194-G198 WeakPolarHBondContact O-CA 3.33Å; C194-G198 PolarHBondContact O-N 2.89Å; C194-A339 HydrophobicContact CB-CB 4.31Å; C194-A339 VanDerWaalsContact O-CB 3.24Å; C194-A339 WeakPolarHBondContact O-CB 3.21Å |
| 195 | I | 88 | Confident | 87.8 | Confident | 2 Ų | 2 | 37.3 Ų | 37.3 | 1% | 0.01 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.5 | -47.4 | 176.2 | -61.2 | 157.1 | 0 | 0 | 0 | 110.7 | I68 Q191 L192 F193 L197 G198 L199 M284 A339 A343 | I68-I195 HydrophobicContact CD1-CG2 3.68Å; Q191-I195 WeakPolarHBondContact O-CD1 3.34Å; Q191-I195 WeakPolarHBondContact O-CG1 3.1Å; Q191-I195 PolarHBondContact O-N 3.14Å; L192-I195 HydrophobicContact CD1-CD1 4.38Å; L192-I195 PolarHBondContact O-N 3.39Å; F193-I195 PolarHBondContact O-N 3.28Å; I195-L197 PolarHBondContact O-N 3.37Å; I195-G198 PolarHBondContact O-N 3.1Å; I195-L199 HydrophobicContact CG2-CD1 3.74Å; I195-L199 HydrophobicContact CG2-CG 4.22Å; I195-L199 WeakPolarHBondContact O-CB 3.48Å; I195-L199 PolarHBondContact O-N 3.19Å; I195-M284 HydrophobicContact CB-CE 3.73Å; I195-M284 HydrophobicContact CG2-CE 3.4Å; I195-M284 VanDerWaalsContact CG2-CE 3.4Å; I195-A339 WeakPolarHBondContact CG1-O 3.24Å; I195-A343 HydrophobicContact CD1-CB 3.12Å; I195-A343 HydrophobicContact CG1-CB 3.66Å |
| 196 | F | 89.4 | Confident | 88.9 | Confident | 78 Ų | 78 | 37.2 Ų | 37.2 | 34% | 0.342 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -57.6 | -54.8 | -178.6 | -179.5 | -99.3 | 0 | 0 | 0 | 109.5 | L192 F193 W200 V283 M284 | L192-F196 WeakPolarHBondContact O-CB 3.05Å; L192-F196 PolarHBondContact O-N 2.96Å; F193-F196 PolarHBondContact O-N 3.34Å; F196-W200 AromaticContact CD2-CD1 3.48Å; F196-W200 VanDerWaalsContact CD2-CD1 3.48Å; F196-W200 AromaticContact CD2-NE1 3.59Å; F196-W200 AromaticContact CE2-CD1 3.48Å; F196-W200 VanDerWaalsContact CE2-CD1 3.48Å; F196-W200 HydrophobicContact CE2-CG 4.42Å; F196-W200 AromaticContact CE2-NE1 3.31Å; F196-W200 VanDerWaalsContact CE2-NE1 3.31Å; F196-W200 AromaticContact CZ-CD1 4Å; F196-W200 VanDerWaalsContact O-CB 3.23Å; F196-W200 WeakPolarHBondContact O-CB 3.27Å; F196-W200 PolarHBondContact O-N 3.05Å; F196-W200 VanDerWaalsContact O-N 3.12Å; F196-V283 HydrophobicContact CE2-CG1 3.91Å; F196-M284 HydrophobicContact CB-CE 3.92Å; F196-M284 HydrophobicContact CB-SD 3.81Å; F196-M284 HydrophobicContact CD2-SD 3.6Å; F196-M284 VanDerWaalsContact CD2-SD 3.6Å; F196-M284 HydrophobicContact CG-SD 4.18Å |
| 197 | L | 91.3 | Very high | 89.8 | Confident | 56 Ų | 56 | 37.7 Ų | 37.7 | 29% | 0.293 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -65.4 | -44.7 | 178.7 | -66.2 | -174.8 | 0 | 0 | 0 | 112.6 | F193 I195 L199 I201 F335 | F193-L197 HydrophobicContact CD1-CD1 4Å; F193-L197 HydrophobicContact CE1-CD1 3.28Å; F193-L197 HydrophobicContact CE1-CG 4.13Å; F193-L197 HydrophobicContact CE2-CD1 4.25Å; F193-L197 HydrophobicContact CE2-CG 4.44Å; F193-L197 HydrophobicContact CZ-CD1 3.44Å; F193-L197 VanDerWaalsContact CZ-CD1 3.44Å; F193-L197 HydrophobicContact CZ-CG 4.09Å; F193-L197 PolarHBondContact O-N 2.93Å; I195-L197 PolarHBondContact O-N 3.37Å; L197-L199 PolarHBondContact O-N 2.58Å; L197-I201 HydrophobicContact CB-CD1 4.25Å; L197-I201 WeakPolarHBondContact O-CB 3.41Å; L197-I201 WeakPolarHBondContact O-CD1 3.43Å; L197-I201 WeakPolarHBondContact O-CG1 3.36Å; L197-I201 PolarHBondContact O-N 3.37Å; L197-F335 HydrophobicContact CB-CE1 4Å; L197-F335 HydrophobicContact CB-CZ 4.17Å |
| 198 | G | 90.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.2 | -48.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | C194 I195 S202 F335 | C194-G198 WeakPolarHBondContact O-CA 3.33Å; C194-G198 PolarHBondContact O-N 2.89Å; I195-G198 PolarHBondContact O-N 3.1Å; G198-S202 WeakPolarHBondContact O-CB 3.43Å; G198-S202 PolarHBondContact O-N 3.09Å; G198-S202 VanDerWaalsContact O-N 3.17Å; G198-S202 PolarHBondContact O-OG 3.5Å; G198-F335 VanDerWaalsContact CA-CE1 3.4Å |
| 199 | L | 91.9 | Very high | 91 | Very high | 1 Ų | 1 | 44.2 Ų | 44.2 | 1% | 0.005 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -76.2 | -43.2 | -179.3 | -61.5 | -177.5 | 0 | 0 | 0 | 112.1 | I68 I195 L197 I201 S202 V203 P287 I291 L320 L324 V340 | I68-L199 HydrophobicContact CD1-CD1 4.15Å; I68-L199 HydrophobicContact CG2-CD1 3.73Å; I195-L199 HydrophobicContact CG2-CD1 3.74Å; I195-L199 HydrophobicContact CG2-CG 4.22Å; I195-L199 WeakPolarHBondContact O-CB 3.48Å; I195-L199 PolarHBondContact O-N 3.19Å; L197-L199 PolarHBondContact O-N 2.58Å; L199-I201 VanDerWaalsContact C-N 3.31Å; L199-I201 PolarHBondContact O-N 3.08Å; L199-S202 PolarHBondContact O-N 3.15Å; L199-S202 VanDerWaalsContact O-N 3.09Å; L199-V203 WeakPolarHBondContact O-CG2 3.34Å; L199-V203 PolarHBondContact O-N 2.75Å; L199-V203 VanDerWaalsContact O-N 3.09Å; L199-P287 HydrophobicContact CB-CB 3.51Å; L199-P287 HydrophobicContact CB-CG 4.14Å; L199-P287 HydrophobicContact CD1-CB 4.41Å; L199-I291 HydrophobicContact CD2-CD1 3.95Å; L199-L320 HydrophobicContact CD2-CD2 4.46Å; L199-L324 HydrophobicContact CD2-CD1 4.19Å; L199-V340 HydrophobicContact CD2-CG2 3.73Å |
| 200 | W | 94.3 | Very high | 91.5 | Very high | 93 Ų | 93 | 48.2 Ų | 48.2 | 35% | 0.352 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.7 | -34.4 | 179.5 | -83.1 | 99 | 0 | 0 | 0 | 113 | F196 P204 L286 P287 | F196-W200 AromaticContact CD2-CD1 3.48Å; F196-W200 VanDerWaalsContact CD2-CD1 3.48Å; F196-W200 AromaticContact CD2-NE1 3.59Å; F196-W200 AromaticContact CE2-CD1 3.48Å; F196-W200 VanDerWaalsContact CE2-CD1 3.48Å; F196-W200 HydrophobicContact CE2-CG 4.42Å; F196-W200 AromaticContact CE2-NE1 3.31Å; F196-W200 VanDerWaalsContact CE2-NE1 3.31Å; F196-W200 AromaticContact CZ-CD1 4Å; F196-W200 VanDerWaalsContact O-CB 3.23Å; F196-W200 WeakPolarHBondContact O-CB 3.27Å; F196-W200 PolarHBondContact O-N 3.05Å; F196-W200 VanDerWaalsContact O-N 3.12Å; W200-P204 WeakPolarHBondContact O-CD 3.45Å; W200-L286 HydrophobicContact CH2-CB 4.23Å; W200-L286 HydrophobicContact CH2-CD1 4.24Å; W200-L286 HydrophobicContact CZ2-CB 3.95Å; W200-L286 HydrophobicContact CZ2-CD1 4.12Å; W200-P287 VanDerWaalsContact CD1-CG 3.45Å; W200-P287 HydrophobicContact CD2-CG 3.76Å; W200-P287 VanDerWaalsContact CE2-CG 3.49Å; W200-P287 HydrophobicContact CG-CG 3.75Å; W200-P287 HydrophobicContact CZ2-CG 4.12Å; W200-P287 VanDerWaalsContact NE1-CG 3.26Å |
| 201 | I | 94 | Very high | 91.9 | Very high | 71 Ų | 71 | 45.6 Ų | 45.6 | 36% | 0.364 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -71.3 | -36.3 | 173.3 | -67.1 | 168.2 | 0 | 0 | 0 | 110.3 | L197 L199 P204 F205 I332 F335 | L197-I201 HydrophobicContact CB-CD1 4.25Å; L197-I201 WeakPolarHBondContact O-CB 3.41Å; L197-I201 WeakPolarHBondContact O-CD1 3.43Å; L197-I201 WeakPolarHBondContact O-CG1 3.36Å; L197-I201 PolarHBondContact O-N 3.37Å; L199-I201 VanDerWaalsContact C-N 3.31Å; L199-I201 PolarHBondContact O-N 3.08Å; I201-P204 VanDerWaalsContact O-CD 3.26Å; I201-P204 WeakPolarHBondContact O-CD 3.37Å; I201-P204 WeakPolarHBondContact O-CG 3.28Å; I201-F205 HydrophobicContact CG2-CD2 4.49Å; I201-F205 HydrophobicContact CG2-CE2 4.31Å; I201-F205 VanDerWaalsContact O-CD2 3.29Å; I201-F205 WeakPolarHBondContact O-CD2 3.47Å; I201-I332 HydrophobicContact CG2-CD1 4.36Å; I201-I332 HydrophobicContact CG2-CG2 4.15Å; I201-F335 HydrophobicContact CD1-CE1 4.37Å |
| 202 | S | 94 | Very high | 92.3 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -68 | -36.7 | -178.2 | -61.5 | 0 | 0 | 0 | 0 | 113.5 | G198 L199 F205 A206 L324 | G198-S202 WeakPolarHBondContact O-CB 3.43Å; G198-S202 PolarHBondContact O-N 3.09Å; G198-S202 VanDerWaalsContact O-N 3.17Å; G198-S202 PolarHBondContact O-OG 3.5Å; L199-S202 PolarHBondContact O-N 3.15Å; L199-S202 VanDerWaalsContact O-N 3.09Å; S202-F205 PolarHBondContact O-N 2.9Å; S202-A206 WeakPolarHBondContact O-CB 3.35Å; S202-A206 PolarHBondContact O-N 3.04Å; S202-L324 WeakPolarHBondContact OG-CD2 3.26Å |
| 203 | V | 95.9 | Very high | 92.7 | Very high | 7 Ų | 7 | 48.3 Ų | 48.3 | 4% | 0.042 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -51.5 | -56.9 | -178.4 | 168.1 | 0 | 0 | 0 | 0 | 113.9 | L199 F205 A206 M207 P287 L290 I291 | L199-V203 WeakPolarHBondContact O-CG2 3.34Å; L199-V203 PolarHBondContact O-N 2.75Å; L199-V203 VanDerWaalsContact O-N 3.09Å; V203-F205 VanDerWaalsContact C-N 3.29Å; V203-F205 PolarHBondContact O-N 3.39Å; V203-A206 PolarHBondContact O-N 3.04Å; V203-M207 HydrophobicContact CG1-CG 4.35Å; V203-M207 HydrophobicContact CG1-SD 3.85Å; V203-M207 WeakPolarHBondContact O-CB 3.39Å; V203-M207 VanDerWaalsContact O-CG 3.32Å; V203-M207 WeakPolarHBondContact O-CG 3.22Å; V203-M207 PolarHBondContact O-N 3.08Å; V203-P287 HydrophobicContact CG2-CB 4.01Å; V203-L290 HydrophobicContact CG1-CB 4.1Å; V203-L290 HydrophobicContact CG1-CD1 3.81Å; V203-L290 HydrophobicContact CG2-CB 4.14Å; V203-L290 HydrophobicContact CG2-CD1 4.45Å; V203-I291 HydrophobicContact CG2-CD1 4.46Å; V203-I291 HydrophobicContact CG2-CG1 4.12Å |
| 204 | P | 95.1 | Very high | 93 | Very high | 70 Ų | 70 | 47.9 Ų | 47.9 | 46% | 0.455 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.3 | -34.2 | -177.4 | 23.4 | -34.5 | 0 | 0 | 0 | 113 | W200 I201 S208 | W200-P204 WeakPolarHBondContact O-CD 3.45Å; I201-P204 VanDerWaalsContact O-CD 3.26Å; I201-P204 WeakPolarHBondContact O-CD 3.37Å; I201-P204 WeakPolarHBondContact O-CG 3.28Å; P204-S208 WeakPolarHBondContact O-CB 3.37Å; P204-S208 PolarHBondContact O-N 3.27Å; P204-S208 PolarHBondContact O-OG 2.97Å |
| 205 | F | 94.9 | Very high | 93.3 | Very high | 88 Ų | 88 | 48.1 Ų | 48.1 | 39% | 0.386 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -68.9 | -46.6 | 176.9 | -77.4 | -89.3 | 0 | 0 | 0 | 111.4 | I201 S202 V203 M207 S208 H209 P329 I332 | I201-F205 HydrophobicContact CG2-CD2 4.49Å; I201-F205 HydrophobicContact CG2-CE2 4.31Å; I201-F205 VanDerWaalsContact O-CD2 3.29Å; I201-F205 WeakPolarHBondContact O-CD2 3.47Å; S202-F205 PolarHBondContact O-N 2.9Å; V203-F205 VanDerWaalsContact C-N 3.29Å; V203-F205 PolarHBondContact O-N 3.39Å; F205-M207 VanDerWaalsContact C-N 3.34Å; F205-M207 PolarHBondContact O-N 3.11Å; F205-S208 PolarHBondContact O-N 3.14Å; F205-S208 VanDerWaalsContact O-N 3.16Å; F205-S208 PolarHBondContact O-OG 3.47Å; F205-H209 PolarHBondContact O-N 3.39Å; F205-P329 HydrophobicContact CD1-CG 3.62Å; F205-P329 HydrophobicContact CE1-CG 4.17Å; F205-P329 HydrophobicContact CG-CG 4.37Å; F205-I332 HydrophobicContact CB-CD1 4.31Å; F205-I332 HydrophobicContact CD1-CD1 3.6Å; F205-I332 HydrophobicContact CD2-CD1 3.25Å; F205-I332 HydrophobicContact CE1-CD1 3.55Å; F205-I332 HydrophobicContact CE2-CD1 3.2Å; F205-I332 HydrophobicContact CG-CD1 3.43Å; F205-I332 VanDerWaalsContact CG-CD1 3.43Å; F205-I332 HydrophobicContact CZ-CD1 3.35Å |
| 206 | A | 95.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.6 | -42.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S202 V203 S208 H209 V212 I294 V323 L327 | S202-A206 WeakPolarHBondContact O-CB 3.35Å; S202-A206 PolarHBondContact O-N 3.04Å; V203-A206 PolarHBondContact O-N 3.04Å; A206-S208 VanDerWaalsContact C-N 3.28Å; A206-S208 PolarHBondContact O-N 2.64Å; A206-H209 WeakPolarHBondContact O-CB 3.23Å; A206-H209 PolarHBondContact O-N 2.91Å; A206-V212 WeakPolarHBondContact O-CG2 3.27Å; A206-I294 HydrophobicContact CB-CD1 3.93Å; A206-I294 HydrophobicContact CB-CG2 4.19Å; A206-V323 HydrophobicContact CB-CG1 4.04Å; A206-L327 HydrophobicContact CB-CB 4.25Å |
| 207 | M | 94.7 | Very high | 93.6 | Very high | 80 Ų | 80 | 50.7 Ų | 50.7 | 39% | 0.394 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.2 | -30.6 | 175.9 | -72.3 | -177.6 | 66.3 | 0 | 0 | 113.6 | V203 F205 H209 I215 I294 | V203-M207 HydrophobicContact CG1-CG 4.35Å; V203-M207 HydrophobicContact CG1-SD 3.85Å; V203-M207 WeakPolarHBondContact O-CB 3.39Å; V203-M207 VanDerWaalsContact O-CG 3.32Å; V203-M207 WeakPolarHBondContact O-CG 3.22Å; V203-M207 PolarHBondContact O-N 3.08Å; F205-M207 VanDerWaalsContact C-N 3.34Å; F205-M207 PolarHBondContact O-N 3.11Å; M207-H209 VanDerWaalsContact C-N 3.27Å; M207-H209 PolarHBondContact O-N 3.44Å; M207-I215 HydrophobicContact CE-CD1 3.6Å; M207-I215 HydrophobicContact CE-CG1 3.96Å; M207-I215 HydrophobicContact SD-CD1 4.14Å; M207-I294 HydrophobicContact CB-CD1 4.5Å; M207-I294 HydrophobicContact CG-CD1 3.44Å; M207-I294 VanDerWaalsContact CG-CD1 3.44Å; M207-I294 HydrophobicContact CG-CG1 3.76Å |
| 208 | S | 93.9 | Very high | 93.7 | Very high | 86 Ų | 86 | 48.3 Ų | 48.3 | 60% | 0.601 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | -5.8 | -179.6 | 70.6 | 0 | 0 | 0 | 0 | 114 | P204 F205 A206 | P204-S208 WeakPolarHBondContact O-CB 3.37Å; P204-S208 PolarHBondContact O-N 3.27Å; P204-S208 PolarHBondContact O-OG 2.97Å; F205-S208 PolarHBondContact O-N 3.14Å; F205-S208 VanDerWaalsContact O-N 3.16Å; F205-S208 PolarHBondContact O-OG 3.47Å; A206-S208 VanDerWaalsContact C-N 3.28Å; A206-S208 PolarHBondContact O-N 2.64Å |
| 209 | H | 94.6 | Very high | 93.8 | Very high | 54 Ų | 54 | 48.9 Ų | 48.9 | 25% | 0.25 | 28% | 0.279 | C | S | . | . | S | Bend | trans | -66.6 | 134 | -177.8 | -171.5 | -82.8 | 0 | 0 | 0 | 110.8 | F205 A206 M207 A211 V212 L327 | F205-H209 PolarHBondContact O-N 3.39Å; A206-H209 WeakPolarHBondContact O-CB 3.23Å; A206-H209 PolarHBondContact O-N 2.91Å; M207-H209 VanDerWaalsContact C-N 3.27Å; M207-H209 PolarHBondContact O-N 3.44Å; H209-A211 WeakPolarHBondContact ND1-CB 3.33Å; H209-A211 PolarHBondContact ND1-N 2.95Å; H209-A211 PolarHBondContact O-N 2.61Å; H209-A211 VanDerWaalsContact O-N 3.09Å; H209-V212 HydrophobicContact CB-CG2 4.02Å; H209-V212 WeakPolarHBondContact O-CB 3.19Å; H209-V212 PolarHBondContact O-N 3.32Å; H209-L327 HydrophobicContact CB-CB 4.32Å; H209-L327 HydrophobicContact CB-CD2 4.44Å |
| 210 | P | 92.8 | Very high | 93.8 | Very high | 122 Ų | 122 | 53 Ų | 53 | 79% | 0.792 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.4 | -29.9 | -173.8 | -27.5 | 34.9 | 0 | 0 | 0 | 115.5 | V212 | P210-V212 PolarHBondContact O-N 3.01Š|
| 211 | A | 92.8 | Very high | 93.6 | Very high | 5 Ų | 5 | 53.7 Ų | 53.7 | 4% | 0.041 | 31% | 0.311 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | -4.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | H209 T298 A299 E302 T303 | H209-A211 WeakPolarHBondContact ND1-CB 3.33Å; H209-A211 PolarHBondContact ND1-N 2.95Å; H209-A211 PolarHBondContact O-N 2.61Å; H209-A211 VanDerWaalsContact O-N 3.09Å; A211-T298 HydrophobicContact CB-CG2 4.49Å; A211-A299 PolarHBondContact O-N 3.33Å; A211-E302 HydrophobicContact CB-CB 4.02Å; A211-T303 HydrophobicContact CB-CG2 3.72Å |
| 212 | V | 94.7 | Very high | 93.5 | Very high | 18 Ų | 18 | 57.7 Ų | 57.7 | 11% | 0.109 | 33% | 0.328 | C | S | . | . | B | Isolated β-bridge | trans | -98.7 | 120.2 | -178.4 | 180 | 0 | 0 | 0 | 0 | 109.3 | A206 H209 P210 I294 L327 | A206-V212 WeakPolarHBondContact O-CG2 3.27Å; H209-V212 HydrophobicContact CB-CG2 4.02Å; H209-V212 WeakPolarHBondContact O-CB 3.19Å; H209-V212 PolarHBondContact O-N 3.32Å; P210-V212 PolarHBondContact O-N 3.01Å; V212-I294 HydrophobicContact CG1-CG2 4.04Å; V212-I294 HydrophobicContact CG2-CG2 3.94Å; V212-L327 HydrophobicContact CG2-CD1 3.94Å; V212-L327 HydrophobicContact CG2-CD2 4.47Å |
| 213 | T | 94.2 | Very high | 93.3 | Very high | 43 Ų | 43 | 60.8 Ų | 60.8 | 26% | 0.264 | 35% | 0.347 | S | S | . | . | P | Polyproline II helix | trans | -78.7 | 157.8 | 172.2 | 48.7 | 0 | 0 | 0 | 0 | 111.4 | I215 T218 V223 H224 S297 | T213-I215 PolarHBondContact O-N 3.17Å; T213-I215 VanDerWaalsContact O-N 3.09Å; T213-T218 VanDerWaalsContact OG1-CG2 3.26Å; T213-T218 WeakPolarHBondContact OG1-CG2 3.34Å; T213-V223 HydrophobicContact CG2-CG1 4.45Å; T213-H224 WeakPolarHBondContact CG2-NE2 3.29Å; T213-H224 PolarHBondContact OG1-NE2 3.31Å; T213-S297 PolarHBondContact N-O 2.97Å; T213-S297 PolarHBondContact OG1-O 3.03Å |
| 214 | D | 93.8 | Very high | 92.8 | Very high | 113 Ų | 113 | 64.5 Ų | 64.5 | 60% | 0.604 | 36% | 0.363 | S | S | * | . | P | Polyproline II helix | trans | -54.4 | 118.4 | 179.8 | -175.3 | -72.1 | 0 | 0 | 0 | 110.9 | G216 L217 T218 | D214-G216 PolarHBondContact O-N 3.04Å; D214-G216 WeakPolarHBondContact OD1-CA 3.36Å; D214-G216 PolarHBondContact OD1-N 3.2Å; D214-L217 HydrophobicContact CB-CB 4.29Å; D214-L217 WeakPolarHBondContact O-CB 3.43Å; D214-L217 PolarHBondContact O-N 3.04Å; D214-L217 PolarHBondContact OD1-N 3.26Å; D214-L217 VanDerWaalsContact OD1-N 3.12Å; D214-T218 PolarHBondContact O-N 2.55Å; D214-T218 VanDerWaalsContact O-N 3.16Å; D214-T218 PolarHBondContact O-OG1 3.36Å |
| 215 | I | 92.9 | Very high | 92.6 | Very high | 23 Ų | 23 | 62.5 Ų | 62.5 | 12% | 0.118 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -64.6 | -25.5 | -176.1 | 64.2 | 172 | 0 | 0 | 0 | 112.3 | M207 T213 L217 T218 A219 W228 L290 I294 | M207-I215 HydrophobicContact CE-CD1 3.6Å; M207-I215 HydrophobicContact CE-CG1 3.96Å; M207-I215 HydrophobicContact SD-CD1 4.14Å; T213-I215 PolarHBondContact O-N 3.17Å; T213-I215 VanDerWaalsContact O-N 3.09Å; I215-L217 VanDerWaalsContact C-N 3.34Å; I215-T218 WeakPolarHBondContact CA-OG1 3.38Å; I215-T218 PolarHBondContact O-OG1 3.11Å; I215-A219 WeakPolarHBondContact O-CB 3.4Å; I215-A219 PolarHBondContact O-N 3.07Å; I215-W228 WeakPolarHBondContact O-CZ2 3.47Å; I215-W228 PolarHBondContact O-NE1 3.44Å; I215-L290 HydrophobicContact CD1-CD2 4.04Å; I215-I294 HydrophobicContact CG2-CG1 4.19Å |
| 216 | G | 92.1 | Very high | 92.4 | Very high | 46 Ų | 46 | 59.8 Ų | 59.8 | 47% | 0.474 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -69.1 | -34.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | D214 A219 | D214-G216 PolarHBondContact O-N 3.04Å; D214-G216 WeakPolarHBondContact OD1-CA 3.36Å; D214-G216 PolarHBondContact OD1-N 3.2Å; G216-A219 WeakPolarHBondContact O-CB 3.46Å |
| 217 | L | 92.4 | Very high | 92.3 | Very high | 88 Ų | 88 | 61.7 Ų | 61.7 | 46% | 0.461 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -70.2 | -51.1 | 174.3 | -174.8 | 74.9 | 0 | 0 | 0 | 111.2 | D214 I215 A219 V220 H221 V223 | D214-L217 HydrophobicContact CB-CB 4.29Å; D214-L217 WeakPolarHBondContact O-CB 3.43Å; D214-L217 PolarHBondContact O-N 3.04Å; D214-L217 PolarHBondContact OD1-N 3.26Å; D214-L217 VanDerWaalsContact OD1-N 3.12Å; I215-L217 VanDerWaalsContact C-N 3.34Å; L217-A219 PolarHBondContact O-N 2.91Å; L217-V220 PolarHBondContact O-N 3.12Å; L217-H221 WeakPolarHBondContact O-CB 3.42Å; L217-H221 PolarHBondContact O-CD2 2.89Å; L217-H221 PolarHBondContact O-N 3.44Å; L217-V223 HydrophobicContact CD2-CG2 4.29Å |
| 218 | T | 93 | Very high | 92.2 | Very high | 7 Ų | 7 | 59.3 Ų | 59.3 | 4% | 0.043 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -70.1 | -11.4 | -178.8 | 60.2 | 0 | 0 | 0 | 0 | 113.4 | T213 D214 I215 V220 H221 V223 P227 W228 S297 | T213-T218 VanDerWaalsContact OG1-CG2 3.26Å; T213-T218 WeakPolarHBondContact OG1-CG2 3.34Å; D214-T218 PolarHBondContact O-N 2.55Å; D214-T218 VanDerWaalsContact O-N 3.16Å; D214-T218 PolarHBondContact O-OG1 3.36Å; I215-T218 WeakPolarHBondContact CA-OG1 3.38Å; I215-T218 PolarHBondContact O-OG1 3.11Å; T218-V220 PolarHBondContact O-N 3.5Å; T218-H221 WeakPolarHBondContact CA-O 3.1Å; T218-V223 HydrophobicContact CG2-CB 4.12Å; T218-V223 HydrophobicContact CG2-CG2 3.94Å; T218-P227 VanDerWaalsContact O-CA 3.3Å; T218-P227 WeakPolarHBondContact O-CA 3.47Å; T218-W228 VanDerWaalsContact C-CD1 3.44Å; T218-W228 PolarHBondContact O-N 3.19Å; T218-W228 PolarHBondContact OG1-NE1 2.86Å; T218-W228 VanDerWaalsContact OG1-NE1 3.15Å; T218-S297 WeakPolarHBondContact CB-OG 3.48Å; T218-S297 PolarHBondContact OG1-OG 3.43Å |
| 219 | A | 92.2 | Very high | 92 | Very high | 12 Ų | 12 | 59 Ų | 59 | 10% | 0.099 | 33% | 0.332 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -35.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | I215 G216 L217 P227 W228 L229 | I215-A219 WeakPolarHBondContact O-CB 3.4Å; I215-A219 PolarHBondContact O-N 3.07Å; G216-A219 WeakPolarHBondContact O-CB 3.46Å; L217-A219 PolarHBondContact O-N 2.91Å; A219-P227 VanDerWaalsContact O-CB 3.22Å; A219-P227 WeakPolarHBondContact O-CB 3.41Å; A219-W228 HydrophobicContact CB-CD2 4.4Å; A219-W228 HydrophobicContact CB-CH2 4.26Å; A219-W228 HydrophobicContact CB-CZ2 3.47Å; A219-W228 VanDerWaalsContact CB-CZ2 3.47Å; A219-W228 VanDerWaalsContact N-NE1 3.13Å; A219-L229 WeakPolarHBondContact O-CB 3.22Å; A219-L229 PolarHBondContact O-N 3.41Å |
| 220 | V | 92 | Very high | 91.8 | Very high | 88 Ų | 88 | 57.5 Ų | 57.5 | 53% | 0.533 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -125 | -20.8 | -173.7 | -63.9 | 0 | 0 | 0 | 0 | 113.3 | L217 T218 P227 | L217-V220 PolarHBondContact O-N 3.12Å; T218-V220 PolarHBondContact O-N 3.5Å; V220-P227 WeakPolarHBondContact O-CG 3.32Å |
| 221 | H | 91.3 | Very high | 91.5 | Very high | 107 Ų | 107 | 56 Ų | 56 | 50% | 0.495 | 32% | 0.323 | S | S | . | . | S | Bend | trans | -105.9 | 139.6 | 178.9 | -62.8 | -68.3 | 0 | 0 | 0 | 111.8 | L217 T218 V223 | L217-H221 WeakPolarHBondContact O-CB 3.42Å; L217-H221 PolarHBondContact O-CD2 2.89Å; L217-H221 PolarHBondContact O-N 3.44Å; T218-H221 WeakPolarHBondContact CA-O 3.1Å; H221-V223 PolarHBondContact O-N 3.41Å |
| 222 | Q | 90.8 | Very high | 91.2 | Very high | 154 Ų | 154 | 58.7 Ų | 58.7 | 72% | 0.72 | 34% | 0.337 | S | S | * | . | trans | -79.1 | 108.6 | 172.8 | -177.2 | 176.2 | -11.7 | 0 | 0 | 109.3 | Q225 | Q222-Q225 WeakPolarHBondContact CG-O 2.84Š| ||
| 223 | V | 89.2 | Confident | 90.7 | Very high | 66 Ų | 66 | 61.7 Ų | 61.7 | 40% | 0.4 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -109.6 | -69.6 | 178.8 | -177 | 0 | 0 | 0 | 0 | 110 | T213 L217 T218 H221 | T213-V223 HydrophobicContact CG2-CG1 4.45Å; L217-V223 HydrophobicContact CD2-CG2 4.29Å; T218-V223 HydrophobicContact CG2-CB 4.12Å; T218-V223 HydrophobicContact CG2-CG2 3.94Å; H221-V223 PolarHBondContact O-N 3.41Å |
| 224 | H | 87.3 | Confident | 90.2 | Very high | 84 Ų | 84 | 64 Ų | 64 | 39% | 0.389 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -96.6 | -38.3 | 176.4 | -57.6 | -61.7 | 0 | 0 | 0 | 111.9 | T213 S297 | T213-H224 WeakPolarHBondContact CG2-NE2 3.29Å; T213-H224 PolarHBondContact OG1-NE2 3.31Å; H224-S297 PolarHBondContact CD2-O 3.31Å |
| 225 | Q | 90.3 | Very high | 89.6 | Confident | 29 Ų | 29 | 63.3 Ų | 63.3 | 14% | 0.136 | 37% | 0.366 | C | S | . | . | S | Bend | trans | -147 | -177.7 | 178 | 57.8 | 171.6 | 45.2 | 0 | 0 | 110.2 | Y76 P78 Q222 A296 | Y76-Q225 PolarHBondContact O-NE2 3.49Å; P78-Q225 HydrophobicContact CG-CB 4.27Å; Q222-Q225 WeakPolarHBondContact CG-O 2.84Å; Q225-A296 HydrophobicContact CG-CB 4.4Å; Q225-A296 WeakPolarHBondContact CG-O 3.41Å; Q225-A296 VanDerWaalsContact NE2-CA 3.33Å |
| 226 | A | 90.2 | Very high | 89.2 | Confident | 30 Ų | 30 | 64.9 Ų | 64.9 | 25% | 0.248 | 37% | 0.373 | C | S | . | . | S | Bend | trans | -54.2 | 147.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | P78 W228 | P78-A226 HydrophobicContact CB-CB 4.09Å; A226-W228 PolarHBondContact O-N 2.94Å |
| 227 | P | 92.5 | Very high | 89.1 | Confident | 41 Ų | 41 | 66.5 Ų | 66.5 | 27% | 0.266 | 37% | 0.37 | S | S | . | . | trans | -57.3 | 132.2 | -175.3 | -22.2 | 31.1 | 0 | 0 | 0 | 112.6 | T218 A219 V220 L229 G230 | T218-P227 VanDerWaalsContact O-CA 3.3Å; T218-P227 WeakPolarHBondContact O-CA 3.47Å; A219-P227 VanDerWaalsContact O-CB 3.22Å; A219-P227 WeakPolarHBondContact O-CB 3.41Å; V220-P227 WeakPolarHBondContact O-CG 3.32Å; P227-L229 VanDerWaalsContact C-N 3.25Å; P227-L229 PolarHBondContact O-N 3.45Å; P227-G230 PolarHBondContact O-N 3.26Å; P227-G230 VanDerWaalsContact O-N 3.07Å | ||
| 228 | W | 92.7 | Very high | 89 | Confident | 30 Ų | 30 | 69.2 Ų | 69.2 | 11% | 0.114 | 38% | 0.375 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | -13.7 | -172.7 | 66 | -100.9 | 0 | 0 | 0 | 113.6 | V75 G81 L82 I215 T218 A219 A226 G230 A293 A296 | V75-W228 HydrophobicContact CG1-CB 4.29Å; V75-W228 HydrophobicContact CG1-CE3 3.98Å; G81-W228 CarbonylContact C-O 3.36Å; G81-W228 WeakPolarHBondContact CA-O 3.24Å; L82-W228 HydrophobicContact CB-CE3 4.4Å; L82-W228 HydrophobicContact CB-CZ3 4.37Å; L82-W228 HydrophobicContact CD2-CZ3 4.27Å; L82-W228 PolarHBondContact N-O 3.43Å; I215-W228 WeakPolarHBondContact O-CZ2 3.47Å; I215-W228 PolarHBondContact O-NE1 3.44Å; T218-W228 VanDerWaalsContact C-CD1 3.44Å; T218-W228 PolarHBondContact O-N 3.19Å; T218-W228 PolarHBondContact OG1-NE1 2.86Å; T218-W228 VanDerWaalsContact OG1-NE1 3.15Å; A219-W228 HydrophobicContact CB-CD2 4.4Å; A219-W228 HydrophobicContact CB-CH2 4.26Å; A219-W228 HydrophobicContact CB-CZ2 3.47Å; A219-W228 VanDerWaalsContact CB-CZ2 3.47Å; A219-W228 VanDerWaalsContact N-NE1 3.13Å; A226-W228 PolarHBondContact O-N 2.94Å; W228-G230 PolarHBondContact O-N 2.88Å; W228-A293 HydrophobicContact CD2-CB 3.55Å; W228-A293 HydrophobicContact CE3-CB 3.8Å; W228-A293 HydrophobicContact CG-CB 3.9Å; W228-A293 HydrophobicContact CH2-CB 4.47Å; W228-A293 HydrophobicContact CZ2-CB 4.22Å; W228-A293 HydrophobicContact CZ3-CB 4.26Å; W228-A296 HydrophobicContact CB-CB 3.78Å |
| 229 | L | 91.4 | Very high | 88.7 | Confident | 78 Ų | 78 | 70.2 Ų | 70.2 | 41% | 0.408 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -31.5 | 170.2 | -167.2 | 72.4 | 0 | 0 | 0 | 110.8 | L82 A83 A219 P227 | L82-L229 HydrophobicContact CB-CD1 4.46Å; L82-L229 HydrophobicContact CD2-CD1 3.94Å; L82-L229 PolarHBondContact N-O 3.49Å; A83-L229 PolarHBondContact N-O 2.83Å; A219-L229 WeakPolarHBondContact O-CB 3.22Å; A219-L229 PolarHBondContact O-N 3.41Å; P227-L229 VanDerWaalsContact C-N 3.25Å; P227-L229 PolarHBondContact O-N 3.45Å |
| 230 | G | 88.5 | Confident | 88.6 | Confident | 24 Ų | 24 | 72.2 Ų | 72.2 | 25% | 0.247 | 39% | 0.386 | C | S | . | . | trans | 71 | 175.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y80 P227 W228 | Y80-G230 WeakPolarHBondContact O-CA 3.33Å; P227-G230 PolarHBondContact O-N 3.26Å; P227-G230 VanDerWaalsContact O-N 3.07Å; W228-G230 PolarHBondContact O-N 2.88Å | ||
| 231 | S | 86.6 | Confident | 88.6 | Confident | 89 Ų | 89 | 71.8 Ų | 71.8 | 62% | 0.622 | 38% | 0.38 | S | S | * | . | trans | -146.5 | 143.4 | 174.5 | 66 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 232 | I | 86.7 | Confident | 88.6 | Confident | 62 Ų | 62 | 66.9 Ų | 66.9 | 32% | 0.318 | 36% | 0.358 | S | S | . | . | trans | -92.4 | 117.3 | 174.6 | -53.4 | 168.7 | 0 | 0 | 0 | 107.5 | A83 I237 W240 | A83-I232 HydrophobicContact CB-CG1 3.98Å; I232-I237 HydrophobicContact CG2-CG1 3.86Å; I232-W240 HydrophobicContact CD1-CD2 3.84Å; I232-W240 HydrophobicContact CD1-CG 3.96Å; I232-W240 HydrophobicContact CD1-CZ2 4.1Å; I232-W240 HydrophobicContact CG1-CG 4.45Å; I232-W240 HydrophobicContact CG2-CB 4.24Å; I232-W240 HydrophobicContact CG2-CG 4.23Å | ||
| 233 | N | 84.9 | Confident | 88.5 | Confident | 81 Ų | 81 | 60.5 Ų | 60.5 | 43% | 0.433 | 33% | 0.329 | S | S | . | . | trans | -68.2 | 140.1 | 174.5 | -169.1 | -37.1 | 0 | 0 | 0 | 109.8 | L235 E236 I237 | N233-L235 PolarHBondContact O-N 3.23Å; N233-L235 PolarHBondContact OD1-N 3.19Å; N233-L235 VanDerWaalsContact OD1-N 3.14Å; N233-E236 HydrophobicContact CB-CG 4.33Å; N233-E236 PolarHBondContact O-N 3.26Å; N233-I237 PolarHBondContact O-N 2.78Å | ||
| 234 | S | 83.3 | Confident | 88.6 | Confident | 93 Ų | 93 | 59 Ų | 59 | 65% | 0.65 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.7 | -29.2 | 176.3 | -55.4 | 0 | 0 | 0 | 0 | 113.5 | E236 | S234-E236 VanDerWaalsContact C-N 3.35Š|
| 235 | L | 82.4 | Confident | 88.9 | Confident | 98 Ų | 98 | 57 Ų | 57 | 51% | 0.513 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | -20.6 | 178.1 | -67.2 | 170.1 | 0 | 0 | 0 | 114 | N233 | N233-L235 PolarHBondContact O-N 3.23Å; N233-L235 PolarHBondContact OD1-N 3.19Å; N233-L235 VanDerWaalsContact OD1-N 3.14Å |
| 236 | E | 84.4 | Confident | 89 | Confident | 56 Ų | 56 | 55.6 Ų | 55.6 | 26% | 0.262 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.1 | -6.7 | -174.2 | -65.3 | 173.3 | 159.7 | 0 | 0 | 112.6 | W84 N233 S234 Y238 T239 W240 | W84-E236 HydrophobicContact CH2-CB 4.16Å; W84-E236 HydrophobicContact CZ2-CB 3.94Å; W84-E236 WeakPolarHBondContact CZ2-OE2 3.46Å; N233-E236 HydrophobicContact CB-CG 4.33Å; N233-E236 PolarHBondContact O-N 3.26Å; S234-E236 VanDerWaalsContact C-N 3.35Å; E236-Y238 PolarHBondContact O-N 3.44Å; E236-Y238 VanDerWaalsContact O-N 3.12Å; E236-T239 PolarHBondContact O-N 3.37Å; E236-W240 WeakPolarHBondContact O-CB 3.46Å; E236-W240 PolarHBondContact O-N 2.94Å |
| 237 | I | 89.1 | Confident | 89 | Confident | 80 Ų | 80 | 54.5 Ų | 54.5 | 41% | 0.41 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -49.5 | -41.5 | 179 | -78.9 | 175 | 0 | 0 | 0 | 112.1 | I232 N233 W240 L241 | I232-I237 HydrophobicContact CG2-CG1 3.86Å; N233-I237 PolarHBondContact O-N 2.78Å; I237-W240 PolarHBondContact O-N 3.01Å; I237-L241 WeakPolarHBondContact O-CB 3.34Å; I237-L241 PolarHBondContact O-N 3.39Å |
| 238 | Y | 89.4 | Confident | 89 | Confident | 145 Ų | 145 | 53.3 Ų | 53.3 | 57% | 0.569 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -70.1 | -40.2 | -179 | -64.6 | -60.4 | 0 | 0 | 0 | 112.7 | E236 L241 D242 R476 | E236-Y238 PolarHBondContact O-N 3.44Å; E236-Y238 VanDerWaalsContact O-N 3.12Å; Y238-L241 PolarHBondContact O-N 3.17Å; Y238-D242 WeakPolarHBondContact O-CB 3.35Å; Y238-D242 PolarHBondContact O-N 3.38Å; Y238-R476 WeakPolarHBondContact CB-O 3.27Å |
| 239 | T | 87.3 | Confident | 89.1 | Confident | 28 Ų | 28 | 54.6 Ų | 54.6 | 17% | 0.172 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.6 | -42.2 | 174.3 | -49.4 | 0 | 0 | 0 | 0 | 111 | E236 L241 D242 N243 R476 | E236-T239 PolarHBondContact O-N 3.37Å; T239-L241 VanDerWaalsContact C-N 3.33Å; T239-L241 PolarHBondContact O-N 3.35Å; T239-D242 PolarHBondContact O-N 2.85Å; T239-N243 WeakPolarHBondContact O-CB 3.46Å; T239-N243 PolarHBondContact O-N 2.87Å; T239-N243 PolarHBondContact O-ND2 3.01Å; T239-N243 PolarHBondContact O-OD1 3.48Å; T239-R476 WeakPolarHBondContact OG1-CA 3.47Å; T239-R476 PolarHBondContact OG1-O 3.15Å; T239-R476 VanDerWaalsContact OG1-O 3.13Å |
| 240 | W | 89.6 | Confident | 89 | Confident | 54 Ų | 54 | 50.9 Ų | 50.9 | 21% | 0.205 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.9 | -47.8 | 175.2 | -172.3 | 98.4 | 0 | 0 | 0 | 110.4 | A83 W84 Q86 I232 E236 I237 N243 F244 | A83-W240 PolarHBondContact O-NE1 3.39Å; W84-W240 AromaticContact CD2-CD1 3.97Å; W84-W240 AromaticContact CE3-CD1 3.99Å; W84-W240 HydrophobicContact CH2-CB 4.31Å; Q86-W240 HydrophobicContact CG-CZ2 3.93Å; Q86-W240 PolarHBondContact NE2-O 3.01Å; I232-W240 HydrophobicContact CD1-CD2 3.84Å; I232-W240 HydrophobicContact CD1-CG 3.96Å; I232-W240 HydrophobicContact CD1-CZ2 4.1Å; I232-W240 HydrophobicContact CG1-CG 4.45Å; I232-W240 HydrophobicContact CG2-CB 4.24Å; I232-W240 HydrophobicContact CG2-CG 4.23Å; E236-W240 WeakPolarHBondContact O-CB 3.46Å; E236-W240 PolarHBondContact O-N 2.94Å; I237-W240 PolarHBondContact O-N 3.01Å; W240-N243 PolarHBondContact O-N 3.41Å; W240-F244 HydrophobicContact CE3-CB 4.28Å; W240-F244 HydrophobicContact CH2-CB 4.41Å; W240-F244 HydrophobicContact CH2-CD1 4.28Å; W240-F244 HydrophobicContact CH2-CD2 4.12Å; W240-F244 HydrophobicContact CH2-CE2 4.45Å; W240-F244 HydrophobicContact CH2-CG 4.03Å; W240-F244 HydrophobicContact CZ3-CB 4.03Å; W240-F244 HydrophobicContact CZ3-CD1 4.08Å; W240-F244 AromaticContact CZ3-CG 3.97Å; W240-F244 HydrophobicContact CZ3-CG 3.97Å; W240-F244 WeakPolarHBondContact O-CB 3.24Å; W240-F244 PolarHBondContact O-N 2.92Å |
| 241 | L | 91.9 | Very high | 89 | Confident | 78 Ų | 78 | 49.7 Ų | 49.7 | 41% | 0.408 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 177.6 | -175 | 65.3 | 0 | 0 | 0 | 112 | I237 Y238 T239 F244 L245 | I237-L241 WeakPolarHBondContact O-CB 3.34Å; I237-L241 PolarHBondContact O-N 3.39Å; Y238-L241 PolarHBondContact O-N 3.17Å; T239-L241 VanDerWaalsContact C-N 3.33Å; T239-L241 PolarHBondContact O-N 3.35Å; L241-F244 PolarHBondContact O-N 3.37Å; L241-L245 HydrophobicContact CD1-CD1 4.45Å; L241-L245 HydrophobicContact CD1-CG 4.31Å; L241-L245 HydrophobicContact CG-CD1 4.09Å; L241-L245 HydrophobicContact CG-CG 4.37Å; L241-L245 VanDerWaalsContact O-CG 3.27Å; L241-L245 WeakPolarHBondContact O-CG 3.42Å; L241-L245 PolarHBondContact O-N 3.47Å |
| 242 | D | 91.6 | Very high | 89.3 | Confident | 4 Ų | 4 | 45.5 Ų | 45.5 | 2% | 0.021 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.9 | -45.9 | 178 | -157.7 | 27.4 | 0 | 0 | 0 | 111.5 | Y238 T239 F244 L246 P478 F479 K480 T481 | Y238-D242 WeakPolarHBondContact O-CB 3.35Å; Y238-D242 PolarHBondContact O-N 3.38Å; T239-D242 PolarHBondContact O-N 2.85Å; D242-F244 VanDerWaalsContact C-N 3.35Å; D242-L246 WeakPolarHBondContact O-CB 3.17Å; D242-L246 PolarHBondContact O-N 3Å; D242-P478 HydrophobicContact CB-CB 3.68Å; D242-P478 VanDerWaalsContact OD2-CA 3.27Å; D242-P478 WeakPolarHBondContact OD2-CA 3.3Å; D242-F479 PolarHBondContact OD2-N 3.23Å; D242-K480 WeakPolarHBondContact OD2-CB 3.47Å; D242-K480 PolarHBondContact OD2-N 3.38Å; D242-T481 WeakPolarHBondContact OD1-CB 3.39Å; D242-T481 PolarHBondContact OD1-N 2.91Å; D242-T481 PolarHBondContact OD1-OG1 3.26Å |
| 243 | N | 89 | Confident | 89.6 | Confident | 20 Ų | 20 | 42.8 Ų | 42.8 | 11% | 0.107 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.2 | -42.6 | 174.4 | -66.4 | -12.5 | 0 | 0 | 0 | 111.5 | T239 W240 L246 L247 Y407 | T239-N243 WeakPolarHBondContact O-CB 3.46Å; T239-N243 PolarHBondContact O-N 2.87Å; T239-N243 PolarHBondContact O-ND2 3.01Å; T239-N243 PolarHBondContact O-OD1 3.48Å; W240-N243 PolarHBondContact O-N 3.41Å; N243-L246 WeakPolarHBondContact O-CB 3.22Å; N243-L246 PolarHBondContact O-N 2.7Å; N243-L247 WeakPolarHBondContact O-CG 3.45Å; N243-L247 PolarHBondContact O-N 3.27Å; N243-Y407 HydrophobicContact CB-CE2 3.96Å; N243-Y407 WeakPolarHBondContact OD1-CE2 3.25Å; N243-Y407 VanDerWaalsContact OD1-CZ 3.23Å; N243-Y407 PolarHBondContact OD1-OH 2.71Å |
| 244 | F | 91.6 | Very high | 89.8 | Confident | 35 Ų | 35 | 39.2 Ų | 39.2 | 15% | 0.154 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -65.4 | -43.9 | -178.3 | -170.5 | -117.7 | 0 | 0 | 0 | 111.7 | Q86 I89 L93 W240 L241 D242 L246 L247 I248 | Q86-F244 HydrophobicContact CB-CD2 4.13Å; Q86-F244 HydrophobicContact CG-CD2 4.22Å; Q86-F244 VanDerWaalsContact OE1-CA 3.28Å; I89-F244 HydrophobicContact CB-CE2 4.28Å; I89-F244 HydrophobicContact CG2-CE2 4Å; I89-F244 HydrophobicContact CG2-CZ 3.92Å; L93-F244 HydrophobicContact CD1-CE1 4.32Å; L93-F244 HydrophobicContact CD1-CZ 3.79Å; W240-F244 HydrophobicContact CE3-CB 4.28Å; W240-F244 HydrophobicContact CH2-CB 4.41Å; W240-F244 HydrophobicContact CH2-CD1 4.28Å; W240-F244 HydrophobicContact CH2-CD2 4.12Å; W240-F244 HydrophobicContact CH2-CE2 4.45Å; W240-F244 HydrophobicContact CH2-CG 4.03Å; W240-F244 HydrophobicContact CZ3-CB 4.03Å; W240-F244 HydrophobicContact CZ3-CD1 4.08Å; W240-F244 AromaticContact CZ3-CG 3.97Å; W240-F244 HydrophobicContact CZ3-CG 3.97Å; W240-F244 WeakPolarHBondContact O-CB 3.24Å; W240-F244 PolarHBondContact O-N 2.92Å; L241-F244 PolarHBondContact O-N 3.37Å; D242-F244 VanDerWaalsContact C-N 3.35Å; F244-L246 VanDerWaalsContact C-N 3.34Å; F244-L247 PolarHBondContact O-N 3.19Å; F244-I248 HydrophobicContact CD1-CD1 3.74Å; F244-I248 HydrophobicContact CE1-CD1 3.48Å; F244-I248 VanDerWaalsContact CE1-CD1 3.48Å; F244-I248 HydrophobicContact CE2-CD1 4.37Å; F244-I248 HydrophobicContact CG-CD1 4.31Å; F244-I248 HydrophobicContact CZ-CD1 3.82Å; F244-I248 VanDerWaalsContact O-CG1 3.32Å; F244-I248 WeakPolarHBondContact O-CG1 3.08Å; F244-I248 PolarHBondContact O-N 3.14Å |
| 245 | L | 93.9 | Very high | 90 | Very high | 42 Ų | 42 | 35 Ų | 35 | 22% | 0.22 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -65 | -38.9 | 175.4 | -66.2 | 172.5 | 0 | 0 | 0 | 111.8 | L241 I248 F249 T481 | L241-L245 HydrophobicContact CD1-CD1 4.45Å; L241-L245 HydrophobicContact CD1-CG 4.31Å; L241-L245 HydrophobicContact CG-CD1 4.09Å; L241-L245 HydrophobicContact CG-CG 4.37Å; L241-L245 VanDerWaalsContact O-CG 3.27Å; L241-L245 WeakPolarHBondContact O-CG 3.42Å; L241-L245 PolarHBondContact O-N 3.47Å; L245-I248 PolarHBondContact O-N 3.33Å; L245-F249 HydrophobicContact CB-CD2 4.27Å; L245-F249 HydrophobicContact CD2-CD2 4.3Å; L245-F249 HydrophobicContact CD2-CE2 3.76Å; L245-F249 WeakPolarHBondContact O-CB 3.24Å; L245-F249 WeakPolarHBondContact O-CD2 3.44Å; L245-F249 PolarHBondContact O-N 3.36Å; L245-T481 HydrophobicContact CD1-CG2 4.05Å |
| 246 | L | 92.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61 | -42.8 | 174.4 | 174.2 | 150.3 | 0 | 0 | 0 | 111.9 | D242 N243 F244 G250 Y407 D411 Y414 K480 | D242-L246 WeakPolarHBondContact O-CB 3.17Å; D242-L246 PolarHBondContact O-N 3Å; N243-L246 WeakPolarHBondContact O-CB 3.22Å; N243-L246 PolarHBondContact O-N 2.7Å; F244-L246 VanDerWaalsContact C-N 3.34Å; L246-G250 WeakPolarHBondContact O-CA 3.44Å; L246-G250 PolarHBondContact O-N 3.01Å; L246-Y407 HydrophobicContact CD1-CE1 3.61Å; L246-Y407 WeakPolarHBondContact CD1-OH 3.24Å; L246-Y407 HydrophobicContact CD2-CE1 4.21Å; L246-Y407 HydrophobicContact CD2-CE2 4.06Å; L246-D411 HydrophobicContact CD1-CB 3.9Å; L246-Y414 HydrophobicContact CB-CD1 3.65Å; L246-Y414 HydrophobicContact CB-CE1 3.97Å; L246-Y414 HydrophobicContact CB-CG 4.11Å; L246-Y414 HydrophobicContact CD1-CD1 3.95Å; L246-Y414 HydrophobicContact CG-CD1 3.89Å; L246-Y414 HydrophobicContact CG-CG 4.14Å; L246-K480 HydrophobicContact CD1-CD 3.78Å |
| 247 | L | 90.1 | Very high | 90.4 | Very high | 7 Ų | 7 | 28 Ų | 28 | 4% | 0.037 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.9 | -42.3 | 177.5 | -67.5 | 171.1 | 0 | 0 | 0 | 111.7 | Q86 Y91 N243 F244 G251 W406 | Q86-L247 HydrophobicContact CB-CD1 3.64Å; Y91-L247 HydrophobicContact CE2-CD2 3.71Å; Y91-L247 VanDerWaalsContact OH-CD2 3.31Å; Y91-L247 WeakPolarHBondContact OH-CD2 3.41Å; N243-L247 WeakPolarHBondContact O-CG 3.45Å; N243-L247 PolarHBondContact O-N 3.27Å; F244-L247 PolarHBondContact O-N 3.19Å; L247-G251 PolarHBondContact O-N 2.86Å; L247-W406 HydrophobicContact CD2-CH2 4.19Å; L247-W406 HydrophobicContact CD2-CZ2 4.36Å |
| 248 | I | 92.6 | Very high | 90.4 | Very high | 15 Ų | 15 | 24.1 Ų | 24.1 | 8% | 0.077 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -66.3 | -54.8 | 179.2 | -65.2 | 168.5 | 0 | 0 | 0 | 110.8 | L93 S94 F244 L245 | L93-I248 HydrophobicContact CB-CD1 4.28Å; L93-I248 HydrophobicContact CB-CG1 4.03Å; L93-I248 HydrophobicContact CB-CG2 4.37Å; L93-I248 HydrophobicContact CD1-CD1 3.83Å; L93-I248 HydrophobicContact CD1-CG1 4.35Å; S94-I248 WeakPolarHBondContact CA-O 3.22Å; S94-I248 WeakPolarHBondContact CB-O 3.4Å; S94-I248 PolarHBondContact OG-O 3.26Å; F244-I248 HydrophobicContact CD1-CD1 3.74Å; F244-I248 HydrophobicContact CE1-CD1 3.48Å; F244-I248 VanDerWaalsContact CE1-CD1 3.48Å; F244-I248 HydrophobicContact CE2-CD1 4.37Å; F244-I248 HydrophobicContact CG-CD1 4.31Å; F244-I248 HydrophobicContact CZ-CD1 3.82Å; F244-I248 VanDerWaalsContact O-CG1 3.32Å; F244-I248 WeakPolarHBondContact O-CG1 3.08Å; F244-I248 PolarHBondContact O-N 3.14Å; L245-I248 PolarHBondContact O-N 3.33Å |
| 249 | F | 94.2 | Very high | 90.2 | Very high | 57 Ų | 57 | 17.3 Ų | 17.3 | 25% | 0.25 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -89.2 | -28 | -169.7 | -66.4 | -53.8 | 0 | 0 | 0 | 113.4 | L245 G251 I252 P253 Y414 F418 | L245-F249 HydrophobicContact CB-CD2 4.27Å; L245-F249 HydrophobicContact CD2-CD2 4.3Å; L245-F249 HydrophobicContact CD2-CE2 3.76Å; L245-F249 WeakPolarHBondContact O-CB 3.24Å; L245-F249 WeakPolarHBondContact O-CD2 3.44Å; L245-F249 PolarHBondContact O-N 3.36Å; F249-G251 VanDerWaalsContact C-N 3.31Å; F249-I252 HydrophobicContact CD1-CD1 3.91Å; F249-I252 PolarHBondContact O-N 3.13Å; F249-P253 WeakPolarHBondContact O-CD 3.02Å; F249-Y414 HydrophobicContact CB-CD2 3.63Å; F249-Y414 HydrophobicContact CB-CE2 3.53Å; F249-Y414 HydrophobicContact CD2-CE2 4.01Å; F249-Y414 HydrophobicContact CG-CE2 4.24Å; F249-F418 HydrophobicContact CB-CD1 3.8Å; F249-F418 HydrophobicContact CB-CD2 4.22Å; F249-F418 HydrophobicContact CB-CE1 3.62Å; F249-F418 HydrophobicContact CB-CE2 4.07Å; F249-F418 HydrophobicContact CB-CG 4.09Å; F249-F418 HydrophobicContact CB-CZ 3.77Å; F249-F418 AromaticContact CD1-CE1 3.81Å; F249-F418 HydrophobicContact CD1-CE1 3.81Å; F249-F418 AromaticContact CD1-CE2 3.86Å; F249-F418 HydrophobicContact CD1-CE2 3.86Å; F249-F418 AromaticContact CD1-CZ 3.27Å; F249-F418 HydrophobicContact CD1-CZ 3.27Å; F249-F418 HydrophobicContact CD2-CE1 4.38Å; F249-F418 AromaticContact CE1-CZ 4Å; F249-F418 HydrophobicContact CE1-CZ 4Å; F249-F418 HydrophobicContact CG-CD1 4.37Å; F249-F418 AromaticContact CG-CE1 3.7Å; F249-F418 HydrophobicContact CG-CE1 3.7Å; F249-F418 HydrophobicContact CG-CE2 4.32Å; F249-F418 AromaticContact CG-CZ 3.66Å; F249-F418 HydrophobicContact CG-CZ 3.66Å; F249-F418 VanDerWaalsContact O-CD2 3.3Å; F249-F418 WeakPolarHBondContact O-CD2 2.92Å |
| 250 | G | 90.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -68.3 | -30.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L246 I252 P253 I413 | L246-G250 WeakPolarHBondContact O-CA 3.44Å; L246-G250 PolarHBondContact O-N 3.01Å; G250-I252 VanDerWaalsContact C-N 3.32Å; G250-I252 PolarHBondContact O-N 2.93Å; G250-P253 WeakPolarHBondContact O-CD 3.13Å; G250-I413 WeakPolarHBondContact O-CG2 3.19Å |
| 251 | G | 88.2 | Confident | 89.9 | Confident | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 7% | 0.068 | C | C | . | . | S | Bend | trans | -71.3 | -21.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | W62 S94 L247 F249 W254 | W62-G251 WeakPolarHBondContact CH2-O 3.16Å; W62-G251 VanDerWaalsContact CZ2-O 3.3Å; W62-G251 WeakPolarHBondContact CZ2-O 3.4Å; S94-G251 VanDerWaalsContact OG-CA 3.27Å; S94-G251 WeakPolarHBondContact OG-CA 3.25Å; L247-G251 PolarHBondContact O-N 2.86Å; F249-G251 VanDerWaalsContact C-N 3.31Å; G251-W254 WeakPolarHBondContact O-CB 3.33Å |
| 252 | I | 92.5 | Very high | 89.6 | Confident | 0 Ų | 0 | 10.1 Ų | 10.1 | 0% | 0 | 5% | 0.049 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -56.6 | -177.4 | -65.2 | 170.2 | 0 | 0 | 0 | 112 | S94 V97 F102 F249 G250 W254 Y257 F258 F418 L421 | S94-I252 PolarHBondContact OG-N 3.47Å; S94-I252 VanDerWaalsContact OG-N 3.11Å; V97-I252 HydrophobicContact CB-CD1 4.09Å; V97-I252 HydrophobicContact CG1-CD1 3.62Å; F102-I252 HydrophobicContact CB-CG2 4.39Å; F102-I252 HydrophobicContact CD1-CG2 4.04Å; F102-I252 HydrophobicContact CD2-CD1 4.49Å; F102-I252 HydrophobicContact CD2-CG2 3.68Å; F102-I252 HydrophobicContact CE1-CG2 4.19Å; F102-I252 HydrophobicContact CE2-CD1 3.99Å; F102-I252 HydrophobicContact CE2-CG2 3.85Å; F102-I252 HydrophobicContact CG-CG2 3.78Å; F102-I252 HydrophobicContact CZ-CG2 4.09Å; F249-I252 HydrophobicContact CD1-CD1 3.91Å; F249-I252 PolarHBondContact O-N 3.13Å; G250-I252 VanDerWaalsContact C-N 3.32Å; G250-I252 PolarHBondContact O-N 2.93Å; I252-W254 PolarHBondContact O-N 3.49Å; I252-Y257 WeakPolarHBondContact O-CD1 3.45Å; I252-F258 WeakPolarHBondContact O-CE2 3.24Å; I252-F418 HydrophobicContact CB-CD2 4.42Å; I252-F418 HydrophobicContact CB-CE2 4.46Å; I252-F418 HydrophobicContact CD1-CE2 3.86Å; I252-L421 HydrophobicContact CG2-CD2 4.11Å |
| 253 | P | 92.5 | Very high | 89 | Confident | 6 Ų | 6 | 10.1 Ų | 10.1 | 4% | 0.039 | 5% | 0.049 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | 18.3 | -178.2 | 32.2 | -41.1 | 0 | 0 | 0 | 115.1 | M114 F249 G250 I413 I417 F418 L421 | M114-P253 HydrophobicContact CE-CB 3.41Å; M114-P253 VanDerWaalsContact CE-CB 3.41Å; F249-P253 WeakPolarHBondContact O-CD 3.02Å; G250-P253 WeakPolarHBondContact O-CD 3.13Å; P253-I413 HydrophobicContact CB-CG2 4.18Å; P253-I413 HydrophobicContact CG-CG2 3.27Å; P253-I417 HydrophobicContact CB-CB 4.14Å; P253-I417 HydrophobicContact CB-CG2 3.51Å; P253-I417 HydrophobicContact CG-CB 4.38Å; P253-I417 HydrophobicContact CG-CG2 4.28Å; P253-F418 HydrophobicContact CG-CB 4.01Å; P253-L421 HydrophobicContact CB-CD2 4.15Å |
| 254 | W | 89.2 | Confident | 88.6 | Confident | 6 Ų | 6 | 9.2 Ų | 9.2 | 2% | 0.023 | 4% | 0.044 | C | C | . | . | trans | -74.6 | 129.9 | -178 | -145.9 | -78.9 | 0 | 0 | 0 | 111.8 | W62 E138 W141 G251 I252 Y257 F258 S409 S410 I413 | W62-W254 HydrophobicContact CH2-CB 3.94Å; W62-W254 HydrophobicContact CH2-CD2 4.2Å; W62-W254 HydrophobicContact CH2-CE3 4.26Å; W62-W254 HydrophobicContact CH2-CG 4.06Å; W62-W254 HydrophobicContact CZ2-CB 4.15Å; E138-W254 VanDerWaalsContact CD-NE1 3.28Å; E138-W254 VanDerWaalsContact OE1-CD1 3.31Å; E138-W254 PolarHBondContact OE1-NE1 3.37Å; E138-W254 VanDerWaalsContact OE1-NE1 3.07Å; E138-W254 PolarHBondContact OE2-NE1 3.49Å; E138-W254 VanDerWaalsContact OE2-NE1 3.11Å; W141-W254 HydrophobicContact CB-CH2 4.36Å; W141-W254 HydrophobicContact CB-CZ2 3.82Å; W141-W254 HydrophobicContact CG-CZ2 4.01Å; G251-W254 WeakPolarHBondContact O-CB 3.33Å; I252-W254 PolarHBondContact O-N 3.49Å; W254-Y257 WeakPolarHBondContact O-CB 3.43Å; W254-Y257 PolarHBondContact O-N 3.28Å; W254-F258 WeakPolarHBondContact O-CD2 3.41Å; W254-F258 PolarHBondContact O-N 3.44Å; W254-S409 WeakPolarHBondContact CH2-OG 3.19Å; W254-S410 WeakPolarHBondContact CZ3-OG 3.41Å; W254-I413 HydrophobicContact CD2-CD1 4.12Å; W254-I413 HydrophobicContact CE3-CD1 3.64Å; W254-I413 HydrophobicContact CE3-CG2 4.49Å; W254-I413 HydrophobicContact CH2-CD1 3.79Å; W254-I413 HydrophobicContact CZ2-CD1 4.23Å; W254-I413 HydrophobicContact CZ3-CD1 3.48Å; W254-I413 VanDerWaalsContact CZ3-CD1 3.48Å | ||
| 255 | Q | 89.1 | Confident | 88 | Confident | 4 Ų | 4 | 10.5 Ų | 10.5 | 2% | 0.019 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -67.7 | -39.8 | -177.6 | 166.8 | 75.9 | -4.6 | 0 | 0 | 111.7 | M114 Y257 F258 Q259 S354 S357 M358 | M114-Q255 HydrophobicContact CB-CB 4.36Å; Q255-Y257 PolarHBondContact O-N 3.19Å; Q255-F258 CarbonylContact O-C 3.52Å; Q255-F258 PolarHBondContact O-N 3.01Å; Q255-F258 VanDerWaalsContact O-N 3.11Å; Q255-Q259 HydrophobicContact CG-CG 4.29Å; Q255-Q259 WeakPolarHBondContact O-CB 3.19Å; Q255-Q259 PolarHBondContact O-N 2.83Å; Q255-S354 WeakPolarHBondContact CB-OG 3.28Å; Q255-S354 WeakPolarHBondContact CG-OG 3.36Å; Q255-S357 PolarHBondContact NE2-OG 3.36Å; Q255-M358 HydrophobicContact CB-CE 3.83Å; Q255-M358 HydrophobicContact CB-CG 4.24Å; Q255-M358 HydrophobicContact CB-SD 3.56Å; Q255-M358 VanDerWaalsContact CB-SD 3.56Å; Q255-M358 HydrophobicContact CG-CE 3.97Å; Q255-M358 HydrophobicContact CG-CG 3.59Å; Q255-M358 HydrophobicContact CG-SD 3.62Å |
| 256 | A | 85.4 | Confident | 87.6 | Confident | 3 Ų | 3 | 10.9 Ų | 10.9 | 3% | 0.025 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -58.5 | -33.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | T61 R260 S354 | T61-A256 HydrophobicContact CG2-CB 3.98Å; A256-R260 PolarHBondContact O-NH1 3.32Å; A256-R260 VanDerWaalsContact O-NH1 3.08Å; A256-S354 PolarHBondContact N-OG 3.13Å |
| 257 | Y | 89.4 | Confident | 87.4 | Confident | 3 Ų | 3 | 11.9 Ų | 11.9 | 1% | 0.012 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -68.8 | -51 | 171.3 | 166.3 | -113.4 | 0 | 0 | 0 | 111.1 | M58 L95 G98 G99 I252 W254 Q255 Q259 R260 V261 S274 | M58-Y257 HydrophobicContact CE-CE2 4.3Å; M58-Y257 HydrophobicContact SD-CD2 4.36Å; M58-Y257 HydrophobicContact SD-CE2 4.04Å; L95-Y257 HydrophobicContact CD2-CD2 3.56Å; L95-Y257 HydrophobicContact CD2-CE2 3.53Å; G98-Y257 PolarHBondContact O-OH 3Å; G99-Y257 PolarHBondContact N-OH 3.41Å; I252-Y257 WeakPolarHBondContact O-CD1 3.45Å; W254-Y257 WeakPolarHBondContact O-CB 3.43Å; W254-Y257 PolarHBondContact O-N 3.28Å; Q255-Y257 PolarHBondContact O-N 3.19Å; Y257-Q259 VanDerWaalsContact C-N 3.34Å; Y257-Q259 PolarHBondContact O-N 2.85Å; Y257-R260 PolarHBondContact O-N 3.42Å; Y257-R260 VanDerWaalsContact O-N 3.15Å; Y257-V261 HydrophobicContact CD1-CG2 4.47Å; Y257-V261 HydrophobicContact CD2-CG2 4.15Å; Y257-V261 HydrophobicContact CE1-CG2 3.97Å; Y257-V261 HydrophobicContact CE2-CG2 3.59Å; Y257-V261 VanDerWaalsContact CZ-CG2 3.49Å; Y257-V261 PolarHBondContact O-N 2.78Å; Y257-V261 VanDerWaalsContact O-N 3.14Å; Y257-S274 WeakPolarHBondContact CE2-OG 3.48Å; Y257-S274 PolarHBondContact OH-OG 3.4Å |
| 258 | F | 89.3 | Confident | 87.3 | Confident | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -67.3 | -30.1 | -178.7 | -82.8 | -64.6 | 0 | 0 | 0 | 113.9 | F102 M106 M114 I252 W254 Q255 R260 V261 L262 L421 | F102-F258 HydrophobicContact CB-CE1 4.18Å; F102-F258 HydrophobicContact CB-CZ 3.8Å; M106-F258 HydrophobicContact CB-CD1 4.1Å; M106-F258 HydrophobicContact CB-CE1 3.88Å; M106-F258 HydrophobicContact CE-CD1 3.95Å; M106-F258 HydrophobicContact CE-CE1 4.16Å; M106-F258 HydrophobicContact CE-CG 4.19Å; M106-F258 HydrophobicContact CG-CD1 4.04Å; M106-F258 HydrophobicContact CG-CE1 3.49Å; M106-F258 VanDerWaalsContact CG-CE1 3.49Å; M106-F258 HydrophobicContact CG-CZ 4.05Å; M114-F258 HydrophobicContact CB-CB 4.23Å; M114-F258 HydrophobicContact CB-CD2 4.22Å; M114-F258 HydrophobicContact CE-CD2 4.06Å; M114-F258 HydrophobicContact CE-CE2 3.72Å; M114-F258 HydrophobicContact CG-CD2 3.9Å; M114-F258 HydrophobicContact CG-CE2 4.46Å; M114-F258 HydrophobicContact SD-CD2 3.21Å; M114-F258 WeakPolarHBondContact SD-CD2 3.27Å; M114-F258 HydrophobicContact SD-CE2 3.33Å; M114-F258 WeakPolarHBondContact SD-CE2 3.37Å; M114-F258 HydrophobicContact SD-CG 3.94Å; M114-F258 HydrophobicContact SD-CZ 4.17Å; I252-F258 WeakPolarHBondContact O-CE2 3.24Å; W254-F258 WeakPolarHBondContact O-CD2 3.41Å; W254-F258 PolarHBondContact O-N 3.44Å; Q255-F258 CarbonylContact O-C 3.52Å; Q255-F258 PolarHBondContact O-N 3.01Å; Q255-F258 VanDerWaalsContact O-N 3.11Å; F258-R260 PolarHBondContact O-N 3.34Å; F258-V261 HydrophobicContact CD1-CB 4.17Å; F258-V261 HydrophobicContact CD1-CG1 4.09Å; F258-V261 HydrophobicContact CD1-CG2 4.48Å; F258-V261 HydrophobicContact CE1-CG1 4.44Å; F258-V261 PolarHBondContact O-N 3.28Å; F258-L262 HydrophobicContact CB-CD1 4.4Å; F258-L262 WeakPolarHBondContact O-CB 3.07Å; F258-L262 WeakPolarHBondContact O-CG 3.42Å; F258-L262 PolarHBondContact O-N 2.95Å; F258-L421 HydrophobicContact CE2-CD2 4.4Å |
| 259 | Q | 84.7 | Confident | 87.1 | Confident | 2 Ų | 2 | 17.7 Ų | 17.7 | 1% | 0.009 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -54.2 | -42.8 | 171.8 | -87.3 | -179.5 | -29.4 | 0 | 0 | 111.1 | Q255 Y257 S263 S357 | Q255-Q259 HydrophobicContact CG-CG 4.29Å; Q255-Q259 WeakPolarHBondContact O-CB 3.19Å; Q255-Q259 PolarHBondContact O-N 2.83Å; Y257-Q259 VanDerWaalsContact C-N 3.34Å; Y257-Q259 PolarHBondContact O-N 2.85Å; Q259-S263 VanDerWaalsContact O-CB 3.27Å; Q259-S263 WeakPolarHBondContact O-CB 3.29Å; Q259-S263 PolarHBondContact O-N 3.43Å; Q259-S263 PolarHBondContact O-OG 3.19Å; Q259-S357 PolarHBondContact NE2-OG 2.91Å |
| 260 | R | 85.3 | Confident | 86.8 | Confident | 7 Ų | 7 | 15 Ų | 15 | 3% | 0.026 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -73.4 | -42.6 | 178.9 | -67.9 | -175.5 | 176.5 | 87.5 | -10.6 | 112.9 | T57 M58 T61 D188 A256 Y257 F258 L262 S263 S264 S350 | T57-R260 HydrophobicContact CG2-CG 4.4Å; T57-R260 PolarHBondContact O-NE 2.88Å; T57-R260 PolarHBondContact O-NH2 3.48Å; T57-R260 VanDerWaalsContact O-NH2 3.14Å; T57-R260 PolarHBondContact OG1-NE 3.4Å; T57-R260 PolarHBondContact OG1-NH2 2.92Å; T57-R260 VanDerWaalsContact OG1-NH2 3.13Å; M58-R260 HydrophobicContact CE-CB 3.6Å; T61-R260 PolarHBondContact OG1-NH1 3.29Å; T61-R260 PolarHBondContact OG1-NH2 2.81Å; D188-R260 IonicContact OD2-CZ 3.78Å; D188-R260 IonicContact OD2-NH2 3.08Å; D188-R260 PolarHBondContact OD2-NH2 3.14Å; A256-R260 PolarHBondContact O-NH1 3.32Å; A256-R260 VanDerWaalsContact O-NH1 3.08Å; Y257-R260 PolarHBondContact O-N 3.42Å; Y257-R260 VanDerWaalsContact O-N 3.15Å; F258-R260 PolarHBondContact O-N 3.34Å; R260-L262 VanDerWaalsContact C-N 3.29Å; R260-L262 PolarHBondContact O-N 3.47Å; R260-S263 VanDerWaalsContact CA-OG 3.32Å; R260-S263 WeakPolarHBondContact CA-OG 3.18Å; R260-S263 PolarHBondContact O-N 3.44Å; R260-S263 PolarHBondContact O-OG 3.39Å; R260-S264 PolarHBondContact O-N 3.38Å; R260-S264 PolarHBondContact O-OG 3.22Å; R260-S350 PolarHBondContact NH2-OG 2.85Å |
| 261 | V | 85.3 | Confident | 86.9 | Confident | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -56.6 | -44.8 | 172.4 | 166.4 | 0 | 0 | 0 | 0 | 111.1 | M58 A103 Y257 F258 S264 A270 | M58-V261 HydrophobicContact CE-CG2 3.89Å; A103-V261 HydrophobicContact CB-CG1 3.84Å; A103-V261 HydrophobicContact CB-CG2 4.3Å; Y257-V261 HydrophobicContact CD1-CG2 4.47Å; Y257-V261 HydrophobicContact CD2-CG2 4.15Å; Y257-V261 HydrophobicContact CE1-CG2 3.97Å; Y257-V261 HydrophobicContact CE2-CG2 3.59Å; Y257-V261 VanDerWaalsContact CZ-CG2 3.49Å; Y257-V261 PolarHBondContact O-N 2.78Å; Y257-V261 VanDerWaalsContact O-N 3.14Å; F258-V261 HydrophobicContact CD1-CB 4.17Å; F258-V261 HydrophobicContact CD1-CG1 4.09Å; F258-V261 HydrophobicContact CD1-CG2 4.48Å; F258-V261 HydrophobicContact CE1-CG1 4.44Å; F258-V261 PolarHBondContact O-N 3.28Å; V261-S264 WeakPolarHBondContact O-CB 3.47Å; V261-S264 PolarHBondContact O-N 2.66Å; V261-S264 PolarHBondContact O-OG 3.27Å; V261-A270 HydrophobicContact CB-CB 4.45Å; V261-A270 HydrophobicContact CG1-CB 3.94Å |
| 262 | L | 85.1 | Confident | 87.1 | Confident | 1 Ų | 1 | 19.9 Ų | 19.9 | 1% | 0.005 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -75.6 | -26.2 | -177.4 | -63.9 | 174.6 | 0 | 0 | 0 | 112.3 | V44 M106 R107 Y111 F258 R260 S264 | V44-L262 WeakPolarHBondContact CG1-O 3.38Å; M106-L262 HydrophobicContact CB-CD2 4.17Å; M106-L262 WeakPolarHBondContact O-CD2 3.19Å; R107-L262 PolarHBondContact NE-O 3.05Å; Y111-L262 WeakPolarHBondContact O-CD2 3.46Å; F258-L262 HydrophobicContact CB-CD1 4.4Å; F258-L262 WeakPolarHBondContact O-CB 3.07Å; F258-L262 WeakPolarHBondContact O-CG 3.42Å; F258-L262 PolarHBondContact O-N 2.95Å; R260-L262 VanDerWaalsContact C-N 3.29Å; R260-L262 PolarHBondContact O-N 3.47Å; L262-S264 PolarHBondContact O-N 2.88Å |
| 263 | S | 79.3 | Confident | 87 | Confident | 4 Ų | 4 | 20 Ų | 20 | 3% | 0.028 | 12% | 0.12 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.9 | -6.4 | 170.8 | 75.2 | 0 | 0 | 0 | 0 | 114.9 | V44 R47 Q259 R260 | V44-S263 VanDerWaalsContact CG1-CA 3.44Å; V44-S263 WeakPolarHBondContact O-CB 3.17Å; R47-S263 CarbonylContact C-O 3.43Å; R47-S263 VanDerWaalsContact CA-O 3.26Å; R47-S263 WeakPolarHBondContact CA-O 3.43Å; Q259-S263 VanDerWaalsContact O-CB 3.27Å; Q259-S263 WeakPolarHBondContact O-CB 3.29Å; Q259-S263 PolarHBondContact O-N 3.43Å; Q259-S263 PolarHBondContact O-OG 3.19Å; R260-S263 VanDerWaalsContact CA-OG 3.32Å; R260-S263 WeakPolarHBondContact CA-OG 3.18Å; R260-S263 PolarHBondContact O-N 3.44Å; R260-S263 PolarHBondContact O-OG 3.39Å |
| 264 | S | 80.8 | Confident | 87 | Confident | 1 Ų | 1 | 19.7 Ų | 19.7 | 1% | 0.007 | 12% | 0.118 | C | C | . | . | S | Bend | trans | -70.7 | 148.8 | 178.1 | -63.6 | 0 | 0 | 0 | 0 | 111.6 | R107 R260 V261 L262 S266 A270 L273 | R107-S264 VanDerWaalsContact CZ-O 3.22Å; R107-S264 PolarHBondContact NE-O 2.81Å; R107-S264 PolarHBondContact NH2-O 3.35Å; R260-S264 PolarHBondContact O-N 3.38Å; R260-S264 PolarHBondContact O-OG 3.22Å; V261-S264 WeakPolarHBondContact O-CB 3.47Å; V261-S264 PolarHBondContact O-N 2.66Å; V261-S264 PolarHBondContact O-OG 3.27Å; L262-S264 PolarHBondContact O-N 2.88Å; S264-S266 VanDerWaalsContact C-N 3.33Å; S264-S266 PolarHBondContact O-N 3.33Å; S264-A270 WeakPolarHBondContact OG-CA 3.47Å; S264-L273 WeakPolarHBondContact OG-CD1 3.37Å |
| 265 | S | 79.3 | Confident | 87.2 | Confident | 63 Ų | 63 | 23 Ų | 23 | 44% | 0.441 | 13% | 0.133 | S | C | . | . | S | Bend | trans | -67.9 | -31.2 | 178 | 59.2 | 0 | 0 | 0 | 0 | 113.1 | R47 R107 | R47-S265 WeakPolarHBondContact O-CA 3.29Å; R107-S265 PolarHBondContact NH2-O 3.48Å |
| 266 | S | 86.1 | Confident | 87.4 | Confident | 50 Ų | 50 | 26.5 Ų | 26.5 | 35% | 0.35 | 15% | 0.151 | S | C | . | . | S | Bend | trans | -143.1 | 163.7 | 178 | 74.9 | 0 | 0 | 0 | 0 | 113.1 | S264 Y269 A270 | S264-S266 VanDerWaalsContact C-N 3.33Å; S264-S266 PolarHBondContact O-N 3.33Å; S266-Y269 WeakPolarHBondContact O-CB 2.98Å; S266-Y269 PolarHBondContact O-N 2.98Å; S266-Y269 VanDerWaalsContact OG-CB 3.25Å; S266-Y269 WeakPolarHBondContact OG-CB 3.47Å; S266-Y269 PolarHBondContact OG-N 3.49Å; S266-A270 PolarHBondContact O-N 3.02Å |
| 267 | A | 87.4 | Confident | 87.7 | Confident | 21 Ų | 21 | 26.4 Ų | 26.4 | 17% | 0.174 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.9 | -45.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | K104 R107 Y269 A270 Q271 | K104-A267 HydrophobicContact CB-CB 4.46Å; K104-A267 HydrophobicContact CG-CB 4.1Å; R107-A267 HydrophobicContact CB-CB 4.35Å; R107-A267 HydrophobicContact CG-CB 4.38Å; A267-Y269 VanDerWaalsContact C-N 3.26Å; A267-Y269 PolarHBondContact O-N 3.16Å; A267-A270 WeakPolarHBondContact O-CB 3.38Å; A267-A270 PolarHBondContact O-N 3.29Å; A267-Q271 WeakPolarHBondContact O-CG 3.5Å; A267-Q271 PolarHBondContact O-N 3.21Å |
| 268 | T | 88.3 | Confident | 87.9 | Confident | 96 Ų | 96 | 26.4 Ų | 26.4 | 59% | 0.589 | 15% | 0.151 | S | C | * | . | H | α-helix | trans | -59.6 | -41.7 | 176.9 | -50.8 | 0 | 0 | 0 | 0 | 111.1 | A270 Q271 V272 | T268-A270 VanDerWaalsContact C-N 3.35Å; T268-A270 PolarHBondContact O-N 3.18Å; T268-Q271 WeakPolarHBondContact O-CB 3.34Å; T268-Q271 PolarHBondContact O-N 3.04Å; T268-V272 WeakPolarHBondContact O-CG2 3.5Å; T268-V272 PolarHBondContact O-N 3.01Å; T268-V272 VanDerWaalsContact O-N 3.08Å |
| 269 | Y | 87.9 | Confident | 88.1 | Confident | 47 Ų | 47 | 32.9 Ų | 32.9 | 18% | 0.184 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.4 | -42.8 | 177.8 | -164.9 | -106.2 | 0 | 0 | 0 | 112.6 | I49 G50 L51 S266 A267 Q271 V272 L273 | I49-Y269 WeakPolarHBondContact O-CE1 3.35Å; I49-Y269 PolarHBondContact O-OH 3.16Å; G50-Y269 WeakPolarHBondContact CA-OH 3.29Å; L51-Y269 VanDerWaalsContact CA-CZ 3.49Å; L51-Y269 WeakPolarHBondContact CA-OH 3.45Å; L51-Y269 HydrophobicContact CB-CE2 3.74Å; L51-Y269 VanDerWaalsContact CB-OH 3.24Å; L51-Y269 WeakPolarHBondContact CB-OH 3.26Å; L51-Y269 HydrophobicContact CD1-CD2 3.84Å; L51-Y269 HydrophobicContact CD1-CE1 4.29Å; L51-Y269 HydrophobicContact CD1-CE2 3.29Å; L51-Y269 HydrophobicContact CG-CE2 4.02Å; L51-Y269 PolarHBondContact N-OH 3.46Å; S266-Y269 WeakPolarHBondContact O-CB 2.98Å; S266-Y269 PolarHBondContact O-N 2.98Å; S266-Y269 VanDerWaalsContact OG-CB 3.25Å; S266-Y269 WeakPolarHBondContact OG-CB 3.47Å; S266-Y269 PolarHBondContact OG-N 3.49Å; A267-Y269 VanDerWaalsContact C-N 3.26Å; A267-Y269 PolarHBondContact O-N 3.16Å; Y269-Q271 PolarHBondContact O-N 2.91Å; Y269-V272 PolarHBondContact O-N 2.82Å; Y269-V272 VanDerWaalsContact O-N 3.15Å; Y269-L273 HydrophobicContact CD1-CD1 3.79Å; Y269-L273 HydrophobicContact CD1-CG 3.99Å; Y269-L273 HydrophobicContact CE1-CD1 3.81Å; Y269-L273 HydrophobicContact CE1-CD2 4.31Å; Y269-L273 HydrophobicContact CE1-CG 4.09Å; Y269-L273 WeakPolarHBondContact O-CG 2.99Å; Y269-L273 PolarHBondContact O-N 2.9Å |
| 270 | A | 87.8 | Confident | 88.4 | Confident | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -58 | -37.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A103 V261 S264 S266 A267 T268 S274 | A103-A270 HydrophobicContact CB-CB 4.24Å; V261-A270 HydrophobicContact CB-CB 4.45Å; V261-A270 HydrophobicContact CG1-CB 3.94Å; S264-A270 WeakPolarHBondContact OG-CA 3.47Å; S266-A270 PolarHBondContact O-N 3.02Å; A267-A270 WeakPolarHBondContact O-CB 3.38Å; A267-A270 PolarHBondContact O-N 3.29Å; T268-A270 VanDerWaalsContact C-N 3.35Å; T268-A270 PolarHBondContact O-N 3.18Å; A270-S274 PolarHBondContact O-N 3.23Å; A270-S274 VanDerWaalsContact O-N 3.14Å; A270-S274 PolarHBondContact O-OG 3.48Å; A270-S274 VanDerWaalsContact O-OG 3.04Å |
| 271 | Q | 92.9 | Very high | 88.6 | Confident | 37 Ų | 37 | 33.1 Ų | 33.1 | 17% | 0.173 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67 | -44.6 | 175.6 | -51.9 | -170.5 | -84.9 | 0 | 0 | 111.9 | G99 L100 A103 A267 T268 Y269 L273 S274 F275 | G99-Q271 VanDerWaalsContact O-CG 3.28Å; G99-Q271 WeakPolarHBondContact O-CG 3.17Å; G99-Q271 PolarHBondContact O-NE2 3.36Å; L100-Q271 PolarHBondContact O-NE2 2.98Å; A103-Q271 HydrophobicContact CB-CG 4.24Å; A267-Q271 WeakPolarHBondContact O-CG 3.5Å; A267-Q271 PolarHBondContact O-N 3.21Å; T268-Q271 WeakPolarHBondContact O-CB 3.34Å; T268-Q271 PolarHBondContact O-N 3.04Å; Y269-Q271 PolarHBondContact O-N 2.91Å; Q271-L273 VanDerWaalsContact C-N 3.31Å; Q271-L273 PolarHBondContact O-N 2.98Å; Q271-S274 WeakPolarHBondContact O-CB 3.39Å; Q271-S274 PolarHBondContact O-N 3.15Å; Q271-F275 HydrophobicContact CB-CE2 4.05Å; Q271-F275 HydrophobicContact CB-CZ 4.44Å; Q271-F275 WeakPolarHBondContact O-CD2 3.21Å; Q271-F275 WeakPolarHBondContact O-CG 3.4Å; Q271-F275 PolarHBondContact O-N 3.38Å |
| 272 | V | 91.6 | Very high | 89 | Confident | 66 Ų | 66 | 36.6 Ų | 36.6 | 40% | 0.4 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -61 | -42.3 | 178.1 | 174.5 | 0 | 0 | 0 | 0 | 110.8 | L51 T268 Y269 S274 F275 L276 | L51-V272 HydrophobicContact CD1-CG1 4.05Å; T268-V272 WeakPolarHBondContact O-CG2 3.5Å; T268-V272 PolarHBondContact O-N 3.01Å; T268-V272 VanDerWaalsContact O-N 3.08Å; Y269-V272 PolarHBondContact O-N 2.82Å; Y269-V272 VanDerWaalsContact O-N 3.15Å; V272-S274 VanDerWaalsContact C-N 3.33Å; V272-S274 PolarHBondContact O-N 3.37Å; V272-F275 PolarHBondContact O-N 3.32Å; V272-L276 WeakPolarHBondContact O-CB 3.46Å; V272-L276 PolarHBondContact O-N 3.46Å |
| 273 | L | 90.3 | Very high | 89.4 | Confident | 3 Ų | 3 | 38.3 Ų | 38.3 | 2% | 0.016 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.8 | -44.6 | 174.5 | -71.1 | -175.2 | 0 | 0 | 0 | 111.7 | L51 G54 G55 M58 S264 Y269 Q271 F275 L276 A277 | L51-L273 HydrophobicContact CD1-CD2 3.68Å; L51-L273 HydrophobicContact CD1-CG 4.39Å; L51-L273 WeakPolarHBondContact O-CD2 3.39Å; G54-L273 VanDerWaalsContact C-CD2 3.48Å; G55-L273 VanDerWaalsContact N-CD2 3.31Å; M58-L273 HydrophobicContact CE-CB 3.81Å; M58-L273 HydrophobicContact CE-CD1 4.44Å; M58-L273 HydrophobicContact SD-CB 3.87Å; S264-L273 WeakPolarHBondContact OG-CD1 3.37Å; Y269-L273 HydrophobicContact CD1-CD1 3.79Å; Y269-L273 HydrophobicContact CD1-CG 3.99Å; Y269-L273 HydrophobicContact CE1-CD1 3.81Å; Y269-L273 HydrophobicContact CE1-CD2 4.31Å; Y269-L273 HydrophobicContact CE1-CG 4.09Å; Y269-L273 WeakPolarHBondContact O-CG 2.99Å; Y269-L273 PolarHBondContact O-N 2.9Å; Q271-L273 VanDerWaalsContact C-N 3.31Å; Q271-L273 PolarHBondContact O-N 2.98Å; L273-F275 VanDerWaalsContact C-N 3.35Å; L273-F275 PolarHBondContact O-N 3.23Å; L273-L276 PolarHBondContact O-N 2.9Å; L273-A277 VanDerWaalsContact O-CB 3.28Å; L273-A277 WeakPolarHBondContact O-CB 3.47Å; L273-A277 PolarHBondContact O-N 2.8Å |
| 274 | S | 92.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.4 | -41 | 177.3 | -55.4 | 0 | 0 | 0 | 0 | 112.5 | M58 L95 Y257 A270 Q271 V272 A277 A278 | M58-S274 WeakPolarHBondContact SD-CA 3.39Å; M58-S274 PolarHBondContact SD-N 3.23Å; M58-S274 VanDerWaalsContact SD-N 3.4Å; L95-S274 WeakPolarHBondContact O-CB 2.99Å; Y257-S274 WeakPolarHBondContact CE2-OG 3.48Å; Y257-S274 PolarHBondContact OH-OG 3.4Å; A270-S274 PolarHBondContact O-N 3.23Å; A270-S274 VanDerWaalsContact O-N 3.14Å; A270-S274 PolarHBondContact O-OG 3.48Å; A270-S274 VanDerWaalsContact O-OG 3.04Å; Q271-S274 WeakPolarHBondContact O-CB 3.39Å; Q271-S274 PolarHBondContact O-N 3.15Å; V272-S274 VanDerWaalsContact C-N 3.33Å; V272-S274 PolarHBondContact O-N 3.37Å; S274-A277 PolarHBondContact O-N 3.25Å; S274-A278 WeakPolarHBondContact O-CB 3.24Å; S274-A278 PolarHBondContact O-N 3.21Å |
| 275 | F | 93.8 | Very high | 90.4 | Very high | 76 Ų | 76 | 38.6 Ų | 38.6 | 33% | 0.333 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -70 | -40.9 | 177.4 | -58.4 | -38.7 | 0 | 0 | 0 | 112.9 | I96 L100 Q271 V272 L273 A277 A278 F279 | I96-F275 HydrophobicContact CG1-CD1 4.38Å; I96-F275 HydrophobicContact CG2-CE1 4.3Å; L100-F275 HydrophobicContact CD2-CE1 4.14Å; L100-F275 HydrophobicContact CD2-CZ 3.59Å; L100-F275 HydrophobicContact CG-CE1 3.79Å; L100-F275 HydrophobicContact CG-CZ 3.71Å; Q271-F275 HydrophobicContact CB-CE2 4.05Å; Q271-F275 HydrophobicContact CB-CZ 4.44Å; Q271-F275 WeakPolarHBondContact O-CD2 3.21Å; Q271-F275 WeakPolarHBondContact O-CG 3.4Å; Q271-F275 PolarHBondContact O-N 3.38Å; V272-F275 PolarHBondContact O-N 3.32Å; L273-F275 VanDerWaalsContact C-N 3.35Å; L273-F275 PolarHBondContact O-N 3.23Å; F275-A277 VanDerWaalsContact C-N 3.3Å; F275-A277 PolarHBondContact O-N 3.13Å; F275-A278 PolarHBondContact O-N 3.14Å; F275-F279 PolarHBondContact O-N 3.36Å; F275-F279 VanDerWaalsContact O-N 3.13Å |
| 276 | L | 92 | Very high | 91.1 | Very high | 77 Ų | 77 | 39.5 Ų | 39.5 | 40% | 0.403 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -62.3 | -42.3 | 175.6 | -177 | 61.5 | 0 | 0 | 0 | 110.6 | V272 L273 F279 G280 | V272-L276 WeakPolarHBondContact O-CB 3.46Å; V272-L276 PolarHBondContact O-N 3.46Å; L273-L276 PolarHBondContact O-N 2.9Å; L276-F279 PolarHBondContact O-N 2.92Å; L276-G280 PolarHBondContact O-N 3.43Å |
| 277 | A | 91.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.9 | -39.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | M58 T59 L95 L273 S274 F275 F279 G280 C281 | M58-A277 HydrophobicContact CB-CB 3.84Å; M58-A277 HydrophobicContact CG-CB 3.55Å; M58-A277 HydrophobicContact SD-CB 3.98Å; T59-A277 WeakPolarHBondContact OG1-CA 3.48Å; L95-A277 HydrophobicContact CD1-CB 3.89Å; L273-A277 VanDerWaalsContact O-CB 3.28Å; L273-A277 WeakPolarHBondContact O-CB 3.47Å; L273-A277 PolarHBondContact O-N 2.8Å; S274-A277 PolarHBondContact O-N 3.25Å; F275-A277 VanDerWaalsContact C-N 3.3Å; F275-A277 PolarHBondContact O-N 3.13Å; A277-F279 VanDerWaalsContact C-N 3.33Å; A277-F279 PolarHBondContact O-N 3.4Å; A277-G280 PolarHBondContact O-N 3.4Å; A277-C281 PolarHBondContact O-N 3.19Å; A277-C281 PolarHBondContact O-SG 3.04Å |
| 278 | A | 93.6 | Very high | 91.8 | Very high | 4 Ų | 4 | 36.2 Ų | 36.2 | 3% | 0.033 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -59.1 | -44.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | S92 L95 I96 S274 F275 L282 | S92-A278 WeakPolarHBondContact O-CB 3.43Å; S92-A278 PolarHBondContact OG-O 3.4Å; L95-A278 HydrophobicContact CB-CB 3.8Å; L95-A278 HydrophobicContact CD1-CB 4.4Å; I96-A278 HydrophobicContact CD1-CB 4.14Å; I96-A278 HydrophobicContact CG1-CB 3.63Å; S274-A278 WeakPolarHBondContact O-CB 3.24Å; S274-A278 PolarHBondContact O-N 3.21Å; F275-A278 PolarHBondContact O-N 3.14Å; A278-L282 PolarHBondContact O-N 3.09Å |
| 279 | F | 93.3 | Very high | 92.1 | Very high | 136 Ų | 136 | 32.9 Ų | 32.9 | 60% | 0.596 | 17% | 0.168 | S | C | * | . | H | α-helix | trans | -65.8 | -43.7 | 174.3 | -179.8 | -101 | 0 | 0 | 0 | 111.7 | F275 L276 A277 C281 L282 V283 | F275-F279 PolarHBondContact O-N 3.36Å; F275-F279 VanDerWaalsContact O-N 3.13Å; L276-F279 PolarHBondContact O-N 2.92Å; A277-F279 VanDerWaalsContact C-N 3.33Å; A277-F279 PolarHBondContact O-N 3.4Å; F279-C281 PolarHBondContact O-N 2.85Å; F279-L282 PolarHBondContact O-N 3.4Å; F279-V283 HydrophobicContact CD1-CG2 4.16Å; F279-V283 HydrophobicContact CE1-CG2 3.68Å; F279-V283 HydrophobicContact CE2-CG2 4.19Å; F279-V283 HydrophobicContact CZ-CG2 3.69Å; F279-V283 WeakPolarHBondContact O-CG2 3.5Å; F279-V283 PolarHBondContact O-N 2.79Å; F279-V283 VanDerWaalsContact O-N 3.13Å |
| 280 | G | 91.1 | Very high | 92.5 | Very high | 14 Ų | 14 | 32.9 Ų | 32.9 | 14% | 0.144 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -55.4 | -47.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L276 A277 L282 V283 M284 | L276-G280 PolarHBondContact O-N 3.43Å; A277-G280 PolarHBondContact O-N 3.4Å; G280-L282 PolarHBondContact O-N 3.06Å; G280-V283 PolarHBondContact O-N 3.04Å; G280-M284 WeakPolarHBondContact O-CB 3.48Å; G280-M284 WeakPolarHBondContact O-CG 3.24Å; G280-M284 PolarHBondContact O-N 3.1Å |
| 281 | C | 91.2 | Very high | 92.9 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -56.8 | -47.1 | 178.7 | -70 | 0 | 0 | 0 | 0 | 112 | V63 Y67 A277 F279 V283 M284 A285 | V63-C281 HydrophobicContact CG2-CB 4.43Å; Y67-C281 PolarHBondContact OH-O 3.26Å; A277-C281 PolarHBondContact O-N 3.19Å; A277-C281 PolarHBondContact O-SG 3.04Å; F279-C281 PolarHBondContact O-N 2.85Å; C281-V283 PolarHBondContact O-N 3.34Å; C281-M284 PolarHBondContact O-N 3.44Å; C281-A285 WeakPolarHBondContact O-CB 3Å; C281-A285 PolarHBondContact O-N 3Å |
| 282 | L | 92.6 | Very high | 93 | Very high | 73 Ų | 73 | 31.1 Ų | 31.1 | 38% | 0.382 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -59.7 | -46.7 | 177.2 | -68.3 | 178.3 | 0 | 0 | 0 | 112.2 | P88 S92 A278 F279 G280 M284 A285 L286 | P88-L282 HydrophobicContact CB-CD2 4.45Å; P88-L282 WeakPolarHBondContact O-CD2 3.42Å; S92-L282 WeakPolarHBondContact OG-CD2 3.44Å; S92-L282 WeakPolarHBondContact OG-CG 3.02Å; A278-L282 PolarHBondContact O-N 3.09Å; F279-L282 PolarHBondContact O-N 3.4Å; G280-L282 PolarHBondContact O-N 3.06Å; L282-M284 VanDerWaalsContact C-N 3.3Å; L282-M284 PolarHBondContact O-N 3.32Å; L282-A285 PolarHBondContact O-N 3.03Å; L282-L286 PolarHBondContact O-N 3.47Å |
| 283 | V | 93 | Very high | 93.3 | Very high | 36 Ų | 36 | 28 Ų | 28 | 22% | 0.218 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.7 | -40.1 | 179.8 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | F196 F279 G280 C281 A285 L286 | F196-V283 HydrophobicContact CE2-CG1 3.91Å; F279-V283 HydrophobicContact CD1-CG2 4.16Å; F279-V283 HydrophobicContact CE1-CG2 3.68Å; F279-V283 HydrophobicContact CE2-CG2 4.19Å; F279-V283 HydrophobicContact CZ-CG2 3.69Å; F279-V283 WeakPolarHBondContact O-CG2 3.5Å; F279-V283 PolarHBondContact O-N 2.79Å; F279-V283 VanDerWaalsContact O-N 3.13Å; G280-V283 PolarHBondContact O-N 3.04Å; C281-V283 PolarHBondContact O-N 3.34Å; V283-A285 VanDerWaalsContact C-N 3.33Å; V283-L286 PolarHBondContact O-N 3.42Å |
| 284 | M | 90 | Very high | 93.6 | Very high | 11 Ų | 11 | 27.8 Ų | 27.8 | 5% | 0.054 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -73.6 | -22.7 | 180 | -64.6 | -61.2 | -57.7 | 0 | 0 | 113.3 | T59 V63 L192 I195 F196 G280 C281 L282 P287 | T59-M284 HydrophobicContact CG2-CG 4.31Å; V63-M284 HydrophobicContact CG1-CB 3.8Å; V63-M284 HydrophobicContact CG1-CE 4.22Å; V63-M284 HydrophobicContact CG1-CG 4.28Å; V63-M284 HydrophobicContact CG2-CB 3.81Å; V63-M284 HydrophobicContact CG2-CG 4.17Å; L192-M284 HydrophobicContact CD1-CE 3.64Å; L192-M284 HydrophobicContact CD1-CG 4.12Å; L192-M284 HydrophobicContact CD1-SD 4.1Å; L192-M284 HydrophobicContact CG-CE 4.49Å; I195-M284 HydrophobicContact CB-CE 3.73Å; I195-M284 HydrophobicContact CG2-CE 3.4Å; I195-M284 VanDerWaalsContact CG2-CE 3.4Å; F196-M284 HydrophobicContact CB-CE 3.92Å; F196-M284 HydrophobicContact CB-SD 3.81Å; F196-M284 HydrophobicContact CD2-SD 3.6Å; F196-M284 VanDerWaalsContact CD2-SD 3.6Å; F196-M284 HydrophobicContact CG-SD 4.18Å; G280-M284 WeakPolarHBondContact O-CB 3.48Å; G280-M284 WeakPolarHBondContact O-CG 3.24Å; G280-M284 PolarHBondContact O-N 3.1Å; C281-M284 PolarHBondContact O-N 3.44Å; L282-M284 VanDerWaalsContact C-N 3.3Å; L282-M284 PolarHBondContact O-N 3.32Å; M284-P287 WeakPolarHBondContact O-CD 3.17Å |
| 285 | A | 91.9 | Very high | 93.7 | Very high | 1 Ų | 1 | 27.8 Ų | 27.8 | 1% | 0.008 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -77.6 | -25.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y67 P88 C281 L282 V283 A288 I289 | Y67-A285 HydrophobicContact CE1-CB 3.86Å; P88-A285 HydrophobicContact CB-CB 3.53Å; P88-A285 HydrophobicContact CG-CB 3.6Å; C281-A285 WeakPolarHBondContact O-CB 3Å; C281-A285 PolarHBondContact O-N 3Å; L282-A285 PolarHBondContact O-N 3.03Å; V283-A285 VanDerWaalsContact C-N 3.33Å; A285-A288 WeakPolarHBondContact O-CB 3.38Å; A285-A288 PolarHBondContact O-N 3.37Å; A285-A288 VanDerWaalsContact O-N 3.08Å; A285-I289 WeakPolarHBondContact O-CG1 3.16Å; A285-I289 PolarHBondContact O-N 2.63Å |
| 286 | L | 94.4 | Very high | 93.7 | Very high | 81 Ų | 81 | 24.4 Ų | 24.4 | 42% | 0.424 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -56 | -48.1 | -176.1 | -69.5 | 174 | 0 | 0 | 0 | 113 | W200 L282 V283 A288 I289 L290 | W200-L286 HydrophobicContact CH2-CB 4.23Å; W200-L286 HydrophobicContact CH2-CD1 4.24Å; W200-L286 HydrophobicContact CZ2-CB 3.95Å; W200-L286 HydrophobicContact CZ2-CD1 4.12Å; L282-L286 PolarHBondContact O-N 3.47Å; V283-L286 PolarHBondContact O-N 3.42Å; L286-A288 VanDerWaalsContact C-N 3.29Å; L286-A288 PolarHBondContact O-N 3.35Å; L286-I289 PolarHBondContact O-N 3.27Å; L286-L290 WeakPolarHBondContact O-CG 3.47Å; L286-L290 PolarHBondContact O-N 3.48Å |
| 287 | P | 94.5 | Very high | 93.9 | Very high | 2 Ų | 2 | 20.8 Ų | 20.8 | 1% | 0.013 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.8 | -37.7 | 175.7 | -25.7 | 35.8 | 0 | 0 | 0 | 113.6 | L199 W200 V203 M284 L290 I291 | L199-P287 HydrophobicContact CB-CB 3.51Å; L199-P287 HydrophobicContact CB-CG 4.14Å; L199-P287 HydrophobicContact CD1-CB 4.41Å; W200-P287 VanDerWaalsContact CD1-CG 3.45Å; W200-P287 HydrophobicContact CD2-CG 3.76Å; W200-P287 VanDerWaalsContact CE2-CG 3.49Å; W200-P287 HydrophobicContact CG-CG 3.75Å; W200-P287 HydrophobicContact CZ2-CG 4.12Å; W200-P287 VanDerWaalsContact NE1-CG 3.26Å; V203-P287 HydrophobicContact CG2-CB 4.01Å; M284-P287 WeakPolarHBondContact O-CD 3.17Å; P287-L290 PolarHBondContact O-N 3.38Å; P287-I291 WeakPolarHBondContact O-CB 3.11Å; P287-I291 WeakPolarHBondContact O-CD1 3.32Å; P287-I291 WeakPolarHBondContact O-CG1 3.48Å; P287-I291 PolarHBondContact O-N 3.23Å |
| 288 | A | 93.1 | Very high | 94 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -65.2 | -42.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | I68 T71 A72 A285 L286 I291 G292 | I68-A288 HydrophobicContact CB-CB 4.47Å; I68-A288 HydrophobicContact CG2-CB 3.66Å; T71-A288 HydrophobicContact CG2-CB 4.24Å; A72-A288 WeakPolarHBondContact CB-O 3.29Å; A285-A288 WeakPolarHBondContact O-CB 3.38Å; A285-A288 PolarHBondContact O-N 3.37Å; A285-A288 VanDerWaalsContact O-N 3.08Å; L286-A288 VanDerWaalsContact C-N 3.29Å; L286-A288 PolarHBondContact O-N 3.35Å; A288-I291 PolarHBondContact O-N 2.94Å; A288-G292 PolarHBondContact O-N 3.28Å |
| 289 | I | 95.3 | Very high | 94 | Very high | 27 Ų | 27 | 20.9 Ų | 20.9 | 14% | 0.138 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -59.6 | -48.1 | 174 | -67.7 | 167.3 | 0 | 0 | 0 | 110.3 | T71 V75 L82 A285 L286 I291 G292 A293 | T71-I289 HydrophobicContact CG2-CD1 4.37Å; T71-I289 HydrophobicContact CG2-CG1 3.47Å; T71-I289 VanDerWaalsContact CG2-CG1 3.47Å; V75-I289 HydrophobicContact CG2-CB 4.5Å; V75-I289 HydrophobicContact CG2-CG1 4.42Å; V75-I289 HydrophobicContact CG2-CG2 4.22Å; L82-I289 HydrophobicContact CD1-CD1 3.97Å; L82-I289 HydrophobicContact CD1-CG1 4.18Å; L82-I289 HydrophobicContact CD1-CG2 3.74Å; A285-I289 WeakPolarHBondContact O-CG1 3.16Å; A285-I289 PolarHBondContact O-N 2.63Å; L286-I289 PolarHBondContact O-N 3.27Å; I289-I291 VanDerWaalsContact C-N 3.35Å; I289-I291 PolarHBondContact O-N 2.94Å; I289-G292 PolarHBondContact O-N 3.41Å; I289-A293 WeakPolarHBondContact O-CB 3.49Å; I289-A293 PolarHBondContact O-N 2.98Å |
| 290 | L | 96.5 | Very high | 94 | Very high | 46 Ų | 46 | 15 Ų | 15 | 24% | 0.241 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -63.4 | -41.2 | 179.6 | -67.2 | 174.1 | 0 | 0 | 0 | 111.5 | V203 I215 L286 P287 A293 I294 | V203-L290 HydrophobicContact CG1-CB 4.1Å; V203-L290 HydrophobicContact CG1-CD1 3.81Å; V203-L290 HydrophobicContact CG2-CB 4.14Å; V203-L290 HydrophobicContact CG2-CD1 4.45Å; I215-L290 HydrophobicContact CD1-CD2 4.04Å; L286-L290 WeakPolarHBondContact O-CG 3.47Å; L286-L290 PolarHBondContact O-N 3.48Å; P287-L290 PolarHBondContact O-N 3.38Å; L290-A293 PolarHBondContact O-N 2.85Å; L290-I294 WeakPolarHBondContact O-CB 3.3Å; L290-I294 WeakPolarHBondContact O-CD1 3.31Å; L290-I294 WeakPolarHBondContact O-CG1 3.49Å; L290-I294 PolarHBondContact O-N 3.11Å |
| 291 | I | 95.8 | Very high | 94 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63.2 | -43.5 | 176.3 | -72.2 | 164.9 | 0 | 0 | 0 | 111.5 | L199 V203 P287 A288 I289 A293 I294 G295 L320 V323 L324 | L199-I291 HydrophobicContact CD2-CD1 3.95Å; V203-I291 HydrophobicContact CG2-CD1 4.46Å; V203-I291 HydrophobicContact CG2-CG1 4.12Å; P287-I291 WeakPolarHBondContact O-CB 3.11Å; P287-I291 WeakPolarHBondContact O-CD1 3.32Å; P287-I291 WeakPolarHBondContact O-CG1 3.48Å; P287-I291 PolarHBondContact O-N 3.23Å; A288-I291 PolarHBondContact O-N 2.94Å; I289-I291 VanDerWaalsContact C-N 3.35Å; I289-I291 PolarHBondContact O-N 2.94Å; I291-A293 VanDerWaalsContact C-N 3.34Å; I291-A293 PolarHBondContact O-N 3.35Å; I291-I294 PolarHBondContact O-N 3.43Å; I291-G295 PolarHBondContact O-N 2.81Å; I291-L320 HydrophobicContact CD1-CG 4.44Å; I291-L320 HydrophobicContact CG2-CB 4.27Å; I291-L320 HydrophobicContact CG2-CG 4.01Å; I291-V323 HydrophobicContact CG2-CB 3.82Å; I291-V323 HydrophobicContact CG2-CG1 3.75Å; I291-V323 HydrophobicContact CG2-CG2 4.23Å; I291-L324 HydrophobicContact CD1-CD2 4.21Å |
| 292 | G | 95.2 | Very high | 94 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.5 | -42.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A72 A288 I289 I294 G295 A296 | A72-G292 WeakPolarHBondContact O-CA 3.36Å; A288-G292 PolarHBondContact O-N 3.28Å; I289-G292 PolarHBondContact O-N 3.41Å; G292-I294 PolarHBondContact O-N 3.21Å; G292-G295 PolarHBondContact O-N 3.47Å; G292-A296 PolarHBondContact O-N 2.88Å |
| 293 | A | 96.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64.1 | -38.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V75 W228 I289 L290 I291 A296 S297 | V75-A293 HydrophobicContact CG1-CB 4.07Å; W228-A293 HydrophobicContact CD2-CB 3.55Å; W228-A293 HydrophobicContact CE3-CB 3.8Å; W228-A293 HydrophobicContact CG-CB 3.9Å; W228-A293 HydrophobicContact CH2-CB 4.47Å; W228-A293 HydrophobicContact CZ2-CB 4.22Å; W228-A293 HydrophobicContact CZ3-CB 4.26Å; I289-A293 WeakPolarHBondContact O-CB 3.49Å; I289-A293 PolarHBondContact O-N 2.98Å; L290-A293 PolarHBondContact O-N 2.85Å; I291-A293 VanDerWaalsContact C-N 3.34Å; I291-A293 PolarHBondContact O-N 3.35Å; A293-A296 PolarHBondContact O-N 3.25Å; A293-S297 WeakPolarHBondContact O-CB 3.49Å; A293-S297 PolarHBondContact O-N 3.49Å; A293-S297 PolarHBondContact O-OG 3.3Å |
| 294 | I | 96.7 | Very high | 93.7 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -62.5 | -48 | 173.8 | -69.6 | 160.2 | 0 | 0 | 0 | 109.9 | A206 M207 V212 I215 L290 I291 G292 A296 S297 T298 V323 L327 | A206-I294 HydrophobicContact CB-CD1 3.93Å; A206-I294 HydrophobicContact CB-CG2 4.19Å; M207-I294 HydrophobicContact CB-CD1 4.5Å; M207-I294 HydrophobicContact CG-CD1 3.44Å; M207-I294 VanDerWaalsContact CG-CD1 3.44Å; M207-I294 HydrophobicContact CG-CG1 3.76Å; V212-I294 HydrophobicContact CG1-CG2 4.04Å; V212-I294 HydrophobicContact CG2-CG2 3.94Å; I215-I294 HydrophobicContact CG2-CG1 4.19Å; L290-I294 WeakPolarHBondContact O-CB 3.3Å; L290-I294 WeakPolarHBondContact O-CD1 3.31Å; L290-I294 WeakPolarHBondContact O-CG1 3.49Å; L290-I294 PolarHBondContact O-N 3.11Å; I291-I294 PolarHBondContact O-N 3.43Å; G292-I294 PolarHBondContact O-N 3.21Å; I294-A296 PolarHBondContact O-N 3.37Å; I294-S297 CarbonylContact O-C 3.6Å; I294-S297 WeakPolarHBondContact O-CA 3.38Å; I294-S297 PolarHBondContact O-N 3.39Å; I294-T298 PolarHBondContact O-N 3.36Å; I294-T298 VanDerWaalsContact O-N 3.08Å; I294-T298 PolarHBondContact O-OG1 3.42Å; I294-V323 HydrophobicContact CG2-CG1 4.12Å; I294-L327 HydrophobicContact CG2-CD1 3.8Å |
| 295 | G | 95.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -57.6 | -38.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y76 I291 G292 S297 T298 W300 | Y76-G295 WeakPolarHBondContact CE2-O 3.31Å; I291-G295 PolarHBondContact O-N 2.81Å; G292-G295 PolarHBondContact O-N 3.47Å; G295-S297 VanDerWaalsContact C-N 3.28Å; G295-S297 PolarHBondContact O-N 2.94Å; G295-T298 PolarHBondContact O-N 3.34Å; G295-W300 PolarHBondContact O-NE1 3.17Å |
| 296 | A | 94.6 | Very high | 93.4 | Very high | 5 Ų | 5 | 30.8 Ų | 30.8 | 4% | 0.041 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -70.2 | -24.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y76 Q225 W228 G292 A293 I294 | Y76-A296 HydrophobicContact CD2-CB 4.23Å; Q225-A296 HydrophobicContact CG-CB 4.4Å; Q225-A296 WeakPolarHBondContact CG-O 3.41Å; Q225-A296 VanDerWaalsContact NE2-CA 3.33Å; W228-A296 HydrophobicContact CB-CB 3.78Å; G292-A296 PolarHBondContact O-N 2.88Å; A293-A296 PolarHBondContact O-N 3.25Å; I294-A296 PolarHBondContact O-N 3.37Å |
| 297 | S | 95.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -98.3 | 4.3 | -177.7 | -50.5 | 0 | 0 | 0 | 0 | 113 | T213 T218 H224 A293 I294 G295 | T213-S297 PolarHBondContact N-O 2.97Å; T213-S297 PolarHBondContact OG1-O 3.03Å; T218-S297 WeakPolarHBondContact CB-OG 3.48Å; T218-S297 PolarHBondContact OG1-OG 3.43Å; H224-S297 PolarHBondContact CD2-O 3.31Å; A293-S297 WeakPolarHBondContact O-CB 3.49Å; A293-S297 PolarHBondContact O-N 3.49Å; A293-S297 PolarHBondContact O-OG 3.3Å; I294-S297 CarbonylContact O-C 3.6Å; I294-S297 WeakPolarHBondContact O-CA 3.38Å; I294-S297 PolarHBondContact O-N 3.39Å; G295-S297 VanDerWaalsContact C-N 3.28Å; G295-S297 PolarHBondContact O-N 2.94Å |
| 298 | T | 95.3 | Very high | 92.7 | Very high | 2 Ų | 2 | 35.7 Ų | 35.7 | 1% | 0.012 | 19% | 0.187 | C | C | . | . | B | Isolated β-bridge | trans | -92.7 | 129.5 | -175 | -59.8 | 0 | 0 | 0 | 0 | 111.2 | A211 I294 G295 W300 T303 L327 | A211-T298 HydrophobicContact CB-CG2 4.49Å; I294-T298 PolarHBondContact O-N 3.36Å; I294-T298 VanDerWaalsContact O-N 3.08Å; I294-T298 PolarHBondContact O-OG1 3.42Å; G295-T298 PolarHBondContact O-N 3.34Å; T298-W300 VanDerWaalsContact C-N 3.32Å; T298-W300 HydrophobicContact CG2-CD2 3.94Å; T298-W300 HydrophobicContact CG2-CE3 4.13Å; T298-W300 HydrophobicContact CG2-CG 4.34Å; T298-W300 HydrophobicContact CG2-CH2 4.47Å; T298-W300 HydrophobicContact CG2-CZ2 4.29Å; T298-W300 HydrophobicContact CG2-CZ3 4.39Å; T298-W300 PolarHBondContact O-N 3.39Å; T298-T303 HydrophobicContact CG2-CG2 3.64Å; T298-L327 HydrophobicContact CG2-CD1 4.03Å; T298-L327 HydrophobicContact CG2-CD2 4.02Å; T298-L327 WeakPolarHBondContact OG1-CD1 3.44Å |
| 299 | A | 93.2 | Very high | 92.5 | Very high | 5 Ų | 5 | 38 Ų | 38 | 4% | 0.041 | 20% | 0.199 | C | C | . | . | trans | -75.3 | 82.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | A211 N301 E302 | A211-A299 PolarHBondContact O-N 3.33Å; A299-N301 VanDerWaalsContact C-OD1 3.25Å; A299-N301 WeakPolarHBondContact CB-OD1 3.16Å; A299-N301 PolarHBondContact O-N 3.2Å; A299-N301 PolarHBondContact O-OD1 2.91Å; A299-E302 HydrophobicContact CB-CB 4.41Å; A299-E302 HydrophobicContact CB-CG 4.23Å; A299-E302 PolarHBondContact O-N 2.95Å | ||
| 300 | W | 93.5 | Very high | 92.2 | Very high | 13 Ų | 13 | 36.7 Ų | 36.7 | 5% | 0.049 | 19% | 0.193 | C | C | . | . | G | 310 helix | trans | -56.5 | -26.6 | -173.6 | -69.2 | 102.1 | 0 | 0 | 0 | 114.2 | G295 T298 E302 T303 Y305 G306 D309 P310 I319 I322 V323 L327 | G295-W300 PolarHBondContact O-NE1 3.17Å; T298-W300 VanDerWaalsContact C-N 3.32Å; T298-W300 HydrophobicContact CG2-CD2 3.94Å; T298-W300 HydrophobicContact CG2-CE3 4.13Å; T298-W300 HydrophobicContact CG2-CG 4.34Å; T298-W300 HydrophobicContact CG2-CH2 4.47Å; T298-W300 HydrophobicContact CG2-CZ2 4.29Å; T298-W300 HydrophobicContact CG2-CZ3 4.39Å; T298-W300 PolarHBondContact O-N 3.39Å; W300-E302 PolarHBondContact O-N 2.92Å; W300-T303 HydrophobicContact CE3-CG2 4.41Å; W300-T303 PolarHBondContact O-N 3.35Å; W300-T303 PolarHBondContact O-OG1 3.03Å; W300-Y305 HydrophobicContact CD2-CD1 4.41Å; W300-Y305 AromaticContact CE3-CD1 3.78Å; W300-Y305 HydrophobicContact CE3-CD1 3.78Å; W300-Y305 HydrophobicContact CE3-CG 4.06Å; W300-Y305 HydrophobicContact CZ3-CD1 4.45Å; W300-Y305 HydrophobicContact CZ3-CG 4.35Å; W300-G306 WeakPolarHBondContact O-CA 3.47Å; W300-G306 PolarHBondContact O-N 2.94Å; W300-D309 HydrophobicContact CB-CB 4.28Å; W300-D309 HydrophobicContact CG-CB 4.27Å; W300-P310 HydrophobicContact CD2-CG 3.92Å; W300-P310 HydrophobicContact CE3-CG 4.21Å; W300-P310 HydrophobicContact CG-CG 4.48Å; W300-P310 HydrophobicContact CH2-CG 4.26Å; W300-P310 HydrophobicContact CZ2-CG 3.98Å; W300-P310 HydrophobicContact CZ3-CG 4.37Å; W300-I319 HydrophobicContact CH2-CD1 4.1Å; W300-I319 HydrophobicContact CZ2-CD1 3.57Å; W300-I322 HydrophobicContact CH2-CG2 3.59Å; W300-I322 HydrophobicContact CZ3-CG2 3.58Å; W300-V323 HydrophobicContact CH2-CG2 4.02Å; W300-V323 HydrophobicContact CZ2-CG2 4.35Å; W300-L327 HydrophobicContact CH2-CD1 4.44Å |
| 301 | N | 90.9 | Very high | 91.8 | Very high | 96 Ų | 96 | 38.1 Ų | 38.1 | 51% | 0.513 | 20% | 0.199 | S | C | . | . | G | 310 helix | trans | -62.9 | -23.7 | 173.2 | 63.6 | -49.6 | 0 | 0 | 0 | 114.3 | A299 L307 | A299-N301 VanDerWaalsContact C-OD1 3.25Å; A299-N301 WeakPolarHBondContact CB-OD1 3.16Å; A299-N301 PolarHBondContact O-N 3.2Å; A299-N301 PolarHBondContact O-OD1 2.91Å; N301-L307 HydrophobicContact CB-CD1 4.08Å; N301-L307 HydrophobicContact CB-CD2 4.31Å; N301-L307 HydrophobicContact CB-CG 4.01Å |
| 302 | E | 90.5 | Very high | 91.4 | Very high | 132 Ų | 132 | 42.6 Ų | 42.6 | 62% | 0.617 | 23% | 0.227 | S | C | * | . | G | 310 helix | trans | -97.4 | 1 | -179.6 | -61.6 | -179.4 | -170.3 | 0 | 0 | 112.7 | A211 A299 W300 | A211-E302 HydrophobicContact CB-CB 4.02Å; A299-E302 HydrophobicContact CB-CB 4.41Å; A299-E302 HydrophobicContact CB-CG 4.23Å; A299-E302 PolarHBondContact O-N 2.95Å; W300-E302 PolarHBondContact O-N 2.92Å |
| 303 | T | 91.6 | Very high | 90.9 | Very high | 14 Ų | 14 | 46.3 Ų | 46.3 | 9% | 0.086 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -100.9 | 163.8 | 179.3 | 70.7 | 0 | 0 | 0 | 0 | 111.3 | A211 T298 W300 Y305 G306 L327 | A211-T303 HydrophobicContact CB-CG2 3.72Å; T298-T303 HydrophobicContact CG2-CG2 3.64Å; W300-T303 HydrophobicContact CE3-CG2 4.41Å; W300-T303 PolarHBondContact O-N 3.35Å; W300-T303 PolarHBondContact O-OG1 3.03Å; T303-Y305 PolarHBondContact O-N 3.43Å; T303-Y305 WeakPolarHBondContact OG1-CB 3.43Å; T303-Y305 PolarHBondContact OG1-N 3.34Å; T303-G306 PolarHBondContact O-N 3.01Å; T303-L327 HydrophobicContact CG2-CD2 3.73Å |
| 304 | E | 87.4 | Confident | 90.4 | Very high | 184 Ų | 184 | 55.2 Ų | 55.2 | 86% | 0.86 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -17.9 | 172.5 | -66.7 | -173.3 | 171.5 | 0 | 0 | 113.4 | Y326 | E304-Y326 HydrophobicContact CB-CD1 4.05Å; E304-Y326 HydrophobicContact CB-CE1 4.43Å |
| 305 | Y | 88.6 | Confident | 89.9 | Confident | 21 Ų | 21 | 57.8 Ų | 57.8 | 8% | 0.082 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.6 | -38.2 | 174.9 | 175.2 | -88.5 | 0 | 0 | 0 | 112.3 | W300 T303 P308 P310 K313 E315 I322 Y326 | W300-Y305 HydrophobicContact CD2-CD1 4.41Å; W300-Y305 AromaticContact CE3-CD1 3.78Å; W300-Y305 HydrophobicContact CE3-CD1 3.78Å; W300-Y305 HydrophobicContact CE3-CG 4.06Å; W300-Y305 HydrophobicContact CZ3-CD1 4.45Å; W300-Y305 HydrophobicContact CZ3-CG 4.35Å; T303-Y305 PolarHBondContact O-N 3.43Å; T303-Y305 WeakPolarHBondContact OG1-CB 3.43Å; T303-Y305 PolarHBondContact OG1-N 3.34Å; Y305-P308 WeakPolarHBondContact CE1-O 3.44Å; Y305-P310 HydrophobicContact CD1-CG 4.36Å; Y305-P310 HydrophobicContact CE1-CG 3.72Å; Y305-P310 HydrophobicContact CE2-CG 4.45Å; Y305-P310 WeakPolarHBondContact OH-CA 3.37Å; Y305-K313 VanDerWaalsContact CZ-NZ 3.33Å; Y305-K313 VanDerWaalsContact OH-CD 3.28Å; Y305-K313 WeakPolarHBondContact OH-CD 3.46Å; Y305-K313 PolarHBondContact OH-NZ 3.26Å; Y305-E315 PolarHBondContact OH-OE2 2.79Å; Y305-I322 HydrophobicContact CD2-CG2 4.03Å; Y305-I322 HydrophobicContact CE2-CD1 4.25Å; Y305-I322 HydrophobicContact CE2-CG2 4.27Å; Y305-Y326 HydrophobicContact CD2-CD2 4.01Å; Y305-Y326 AromaticContact CD2-CE2 3.63Å; Y305-Y326 HydrophobicContact CD2-CE2 3.63Å; Y305-Y326 HydrophobicContact CG-CD2 4.41Å; Y305-Y326 HydrophobicContact CG-CE2 4.37Å |
| 306 | G | 88.5 | Confident | 89.5 | Confident | 19 Ų | 19 | 58.2 Ų | 58.2 | 20% | 0.196 | 30% | 0.297 | C | S | . | . | trans | 72 | -160.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | W300 T303 | W300-G306 WeakPolarHBondContact O-CA 3.47Å; W300-G306 PolarHBondContact O-N 2.94Å; T303-G306 PolarHBondContact O-N 3.01Å | ||
| 307 | L | 86.6 | Confident | 88.8 | Confident | 122 Ų | 122 | 60.3 Ų | 60.3 | 64% | 0.639 | 31% | 0.307 | S | S | * | . | S | Bend | trans | -106.6 | 152.7 | 177.9 | -70.8 | 176.9 | 0 | 0 | 0 | 111.5 | N301 | N301-L307 HydrophobicContact CB-CD1 4.08Å; N301-L307 HydrophobicContact CB-CD2 4.31Å; N301-L307 HydrophobicContact CB-CG 4.01Å |
| 308 | P | 86.8 | Confident | 88.4 | Confident | 63 Ų | 63 | 61.7 Ų | 61.7 | 41% | 0.409 | 31% | 0.314 | S | S | . | . | S | Bend | cis | -70.9 | 155.7 | -3.5 | 24.6 | -29.9 | 0 | 0 | 0 | 113.4 | Y305 T312 K313 | Y305-P308 WeakPolarHBondContact CE1-O 3.44Å; P308-T312 HydrophobicContact CB-CG2 3.88Å; P308-K313 HydrophobicContact CB-CG 4.36Å; P308-K313 HydrophobicContact CG-CD 4.34Å; P308-K313 HydrophobicContact CG-CG 3.74Å; P308-K313 WeakPolarHBondContact O-CE 3.29Å |
| 309 | D | 88.4 | Confident | 88.2 | Confident | 48 Ų | 48 | 61.6 Ų | 61.6 | 26% | 0.257 | 31% | 0.314 | S | S | . | . | trans | -62.2 | 162.9 | -178.2 | 63.1 | 40.4 | 0 | 0 | 0 | 113 | W300 M311 T312 K313 | W300-D309 HydrophobicContact CB-CB 4.28Å; W300-D309 HydrophobicContact CG-CB 4.27Å; D309-M311 VanDerWaalsContact C-N 3.26Å; D309-M311 PolarHBondContact O-N 3.17Å; D309-M311 PolarHBondContact OD1-N 3.44Å; D309-T312 PolarHBondContact O-N 3Å; D309-T312 VanDerWaalsContact OD1-CB 3.22Å; D309-T312 WeakPolarHBondContact OD1-CB 3.46Å; D309-T312 PolarHBondContact OD1-N 3.14Å; D309-T312 PolarHBondContact OD1-OG1 3.47Å; D309-K313 PolarHBondContact O-N 2.53Å | ||
| 310 | P | 89.3 | Confident | 88.1 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | -37.6 | -178.7 | -25.8 | 34.1 | 0 | 0 | 0 | 113.9 | Y76 W300 Y305 K313 K314 E315 I319 I322 | Y76-P310 HydrophobicContact CE1-CB 4.14Å; Y76-P310 WeakPolarHBondContact OH-CD 3.45Å; W300-P310 HydrophobicContact CD2-CG 3.92Å; W300-P310 HydrophobicContact CE3-CG 4.21Å; W300-P310 HydrophobicContact CG-CG 4.48Å; W300-P310 HydrophobicContact CH2-CG 4.26Å; W300-P310 HydrophobicContact CZ2-CG 3.98Å; W300-P310 HydrophobicContact CZ3-CG 4.37Å; Y305-P310 HydrophobicContact CD1-CG 4.36Å; Y305-P310 HydrophobicContact CE1-CG 3.72Å; Y305-P310 HydrophobicContact CE2-CG 4.45Å; Y305-P310 WeakPolarHBondContact OH-CA 3.37Å; P310-K313 PolarHBondContact O-N 2.94Å; P310-K314 PolarHBondContact O-N 3.03Å; P310-E315 HydrophobicContact CB-CB 4.46Å; P310-E315 PolarHBondContact O-N 3.29Å; P310-I319 HydrophobicContact CB-CD1 4.2Å; P310-I319 HydrophobicContact CG-CD1 4.15Å; P310-I322 HydrophobicContact CB-CD1 4.17Å; P310-I322 HydrophobicContact CG-CD1 4.4Å; P310-I322 HydrophobicContact CG-CG2 4.29Å |
| 311 | M | 87.8 | Confident | 88 | Confident | 76 Ų | 76 | 60.8 Ų | 60.8 | 37% | 0.374 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -47 | 177.6 | -173.9 | 62.9 | -166.4 | 0 | 0 | 111.9 | Y76 V77 P78 D309 K313 K314 A316 | Y76-M311 HydrophobicContact CE1-CB 4.06Å; Y76-M311 PolarHBondContact OH-N 3.23Å; Y76-M311 VanDerWaalsContact OH-N 3.12Å; V77-M311 HydrophobicContact CG1-CE 4.32Å; V77-M311 HydrophobicContact CG2-SD 4.32Å; P78-M311 HydrophobicContact CG-CG 4.39Å; D309-M311 VanDerWaalsContact C-N 3.26Å; D309-M311 PolarHBondContact O-N 3.17Å; D309-M311 PolarHBondContact OD1-N 3.44Å; M311-K313 VanDerWaalsContact C-N 3.32Å; M311-K313 PolarHBondContact O-N 2.87Å; M311-K314 PolarHBondContact O-N 3.23Å; M311-A316 HydrophobicContact SD-CB 3.94Å |
| 312 | T | 87.3 | Confident | 88 | Confident | 95 Ų | 95 | 56.4 Ų | 56.4 | 58% | 0.583 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -31.6 | -179 | -55.4 | 0 | 0 | 0 | 0 | 111.9 | P308 D309 K314 | P308-T312 HydrophobicContact CB-CG2 3.88Å; D309-T312 PolarHBondContact O-N 3Å; D309-T312 VanDerWaalsContact OD1-CB 3.22Å; D309-T312 WeakPolarHBondContact OD1-CB 3.46Å; D309-T312 PolarHBondContact OD1-N 3.14Å; D309-T312 PolarHBondContact OD1-OG1 3.47Å; T312-K314 PolarHBondContact O-N 2.9Å |
| 313 | K | 86.3 | Confident | 88.2 | Confident | 77 Ų | 77 | 50.1 Ų | 50.1 | 34% | 0.335 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -5.1 | 172.3 | -69.1 | -160.8 | -161.6 | 142.2 | 0 | 114.3 | Y305 P308 D309 P310 M311 E315 | Y305-K313 VanDerWaalsContact CZ-NZ 3.33Å; Y305-K313 VanDerWaalsContact OH-CD 3.28Å; Y305-K313 WeakPolarHBondContact OH-CD 3.46Å; Y305-K313 PolarHBondContact OH-NZ 3.26Å; P308-K313 HydrophobicContact CB-CG 4.36Å; P308-K313 HydrophobicContact CG-CD 4.34Å; P308-K313 HydrophobicContact CG-CG 3.74Å; P308-K313 WeakPolarHBondContact O-CE 3.29Å; D309-K313 PolarHBondContact O-N 2.53Å; P310-K313 PolarHBondContact O-N 2.94Å; M311-K313 VanDerWaalsContact C-N 3.32Å; M311-K313 PolarHBondContact O-N 2.87Å; K313-E315 VanDerWaalsContact C-N 3.32Å; K313-E315 HydrophobicContact CB-CB 4.45Å; K313-E315 HydrophobicContact CB-CG 3.8Å |
| 314 | K | 84.7 | Confident | 88.2 | Confident | 187 Ų | 187 | 49.4 Ų | 49.4 | 81% | 0.813 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.1 | 38.7 | -171.7 | -51 | -179.2 | 177.2 | -176.1 | 0 | 112.7 | P310 M311 T312 | P310-K314 PolarHBondContact O-N 3.03Å; M311-K314 PolarHBondContact O-N 3.23Å; T312-K314 PolarHBondContact O-N 2.9Å |
| 315 | E | 85.9 | Confident | 88.4 | Confident | 55 Ų | 55 | 42.1 Ų | 42.1 | 26% | 0.257 | 22% | 0.218 | S | C | . | . | trans | -113.2 | 21.9 | 179.2 | -60 | -177.5 | 166 | 0 | 0 | 111.4 | Y305 P310 K313 D317 M318 I319 I322 | Y305-E315 PolarHBondContact OH-OE2 2.79Å; P310-E315 HydrophobicContact CB-CB 4.46Å; P310-E315 PolarHBondContact O-N 3.29Å; K313-E315 VanDerWaalsContact C-N 3.32Å; K313-E315 HydrophobicContact CB-CB 4.45Å; K313-E315 HydrophobicContact CB-CG 3.8Å; E315-D317 VanDerWaalsContact C-N 3.27Å; E315-D317 PolarHBondContact O-N 3.05Å; E315-M318 HydrophobicContact CB-CE 3.65Å; E315-M318 HydrophobicContact CG-CE 3.49Å; E315-M318 VanDerWaalsContact CG-CE 3.49Å; E315-M318 CarbonylContact O-C 3.45Å; E315-M318 WeakPolarHBondContact O-CA 3.32Å; E315-M318 WeakPolarHBondContact O-CB 3.34Å; E315-M318 PolarHBondContact O-N 3.38Å; E315-I319 PolarHBondContact O-N 3Å; E315-I322 HydrophobicContact CB-CD1 4.05Å | ||
| 316 | A | 86.3 | Confident | 88.5 | Confident | 8 Ų | 8 | 45 Ų | 45 | 7% | 0.066 | 23% | 0.229 | C | C | . | . | G | 310 helix | trans | -63.2 | -32 | 180 | 0 | 0 | 0 | 0 | 0 | 112.8 | E73 Y76 V77 M311 M318 I319 | E73-A316 HydrophobicContact CG-CB 4.44Å; Y76-A316 HydrophobicContact CD1-CB 3.9Å; Y76-A316 HydrophobicContact CE1-CB 3.96Å; V77-A316 HydrophobicContact CG2-CB 4.05Å; M311-A316 HydrophobicContact SD-CB 3.94Å; A316-M318 PolarHBondContact O-N 3.39Å; A316-I319 VanDerWaalsContact O-CB 3.31Å; A316-I319 WeakPolarHBondContact O-CB 3.47Å; A316-I319 VanDerWaalsContact O-CG2 3.26Å; A316-I319 WeakPolarHBondContact O-CG2 3.46Å; A316-I319 PolarHBondContact O-N 3.22Å; A316-I319 VanDerWaalsContact O-N 3.15Å |
| 317 | D | 80.6 | Confident | 88.8 | Confident | 49 Ų | 49 | 44.2 Ų | 44.2 | 26% | 0.262 | 22% | 0.221 | S | C | . | . | G | 310 helix | trans | -66 | -19.9 | 173 | 63.2 | -26.2 | 0 | 0 | 0 | 112.9 | E315 | E315-D317 VanDerWaalsContact C-N 3.27Å; E315-D317 PolarHBondContact O-N 3.05Å |
| 318 | M | 86.6 | Confident | 89.1 | Confident | 30 Ų | 30 | 39 Ų | 39 | 15% | 0.148 | 20% | 0.195 | C | C | . | . | G | 310 helix | trans | -100.3 | 10.5 | 175.6 | -55.8 | -164.1 | -70.6 | 0 | 0 | 113.1 | A151 V155 E315 A316 L320 P321 I322 | A151-M318 HydrophobicContact CB-CG 3.91Å; A151-M318 HydrophobicContact CB-SD 3.94Å; V155-M318 HydrophobicContact CG2-SD 4.15Å; E315-M318 HydrophobicContact CB-CE 3.65Å; E315-M318 HydrophobicContact CG-CE 3.49Å; E315-M318 VanDerWaalsContact CG-CE 3.49Å; E315-M318 CarbonylContact O-C 3.45Å; E315-M318 WeakPolarHBondContact O-CA 3.32Å; E315-M318 WeakPolarHBondContact O-CB 3.34Å; E315-M318 PolarHBondContact O-N 3.38Å; A316-M318 PolarHBondContact O-N 3.39Å; M318-L320 VanDerWaalsContact C-N 3.25Å; M318-L320 PolarHBondContact O-N 3.11Å; M318-P321 HydrophobicContact CB-CG 4.18Å; M318-P321 WeakPolarHBondContact O-CD 3.09Å; M318-P321 WeakPolarHBondContact O-CG 3.28Å; M318-I322 HydrophobicContact CB-CD1 3.89Å; M318-I322 HydrophobicContact CB-CG1 4.27Å; M318-I322 WeakPolarHBondContact O-CB 3.36Å; M318-I322 WeakPolarHBondContact O-CD1 3.5Å; M318-I322 WeakPolarHBondContact O-CG1 3.36Å; M318-I322 PolarHBondContact O-N 3.35Å |
| 319 | I | 91.5 | Very high | 89.3 | Confident | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.4 | -38.3 | -175.6 | -168 | 63.9 | 0 | 0 | 0 | 112.8 | A72 Y76 W300 P310 E315 A316 I322 V323 | A72-I319 HydrophobicContact CB-CG2 4.03Å; Y76-I319 HydrophobicContact CD1-CB 3.87Å; Y76-I319 HydrophobicContact CD1-CD1 3.87Å; Y76-I319 HydrophobicContact CD1-CG1 3.75Å; Y76-I319 HydrophobicContact CD1-CG2 4.33Å; Y76-I319 HydrophobicContact CD2-CD1 3.77Å; Y76-I319 HydrophobicContact CD2-CG1 3.81Å; Y76-I319 HydrophobicContact CE1-CB 4.45Å; Y76-I319 HydrophobicContact CE1-CD1 3.8Å; Y76-I319 HydrophobicContact CE1-CG1 4.22Å; Y76-I319 HydrophobicContact CE2-CD1 3.72Å; Y76-I319 HydrophobicContact CE2-CG1 4.28Å; Y76-I319 HydrophobicContact CG-CB 4.05Å; Y76-I319 HydrophobicContact CG-CD1 3.86Å; Y76-I319 HydrophobicContact CG-CG1 3.53Å; Y76-I319 HydrophobicContact CG-CG2 4.3Å; W300-I319 HydrophobicContact CH2-CD1 4.1Å; W300-I319 HydrophobicContact CZ2-CD1 3.57Å; P310-I319 HydrophobicContact CB-CD1 4.2Å; P310-I319 HydrophobicContact CG-CD1 4.15Å; E315-I319 PolarHBondContact O-N 3Å; A316-I319 VanDerWaalsContact O-CB 3.31Å; A316-I319 WeakPolarHBondContact O-CB 3.47Å; A316-I319 VanDerWaalsContact O-CG2 3.26Å; A316-I319 WeakPolarHBondContact O-CG2 3.46Å; A316-I319 PolarHBondContact O-N 3.22Å; A316-I319 VanDerWaalsContact O-N 3.15Å; I319-I322 PolarHBondContact O-N 2.94Å; I319-V323 HydrophobicContact CD1-CG2 4.31Å; I319-V323 HydrophobicContact CG1-CG2 4.24Å; I319-V323 WeakPolarHBondContact O-CB 3.36Å; I319-V323 WeakPolarHBondContact O-CG2 3.25Å; I319-V323 PolarHBondContact O-N 3.29Å |
| 320 | L | 91.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.5 | -57 | 179.2 | -173.5 | 156.8 | 0 | 0 | 0 | 111.5 | I68 A72 L199 I291 M318 I322 V323 L324 V340 | I68-L320 HydrophobicContact CB-CD1 4.47Å; I68-L320 HydrophobicContact CG2-CD1 3.32Å; A72-L320 HydrophobicContact CB-CB 3.9Å; A72-L320 HydrophobicContact CB-CD1 4.06Å; A72-L320 HydrophobicContact CB-CG 4.45Å; L199-L320 HydrophobicContact CD2-CD2 4.46Å; I291-L320 HydrophobicContact CD1-CG 4.44Å; I291-L320 HydrophobicContact CG2-CB 4.27Å; I291-L320 HydrophobicContact CG2-CG 4.01Å; M318-L320 VanDerWaalsContact C-N 3.25Å; M318-L320 PolarHBondContact O-N 3.11Å; L320-I322 VanDerWaalsContact C-N 3.28Å; L320-I322 PolarHBondContact O-N 2.95Å; L320-V323 PolarHBondContact O-N 3.48Å; L320-L324 HydrophobicContact CD2-CD1 3.73Å; L320-L324 HydrophobicContact CD2-CG 4.31Å; L320-L324 WeakPolarHBondContact O-CG 3.47Å; L320-L324 PolarHBondContact O-N 2.75Å; L320-L324 VanDerWaalsContact O-N 3.12Å; L320-V340 HydrophobicContact CD2-CB 4.49Å; L320-V340 HydrophobicContact CD2-CG1 4.3Å; L320-V340 HydrophobicContact CD2-CG2 3.48Å; L320-V340 VanDerWaalsContact CD2-CG2 3.48Å |
| 321 | P | 90.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63.6 | -32.8 | 177.4 | 21.5 | -31.5 | 0 | 0 | 0 | 113.1 | V155 M318 L324 Q325 L337 | V155-P321 HydrophobicContact CB-CB 4.18Å; V155-P321 HydrophobicContact CG1-CB 4.19Å; V155-P321 HydrophobicContact CG2-CB 4.27Å; V155-P321 HydrophobicContact CG2-CG 4.35Å; M318-P321 HydrophobicContact CB-CG 4.18Å; M318-P321 WeakPolarHBondContact O-CD 3.09Å; M318-P321 WeakPolarHBondContact O-CG 3.28Å; P321-L324 PolarHBondContact O-N 3.22Å; P321-Q325 WeakPolarHBondContact O-CB 3.24Å; P321-Q325 PolarHBondContact O-N 3.22Å; P321-L337 HydrophobicContact CB-CD2 3.46Å; P321-L337 VanDerWaalsContact CB-CD2 3.46Å |
| 322 | I | 91.6 | Very high | 89.1 | Confident | 4 Ų | 4 | 47 Ų | 47 | 2% | 0.021 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.9 | -48 | 175.5 | -69.3 | 168.9 | 0 | 0 | 0 | 111 | W300 Y305 P310 E315 M318 I319 L320 L324 Q325 Y326 | W300-I322 HydrophobicContact CH2-CG2 3.59Å; W300-I322 HydrophobicContact CZ3-CG2 3.58Å; Y305-I322 HydrophobicContact CD2-CG2 4.03Å; Y305-I322 HydrophobicContact CE2-CD1 4.25Å; Y305-I322 HydrophobicContact CE2-CG2 4.27Å; P310-I322 HydrophobicContact CB-CD1 4.17Å; P310-I322 HydrophobicContact CG-CD1 4.4Å; P310-I322 HydrophobicContact CG-CG2 4.29Å; E315-I322 HydrophobicContact CB-CD1 4.05Å; M318-I322 HydrophobicContact CB-CD1 3.89Å; M318-I322 HydrophobicContact CB-CG1 4.27Å; M318-I322 WeakPolarHBondContact O-CB 3.36Å; M318-I322 WeakPolarHBondContact O-CD1 3.5Å; M318-I322 WeakPolarHBondContact O-CG1 3.36Å; M318-I322 PolarHBondContact O-N 3.35Å; I319-I322 PolarHBondContact O-N 2.94Å; L320-I322 VanDerWaalsContact C-N 3.28Å; L320-I322 PolarHBondContact O-N 2.95Å; I322-L324 VanDerWaalsContact C-N 3.3Å; I322-L324 PolarHBondContact O-N 3.25Å; I322-Q325 PolarHBondContact O-N 3.32Å; I322-Q325 VanDerWaalsContact O-N 3.17Å; I322-Y326 HydrophobicContact CG2-CD2 3.8Å; I322-Y326 HydrophobicContact CG2-CE2 4.29Å; I322-Y326 VanDerWaalsContact O-CD2 3.3Å; I322-Y326 WeakPolarHBondContact O-CD2 3.49Å; I322-Y326 PolarHBondContact O-N 3.37Å |
| 323 | V | 94.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -59.1 | -44.3 | 176.9 | 164 | 0 | 0 | 0 | 0 | 110.7 | A206 I291 I294 W300 I319 L320 Q325 L327 | A206-V323 HydrophobicContact CB-CG1 4.04Å; I291-V323 HydrophobicContact CG2-CB 3.82Å; I291-V323 HydrophobicContact CG2-CG1 3.75Å; I291-V323 HydrophobicContact CG2-CG2 4.23Å; I294-V323 HydrophobicContact CG2-CG1 4.12Å; W300-V323 HydrophobicContact CH2-CG2 4.02Å; W300-V323 HydrophobicContact CZ2-CG2 4.35Å; I319-V323 HydrophobicContact CD1-CG2 4.31Å; I319-V323 HydrophobicContact CG1-CG2 4.24Å; I319-V323 WeakPolarHBondContact O-CB 3.36Å; I319-V323 WeakPolarHBondContact O-CG2 3.25Å; I319-V323 PolarHBondContact O-N 3.29Å; L320-V323 PolarHBondContact O-N 3.48Å; V323-Q325 VanDerWaalsContact C-N 3.34Å; V323-Q325 PolarHBondContact O-N 3.16Å; V323-L327 HydrophobicContact CB-CD1 4.38Å; V323-L327 HydrophobicContact CG1-CB 4.49Å; V323-L327 HydrophobicContact CG1-CD1 4.04Å; V323-L327 HydrophobicContact CG2-CD1 4.15Å; V323-L327 VanDerWaalsContact O-CB 3.29Å; V323-L327 WeakPolarHBondContact O-CB 3.06Å; V323-L327 PolarHBondContact O-N 2.94Å |
| 324 | L | 92.6 | Very high | 89.1 | Confident | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.5 | -39.5 | 176.9 | -64.8 | -176.6 | 0 | 0 | 0 | 112.3 | L199 S202 I291 L320 P321 I322 C328 S333 L337 V340 | L199-L324 HydrophobicContact CD2-CD1 4.19Å; S202-L324 WeakPolarHBondContact OG-CD2 3.26Å; I291-L324 HydrophobicContact CD1-CD2 4.21Å; L320-L324 HydrophobicContact CD2-CD1 3.73Å; L320-L324 HydrophobicContact CD2-CG 4.31Å; L320-L324 WeakPolarHBondContact O-CG 3.47Å; L320-L324 PolarHBondContact O-N 2.75Å; L320-L324 VanDerWaalsContact O-N 3.12Å; P321-L324 PolarHBondContact O-N 3.22Å; I322-L324 VanDerWaalsContact C-N 3.3Å; I322-L324 PolarHBondContact O-N 3.25Å; L324-C328 VanDerWaalsContact O-CB 3.32Å; L324-C328 WeakPolarHBondContact O-CB 3.27Å; L324-S333 VanDerWaalsContact C-OG 3.3Å; L324-S333 WeakPolarHBondContact O-CB 3.19Å; L324-S333 PolarHBondContact O-OG 2.94Å; L324-L337 HydrophobicContact CB-CD1 4.35Å; L324-L337 HydrophobicContact CB-CD2 3.99Å; L324-L337 HydrophobicContact CB-CG 3.88Å; L324-L337 HydrophobicContact CD1-CD2 3.98Å; L324-L337 HydrophobicContact CD1-CG 4.05Å; L324-V340 HydrophobicContact CD1-CG2 4.18Å |
| 325 | Q | 90.6 | Very high | 89.1 | Confident | 31 Ų | 31 | 35.3 Ų | 35.3 | 15% | 0.145 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -69.8 | -45 | -178.5 | -176.7 | 62.8 | 26.9 | 0 | 0 | 112.5 | V155 P321 I322 V323 S333 L337 | V155-Q325 HydrophobicContact CG1-CB 3.96Å; V155-Q325 HydrophobicContact CG1-CG 4.21Å; P321-Q325 WeakPolarHBondContact O-CB 3.24Å; P321-Q325 PolarHBondContact O-N 3.22Å; I322-Q325 PolarHBondContact O-N 3.32Å; I322-Q325 VanDerWaalsContact O-N 3.17Å; V323-Q325 VanDerWaalsContact C-N 3.34Å; V323-Q325 PolarHBondContact O-N 3.16Å; Q325-S333 WeakPolarHBondContact CA-OG 3.3Å; Q325-L337 HydrophobicContact CB-CD1 4.46Å |
| 326 | Y | 91.6 | Very high | 89.2 | Confident | 80 Ų | 80 | 32.7 Ų | 32.7 | 31% | 0.314 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -103.2 | -17.7 | -166.8 | -67.3 | -76 | 0 | 0 | 0 | 114.7 | E304 Y305 I322 | E304-Y326 HydrophobicContact CB-CD1 4.05Å; E304-Y326 HydrophobicContact CB-CE1 4.43Å; Y305-Y326 HydrophobicContact CD2-CD2 4.01Å; Y305-Y326 AromaticContact CD2-CE2 3.63Å; Y305-Y326 HydrophobicContact CD2-CE2 3.63Å; Y305-Y326 HydrophobicContact CG-CD2 4.41Å; Y305-Y326 HydrophobicContact CG-CE2 4.37Å; I322-Y326 HydrophobicContact CG2-CD2 3.8Å; I322-Y326 HydrophobicContact CG2-CE2 4.29Å; I322-Y326 VanDerWaalsContact O-CD2 3.3Å; I322-Y326 WeakPolarHBondContact O-CD2 3.49Å; I322-Y326 PolarHBondContact O-N 3.37Å |
| 327 | L | 93.7 | Very high | 89.2 | Confident | 4 Ų | 4 | 32.3 Ų | 32.3 | 2% | 0.021 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -112.8 | -9.5 | -176.9 | -53.1 | -180 | 0 | 0 | 0 | 113.4 | A206 H209 V212 I294 T298 W300 T303 V323 | A206-L327 HydrophobicContact CB-CB 4.25Å; H209-L327 HydrophobicContact CB-CB 4.32Å; H209-L327 HydrophobicContact CB-CD2 4.44Å; V212-L327 HydrophobicContact CG2-CD1 3.94Å; V212-L327 HydrophobicContact CG2-CD2 4.47Å; I294-L327 HydrophobicContact CG2-CD1 3.8Å; T298-L327 HydrophobicContact CG2-CD1 4.03Å; T298-L327 HydrophobicContact CG2-CD2 4.02Å; T298-L327 WeakPolarHBondContact OG1-CD1 3.44Å; W300-L327 HydrophobicContact CH2-CD1 4.44Å; T303-L327 HydrophobicContact CG2-CD2 3.73Å; V323-L327 HydrophobicContact CB-CD1 4.38Å; V323-L327 HydrophobicContact CG1-CB 4.49Å; V323-L327 HydrophobicContact CG1-CD1 4.04Å; V323-L327 HydrophobicContact CG2-CD1 4.15Å; V323-L327 VanDerWaalsContact O-CB 3.29Å; V323-L327 WeakPolarHBondContact O-CB 3.06Å; V323-L327 PolarHBondContact O-N 2.94Å |
| 328 | C | 93.1 | Very high | 89.4 | Confident | 13 Ų | 13 | 30.2 Ų | 30.2 | 9% | 0.088 | 14% | 0.144 | C | C | . | . | S | Bend | trans | -105.8 | 152.1 | 176.3 | -62.9 | 0 | 0 | 0 | 0 | 111.7 | L324 I332 | L324-C328 VanDerWaalsContact O-CB 3.32Å; L324-C328 WeakPolarHBondContact O-CB 3.27Å; C328-I332 HydrophobicContact CB-CB 4.44Å; C328-I332 HydrophobicContact CB-CG2 4.31Å |
| 329 | P | 90.7 | Very high | 89.3 | Confident | 60 Ų | 60 | 28.9 Ų | 28.9 | 39% | 0.39 | 14% | 0.138 | S | C | . | . | trans | -57.6 | 146.6 | 166.7 | -22.7 | 32.8 | 0 | 0 | 0 | 112 | F205 Y331 I332 S333 | F205-P329 HydrophobicContact CD1-CG 3.62Å; F205-P329 HydrophobicContact CE1-CG 4.17Å; F205-P329 HydrophobicContact CG-CG 4.37Å; P329-Y331 VanDerWaalsContact C-N 3.32Å; P329-Y331 PolarHBondContact O-N 3.27Å; P329-Y331 VanDerWaalsContact O-N 3.1Å; P329-I332 HydrophobicContact CG-CD1 4.22Å; P329-I332 PolarHBondContact O-N 3.41Å; P329-S333 PolarHBondContact O-N 3Å | ||
| 330 | V | 86.6 | Confident | 88.9 | Confident | 77 Ų | 77 | 28.9 Ų | 28.9 | 47% | 0.467 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -44.6 | -49.3 | -174 | 179.8 | 0 | 0 | 0 | 0 | 113.8 | I332 S333 F334 | V330-I332 PolarHBondContact O-N 3.16Å; V330-S333 WeakPolarHBondContact O-CB 3.33Å; V330-S333 PolarHBondContact O-N 3.45Å; V330-F334 HydrophobicContact CG1-CD2 3.87Å; V330-F334 HydrophobicContact CG1-CE2 3.27Å; V330-F334 HydrophobicContact CG1-CZ 3.79Å; V330-F334 WeakPolarHBondContact O-CD2 3.45Å; V330-F334 WeakPolarHBondContact O-CG 3.35Å; V330-F334 PolarHBondContact O-N 3.36Å |
| 331 | Y | 86.8 | Confident | 88.4 | Confident | 193 Ų | 193 | 28.9 Ų | 28.9 | 76% | 0.757 | 14% | 0.138 | S | C | * | . | H | α-helix | trans | -66.4 | -36.6 | -178.2 | -56.3 | -69.3 | 0 | 0 | 0 | 113.6 | P329 F335 | P329-Y331 VanDerWaalsContact C-N 3.32Å; P329-Y331 PolarHBondContact O-N 3.27Å; P329-Y331 VanDerWaalsContact O-N 3.1Å; Y331-F335 WeakPolarHBondContact O-CB 3.43Å; Y331-F335 PolarHBondContact O-N 3.45Å; Y331-F335 VanDerWaalsContact O-N 3.15Å |
| 332 | I | 89.7 | Confident | 87.9 | Confident | 25 Ų | 25 | 28.9 Ų | 28.9 | 13% | 0.128 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -76 | -40.1 | -179.4 | -61.3 | -179 | 0 | 0 | 0 | 109.5 | I201 F205 C328 P329 V330 F335 G336 | I201-I332 HydrophobicContact CG2-CD1 4.36Å; I201-I332 HydrophobicContact CG2-CG2 4.15Å; F205-I332 HydrophobicContact CB-CD1 4.31Å; F205-I332 HydrophobicContact CD1-CD1 3.6Å; F205-I332 HydrophobicContact CD2-CD1 3.25Å; F205-I332 HydrophobicContact CE1-CD1 3.55Å; F205-I332 HydrophobicContact CE2-CD1 3.2Å; F205-I332 HydrophobicContact CG-CD1 3.43Å; F205-I332 VanDerWaalsContact CG-CD1 3.43Å; F205-I332 HydrophobicContact CZ-CD1 3.35Å; C328-I332 HydrophobicContact CB-CB 4.44Å; C328-I332 HydrophobicContact CB-CG2 4.31Å; P329-I332 HydrophobicContact CG-CD1 4.22Å; P329-I332 PolarHBondContact O-N 3.41Å; V330-I332 PolarHBondContact O-N 3.16Å; I332-F335 PolarHBondContact O-N 2.92Å; I332-G336 PolarHBondContact O-N 2.84Å |
| 333 | S | 87.7 | Confident | 87.2 | Confident | 1 Ų | 1 | 28.7 Ų | 28.7 | 1% | 0.007 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -53 | -55.1 | 172.2 | -175.2 | 0 | 0 | 0 | 0 | 111.2 | L324 Q325 P329 V330 F335 G336 L337 | L324-S333 VanDerWaalsContact C-OG 3.3Å; L324-S333 WeakPolarHBondContact O-CB 3.19Å; L324-S333 PolarHBondContact O-OG 2.94Å; Q325-S333 WeakPolarHBondContact CA-OG 3.3Å; P329-S333 PolarHBondContact O-N 3Å; V330-S333 WeakPolarHBondContact O-CB 3.33Å; V330-S333 PolarHBondContact O-N 3.45Å; S333-F335 PolarHBondContact O-N 3.47Å; S333-G336 PolarHBondContact O-N 3.12Å; S333-L337 VanDerWaalsContact O-CB 3.23Å; S333-L337 WeakPolarHBondContact O-CB 3.32Å; S333-L337 VanDerWaalsContact O-CG 3.24Å; S333-L337 WeakPolarHBondContact O-CG 3.35Å; S333-L337 PolarHBondContact O-N 2.92Å; S333-L337 WeakPolarHBondContact OG-CD1 3.47Å |
| 334 | F | 84.2 | Confident | 86.5 | Confident | 25 Ų | 25 | 28.7 Ų | 28.7 | 11% | 0.11 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.6 | -38.6 | 180 | -64.9 | -31.5 | 0 | 0 | 0 | 113.3 | E6 G7 A10 I156 V330 G338 | E6-F334 HydrophobicContact CB-CE2 3.77Å; E6-F334 HydrophobicContact CB-CZ 4.3Å; G7-F334 VanDerWaalsContact CA-CE1 3.5Å; A10-F334 HydrophobicContact CB-CB 4.35Å; I156-F334 HydrophobicContact CG2-CD1 4.34Å; I156-F334 HydrophobicContact CG2-CE1 4.39Å; V330-F334 HydrophobicContact CG1-CD2 3.87Å; V330-F334 HydrophobicContact CG1-CE2 3.27Å; V330-F334 HydrophobicContact CG1-CZ 3.79Å; V330-F334 WeakPolarHBondContact O-CD2 3.45Å; V330-F334 WeakPolarHBondContact O-CG 3.35Å; V330-F334 PolarHBondContact O-N 3.36Å; F334-G338 PolarHBondContact O-N 3.04Å |
| 335 | F | 85.9 | Confident | 85.8 | Confident | 86 Ų | 86 | 28.8 Ų | 28.8 | 38% | 0.377 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -65.4 | -46 | 175.8 | -177.1 | -113.3 | 0 | 0 | 0 | 111.9 | L197 G198 I201 Y331 I332 S333 A339 | L197-F335 HydrophobicContact CB-CE1 4Å; L197-F335 HydrophobicContact CB-CZ 4.17Å; G198-F335 VanDerWaalsContact CA-CE1 3.4Å; I201-F335 HydrophobicContact CD1-CE1 4.37Å; Y331-F335 WeakPolarHBondContact O-CB 3.43Å; Y331-F335 PolarHBondContact O-N 3.45Å; Y331-F335 VanDerWaalsContact O-N 3.15Å; I332-F335 PolarHBondContact O-N 2.92Å; S333-F335 PolarHBondContact O-N 3.47Å; F335-A339 VanDerWaalsContact O-CB 3.27Å; F335-A339 WeakPolarHBondContact O-CB 3.17Å; F335-A339 PolarHBondContact O-N 2.91Å |
| 336 | G | 88 | Confident | 85.3 | Confident | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.5 | -46.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | I332 S333 A339 V340 | I332-G336 PolarHBondContact O-N 2.84Å; S333-G336 PolarHBondContact O-N 3.12Å; G336-A339 WeakPolarHBondContact O-CB 3.35Å; G336-A339 PolarHBondContact O-N 3.39Å; G336-V340 WeakPolarHBondContact O-CG2 3.28Å; G336-V340 PolarHBondContact O-N 2.87Å |
| 337 | L | 86.1 | Confident | 84.8 | Confident | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.5 | -39.5 | 178.9 | -74.1 | 168.3 | 0 | 0 | 0 | 112.5 | T152 I156 P321 L324 Q325 S333 A339 V340 S341 | T152-L337 HydrophobicContact CG2-CD2 4.22Å; I156-L337 HydrophobicContact CD1-CB 3.62Å; I156-L337 HydrophobicContact CD1-CD2 4.48Å; I156-L337 HydrophobicContact CD1-CG 4.41Å; I156-L337 HydrophobicContact CG1-CB 3.71Å; I156-L337 HydrophobicContact CG1-CD1 3.63Å; I156-L337 HydrophobicContact CG1-CD2 4.15Å; I156-L337 HydrophobicContact CG1-CG 4.03Å; P321-L337 HydrophobicContact CB-CD2 3.46Å; P321-L337 VanDerWaalsContact CB-CD2 3.46Å; L324-L337 HydrophobicContact CB-CD1 4.35Å; L324-L337 HydrophobicContact CB-CD2 3.99Å; L324-L337 HydrophobicContact CB-CG 3.88Å; L324-L337 HydrophobicContact CD1-CD2 3.98Å; L324-L337 HydrophobicContact CD1-CG 4.05Å; Q325-L337 HydrophobicContact CB-CD1 4.46Å; S333-L337 VanDerWaalsContact O-CB 3.23Å; S333-L337 WeakPolarHBondContact O-CB 3.32Å; S333-L337 VanDerWaalsContact O-CG 3.24Å; S333-L337 WeakPolarHBondContact O-CG 3.35Å; S333-L337 PolarHBondContact O-N 2.92Å; S333-L337 WeakPolarHBondContact OG-CD1 3.47Å; L337-A339 VanDerWaalsContact C-N 3.34Å; L337-V340 PolarHBondContact O-N 3.15Å; L337-S341 PolarHBondContact O-N 2.76Å; L337-S341 PolarHBondContact O-OG 2.99Å |
| 338 | G | 84.6 | Confident | 84.4 | Confident | 6 Ų | 6 | 23.4 Ų | 23.4 | 6% | 0.062 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.1 | -42 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | F14 F334 S341 A342 | F14-G338 WeakPolarHBondContact CE1-O 3.46Å; F334-G338 PolarHBondContact O-N 3.04Å; G338-S341 WeakPolarHBondContact O-CB 3.41Å; G338-S341 PolarHBondContact O-N 2.87Å; G338-A342 PolarHBondContact O-N 3.29Å |
| 339 | A | 83.9 | Confident | 83.8 | Confident | 1 Ų | 1 | 22.8 Ų | 22.8 | 1% | 0.008 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.6 | -42.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | C194 I195 F335 G336 L337 S341 A342 A343 | C194-A339 HydrophobicContact CB-CB 4.31Å; C194-A339 VanDerWaalsContact O-CB 3.24Å; C194-A339 WeakPolarHBondContact O-CB 3.21Å; I195-A339 WeakPolarHBondContact CG1-O 3.24Å; F335-A339 VanDerWaalsContact O-CB 3.27Å; F335-A339 WeakPolarHBondContact O-CB 3.17Å; F335-A339 PolarHBondContact O-N 2.91Å; G336-A339 WeakPolarHBondContact O-CB 3.35Å; G336-A339 PolarHBondContact O-N 3.39Å; L337-A339 VanDerWaalsContact C-N 3.34Å; A339-S341 VanDerWaalsContact C-N 3.31Å; A339-S341 PolarHBondContact O-N 2.97Å; A339-A342 WeakPolarHBondContact O-CB 3.39Å; A339-A342 PolarHBondContact O-N 3.02Å; A339-A343 PolarHBondContact O-N 2.92Å; A339-A343 VanDerWaalsContact O-N 3.09Å |
| 340 | V | 83.1 | Confident | 83.5 | Confident | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.1 | -46.9 | 172 | 173.9 | 0 | 0 | 0 | 0 | 110.1 | T152 L199 L320 L324 G336 L337 A342 A343 V344 | T152-V340 HydrophobicContact CG2-CB 4.27Å; T152-V340 HydrophobicContact CG2-CG1 4.02Å; L199-V340 HydrophobicContact CD2-CG2 3.73Å; L320-V340 HydrophobicContact CD2-CB 4.49Å; L320-V340 HydrophobicContact CD2-CG1 4.3Å; L320-V340 HydrophobicContact CD2-CG2 3.48Å; L320-V340 VanDerWaalsContact CD2-CG2 3.48Å; L324-V340 HydrophobicContact CD1-CG2 4.18Å; G336-V340 WeakPolarHBondContact O-CG2 3.28Å; G336-V340 PolarHBondContact O-N 2.87Å; L337-V340 PolarHBondContact O-N 3.15Å; V340-A342 PolarHBondContact O-N 3.03Å; V340-A343 WeakPolarHBondContact O-CA 3.28Å; V340-A343 WeakPolarHBondContact O-CB 3.45Å; V340-A343 PolarHBondContact O-N 3.49Å; V340-V344 HydrophobicContact CG1-CG2 4.19Å; V340-V344 WeakPolarHBondContact O-CG2 3.46Å; V340-V344 PolarHBondContact O-N 2.77Å; V340-V344 VanDerWaalsContact O-N 3.1Å |
| 341 | S | 82.7 | Confident | 83.6 | Confident | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -57.3 | -39 | 178 | -57 | 0 | 0 | 0 | 0 | 112.1 | T152 L337 G338 A339 V344 M345 | T152-S341 WeakPolarHBondContact CG2-OG 3.46Å; L337-S341 PolarHBondContact O-N 2.76Å; L337-S341 PolarHBondContact O-OG 2.99Å; G338-S341 WeakPolarHBondContact O-CB 3.41Å; G338-S341 PolarHBondContact O-N 2.87Å; A339-S341 VanDerWaalsContact C-N 3.31Å; A339-S341 PolarHBondContact O-N 2.97Å; S341-V344 PolarHBondContact O-N 3.14Å; S341-M345 WeakPolarHBondContact O-CG 3.49Å; S341-M345 PolarHBondContact O-N 3.33Å; S341-M345 VanDerWaalsContact O-N 3.09Å |
| 342 | A | 78.2 | Confident | 83.7 | Confident | 0 Ų | 0 | 7.3 Ų | 7.3 | 0% | 0 | 4% | 0.036 | C | C | . | . | H | α-helix | trans | -59.3 | -45.7 | 172 | 0 | 0 | 0 | 0 | 0 | 113.4 | F14 I18 Q191 G338 A339 V340 V344 M345 S346 | F14-A342 HydrophobicContact CE1-CB 3.29Å; F14-A342 HydrophobicContact CZ-CB 3.39Å; I18-A342 HydrophobicContact CD1-CB 4.1Å; Q191-A342 HydrophobicContact CB-CB 3.88Å; Q191-A342 HydrophobicContact CG-CB 3.7Å; Q191-A342 PolarHBondContact NE2-O 3.28Å; G338-A342 PolarHBondContact O-N 3.29Å; A339-A342 WeakPolarHBondContact O-CB 3.39Å; A339-A342 PolarHBondContact O-N 3.02Å; V340-A342 PolarHBondContact O-N 3.03Å; A342-V344 VanDerWaalsContact C-N 3.28Å; A342-V344 PolarHBondContact O-N 2.96Å; A342-M345 PolarHBondContact O-N 3.44Å; A342-S346 PolarHBondContact O-N 3.47Å; A342-S346 VanDerWaalsContact O-N 3.1Å |
| 343 | A | 78.2 | Confident | 83.5 | Confident | 0 Ų | 0 | 6.4 Ų | 6.4 | 0% | 0 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -55.5 | -48.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | I68 I195 A339 V340 M345 S346 S347 | I68-A343 HydrophobicContact CD1-CB 3.97Å; I195-A343 HydrophobicContact CD1-CB 3.12Å; I195-A343 HydrophobicContact CG1-CB 3.66Å; A339-A343 PolarHBondContact O-N 2.92Å; A339-A343 VanDerWaalsContact O-N 3.09Å; V340-A343 WeakPolarHBondContact O-CA 3.28Å; V340-A343 WeakPolarHBondContact O-CB 3.45Å; V340-A343 PolarHBondContact O-N 3.49Å; A343-M345 VanDerWaalsContact C-N 3.3Å; A343-M345 PolarHBondContact O-N 3.36Å; A343-S346 PolarHBondContact O-N 3.45Å; A343-S347 PolarHBondContact O-N 3.39Å; A343-S347 PolarHBondContact O-OG 3.44Å |
| 344 | V | 77.9 | Confident | 83.5 | Confident | 0 Ų | 0 | 6.3 Ų | 6.3 | 0% | 0 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -68.1 | -39.3 | -173.6 | -163.4 | 0 | 0 | 0 | 0 | 109.2 | I145 A148 L149 V340 S341 A342 S347 A348 | I145-V344 HydrophobicContact CB-CG1 4.19Å; I145-V344 HydrophobicContact CG2-CB 4.38Å; I145-V344 HydrophobicContact CG2-CG1 3.3Å; I145-V344 WeakPolarHBondContact CG2-O 3.18Å; I145-V344 WeakPolarHBondContact O-CG1 3.37Å; A148-V344 HydrophobicContact CB-CG1 4.36Å; L149-V344 HydrophobicContact CB-CB 4.06Å; L149-V344 HydrophobicContact CB-CG1 3.57Å; L149-V344 HydrophobicContact CD1-CB 4.04Å; L149-V344 HydrophobicContact CD1-CG2 4.41Å; L149-V344 HydrophobicContact CD2-CB 4.45Å; L149-V344 HydrophobicContact CD2-CG1 4.47Å; L149-V344 HydrophobicContact CG-CB 4.39Å; L149-V344 HydrophobicContact CG-CG1 4.38Å; V340-V344 HydrophobicContact CG1-CG2 4.19Å; V340-V344 WeakPolarHBondContact O-CG2 3.46Å; V340-V344 PolarHBondContact O-N 2.77Å; V340-V344 VanDerWaalsContact O-N 3.1Å; S341-V344 PolarHBondContact O-N 3.14Å; A342-V344 VanDerWaalsContact C-N 3.28Å; A342-V344 PolarHBondContact O-N 2.96Å; V344-S347 PolarHBondContact O-N 3.08Å; V344-A348 PolarHBondContact O-N 3.18Å |
| 345 | M | 79.1 | Confident | 83.9 | Confident | 3 Ų | 3 | 5.1 Ų | 5.1 | 2% | 0.015 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -59.4 | -49.2 | 174.2 | -76.2 | -176.4 | 144.1 | 0 | 0 | 113.2 | Y15 L149 I171 Y175 S341 A342 A343 S347 A348 D349 | Y15-M345 HydrophobicContact CD1-CE 4.15Å; Y15-M345 HydrophobicContact CD1-SD 3.85Å; Y15-M345 HydrophobicContact CD2-CE 3.91Å; Y15-M345 HydrophobicContact CE1-CE 3.74Å; Y15-M345 HydrophobicContact CE1-SD 3.42Å; Y15-M345 WeakPolarHBondContact CE1-SD 3.5Å; Y15-M345 HydrophobicContact CE2-CE 3.47Å; Y15-M345 VanDerWaalsContact CE2-CE 3.47Å; Y15-M345 HydrophobicContact CE2-SD 4.31Å; Y15-M345 HydrophobicContact CG-CE 4.22Å; Y15-M345 HydrophobicContact CG-SD 4.45Å; L149-M345 HydrophobicContact CD2-CG 3.69Å; I171-M345 HydrophobicContact CB-CE 4.01Å; I171-M345 HydrophobicContact CG2-CE 3.49Å; I171-M345 VanDerWaalsContact CG2-CE 3.49Å; Y175-M345 PolarHBondContact OH-O 2.86Å; Y175-M345 VanDerWaalsContact OH-O 3.09Å; S341-M345 WeakPolarHBondContact O-CG 3.49Å; S341-M345 PolarHBondContact O-N 3.33Å; S341-M345 VanDerWaalsContact O-N 3.09Å; A342-M345 PolarHBondContact O-N 3.44Å; A343-M345 VanDerWaalsContact C-N 3.3Å; A343-M345 PolarHBondContact O-N 3.36Å; M345-S347 PolarHBondContact O-N 3.44Å; M345-A348 WeakPolarHBondContact O-CB 3.49Å; M345-A348 PolarHBondContact O-N 2.9Å; M345-A348 VanDerWaalsContact O-N 3.08Å; M345-D349 PolarHBondContact O-N 3.27Å; M345-D349 VanDerWaalsContact O-N 3.15Å |
| 346 | S | 78.8 | Confident | 84.1 | Confident | 1 Ų | 1 | 1 Ų | 1 | 1% | 0.007 | 1% | 0.008 | C | C | . | . | H | α-helix | trans | -60.1 | -20.7 | 179 | -176.7 | 0 | 0 | 0 | 0 | 115.4 | D188 Q191 A342 A343 D349 S350 | D188-S346 PolarHBondContact OD1-OG 2.85Å; Q191-S346 PolarHBondContact OE1-OG 3.27Å; A342-S346 PolarHBondContact O-N 3.47Å; A342-S346 VanDerWaalsContact O-N 3.1Å; A343-S346 PolarHBondContact O-N 3.45Å; S346-D349 WeakPolarHBondContact CA-OD1 3.37Å; S346-S350 WeakPolarHBondContact O-CB 3.32Å; S346-S350 PolarHBondContact O-OG 3.2Å |
| 347 | S | 82.9 | Confident | 84.1 | Confident | 1 Ų | 1 | 1 Ų | 1 | 1% | 0.007 | 1% | 0.008 | C | C | . | . | H | α-helix | trans | -92 | -34.6 | 174.6 | -62.5 | 0 | 0 | 0 | 0 | 111.8 | A60 G64 I145 A343 V344 M345 D349 S351 | A60-S347 PolarHBondContact O-OG 3.04Å; G64-S347 WeakPolarHBondContact CA-OG 3.42Å; I145-S347 VanDerWaalsContact CD1-CB 3.45Å; A343-S347 PolarHBondContact O-N 3.39Å; A343-S347 PolarHBondContact O-OG 3.44Å; V344-S347 PolarHBondContact O-N 3.08Å; M345-S347 PolarHBondContact O-N 3.44Å; S347-D349 PolarHBondContact N-OD1 3.05Å; S347-S351 WeakPolarHBondContact O-CB 3.2Å; S347-S351 PolarHBondContact O-N 2.94Å |
| 348 | A | 83.5 | Confident | 84.3 | Confident | 0 Ų | 0 | 1.1 Ų | 1.1 | 0% | 0 | 1% | 0.008 | C | C | . | . | H | α-helix | trans | -64.9 | -49.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I145 F146 A172 V344 M345 S351 I352 | I145-A348 HydrophobicContact CG2-CB 3.68Å; F146-A348 HydrophobicContact CD1-CB 4.13Å; F146-A348 HydrophobicContact CE1-CB 3.55Å; F146-A348 HydrophobicContact CZ-CB 4.24Å; A172-A348 HydrophobicContact CB-CB 4.42Å; V344-A348 PolarHBondContact O-N 3.18Å; M345-A348 WeakPolarHBondContact O-CB 3.49Å; M345-A348 PolarHBondContact O-N 2.9Å; M345-A348 VanDerWaalsContact O-N 3.08Å; A348-S351 PolarHBondContact O-N 2.91Å; A348-I352 WeakPolarHBondContact O-CB 3.35Å; A348-I352 VanDerWaalsContact O-CG1 3.29Å; A348-I352 WeakPolarHBondContact O-CG1 3.37Å; A348-I352 PolarHBondContact O-N 3.18Å |
| 349 | D | 82 | Confident | 84.7 | Confident | 0 Ų | 0 | 3.5 Ų | 3.5 | 0% | 0 | 2% | 0.017 | C | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 176.6 | 49.7 | 5.4 | 0 | 0 | 0 | 111.9 | Y175 T176 V184 M345 S346 S347 S351 I352 L353 | Y175-D349 HydrophobicContact CE2-CB 3.78Å; Y175-D349 WeakPolarHBondContact CE2-OD2 3.05Å; Y175-D349 VanDerWaalsContact CZ-OD2 3.27Å; Y175-D349 WeakPolarHBondContact OH-CB 3.49Å; Y175-D349 PolarHBondContact OH-OD2 2.83Å; T176-D349 HydrophobicContact CG2-CB 4.29Å; T176-D349 WeakPolarHBondContact OG1-CB 3.49Å; V184-D349 HydrophobicContact CG2-CB 4.31Å; M345-D349 PolarHBondContact O-N 3.27Å; M345-D349 VanDerWaalsContact O-N 3.15Å; S346-D349 WeakPolarHBondContact CA-OD1 3.37Å; S347-D349 PolarHBondContact N-OD1 3.05Å; D349-S351 VanDerWaalsContact C-N 3.34Å; D349-S351 PolarHBondContact O-N 3.39Å; D349-I352 PolarHBondContact O-N 3.15Å; D349-L353 WeakPolarHBondContact O-CB 3.24Å; D349-L353 PolarHBondContact O-N 3.32Å |
| 350 | S | 83.8 | Confident | 85 | Confident | 4 Ų | 4 | 3.4 Ų | 3.4 | 3% | 0.028 | 2% | 0.016 | C | C | . | . | H | α-helix | trans | -57.5 | -45.5 | 174.6 | -69.4 | 0 | 0 | 0 | 0 | 111.5 | T61 R260 S346 S354 | T61-S350 WeakPolarHBondContact OG1-CB 3.23Å; T61-S350 PolarHBondContact OG1-OG 3.28Å; T61-S350 VanDerWaalsContact OG1-OG 3.04Å; R260-S350 PolarHBondContact NH2-OG 2.85Å; S346-S350 WeakPolarHBondContact O-CB 3.32Å; S346-S350 PolarHBondContact O-OG 3.2Å; S350-S354 WeakPolarHBondContact O-CB 3.45Å; S350-S354 PolarHBondContact O-N 3.09Å |
| 351 | S | 88.3 | Confident | 85.2 | Confident | 1 Ų | 1 | 6 Ų | 6 | 1% | 0.007 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -70.2 | -43.8 | -178.3 | -172.5 | 0 | 0 | 0 | 0 | 112.6 | E138 S347 A348 D349 S354 A355 | E138-S351 PolarHBondContact O-OG 2.82Å; E138-S351 WeakPolarHBondContact OE2-CA 3.4Å; E138-S351 WeakPolarHBondContact OE2-CB 3.27Å; E138-S351 PolarHBondContact OE2-OG 2.92Å; S347-S351 WeakPolarHBondContact O-CB 3.2Å; S347-S351 PolarHBondContact O-N 2.94Å; A348-S351 PolarHBondContact O-N 2.91Å; D349-S351 VanDerWaalsContact C-N 3.34Å; D349-S351 PolarHBondContact O-N 3.39Å; S351-S354 WeakPolarHBondContact O-CB 3.42Å; S351-S354 PolarHBondContact O-N 3Å; S351-A355 PolarHBondContact O-N 3.49Å |
| 352 | I | 89.1 | Confident | 85.5 | Confident | 0 Ų | 0 | 6 Ų | 6 | 0% | 0 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -68.1 | -40.6 | 178.5 | -67.8 | 167.2 | 0 | 0 | 0 | 111 | A142 F146 A348 D349 S354 S356 V385 | A142-I352 HydrophobicContact CB-CG1 4.26Å; F146-I352 HydrophobicContact CE1-CD1 4.5Å; F146-I352 HydrophobicContact CE2-CD1 4.01Å; F146-I352 HydrophobicContact CZ-CD1 3.52Å; A348-I352 WeakPolarHBondContact O-CB 3.35Å; A348-I352 VanDerWaalsContact O-CG1 3.29Å; A348-I352 WeakPolarHBondContact O-CG1 3.37Å; A348-I352 PolarHBondContact O-N 3.18Å; D349-I352 PolarHBondContact O-N 3.15Å; I352-S354 VanDerWaalsContact C-N 3.35Å; I352-S356 VanDerWaalsContact O-CB 3.24Å; I352-S356 WeakPolarHBondContact O-CB 3.24Å; I352-S356 PolarHBondContact O-N 3.49Å; I352-S356 PolarHBondContact O-OG 3.39Å; I352-V385 HydrophobicContact CG2-CB 4.07Å; I352-V385 HydrophobicContact CG2-CG1 3.79Å; I352-V385 HydrophobicContact CG2-CG2 4.16Å; I352-V385 WeakPolarHBondContact CG2-O 3.4Å |
| 353 | L | 85.8 | Confident | 86.1 | Confident | 5 Ų | 5 | 6.8 Ų | 6.8 | 3% | 0.026 | 3% | 0.03 | C | C | . | . | H | α-helix | trans | -65.4 | -40.7 | 175.2 | -177.4 | 63.4 | 0 | 0 | 0 | 111 | T176 L181 V184 D349 S356 S357 M381 | T176-L353 HydrophobicContact CG2-CB 4.38Å; L181-L353 HydrophobicContact CB-CD2 4.25Å; L181-L353 HydrophobicContact CD1-CD2 4.01Å; V184-L353 HydrophobicContact CG2-CD2 4.23Å; D349-L353 WeakPolarHBondContact O-CB 3.24Å; D349-L353 PolarHBondContact O-N 3.32Å; L353-S356 PolarHBondContact O-N 2.94Å; L353-S357 VanDerWaalsContact O-CB 3.27Å; L353-S357 WeakPolarHBondContact O-CB 3.28Å; L353-S357 PolarHBondContact O-N 2.89Å; L353-S357 PolarHBondContact O-OG 3.46Å; L353-M381 HydrophobicContact CD1-SD 3.9Å |
| 354 | S | 88.3 | Confident | 86.7 | Confident | 0 Ų | 0 | 9.5 Ų | 9.5 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -55.7 | -56.9 | 173.4 | 170.5 | 0 | 0 | 0 | 0 | 111.6 | E138 Q255 A256 S350 S351 I352 S356 S357 M358 | E138-S354 VanDerWaalsContact CD-OG 3.25Å; E138-S354 WeakPolarHBondContact OE1-CB 3.46Å; E138-S354 PolarHBondContact OE1-OG 3.21Å; Q255-S354 WeakPolarHBondContact CB-OG 3.28Å; Q255-S354 WeakPolarHBondContact CG-OG 3.36Å; A256-S354 PolarHBondContact N-OG 3.13Å; S350-S354 WeakPolarHBondContact O-CB 3.45Å; S350-S354 PolarHBondContact O-N 3.09Å; S351-S354 WeakPolarHBondContact O-CB 3.42Å; S351-S354 PolarHBondContact O-N 3Å; I352-S354 VanDerWaalsContact C-N 3.35Å; S354-S356 VanDerWaalsContact C-N 3.33Å; S354-S356 PolarHBondContact O-N 2.85Å; S354-S357 PolarHBondContact O-N 3.48Å; S354-S357 PolarHBondContact O-OG 2.81Å; S354-M358 PolarHBondContact O-N 3.31Å; S354-M358 VanDerWaalsContact O-N 3.11Å |
| 355 | A | 91.8 | Very high | 86.9 | Confident | 0 Ų | 0 | 10.8 Ų | 10.8 | 0% | 0 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -55.7 | -45.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L135 E138 M139 S351 S357 M358 F359 F388 | L135-A355 HydrophobicContact CD1-CB 3.74Å; E138-A355 HydrophobicContact CB-CB 3.97Å; E138-A355 HydrophobicContact CG-CB 4.37Å; M139-A355 HydrophobicContact CE-CB 3.7Å; S351-A355 PolarHBondContact O-N 3.49Å; A355-S357 PolarHBondContact O-N 2.9Å; A355-M358 PolarHBondContact O-N 3.45Å; A355-F359 PolarHBondContact O-N 2.76Å; A355-F388 HydrophobicContact CB-CD2 3.77Å; A355-F388 HydrophobicContact CB-CE2 4.13Å |
| 356 | S | 90.7 | Very high | 86.9 | Confident | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -66.7 | -37.7 | -179.1 | -61.6 | 0 | 0 | 0 | 0 | 112.6 | I352 L353 S354 F359 A360 T384 V385 | I352-S356 VanDerWaalsContact O-CB 3.24Å; I352-S356 WeakPolarHBondContact O-CB 3.24Å; I352-S356 PolarHBondContact O-N 3.49Å; I352-S356 PolarHBondContact O-OG 3.39Å; L353-S356 PolarHBondContact O-N 2.94Å; S354-S356 VanDerWaalsContact C-N 3.33Å; S354-S356 PolarHBondContact O-N 2.85Å; S356-F359 PolarHBondContact O-N 3.28Å; S356-A360 VanDerWaalsContact O-CB 3.32Å; S356-A360 WeakPolarHBondContact O-CB 3.41Å; S356-A360 PolarHBondContact O-N 2.91Å; S356-T384 VanDerWaalsContact CB-OG1 3.31Å; S356-T384 WeakPolarHBondContact CB-OG1 3.22Å; S356-T384 PolarHBondContact OG-OG1 3.26Å; S356-V385 VanDerWaalsContact OG-CA 3.27Å; S356-V385 WeakPolarHBondContact OG-CA 3.24Å; S356-V385 VanDerWaalsContact OG-CG2 3.28Å; S356-V385 WeakPolarHBondContact OG-CG2 3.38Å; S356-V385 PolarHBondContact OG-N 2.97Å; S356-V385 VanDerWaalsContact OG-N 3.1Å |
| 357 | S | 87.6 | Confident | 86.9 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -67.1 | -43.1 | 177.7 | 75.1 | 0 | 0 | 0 | 0 | 112.1 | Q255 Q259 L353 S354 A355 F359 A360 R361 | Q255-S357 PolarHBondContact NE2-OG 3.36Å; Q259-S357 PolarHBondContact NE2-OG 2.91Å; L353-S357 VanDerWaalsContact O-CB 3.27Å; L353-S357 WeakPolarHBondContact O-CB 3.28Å; L353-S357 PolarHBondContact O-N 2.89Å; L353-S357 PolarHBondContact O-OG 3.46Å; S354-S357 PolarHBondContact O-N 3.48Å; S354-S357 PolarHBondContact O-OG 2.81Å; A355-S357 PolarHBondContact O-N 2.9Å; S357-F359 VanDerWaalsContact C-N 3.34Å; S357-F359 PolarHBondContact O-N 3.2Å; S357-A360 PolarHBondContact O-N 2.97Å; S357-R361 VanDerWaalsContact O-CB 3.29Å; S357-R361 WeakPolarHBondContact O-CB 3.03Å; S357-R361 PolarHBondContact O-N 3.24Å |
| 358 | M | 90.8 | Very high | 86.9 | Confident | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.005 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -62.5 | -43.4 | 176 | -72.6 | -172.8 | -68.4 | 0 | 0 | 110.8 | L115 F131 A134 E138 Q255 S354 A355 N362 | L115-M358 HydrophobicContact CD1-CB 4.16Å; L115-M358 HydrophobicContact CD1-CG 4.24Å; L115-M358 HydrophobicContact CD1-SD 3.98Å; L115-M358 HydrophobicContact CG-SD 4.13Å; F131-M358 HydrophobicContact CD2-CB 3.84Å; F131-M358 HydrophobicContact CE2-CB 3.69Å; A134-M358 HydrophobicContact CB-CE 4.26Å; A134-M358 HydrophobicContact CB-SD 4.17Å; E138-M358 HydrophobicContact CG-CE 4Å; Q255-M358 HydrophobicContact CB-CE 3.83Å; Q255-M358 HydrophobicContact CB-CG 4.24Å; Q255-M358 HydrophobicContact CB-SD 3.56Å; Q255-M358 VanDerWaalsContact CB-SD 3.56Å; Q255-M358 HydrophobicContact CG-CE 3.97Å; Q255-M358 HydrophobicContact CG-CG 3.59Å; Q255-M358 HydrophobicContact CG-SD 3.62Å; S354-M358 PolarHBondContact O-N 3.31Å; S354-M358 VanDerWaalsContact O-N 3.11Å; A355-M358 PolarHBondContact O-N 3.45Å; M358-N362 WeakPolarHBondContact O-CA 3.18Å; M358-N362 VanDerWaalsContact O-CB 3.24Å; M358-N362 WeakPolarHBondContact O-CB 3.12Å; M358-N362 PolarHBondContact O-N 3.46Å; M358-N362 PolarHBondContact O-OD1 2.83Å |
| 359 | F | 93.2 | Very high | 87 | Confident | 56 Ų | 56 | 28.9 Ų | 28.9 | 25% | 0.246 | 13% | 0.129 | C | C | . | . | I | π-helix | trans | -63.6 | -51.4 | 177.2 | -173.5 | -89.1 | 0 | 0 | 0 | 111.6 | F131 A355 S356 S357 R361 I363 Y364 V380 T384 F388 | F131-F359 AromaticContact CE1-CD2 3.81Å; F131-F359 HydrophobicContact CE1-CD2 3.81Å; F131-F359 HydrophobicContact CE2-CB 4.18Å; F131-F359 HydrophobicContact CZ-CB 3.81Å; F131-F359 AromaticContact CZ-CD2 3.73Å; F131-F359 HydrophobicContact CZ-CD2 3.73Å; F131-F359 HydrophobicContact CZ-CG 4.28Å; A355-F359 PolarHBondContact O-N 2.76Å; S356-F359 PolarHBondContact O-N 3.28Å; S357-F359 VanDerWaalsContact C-N 3.34Å; S357-F359 PolarHBondContact O-N 3.2Å; F359-R361 VanDerWaalsContact C-N 3.34Å; F359-R361 PolarHBondContact O-N 3.15Å; F359-I363 HydrophobicContact CD2-CB 3.97Å; F359-I363 HydrophobicContact CD2-CG1 4.16Å; F359-I363 HydrophobicContact CD2-CG2 4.07Å; F359-I363 HydrophobicContact CE2-CB 4.2Å; F359-I363 HydrophobicContact CE2-CG2 3.79Å; F359-I363 HydrophobicContact CG-CB 4.36Å; F359-I363 HydrophobicContact CZ-CG2 4.3Å; F359-I363 WeakPolarHBondContact O-CA 3.48Å; F359-I363 WeakPolarHBondContact O-CB 3.3Å; F359-I363 PolarHBondContact O-N 3.48Å; F359-I363 VanDerWaalsContact O-N 3.15Å; F359-Y364 PolarHBondContact O-N 3.5Å; F359-V380 HydrophobicContact CD1-CG1 4.12Å; F359-V380 HydrophobicContact CE1-CG1 4.15Å; F359-T384 HydrophobicContact CD1-CG2 3.52Å; F359-T384 HydrophobicContact CE1-CG2 3.82Å; F359-T384 HydrophobicContact CG-CG2 4.18Å; F359-F388 HydrophobicContact CB-CE2 4.03Å; F359-F388 HydrophobicContact CB-CZ 4.18Å; F359-F388 HydrophobicContact CD2-CZ 4.23Å; F359-F388 HydrophobicContact CG-CZ 4.26Å |
| 360 | A | 90.4 | Very high | 86.9 | Confident | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 16% | 0.157 | C | C | . | . | I | π-helix | trans | -62.3 | -40.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | S356 S357 Y364 Q365 I377 V380 M381 | S356-A360 VanDerWaalsContact O-CB 3.32Å; S356-A360 WeakPolarHBondContact O-CB 3.41Å; S356-A360 PolarHBondContact O-N 2.91Å; S357-A360 PolarHBondContact O-N 2.97Å; A360-Y364 WeakPolarHBondContact O-CB 3.42Å; A360-Q365 WeakPolarHBondContact O-CB 3.38Å; A360-Q365 PolarHBondContact O-N 3.02Å; A360-I377 HydrophobicContact CB-CG2 4.11Å; A360-V380 HydrophobicContact CB-CG1 4.17Å; A360-M381 HydrophobicContact CB-CB 4.13Å |
| 361 | R | 85.6 | Confident | 86.9 | Confident | 55 Ų | 55 | 41.9 Ų | 41.9 | 21% | 0.208 | 20% | 0.195 | C | C | . | . | I | π-helix | trans | -83.4 | -57.4 | -178.9 | -176.4 | 57.7 | 165.7 | -146.2 | -6.3 | 112.7 | T113 S357 F359 Q365 L366 | T113-R361 HydrophobicContact CG2-CB 4Å; T113-R361 HydrophobicContact CG2-CG 3.86Å; S357-R361 VanDerWaalsContact O-CB 3.29Å; S357-R361 WeakPolarHBondContact O-CB 3.03Å; S357-R361 PolarHBondContact O-N 3.24Å; F359-R361 VanDerWaalsContact C-N 3.34Å; F359-R361 PolarHBondContact O-N 3.15Å; R361-Q365 WeakPolarHBondContact O-CB 3.36Å; R361-L366 WeakPolarHBondContact O-CB 3.35Å; R361-L366 VanDerWaalsContact O-CG 3.3Å; R361-L366 WeakPolarHBondContact O-CG 3.3Å; R361-L366 PolarHBondContact O-N 2.93Å |
| 362 | N | 89.5 | Confident | 86.6 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 20% | 0.198 | C | C | . | . | I | π-helix | trans | -82.6 | -36.3 | -168.6 | -57.6 | 99.5 | 0 | 0 | 0 | 112.9 | T113 L115 D116 Q119 M358 S367 | T113-N362 WeakPolarHBondContact CB-OD1 3.16Å; T113-N362 WeakPolarHBondContact CG2-OD1 3.46Å; T113-N362 PolarHBondContact OG1-ND2 3.09Å; T113-N362 PolarHBondContact OG1-OD1 3.41Å; L115-N362 HydrophobicContact CB-CB 4.26Å; L115-N362 HydrophobicContact CD1-CB 4.12Å; D116-N362 PolarHBondContact OD1-ND2 2.88Å; Q119-N362 PolarHBondContact NE2-O 3.5Å; Q119-N362 PolarHBondContact OE1-ND2 3.47Å; M358-N362 WeakPolarHBondContact O-CA 3.18Å; M358-N362 VanDerWaalsContact O-CB 3.24Å; M358-N362 WeakPolarHBondContact O-CB 3.12Å; M358-N362 PolarHBondContact O-N 3.46Å; M358-N362 PolarHBondContact O-OD1 2.83Å; N362-S367 PolarHBondContact O-OG 2.65Å |
| 363 | I | 91.4 | Very high | 86.4 | Confident | 16 Ų | 16 | 45.3 Ų | 45.3 | 8% | 0.082 | 22% | 0.219 | C | C | . | . | I | π-helix | trans | -90.2 | -62.9 | -178.4 | -54.3 | -54.2 | 0 | 0 | 0 | 109.3 | F131 F359 S367 F368 | F131-I363 HydrophobicContact CB-CD1 3.71Å; F131-I363 HydrophobicContact CB-CG1 4.25Å; F131-I363 HydrophobicContact CD1-CD1 3.75Å; F131-I363 HydrophobicContact CD1-CG1 3.56Å; F131-I363 HydrophobicContact CD2-CG1 4.13Å; F131-I363 HydrophobicContact CE1-CG1 3.87Å; F131-I363 HydrophobicContact CE2-CG1 4.41Å; F131-I363 HydrophobicContact CG-CD1 3.73Å; F131-I363 HydrophobicContact CG-CG1 3.7Å; F131-I363 HydrophobicContact CZ-CG1 4.29Å; F359-I363 HydrophobicContact CD2-CB 3.97Å; F359-I363 HydrophobicContact CD2-CG1 4.16Å; F359-I363 HydrophobicContact CD2-CG2 4.07Å; F359-I363 HydrophobicContact CE2-CB 4.2Å; F359-I363 HydrophobicContact CE2-CG2 3.79Å; F359-I363 HydrophobicContact CG-CB 4.36Å; F359-I363 HydrophobicContact CZ-CG2 4.3Å; F359-I363 WeakPolarHBondContact O-CA 3.48Å; F359-I363 WeakPolarHBondContact O-CB 3.3Å; F359-I363 PolarHBondContact O-N 3.48Å; F359-I363 VanDerWaalsContact O-N 3.15Å; I363-S367 WeakPolarHBondContact O-CA 3.34Å; I363-S367 WeakPolarHBondContact O-CB 3.4Å; I363-S367 PolarHBondContact O-N 3.34Å; I363-S367 VanDerWaalsContact O-N 3.14Å; I363-F368 HydrophobicContact CG2-CD2 3.85Å; I363-F368 HydrophobicContact CG2-CE2 3.52Å; I363-F368 VanDerWaalsContact O-CD2 3.31Å; I363-F368 WeakPolarHBondContact O-CD2 3.27Å; I363-F368 PolarHBondContact O-N 3.11Å; I363-F368 VanDerWaalsContact O-N 3.15Å |
| 364 | Y | 89.8 | Confident | 86.1 | Confident | 56 Ų | 56 | 47.2 Ų | 47.2 | 22% | 0.22 | 23% | 0.229 | C | C | . | . | I | π-helix | trans | -66.4 | -62.5 | -174 | -169.2 | -94.8 | 0 | 0 | 0 | 112.4 | F359 A360 F368 R369 A372 E376 V380 | F359-Y364 PolarHBondContact O-N 3.5Å; A360-Y364 WeakPolarHBondContact O-CB 3.42Å; Y364-F368 CarbonylContact O-C 3.53Å; Y364-F368 WeakPolarHBondContact O-CB 3.26Å; Y364-F368 PolarHBondContact O-N 3.46Å; Y364-F368 VanDerWaalsContact O-N 3.13Å; Y364-R369 HydrophobicContact CE1-CB 4.19Å; Y364-R369 PolarHBondContact O-N 3.43Å; Y364-A372 HydrophobicContact CD1-CB 4.45Å; Y364-A372 HydrophobicContact CE1-CB 4.1Å; Y364-E376 HydrophobicContact CE1-CG 4.21Å; Y364-E376 WeakPolarHBondContact CE1-OE1 3.47Å; Y364-E376 PolarHBondContact OH-OE1 3.02Å; Y364-V380 HydrophobicContact CD1-CG1 4.4Å; Y364-V380 HydrophobicContact CD1-CG2 3.88Å; Y364-V380 HydrophobicContact CD2-CG1 4.26Å; Y364-V380 HydrophobicContact CD2-CG2 4.21Å; Y364-V380 HydrophobicContact CE1-CG2 3.72Å; Y364-V380 HydrophobicContact CE2-CG2 4.06Å; Y364-V380 HydrophobicContact CG-CG1 4Å; Y364-V380 HydrophobicContact CG-CG2 4.11Å |
| 365 | Q | 82.6 | Confident | 85.8 | Confident | 28 Ų | 28 | 55.2 Ų | 55.2 | 13% | 0.131 | 26% | 0.259 | C | S | . | . | I | π-helix | trans | -67.7 | -56.1 | -176.7 | -175.1 | -178.7 | 24 | 0 | 0 | 111.7 | A360 R361 S367 R369 Q370 I377 | A360-Q365 WeakPolarHBondContact O-CB 3.38Å; A360-Q365 PolarHBondContact O-N 3.02Å; R361-Q365 WeakPolarHBondContact O-CB 3.36Å; Q365-S367 PolarHBondContact O-N 3.39Å; Q365-R369 CarbonylContact O-C 3.44Å; Q365-Q370 WeakPolarHBondContact O-CA 3.37Å; Q365-Q370 PolarHBondContact O-N 2.78Å; Q365-Q370 VanDerWaalsContact O-N 3.14Å; Q365-I377 HydrophobicContact CB-CD1 4.38Å; Q365-I377 HydrophobicContact CG-CD1 4.09Å |
| 366 | L | 79.3 | Confident | 85.6 | Confident | 54 Ų | 54 | 56.9 Ų | 56.9 | 28% | 0.283 | 27% | 0.267 | S | S | . | . | I | π-helix | trans | -73.8 | -30.6 | -170.5 | -70.9 | 173.7 | 0 | 0 | 0 | 113.8 | K124 R361 | K124-L366 VanDerWaalsContact CD-O 3.29Å; K124-L366 WeakPolarHBondContact CD-O 3.31Å; K124-L366 WeakPolarHBondContact CE-O 3.16Å; K124-L366 PolarHBondContact NZ-O 3.1Å; R361-L366 WeakPolarHBondContact O-CB 3.35Å; R361-L366 VanDerWaalsContact O-CG 3.3Å; R361-L366 WeakPolarHBondContact O-CG 3.3Å; R361-L366 PolarHBondContact O-N 2.93Å |
| 367 | S | 78.1 | Confident | 85.2 | Confident | 41 Ų | 41 | 56.9 Ų | 56.9 | 29% | 0.287 | 27% | 0.267 | S | S | . | . | I | π-helix | trans | -103.3 | -43.8 | -175.4 | -50.6 | 0 | 0 | 0 | 0 | 113.9 | N362 I363 Q365 | N362-S367 PolarHBondContact O-OG 2.65Å; I363-S367 WeakPolarHBondContact O-CA 3.34Å; I363-S367 WeakPolarHBondContact O-CB 3.4Å; I363-S367 PolarHBondContact O-N 3.34Å; I363-S367 VanDerWaalsContact O-N 3.14Å; Q365-S367 PolarHBondContact O-N 3.39Å |
| 368 | F | 82.6 | Confident | 85 | Confident | 160 Ų | 160 | 57.7 Ų | 57.7 | 70% | 0.702 | 27% | 0.272 | S | S | * | . | I | π-helix | trans | -95.2 | -49.3 | -175.3 | -71.5 | -74.7 | 0 | 0 | 0 | 114.1 | I363 Y364 | I363-F368 HydrophobicContact CG2-CD2 3.85Å; I363-F368 HydrophobicContact CG2-CE2 3.52Å; I363-F368 VanDerWaalsContact O-CD2 3.31Å; I363-F368 WeakPolarHBondContact O-CD2 3.27Å; I363-F368 PolarHBondContact O-N 3.11Å; I363-F368 VanDerWaalsContact O-N 3.15Å; Y364-F368 CarbonylContact O-C 3.53Å; Y364-F368 WeakPolarHBondContact O-CB 3.26Å; Y364-F368 PolarHBondContact O-N 3.46Å; Y364-F368 VanDerWaalsContact O-N 3.13Å |
| 369 | R | 85.7 | Confident | 84.8 | Confident | 129 Ų | 129 | 65.2 Ų | 65.2 | 49% | 0.487 | 30% | 0.3 | S | S | . | . | trans | -134.7 | 83 | -173 | -164.5 | -178.2 | 178.1 | 163.7 | -0 | 111.9 | Y364 Q365 N371 A372 E376 | Y364-R369 HydrophobicContact CE1-CB 4.19Å; Y364-R369 PolarHBondContact O-N 3.43Å; Q365-R369 CarbonylContact O-C 3.44Å; R369-N371 PolarHBondContact O-N 2.86Å; R369-A372 HydrophobicContact CB-CB 4.33Å; R369-A372 HydrophobicContact CG-CB 4.17Å; R369-A372 VanDerWaalsContact O-CB 3.26Å; R369-A372 WeakPolarHBondContact O-CB 3.22Å; R369-A372 PolarHBondContact O-N 3.34Å; R369-E376 WeakPolarHBondContact CD-OE1 3.42Å; R369-E376 IonicContact CZ-OE1 3.24Å; R369-E376 IonicContact CZ-OE2 2.8Å; R369-E376 VanDerWaalsContact CZ-OE2 3.24Å; R369-E376 IonicContact NE-OE1 3.43Å; R369-E376 PolarHBondContact NE-OE1 3.25Å; R369-E376 IonicContact NE-OE2 2.85Å; R369-E376 PolarHBondContact NE-OE2 3.29Å; R369-E376 VanDerWaalsContact NH1-CD 3.29Å; R369-E376 IonicContact NH1-OE1 3.66Å; R369-E376 PolarHBondContact NH1-OE1 3.3Å; R369-E376 IonicContact NH1-OE2 3.93Å; R369-E376 PolarHBondContact NH1-OE2 2.86Å; R369-E376 IonicContact NH2-OE2 3.57Å | ||
| 370 | Q | 81.6 | Confident | 84.7 | Confident | 124 Ų | 124 | 63.5 Ų | 63.5 | 58% | 0.579 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -27.8 | -175.6 | -61.9 | 176.1 | 30.6 | 0 | 0 | 113.8 | Q365 | Q365-Q370 WeakPolarHBondContact O-CA 3.37Å; Q365-Q370 PolarHBondContact O-N 2.78Å; Q365-Q370 VanDerWaalsContact O-N 3.14Å |
| 371 | N | 82 | Confident | 84.5 | Confident | 154 Ų | 154 | 63.9 Ų | 63.9 | 82% | 0.824 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.8 | 21.2 | 178.8 | -59.3 | -24.8 | 0 | 0 | 0 | 112.7 | R369 S373 | R369-N371 PolarHBondContact O-N 2.86Å; N371-S373 PolarHBondContact O-N 2.98Å |
| 372 | A | 83.8 | Confident | 84.5 | Confident | 9 Ų | 9 | 66 Ų | 66 | 7% | 0.074 | 30% | 0.304 | C | S | . | . | trans | -62.1 | 134.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | Y364 R369 I377 | Y364-A372 HydrophobicContact CD1-CB 4.45Å; Y364-A372 HydrophobicContact CE1-CB 4.1Å; R369-A372 HydrophobicContact CB-CB 4.33Å; R369-A372 HydrophobicContact CG-CB 4.17Å; R369-A372 VanDerWaalsContact O-CB 3.26Å; R369-A372 WeakPolarHBondContact O-CB 3.22Å; R369-A372 PolarHBondContact O-N 3.34Å; A372-I377 HydrophobicContact CB-CG1 4.11Å | ||
| 373 | S | 84.6 | Confident | 84.6 | Confident | 63 Ų | 63 | 70.7 Ų | 70.7 | 44% | 0.441 | 33% | 0.328 | S | S | . | . | trans | -74.4 | 158.7 | 176.8 | 70 | 0 | 0 | 0 | 0 | 111.5 | N371 R375 E376 I377 | N371-S373 PolarHBondContact O-N 2.98Å; S373-R375 VanDerWaalsContact C-N 3.27Å; S373-R375 PolarHBondContact O-N 2.95Å; S373-E376 PolarHBondContact N-OE2 3.4Å; S373-E376 WeakPolarHBondContact O-CA 3.08Å; S373-E376 VanDerWaalsContact O-CB 3.29Å; S373-E376 WeakPolarHBondContact O-CB 3.43Å; S373-E376 PolarHBondContact O-N 3.29Å; S373-E376 WeakPolarHBondContact OG-CB 3.18Å; S373-E376 PolarHBondContact OG-N 3.12Å; S373-I377 WeakPolarHBondContact O-CG1 3.19Å; S373-I377 PolarHBondContact O-N 3.2Å | ||
| 374 | D | 79.2 | Confident | 84.7 | Confident | 45 Ų | 45 | 70.3 Ų | 70.3 | 24% | 0.241 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -54.6 | -41.6 | 175.4 | -91 | 8.7 | 0 | 0 | 0 | 113.4 | R38 S39 E376 I377 V378 | R38-D374 PolarHBondContact N-OD2 2.91Å; R38-D374 VanDerWaalsContact N-OD2 3.14Å; S39-D374 VanDerWaalsContact CB-OD1 3.3Å; S39-D374 WeakPolarHBondContact CB-OD1 3.45Å; S39-D374 PolarHBondContact N-OD2 3.42Å; S39-D374 VanDerWaalsContact OG-CG 3.24Å; S39-D374 PolarHBondContact OG-OD1 3.32Å; S39-D374 PolarHBondContact OG-OD2 3.28Å; D374-E376 VanDerWaalsContact C-N 3.26Å; D374-E376 PolarHBondContact O-N 3.43Å; D374-I377 PolarHBondContact O-N 3.39Å; D374-V378 VanDerWaalsContact O-CG2 3.27Å; D374-V378 WeakPolarHBondContact O-CG2 3.37Å; D374-V378 PolarHBondContact O-N 3.23Å; D374-V378 VanDerWaalsContact O-N 3.1Å |
| 375 | R | 81.1 | Confident | 84.8 | Confident | 169 Ų | 169 | 67.8 Ų | 67.8 | 64% | 0.638 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -61.4 | -38.9 | 176.7 | -78 | -175.9 | 177 | 171.1 | 1.9 | 111.8 | S373 W379 | S373-R375 VanDerWaalsContact C-N 3.27Å; S373-R375 PolarHBondContact O-N 2.95Å; R375-W379 VanDerWaalsContact O-CD1 3.23Å; R375-W379 PolarHBondContact O-N 3.25Å; R375-W379 VanDerWaalsContact O-N 3.13Å |
| 376 | E | 87.1 | Confident | 85.2 | Confident | 34 Ų | 34 | 71.4 Ų | 71.4 | 16% | 0.159 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67.7 | -45.4 | 179.9 | -173.8 | 179.9 | 171.9 | 0 | 0 | 111.5 | Y364 R369 S373 D374 V378 W379 V380 | Y364-E376 HydrophobicContact CE1-CG 4.21Å; Y364-E376 WeakPolarHBondContact CE1-OE1 3.47Å; Y364-E376 PolarHBondContact OH-OE1 3.02Å; R369-E376 WeakPolarHBondContact CD-OE1 3.42Å; R369-E376 IonicContact CZ-OE1 3.24Å; R369-E376 IonicContact CZ-OE2 2.8Å; R369-E376 VanDerWaalsContact CZ-OE2 3.24Å; R369-E376 IonicContact NE-OE1 3.43Å; R369-E376 PolarHBondContact NE-OE1 3.25Å; R369-E376 IonicContact NE-OE2 2.85Å; R369-E376 PolarHBondContact NE-OE2 3.29Å; R369-E376 VanDerWaalsContact NH1-CD 3.29Å; R369-E376 IonicContact NH1-OE1 3.66Å; R369-E376 PolarHBondContact NH1-OE1 3.3Å; R369-E376 IonicContact NH1-OE2 3.93Å; R369-E376 PolarHBondContact NH1-OE2 2.86Å; R369-E376 IonicContact NH2-OE2 3.57Å; S373-E376 PolarHBondContact N-OE2 3.4Å; S373-E376 WeakPolarHBondContact O-CA 3.08Å; S373-E376 VanDerWaalsContact O-CB 3.29Å; S373-E376 WeakPolarHBondContact O-CB 3.43Å; S373-E376 PolarHBondContact O-N 3.29Å; S373-E376 WeakPolarHBondContact OG-CB 3.18Å; S373-E376 PolarHBondContact OG-N 3.12Å; D374-E376 VanDerWaalsContact C-N 3.26Å; D374-E376 PolarHBondContact O-N 3.43Å; E376-V378 VanDerWaalsContact C-N 3.27Å; E376-V378 PolarHBondContact O-N 2.93Å; E376-W379 PolarHBondContact O-N 3.28Å; E376-W379 VanDerWaalsContact O-N 3.13Å; E376-V380 WeakPolarHBondContact O-CG2 3.42Å; E376-V380 PolarHBondContact O-N 3.33Å |
| 377 | I | 83.8 | Confident | 85.9 | Confident | 0 Ų | 0 | 73.5 Ų | 73.5 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -58.7 | -41.4 | 177 | -64.3 | 164.9 | 0 | 0 | 0 | 110.7 | A360 Q365 A372 S373 D374 V380 M381 | A360-I377 HydrophobicContact CB-CG2 4.11Å; Q365-I377 HydrophobicContact CB-CD1 4.38Å; Q365-I377 HydrophobicContact CG-CD1 4.09Å; A372-I377 HydrophobicContact CB-CG1 4.11Å; S373-I377 WeakPolarHBondContact O-CG1 3.19Å; S373-I377 PolarHBondContact O-N 3.2Å; D374-I377 PolarHBondContact O-N 3.39Å; I377-V380 PolarHBondContact O-N 3.12Å; I377-M381 WeakPolarHBondContact O-CB 3.07Å; I377-M381 PolarHBondContact O-N 3.12Å |
| 378 | V | 82.7 | Confident | 86.6 | Confident | 17 Ų | 17 | 72.9 Ų | 72.9 | 10% | 0.103 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64.7 | -40.5 | 177.1 | 173.1 | 0 | 0 | 0 | 0 | 112 | I42 D374 E376 M381 R382 | I42-V378 HydrophobicContact CD1-CB 4.36Å; I42-V378 HydrophobicContact CD1-CG1 3.92Å; I42-V378 HydrophobicContact CD1-CG2 3.42Å; I42-V378 VanDerWaalsContact CD1-CG2 3.42Å; D374-V378 VanDerWaalsContact O-CG2 3.27Å; D374-V378 WeakPolarHBondContact O-CG2 3.37Å; D374-V378 PolarHBondContact O-N 3.23Å; D374-V378 VanDerWaalsContact O-N 3.1Å; E376-V378 VanDerWaalsContact C-N 3.27Å; E376-V378 PolarHBondContact O-N 2.93Å; V378-M381 PolarHBondContact O-N 2.88Å; V378-R382 WeakPolarHBondContact O-CG 3.4Å; V378-R382 PolarHBondContact O-N 3.48Å |
| 379 | W | 86.9 | Confident | 87 | Confident | 159 Ų | 159 | 65.2 Ų | 65.2 | 60% | 0.602 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -66.9 | -42.5 | 175.8 | -86.5 | 112.2 | 0 | 0 | 0 | 112.5 | R375 E376 M381 R382 I383 | R375-W379 VanDerWaalsContact O-CD1 3.23Å; R375-W379 PolarHBondContact O-N 3.25Å; R375-W379 VanDerWaalsContact O-N 3.13Å; E376-W379 PolarHBondContact O-N 3.28Å; E376-W379 VanDerWaalsContact O-N 3.13Å; W379-M381 VanDerWaalsContact C-N 3.3Å; W379-M381 PolarHBondContact O-N 2.67Å; W379-R382 PolarHBondContact O-N 2.87Å; W379-I383 WeakPolarHBondContact O-CG1 3.38Å; W379-I383 PolarHBondContact O-N 3.25Å |
| 380 | V | 90.6 | Very high | 87.4 | Confident | 20 Ų | 20 | 61.4 Ų | 61.4 | 12% | 0.121 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58 | -47.1 | 174.5 | 171.6 | 0 | 0 | 0 | 0 | 110.1 | F359 A360 Y364 E376 I377 R382 I383 T384 | F359-V380 HydrophobicContact CD1-CG1 4.12Å; F359-V380 HydrophobicContact CE1-CG1 4.15Å; A360-V380 HydrophobicContact CB-CG1 4.17Å; Y364-V380 HydrophobicContact CD1-CG1 4.4Å; Y364-V380 HydrophobicContact CD1-CG2 3.88Å; Y364-V380 HydrophobicContact CD2-CG1 4.26Å; Y364-V380 HydrophobicContact CD2-CG2 4.21Å; Y364-V380 HydrophobicContact CE1-CG2 3.72Å; Y364-V380 HydrophobicContact CE2-CG2 4.06Å; Y364-V380 HydrophobicContact CG-CG1 4Å; Y364-V380 HydrophobicContact CG-CG2 4.11Å; E376-V380 WeakPolarHBondContact O-CG2 3.42Å; E376-V380 PolarHBondContact O-N 3.33Å; I377-V380 PolarHBondContact O-N 3.12Å; V380-R382 VanDerWaalsContact C-N 3.34Å; V380-R382 PolarHBondContact O-N 3.38Å; V380-I383 PolarHBondContact O-N 3.3Å; V380-T384 HydrophobicContact CG1-CG2 4.45Å; V380-T384 WeakPolarHBondContact O-CG2 3.37Å; V380-T384 PolarHBondContact O-N 2.7Å; V380-T384 PolarHBondContact O-OG1 2.61Å |
| 381 | M | 86.1 | Confident | 87.9 | Confident | 8 Ų | 8 | 57.5 Ų | 57.5 | 4% | 0.039 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.8 | -43.4 | 177.7 | -170.3 | -170.9 | -58.3 | 0 | 0 | 112.2 | I42 I43 L353 A360 I377 V378 W379 T384 V385 | I42-M381 HydrophobicContact CG2-CE 4.06Å; I42-M381 HydrophobicContact CG2-SD 3.75Å; I43-M381 HydrophobicContact CD1-CE 3.95Å; I43-M381 HydrophobicContact CG1-CE 3.41Å; I43-M381 VanDerWaalsContact CG1-CE 3.41Å; L353-M381 HydrophobicContact CD1-SD 3.9Å; A360-M381 HydrophobicContact CB-CB 4.13Å; I377-M381 WeakPolarHBondContact O-CB 3.07Å; I377-M381 PolarHBondContact O-N 3.12Å; V378-M381 PolarHBondContact O-N 2.88Å; W379-M381 VanDerWaalsContact C-N 3.3Å; W379-M381 PolarHBondContact O-N 2.67Å; M381-T384 WeakPolarHBondContact CA-OG1 3.35Å; M381-T384 PolarHBondContact O-N 2.89Å; M381-T384 PolarHBondContact O-OG1 3.37Å; M381-V385 VanDerWaalsContact O-CG2 3.26Å; M381-V385 WeakPolarHBondContact O-CG2 3.12Å; M381-V385 PolarHBondContact O-N 2.83Å |
| 382 | R | 87.1 | Confident | 88.4 | Confident | 100 Ų | 100 | 50.2 Ų | 50.2 | 38% | 0.377 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.6 | -43.2 | 176.9 | -74.4 | 174.5 | 172.4 | -174.2 | -3.1 | 112.4 | L177 V378 W379 V380 T384 V385 F386 | L177-R382 HydrophobicContact CD2-CB 4.07Å; L177-R382 HydrophobicContact CD2-CG 4.48Å; L177-R382 WeakPolarHBondContact CD2-O 3.25Å; L177-R382 PolarHBondContact O-NE 3.14Å; V378-R382 WeakPolarHBondContact O-CG 3.4Å; V378-R382 PolarHBondContact O-N 3.48Å; W379-R382 PolarHBondContact O-N 2.87Å; V380-R382 VanDerWaalsContact C-N 3.34Å; V380-R382 PolarHBondContact O-N 3.38Å; R382-T384 VanDerWaalsContact C-N 3.32Å; R382-T384 PolarHBondContact O-N 2.87Å; R382-V385 PolarHBondContact O-N 2.7Å; R382-F386 PolarHBondContact O-N 2.93Å |
| 383 | I | 91.6 | Very high | 88.7 | Confident | 98 Ų | 98 | 50.7 Ų | 50.7 | 50% | 0.503 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.5 | -44 | 176.7 | -66.9 | 166.2 | 0 | 0 | 0 | 109.9 | W379 V380 F386 L387 | W379-I383 WeakPolarHBondContact O-CG1 3.38Å; W379-I383 PolarHBondContact O-N 3.25Å; V380-I383 PolarHBondContact O-N 3.3Å; I383-F386 PolarHBondContact O-N 3.39Å; I383-L387 HydrophobicContact CG2-CD1 3.87Å; I383-L387 HydrophobicContact CG2-CG 4.37Å; I383-L387 WeakPolarHBondContact O-CG 3.23Å; I383-L387 PolarHBondContact O-N 3.12Å |
| 384 | T | 92.7 | Very high | 89.1 | Confident | 8 Ų | 8 | 49.9 Ų | 49.9 | 5% | 0.049 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -71.2 | -31.3 | 180 | 58.3 | 0 | 0 | 0 | 0 | 113.4 | S356 F359 V380 M381 R382 F386 L387 F388 | S356-T384 VanDerWaalsContact CB-OG1 3.31Å; S356-T384 WeakPolarHBondContact CB-OG1 3.22Å; S356-T384 PolarHBondContact OG-OG1 3.26Å; F359-T384 HydrophobicContact CD1-CG2 3.52Å; F359-T384 HydrophobicContact CE1-CG2 3.82Å; F359-T384 HydrophobicContact CG-CG2 4.18Å; V380-T384 HydrophobicContact CG1-CG2 4.45Å; V380-T384 WeakPolarHBondContact O-CG2 3.37Å; V380-T384 PolarHBondContact O-N 2.7Å; V380-T384 PolarHBondContact O-OG1 2.61Å; M381-T384 WeakPolarHBondContact CA-OG1 3.35Å; M381-T384 PolarHBondContact O-N 2.89Å; M381-T384 PolarHBondContact O-OG1 3.37Å; R382-T384 VanDerWaalsContact C-N 3.32Å; R382-T384 PolarHBondContact O-N 2.87Å; T384-F386 VanDerWaalsContact C-N 3.29Å; T384-F386 PolarHBondContact O-N 3.19Å; T384-L387 PolarHBondContact O-N 3.32Å; T384-F388 HydrophobicContact CG2-CE2 4.42Å; T384-F388 WeakPolarHBondContact O-CB 3.22Å; T384-F388 WeakPolarHBondContact O-CD2 3.32Å; T384-F388 VanDerWaalsContact O-CG 3.23Å; T384-F388 WeakPolarHBondContact O-CG 3.37Å; T384-F388 PolarHBondContact O-N 2.7Å |
| 385 | V | 90.9 | Very high | 89.5 | Confident | 4 Ų | 4 | 50.2 Ų | 50.2 | 2% | 0.024 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.4 | -46.8 | 171 | 162.7 | 0 | 0 | 0 | 0 | 110.1 | T173 T176 L177 I352 S356 M381 R382 G389 | T173-V385 HydrophobicContact CG2-CG1 4.17Å; T176-V385 HydrophobicContact CG2-CG1 3.89Å; T176-V385 HydrophobicContact CG2-CG2 4.36Å; L177-V385 HydrophobicContact CD2-CB 3.74Å; L177-V385 HydrophobicContact CD2-CG1 3.55Å; L177-V385 HydrophobicContact CG-CG1 3.83Å; I352-V385 HydrophobicContact CG2-CB 4.07Å; I352-V385 HydrophobicContact CG2-CG1 3.79Å; I352-V385 HydrophobicContact CG2-CG2 4.16Å; I352-V385 WeakPolarHBondContact CG2-O 3.4Å; S356-V385 VanDerWaalsContact OG-CA 3.27Å; S356-V385 WeakPolarHBondContact OG-CA 3.24Å; S356-V385 VanDerWaalsContact OG-CG2 3.28Å; S356-V385 WeakPolarHBondContact OG-CG2 3.38Å; S356-V385 PolarHBondContact OG-N 2.97Å; S356-V385 VanDerWaalsContact OG-N 3.1Å; M381-V385 VanDerWaalsContact O-CG2 3.26Å; M381-V385 WeakPolarHBondContact O-CG2 3.12Å; M381-V385 PolarHBondContact O-N 2.83Å; R382-V385 PolarHBondContact O-N 2.7Å; V385-G389 PolarHBondContact O-N 2.82Å |
| 386 | F | 91.3 | Very high | 89.8 | Confident | 103 Ų | 103 | 42.4 Ų | 42.4 | 45% | 0.452 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -66.4 | -46.3 | 178.3 | -177.9 | -97.6 | 0 | 0 | 0 | 112.3 | T173 R382 I383 T384 G389 A390 | T173-F386 HydrophobicContact CG2-CD2 4.28Å; R382-F386 PolarHBondContact O-N 2.93Å; I383-F386 PolarHBondContact O-N 3.39Å; T384-F386 VanDerWaalsContact C-N 3.29Å; T384-F386 PolarHBondContact O-N 3.19Å; F386-G389 PolarHBondContact O-N 3.37Å; F386-A390 WeakPolarHBondContact O-CB 3.2Å; F386-A390 PolarHBondContact O-N 3.37Å |
| 387 | L | 93.7 | Very high | 89.8 | Confident | 99 Ų | 99 | 43.6 Ų | 43.6 | 52% | 0.518 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.2 | -45.3 | -179.8 | -69.9 | 173.5 | 0 | 0 | 0 | 112.3 | I383 T384 A390 S391 | I383-L387 HydrophobicContact CG2-CD1 3.87Å; I383-L387 HydrophobicContact CG2-CG 4.37Å; I383-L387 WeakPolarHBondContact O-CG 3.23Å; I383-L387 PolarHBondContact O-N 3.12Å; T384-L387 PolarHBondContact O-N 3.32Å; L387-A390 PolarHBondContact O-N 3.37Å; L387-S391 PolarHBondContact O-N 3.18Å; L387-S391 PolarHBondContact O-OG 3.09Å |
| 388 | F | 93.6 | Very high | 89.6 | Confident | 27 Ų | 27 | 50.7 Ų | 50.7 | 12% | 0.118 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -71 | -37.6 | 179.5 | -67.4 | -24.3 | 0 | 0 | 0 | 112.2 | L135 M139 A355 F359 T384 S391 A392 | L135-F388 HydrophobicContact CD1-CD1 4.26Å; L135-F388 HydrophobicContact CD1-CD2 4.23Å; L135-F388 HydrophobicContact CD1-CE1 3.94Å; L135-F388 HydrophobicContact CD1-CE2 3.88Å; L135-F388 HydrophobicContact CD1-CG 4.42Å; L135-F388 HydrophobicContact CD1-CZ 3.74Å; L135-F388 HydrophobicContact CD2-CE1 4.1Å; L135-F388 HydrophobicContact CD2-CZ 4.18Å; M139-F388 HydrophobicContact CE-CB 3.84Å; M139-F388 HydrophobicContact CE-CG 4.3Å; M139-F388 HydrophobicContact SD-CB 3.69Å; M139-F388 HydrophobicContact SD-CD1 4.25Å; M139-F388 HydrophobicContact SD-CG 4.11Å; A355-F388 HydrophobicContact CB-CD2 3.77Å; A355-F388 HydrophobicContact CB-CE2 4.13Å; F359-F388 HydrophobicContact CB-CE2 4.03Å; F359-F388 HydrophobicContact CB-CZ 4.18Å; F359-F388 HydrophobicContact CD2-CZ 4.23Å; F359-F388 HydrophobicContact CG-CZ 4.26Å; T384-F388 HydrophobicContact CG2-CE2 4.42Å; T384-F388 WeakPolarHBondContact O-CB 3.22Å; T384-F388 WeakPolarHBondContact O-CD2 3.32Å; T384-F388 VanDerWaalsContact O-CG 3.23Å; T384-F388 WeakPolarHBondContact O-CG 3.37Å; T384-F388 PolarHBondContact O-N 2.7Å; F388-S391 VanDerWaalsContact CA-OG 3.31Å; F388-S391 WeakPolarHBondContact CA-OG 3.41Å; F388-S391 PolarHBondContact O-N 2.92Å; F388-S391 PolarHBondContact O-OG 3.47Å; F388-A392 VanDerWaalsContact O-CB 3.31Å; F388-A392 WeakPolarHBondContact O-CB 3.44Å; F388-A392 PolarHBondContact O-N 2.85Å |
| 389 | G | 92.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.2 | -45.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112 | V385 F386 A392 T393 | V385-G389 PolarHBondContact O-N 2.82Å; F386-G389 PolarHBondContact O-N 3.37Å; G389-A392 PolarHBondContact O-N 3.3Å; G389-T393 WeakPolarHBondContact O-CB 3.17Å; G389-T393 PolarHBondContact O-N 2.99Å; G389-T393 PolarHBondContact O-OG1 3.4Å |
| 390 | A | 92.5 | Very high | 87.9 | Confident | 48 Ų | 48 | 49 Ų | 49 | 40% | 0.397 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.8 | -42 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F386 L387 T393 A394 | F386-A390 WeakPolarHBondContact O-CB 3.2Å; F386-A390 PolarHBondContact O-N 3.37Å; L387-A390 PolarHBondContact O-N 3.37Å; A390-T393 WeakPolarHBondContact O-CB 3.45Å; A390-T393 PolarHBondContact O-N 3.47Å; A390-A394 PolarHBondContact O-N 3.1Å |
| 391 | S | 92.4 | Very high | 86.7 | Confident | 43 Ų | 43 | 50.1 Ų | 50.1 | 30% | 0.301 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -66.7 | -42.6 | 176.6 | 58.7 | 0 | 0 | 0 | 0 | 112.5 | L387 F388 T393 A394 M395 | L387-S391 PolarHBondContact O-N 3.18Å; L387-S391 PolarHBondContact O-OG 3.09Å; F388-S391 VanDerWaalsContact CA-OG 3.31Å; F388-S391 WeakPolarHBondContact CA-OG 3.41Å; F388-S391 PolarHBondContact O-N 2.92Å; F388-S391 PolarHBondContact O-OG 3.47Å; S391-T393 VanDerWaalsContact C-N 3.29Å; S391-T393 PolarHBondContact O-N 3.49Å; S391-A394 PolarHBondContact O-N 3.43Å; S391-M395 VanDerWaalsContact O-CG 3.26Å; S391-M395 WeakPolarHBondContact O-CG 3.47Å; S391-M395 PolarHBondContact O-N 2.92Å |
| 392 | A | 92 | Very high | 85.7 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62.9 | -37.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | M139 A142 A143 F146 F388 G389 M395 A396 | M139-A392 HydrophobicContact SD-CB 4.41Å; A142-A392 HydrophobicContact CB-CB 3.71Å; A143-A392 WeakPolarHBondContact CB-O 3.49Å; F146-A392 HydrophobicContact CD2-CB 4.08Å; F146-A392 HydrophobicContact CE2-CB 3.97Å; F388-A392 VanDerWaalsContact O-CB 3.31Å; F388-A392 WeakPolarHBondContact O-CB 3.44Å; F388-A392 PolarHBondContact O-N 2.85Å; G389-A392 PolarHBondContact O-N 3.3Å; A392-M395 PolarHBondContact O-N 2.89Å; A392-A396 WeakPolarHBondContact O-CB 3.43Å; A392-A396 PolarHBondContact O-N 2.66Å |
| 393 | T | 91.8 | Very high | 84.6 | Confident | 20 Ų | 20 | 47.9 Ų | 47.9 | 12% | 0.123 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.3 | -47.6 | 173.6 | -52 | 0 | 0 | 0 | 0 | 111.3 | V165 I166 A169 G389 A390 S391 M395 A396 L397 | V165-T393 HydrophobicContact CG1-CG2 4.39Å; I166-T393 HydrophobicContact CG1-CG2 4.44Å; A169-T393 HydrophobicContact CB-CG2 3.9Å; A169-T393 WeakPolarHBondContact CB-OG1 3.34Å; G389-T393 WeakPolarHBondContact O-CB 3.17Å; G389-T393 PolarHBondContact O-N 2.99Å; G389-T393 PolarHBondContact O-OG1 3.4Å; A390-T393 WeakPolarHBondContact O-CB 3.45Å; A390-T393 PolarHBondContact O-N 3.47Å; S391-T393 VanDerWaalsContact C-N 3.29Å; S391-T393 PolarHBondContact O-N 3.49Å; T393-M395 VanDerWaalsContact C-N 3.28Å; T393-M395 PolarHBondContact O-N 3.12Å; T393-A396 WeakPolarHBondContact O-CB 3.36Å; T393-A396 PolarHBondContact O-N 2.89Å; T393-L397 HydrophobicContact CG2-CD1 4.29Å; T393-L397 WeakPolarHBondContact O-CG 3.33Å; T393-L397 PolarHBondContact O-N 3.17Å |
| 394 | A | 91.5 | Very high | 83.5 | Confident | 46 Ų | 46 | 43.3 Ų | 43.3 | 38% | 0.38 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.4 | -41.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | A390 S391 L397 L398 | A390-A394 PolarHBondContact O-N 3.1Å; S391-A394 PolarHBondContact O-N 3.43Å; A394-L397 PolarHBondContact O-N 2.95Å; A394-L398 WeakPolarHBondContact O-CB 3.08Å; A394-L398 WeakPolarHBondContact O-CG 3.4Å; A394-L398 PolarHBondContact O-N 3.43Å; A394-L398 VanDerWaalsContact O-N 3.13Å |
| 395 | M | 88.5 | Confident | 82.4 | Confident | 51 Ų | 51 | 43.6 Ų | 43.6 | 25% | 0.251 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 174.9 | -69.4 | 166.6 | 61.1 | 0 | 0 | 112.1 | M139 F140 A143 S391 A392 T393 L397 L398 A399 | M139-M395 HydrophobicContact CB-CE 4.13Å; M139-M395 HydrophobicContact CB-SD 4.07Å; F140-M395 HydrophobicContact CD1-CE 3.13Å; F140-M395 HydrophobicContact CE1-CE 3.38Å; F140-M395 HydrophobicContact CG-CE 4.22Å; A143-M395 HydrophobicContact CB-CB 3.73Å; A143-M395 HydrophobicContact CB-CE 4.49Å; S391-M395 VanDerWaalsContact O-CG 3.26Å; S391-M395 WeakPolarHBondContact O-CG 3.47Å; S391-M395 PolarHBondContact O-N 2.92Å; A392-M395 PolarHBondContact O-N 2.89Å; T393-M395 VanDerWaalsContact C-N 3.28Å; T393-M395 PolarHBondContact O-N 3.12Å; M395-L397 VanDerWaalsContact C-N 3.29Å; M395-L397 PolarHBondContact O-N 2.93Å; M395-L398 PolarHBondContact O-N 3.43Å; M395-A399 VanDerWaalsContact O-CB 3.22Å; M395-A399 WeakPolarHBondContact O-CB 3.33Å; M395-A399 PolarHBondContact O-N 2.93Å |
| 396 | A | 86.8 | Confident | 81.3 | Confident | 5 Ų | 5 | 43.9 Ų | 43.9 | 4% | 0.041 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.8 | -37.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | A143 F146 V165 A392 T393 | A143-A396 HydrophobicContact CB-CB 4.3Å; A143-A396 VanDerWaalsContact O-CB 3.3Å; A143-A396 WeakPolarHBondContact O-CB 3.29Å; F146-A396 HydrophobicContact CB-CB 4Å; V165-A396 HydrophobicContact CG1-CB 3.94Å; A392-A396 WeakPolarHBondContact O-CB 3.43Å; A392-A396 PolarHBondContact O-N 2.66Å; T393-A396 WeakPolarHBondContact O-CB 3.36Å; T393-A396 PolarHBondContact O-N 2.89Å |
| 397 | L | 86.6 | Confident | 80.3 | Confident | 60 Ų | 60 | 39.3 Ų | 39.3 | 31% | 0.314 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -75 | -25.8 | 178.2 | -67.1 | 173.5 | 0 | 0 | 0 | 113.6 | N162 V165 I166 T393 A394 M395 | N162-L397 HydrophobicContact CB-CD2 3.84Å; V165-L397 HydrophobicContact CB-CD2 3.97Å; V165-L397 HydrophobicContact CG1-CD2 3.91Å; V165-L397 HydrophobicContact CG1-CG 4.24Å; I166-L397 HydrophobicContact CD1-CD1 4.11Å; I166-L397 HydrophobicContact CG1-CD1 3.92Å; I166-L397 HydrophobicContact CG1-CD2 4.37Å; T393-L397 HydrophobicContact CG2-CD1 4.29Å; T393-L397 WeakPolarHBondContact O-CG 3.33Å; T393-L397 PolarHBondContact O-N 3.17Å; A394-L397 PolarHBondContact O-N 2.95Å; M395-L397 VanDerWaalsContact C-N 3.29Å; M395-L397 PolarHBondContact O-N 2.93Å |
| 398 | L | 81.3 | Confident | 79.4 | Confident | 148 Ų | 148 | 35 Ų | 35 | 78% | 0.775 | 21% | 0.214 | S | C | * | . | H | α-helix | trans | -94.4 | -18.8 | -178.9 | -67.8 | 172.7 | 0 | 0 | 0 | 112.9 | A394 M395 | A394-L398 WeakPolarHBondContact O-CB 3.08Å; A394-L398 WeakPolarHBondContact O-CG 3.4Å; A394-L398 PolarHBondContact O-N 3.43Å; A394-L398 VanDerWaalsContact O-N 3.13Å; M395-L398 PolarHBondContact O-N 3.43Å |
| 399 | A | 70.6 | Confident | 78.6 | Confident | 33 Ų | 33 | 33.7 Ų | 33.7 | 27% | 0.273 | 21% | 0.209 | S | C | . | . | trans | -79.6 | 136.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | M395 L405 | M395-A399 VanDerWaalsContact O-CB 3.22Å; M395-A399 WeakPolarHBondContact O-CB 3.33Å; M395-A399 PolarHBondContact O-N 2.93Å; A399-L405 HydrophobicContact CB-CD1 3.26Å; A399-L405 HydrophobicContact CB-CD2 4.01Å; A399-L405 HydrophobicContact CB-CG 3.62Å | ||
| 400 | S | 62.5 | Low | 78 | Confident | 109 Ų | 109 | 33.7 Ų | 33.7 | 76% | 0.762 | 21% | 0.209 | S | C | * | . | S | Bend | trans | -82 | -12.8 | 178.7 | -45.2 | 0 | 0 | 0 | 0 | 113.8 | ||
| 401 | S | 65.9 | Low | 77.7 | Confident | 42 Ų | 42 | 31.6 Ų | 31.6 | 29% | 0.294 | 19% | 0.191 | S | C | . | . | trans | -153.1 | 127.6 | -176.9 | 175.5 | 0 | 0 | 0 | 0 | 112.4 | Y403 G404 L405 | S401-Y403 PolarHBondContact OG-N 3.42Å; S401-G404 PolarHBondContact OG-N 3.22Å; S401-G404 VanDerWaalsContact OG-N 3.12Å; S401-L405 PolarHBondContact O-N 3.3Å | ||
| 402 | V | 64.8 | Low | 77.5 | Confident | 16 Ų | 16 | 30.6 Ų | 30.6 | 10% | 0.097 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.4 | -46.5 | 171.1 | -178.6 | 0 | 0 | 0 | 0 | 110.9 | A144 S147 A148 L405 W406 | A144-V402 HydrophobicContact CB-CG1 4.04Å; A144-V402 WeakPolarHBondContact O-CG1 3.26Å; S147-V402 VanDerWaalsContact OG-CG2 3.29Å; S147-V402 WeakPolarHBondContact OG-CG2 3.35Å; A148-V402 HydrophobicContact CB-CG1 4.25Å; V402-L405 PolarHBondContact O-N 3.39Å; V402-W406 PolarHBondContact O-N 3.3Å |
| 403 | Y | 64 | Low | 77.6 | Confident | 46 Ų | 46 | 30.8 Ų | 30.8 | 18% | 0.18 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.4 | -41.6 | -178.3 | -172.5 | -95.9 | 0 | 0 | 0 | 112.1 | S401 W406 Y407 | S401-Y403 PolarHBondContact OG-N 3.42Å; Y403-W406 AromaticContact CD2-CE3 3.86Å; Y403-W406 HydrophobicContact CD2-CE3 3.86Å; Y403-W406 HydrophobicContact CD2-CZ3 4.07Å; Y403-W406 AromaticContact CE2-CE3 3.76Å; Y403-W406 HydrophobicContact CE2-CE3 3.76Å; Y403-W406 AromaticContact CE2-CZ3 3.52Å; Y403-W406 HydrophobicContact CE2-CZ3 3.52Å; Y403-W406 PolarHBondContact O-N 3.13Å; Y403-Y407 PolarHBondContact O-N 3.42Å |
| 404 | G | 68.1 | Low | 77.7 | Confident | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.01 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.1 | -47.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | S401 W406 Y407 L408 | S401-G404 PolarHBondContact OG-N 3.22Å; S401-G404 VanDerWaalsContact OG-N 3.12Å; G404-W406 VanDerWaalsContact C-N 3.3Å; G404-W406 PolarHBondContact O-N 3.24Å; G404-Y407 PolarHBondContact O-N 3.13Å; G404-L408 WeakPolarHBondContact O-CB 3.3Å; G404-L408 WeakPolarHBondContact O-CD1 3.48Å; G404-L408 VanDerWaalsContact O-CG 3.26Å; G404-L408 WeakPolarHBondContact O-CG 3.45Å; G404-L408 PolarHBondContact O-N 3.43Å |
| 405 | L | 68.9 | Low | 77.8 | Confident | 14 Ų | 14 | 27.7 Ų | 27.7 | 7% | 0.073 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -58.5 | -43.3 | 174.4 | -78.3 | 176.5 | 0 | 0 | 0 | 111.9 | F140 A143 A144 A399 S401 V402 L408 S409 | F140-L405 WeakPolarHBondContact CB-O 3.46Å; F140-L405 HydrophobicContact CD1-CD2 3.99Å; A143-L405 HydrophobicContact CB-CD1 3.77Å; A144-L405 HydrophobicContact CB-CB 3.94Å; A399-L405 HydrophobicContact CB-CD1 3.26Å; A399-L405 HydrophobicContact CB-CD2 4.01Å; A399-L405 HydrophobicContact CB-CG 3.62Å; S401-L405 PolarHBondContact O-N 3.3Å; V402-L405 PolarHBondContact O-N 3.39Å; L405-L408 WeakPolarHBondContact O-CB 3.23Å; L405-L408 PolarHBondContact O-N 2.83Å; L405-S409 PolarHBondContact O-N 3.19Å |
| 406 | W | 69.3 | Low | 78 | Confident | 10 Ų | 10 | 25.3 Ų | 25.3 | 4% | 0.038 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64 | -44.9 | 178.2 | 174.6 | 47.4 | 0 | 0 | 0 | 112.5 | A87 Y91 W141 A144 L247 V402 Y403 G404 L408 S409 | A87-W406 HydrophobicContact CB-CH2 3.39Å; A87-W406 HydrophobicContact CB-CZ2 3.82Å; Y91-W406 HydrophobicContact CD2-CZ2 4.44Å; Y91-W406 HydrophobicContact CE2-CH2 4.16Å; Y91-W406 AromaticContact CE2-CZ2 3.39Å; Y91-W406 HydrophobicContact CE2-CZ2 3.39Å; Y91-W406 AromaticContact CZ-CZ2 3.97Å; Y91-W406 PolarHBondContact OH-NE1 3.21Å; W141-W406 HydrophobicContact CE3-CB 4.4Å; W141-W406 AromaticContact CE3-CD1 3.14Å; W141-W406 HydrophobicContact CE3-CG 4.01Å; W141-W406 AromaticContact CE3-NE1 3.71Å; W141-W406 AromaticContact CH2-CD1 3.87Å; W141-W406 AromaticContact CH2-NE1 3.58Å; W141-W406 HydrophobicContact CZ3-CB 4.28Å; W141-W406 AromaticContact CZ3-CD1 2.92Å; W141-W406 HydrophobicContact CZ3-CD2 4.41Å; W141-W406 AromaticContact CZ3-CG 3.64Å; W141-W406 HydrophobicContact CZ3-CG 3.64Å; W141-W406 AromaticContact CZ3-NE1 3.11Å; A144-W406 HydrophobicContact CB-CB 4.14Å; L247-W406 HydrophobicContact CD2-CH2 4.19Å; L247-W406 HydrophobicContact CD2-CZ2 4.36Å; V402-W406 PolarHBondContact O-N 3.3Å; Y403-W406 AromaticContact CD2-CE3 3.86Å; Y403-W406 HydrophobicContact CD2-CE3 3.86Å; Y403-W406 HydrophobicContact CD2-CZ3 4.07Å; Y403-W406 AromaticContact CE2-CE3 3.76Å; Y403-W406 HydrophobicContact CE2-CE3 3.76Å; Y403-W406 AromaticContact CE2-CZ3 3.52Å; Y403-W406 HydrophobicContact CE2-CZ3 3.52Å; Y403-W406 PolarHBondContact O-N 3.13Å; G404-W406 VanDerWaalsContact C-N 3.3Å; G404-W406 PolarHBondContact O-N 3.24Å; W406-L408 VanDerWaalsContact C-N 3.32Å; W406-L408 PolarHBondContact O-N 3.17Å; W406-S409 VanDerWaalsContact O-CB 3.31Å; W406-S409 WeakPolarHBondContact O-CB 3.39Å; W406-S409 PolarHBondContact O-N 3.37Å; W406-S409 VanDerWaalsContact O-N 3.11Å; W406-S409 PolarHBondContact O-OG 3.39Å |
| 407 | Y | 70.6 | Confident | 78.4 | Confident | 7 Ų | 7 | 25.2 Ų | 25.2 | 3% | 0.027 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63 | -43 | 177.2 | -166.3 | -76.9 | 0 | 0 | 0 | 111.3 | N243 L246 Y403 G404 S409 S410 D411 K480 | N243-Y407 HydrophobicContact CB-CE2 3.96Å; N243-Y407 WeakPolarHBondContact OD1-CE2 3.25Å; N243-Y407 VanDerWaalsContact OD1-CZ 3.23Å; N243-Y407 PolarHBondContact OD1-OH 2.71Å; L246-Y407 HydrophobicContact CD1-CE1 3.61Å; L246-Y407 WeakPolarHBondContact CD1-OH 3.24Å; L246-Y407 HydrophobicContact CD2-CE1 4.21Å; L246-Y407 HydrophobicContact CD2-CE2 4.06Å; Y403-Y407 PolarHBondContact O-N 3.42Å; G404-Y407 PolarHBondContact O-N 3.13Å; Y407-S409 PolarHBondContact O-N 3.12Å; Y407-S410 PolarHBondContact O-N 2.98Å; Y407-D411 HydrophobicContact CE1-CB 4.39Å; Y407-D411 WeakPolarHBondContact O-CB 3.36Å; Y407-D411 PolarHBondContact O-N 3.32Å; Y407-K480 HydrophobicContact CE1-CD 3.9Å; Y407-K480 WeakPolarHBondContact OH-CD 3.3Å; Y407-K480 WeakPolarHBondContact OH-CE 3.46Å; Y407-K480 PolarHBondContact OH-NZ 3.46Å |
| 408 | L | 73.6 | Confident | 78.8 | Confident | 9 Ų | 9 | 22.7 Ų | 22.7 | 5% | 0.047 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -56.9 | -31.5 | 174.4 | -79.5 | 163.7 | 0 | 0 | 0 | 112.8 | F140 G404 L405 W406 D411 E451 L454 | F140-L408 HydrophobicContact CD2-CB 4Å; F140-L408 HydrophobicContact CE2-CB 4.32Å; F140-L408 HydrophobicContact CG-CB 4.29Å; G404-L408 WeakPolarHBondContact O-CB 3.3Å; G404-L408 WeakPolarHBondContact O-CD1 3.48Å; G404-L408 VanDerWaalsContact O-CG 3.26Å; G404-L408 WeakPolarHBondContact O-CG 3.45Å; G404-L408 PolarHBondContact O-N 3.43Å; L405-L408 WeakPolarHBondContact O-CB 3.23Å; L405-L408 PolarHBondContact O-N 2.83Å; W406-L408 VanDerWaalsContact C-N 3.32Å; W406-L408 PolarHBondContact O-N 3.17Å; L408-D411 PolarHBondContact O-N 2.87Å; L408-E451 HydrophobicContact CD2-CG 3.97Å; L408-L454 HydrophobicContact CD1-CD1 4.23Å; L408-L454 HydrophobicContact CD1-CD2 3.9Å; L408-L454 HydrophobicContact CD1-CG 3.97Å; L408-L454 HydrophobicContact CD2-CD1 3.82Å; L408-L454 HydrophobicContact CD2-CG 4.28Å |
| 409 | S | 76.2 | Confident | 79.5 | Confident | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.7 | -42.8 | -179.7 | 77.8 | 0 | 0 | 0 | 0 | 113 | G137 W254 L405 W406 Y407 I413 | G137-S409 VanDerWaalsContact CA-O 3.32Å; G137-S409 WeakPolarHBondContact CA-O 3.09Å; G137-S409 VanDerWaalsContact O-CB 3.31Å; G137-S409 WeakPolarHBondContact O-CB 3.32Å; W254-S409 WeakPolarHBondContact CH2-OG 3.19Å; L405-S409 PolarHBondContact O-N 3.19Å; W406-S409 VanDerWaalsContact O-CB 3.31Å; W406-S409 WeakPolarHBondContact O-CB 3.39Å; W406-S409 PolarHBondContact O-N 3.37Å; W406-S409 VanDerWaalsContact O-N 3.11Å; W406-S409 PolarHBondContact O-OG 3.39Å; Y407-S409 PolarHBondContact O-N 3.12Å; S409-I413 WeakPolarHBondContact O-CD1 3.32Å |
| 410 | S | 80.8 | Confident | 80.7 | Confident | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -84 | -15.1 | -178.3 | -68.4 | 0 | 0 | 0 | 0 | 113.7 | Y91 W254 Y407 Y414 | Y91-S410 PolarHBondContact OH-OG 2.62Å; W254-S410 WeakPolarHBondContact CZ3-OG 3.41Å; Y407-S410 PolarHBondContact O-N 2.98Å; S410-Y414 WeakPolarHBondContact O-CB 3.38Å; S410-Y414 PolarHBondContact O-N 3.01Å |
| 411 | D | 86.5 | Confident | 82.3 | Confident | 3 Ų | 3 | 8.9 Ų | 8.9 | 2% | 0.016 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -75.4 | -52.1 | -168.5 | 173.8 | 64.8 | 0 | 0 | 0 | 113.7 | L246 Y407 L408 I413 Y414 I415 R446 | L246-D411 HydrophobicContact CD1-CB 3.9Å; Y407-D411 HydrophobicContact CE1-CB 4.39Å; Y407-D411 WeakPolarHBondContact O-CB 3.36Å; Y407-D411 PolarHBondContact O-N 3.32Å; L408-D411 PolarHBondContact O-N 2.87Å; D411-I413 PolarHBondContact O-N 3.43Å; D411-Y414 PolarHBondContact O-N 3.39Å; D411-I415 WeakPolarHBondContact O-CG1 3.29Å; D411-I415 PolarHBondContact O-N 2.91Å; D411-I415 WeakPolarHBondContact OD1-CD1 3.18Å; D411-R446 IonicContact OD1-CZ 3.46Å; D411-R446 IonicContact OD1-NE 3.82Å; D411-R446 PolarHBondContact OD1-NE 3.4Å; D411-R446 VanDerWaalsContact OD1-NE 3.12Å; D411-R446 IonicContact OD1-NH2 2.59Å; D411-R446 IonicContact OD2-CZ 3.23Å; D411-R446 IonicContact OD2-NE 3.12Å; D411-R446 PolarHBondContact OD2-NE 3.44Å; D411-R446 IonicContact OD2-NH2 3.08Å; D411-R446 PolarHBondContact OD2-NH2 3.38Å |
| 412 | L | 88.5 | Confident | 83.8 | Confident | 22 Ų | 22 | 8.8 Ų | 8.8 | 12% | 0.115 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -63.6 | -34.4 | 173.3 | -68.3 | 179.2 | 0 | 0 | 0 | 111.8 | P133 M136 I416 L443 | P133-L412 HydrophobicContact CB-CB 3.99Å; M136-L412 HydrophobicContact CB-CD1 4.11Å; M136-L412 HydrophobicContact CE-CD1 3.68Å; M136-L412 HydrophobicContact SD-CD1 3.77Å; L412-I416 HydrophobicContact CD2-CD1 4.16Å; L412-I416 VanDerWaalsContact O-CB 3.28Å; L412-I416 WeakPolarHBondContact O-CB 3.46Å; L412-I416 PolarHBondContact O-N 2.87Å; L412-L443 HydrophobicContact CD2-CD1 4.24Å |
| 413 | I | 92.3 | Very high | 85.2 | Confident | 5 Ų | 5 | 8 Ų | 8 | 3% | 0.026 | 4% | 0.038 | C | C | . | . | I | π-helix | trans | -65.1 | -46.4 | 177.7 | -70.1 | -178.1 | 0 | 0 | 0 | 110.5 | G250 P253 W254 S409 D411 I417 F418 | G250-I413 WeakPolarHBondContact O-CG2 3.19Å; P253-I413 HydrophobicContact CB-CG2 4.18Å; P253-I413 HydrophobicContact CG-CG2 3.27Å; W254-I413 HydrophobicContact CD2-CD1 4.12Å; W254-I413 HydrophobicContact CE3-CD1 3.64Å; W254-I413 HydrophobicContact CE3-CG2 4.49Å; W254-I413 HydrophobicContact CH2-CD1 3.79Å; W254-I413 HydrophobicContact CZ2-CD1 4.23Å; W254-I413 HydrophobicContact CZ3-CD1 3.48Å; W254-I413 VanDerWaalsContact CZ3-CD1 3.48Å; S409-I413 WeakPolarHBondContact O-CD1 3.32Å; D411-I413 PolarHBondContact O-N 3.43Å; I413-I417 HydrophobicContact CG2-CB 4.41Å; I413-I417 WeakPolarHBondContact O-CA 3.26Å; I413-I417 WeakPolarHBondContact O-CB 3.31Å; I413-I417 PolarHBondContact O-N 2.96Å; I413-F418 PolarHBondContact O-N 3.05Å |
| 414 | Y | 94.4 | Very high | 86.6 | Confident | 1 Ų | 1 | 6.5 Ų | 6.5 | 0% | 0.004 | 3% | 0.033 | C | C | . | . | I | π-helix | trans | -63.5 | -43.5 | 177.3 | 174.9 | -129.2 | 0 | 0 | 0 | 112.5 | L246 F249 S410 D411 F418 P419 K480 T481 M484 | L246-Y414 HydrophobicContact CB-CD1 3.65Å; L246-Y414 HydrophobicContact CB-CE1 3.97Å; L246-Y414 HydrophobicContact CB-CG 4.11Å; L246-Y414 HydrophobicContact CD1-CD1 3.95Å; L246-Y414 HydrophobicContact CG-CD1 3.89Å; L246-Y414 HydrophobicContact CG-CG 4.14Å; F249-Y414 HydrophobicContact CB-CD2 3.63Å; F249-Y414 HydrophobicContact CB-CE2 3.53Å; F249-Y414 HydrophobicContact CD2-CE2 4.01Å; F249-Y414 HydrophobicContact CG-CE2 4.24Å; S410-Y414 WeakPolarHBondContact O-CB 3.38Å; S410-Y414 PolarHBondContact O-N 3.01Å; D411-Y414 PolarHBondContact O-N 3.39Å; Y414-F418 HydrophobicContact CD2-CD1 4.33Å; Y414-F418 HydrophobicContact CE2-CD1 4.39Å; Y414-P419 WeakPolarHBondContact O-CD 3.1Å; Y414-K480 HydrophobicContact CD1-CB 4.43Å; Y414-K480 HydrophobicContact CE1-CB 4.3Å; Y414-T481 PolarHBondContact OH-OG1 2.86Å; Y414-M484 HydrophobicContact CD1-CB 4.45Å; Y414-M484 HydrophobicContact CD2-CG 4.07Å; Y414-M484 HydrophobicContact CE1-CB 4.11Å; Y414-M484 HydrophobicContact CE1-CG 4.48Å; Y414-M484 HydrophobicContact CE2-CB 4.26Å; Y414-M484 HydrophobicContact CE2-CE 3.82Å; Y414-M484 HydrophobicContact CE2-CG 3.75Å; Y414-M484 HydrophobicContact CE2-SD 4.48Å; Y414-M484 WeakPolarHBondContact O-CG 3.46Å; Y414-M484 WeakPolarHBondContact OH-CE 3.46Å |
| 415 | I | 93.2 | Very high | 87.8 | Confident | 0 Ų | 0 | 7.6 Ų | 7.6 | 0% | 0 | 4% | 0.039 | C | C | . | . | I | π-helix | trans | -80.7 | -33.5 | -172.7 | -65.2 | 169.8 | 0 | 0 | 0 | 112.4 | D411 P419 R446 K480 A483 S487 | D411-I415 WeakPolarHBondContact O-CG1 3.29Å; D411-I415 PolarHBondContact O-N 2.91Å; D411-I415 WeakPolarHBondContact OD1-CD1 3.18Å; I415-P419 WeakPolarHBondContact O-CG 3.17Å; I415-R446 HydrophobicContact CD1-CB 3.92Å; I415-R446 HydrophobicContact CD1-CG 3.65Å; I415-R446 HydrophobicContact CG2-CB 4.39Å; I415-K480 HydrophobicContact CD1-CB 4.13Å; I415-K480 HydrophobicContact CD1-CG 4.34Å; I415-A483 HydrophobicContact CD1-CB 4.29Å; I415-A483 HydrophobicContact CG1-CB 4.41Å; I415-A483 HydrophobicContact CG2-CB 3.81Å; I415-S487 WeakPolarHBondContact O-CB 3.49Å; I415-S487 PolarHBondContact O-OG 3.19Å |
| 416 | I | 93.3 | Very high | 89 | Confident | 1 Ų | 1 | 11.5 Ų | 11.5 | 1% | 0.005 | 6% | 0.055 | C | C | . | . | I | π-helix | trans | -113.2 | -42.4 | -170.6 | -55.1 | 178.2 | 0 | 0 | 0 | 112.4 | L130 P133 L412 Q420 Y439 L443 | L130-I416 HydrophobicContact CD2-CG2 4.02Å; P133-I416 HydrophobicContact CB-CD1 4.38Å; P133-I416 HydrophobicContact CG-CB 4.49Å; P133-I416 HydrophobicContact CG-CG2 4.09Å; L412-I416 HydrophobicContact CD2-CD1 4.16Å; L412-I416 VanDerWaalsContact O-CB 3.28Å; L412-I416 WeakPolarHBondContact O-CB 3.46Å; L412-I416 PolarHBondContact O-N 2.87Å; I416-Q420 WeakPolarHBondContact O-CG 3.33Å; I416-Q420 PolarHBondContact O-NE2 2.86Å; I416-Q420 PolarHBondContact O-OE1 3.38Å; I416-Y439 HydrophobicContact CD1-CE2 4.33Å; I416-Y439 HydrophobicContact CG2-CD2 3.26Å; I416-Y439 HydrophobicContact CG2-CE2 3.6Å; I416-Y439 HydrophobicContact CG2-CG 4.09Å; I416-L443 HydrophobicContact CD1-CB 4.18Å; I416-L443 HydrophobicContact CD1-CD1 3.97Å |
| 417 | I | 95.1 | Very high | 90.1 | Very high | 2 Ų | 2 | 13.5 Ų | 13.5 | 1% | 0.01 | 7% | 0.066 | C | C | . | . | I | π-helix | trans | -85.8 | -45.1 | -174 | -54.9 | -55.8 | 0 | 0 | 0 | 111.4 | M114 F118 L130 P133 P253 I413 Q420 L421 | M114-I417 HydrophobicContact CE-CG2 4.28Å; F118-I417 HydrophobicContact CE2-CG2 4.03Å; F118-I417 HydrophobicContact CZ-CG2 3.94Å; L130-I417 HydrophobicContact CB-CD1 4.07Å; L130-I417 HydrophobicContact CD2-CD1 3.81Å; L130-I417 WeakPolarHBondContact O-CD1 3.32Å; P133-I417 HydrophobicContact CB-CD1 4.36Å; P133-I417 HydrophobicContact CG-CD1 3.65Å; P133-I417 HydrophobicContact CG-CG1 4.3Å; P253-I417 HydrophobicContact CB-CB 4.14Å; P253-I417 HydrophobicContact CB-CG2 3.51Å; P253-I417 HydrophobicContact CG-CB 4.38Å; P253-I417 HydrophobicContact CG-CG2 4.28Å; I413-I417 HydrophobicContact CG2-CB 4.41Å; I413-I417 WeakPolarHBondContact O-CA 3.26Å; I413-I417 WeakPolarHBondContact O-CB 3.31Å; I413-I417 PolarHBondContact O-N 2.96Å; I417-Q420 PolarHBondContact O-N 3.39Å; I417-L421 WeakPolarHBondContact O-CB 3.5Å; I417-L421 PolarHBondContact O-N 2.97Å |
| 418 | F | 96.1 | Very high | 90.9 | Very high | 8 Ų | 8 | 22 Ų | 22 | 4% | 0.035 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -56.7 | -51.4 | -178.2 | 177.5 | -110.6 | 0 | 0 | 0 | 113.9 | F102 F249 I252 P253 I413 Y414 Q420 L421 L422 M484 | F102-F418 AromaticContact CZ-CE2 3.95Å; F102-F418 HydrophobicContact CZ-CE2 3.95Å; F249-F418 HydrophobicContact CB-CD1 3.8Å; F249-F418 HydrophobicContact CB-CD2 4.22Å; F249-F418 HydrophobicContact CB-CE1 3.62Å; F249-F418 HydrophobicContact CB-CE2 4.07Å; F249-F418 HydrophobicContact CB-CG 4.09Å; F249-F418 HydrophobicContact CB-CZ 3.77Å; F249-F418 AromaticContact CD1-CE1 3.81Å; F249-F418 HydrophobicContact CD1-CE1 3.81Å; F249-F418 AromaticContact CD1-CE2 3.86Å; F249-F418 HydrophobicContact CD1-CE2 3.86Å; F249-F418 AromaticContact CD1-CZ 3.27Å; F249-F418 HydrophobicContact CD1-CZ 3.27Å; F249-F418 HydrophobicContact CD2-CE1 4.38Å; F249-F418 AromaticContact CE1-CZ 4Å; F249-F418 HydrophobicContact CE1-CZ 4Å; F249-F418 HydrophobicContact CG-CD1 4.37Å; F249-F418 AromaticContact CG-CE1 3.7Å; F249-F418 HydrophobicContact CG-CE1 3.7Å; F249-F418 HydrophobicContact CG-CE2 4.32Å; F249-F418 AromaticContact CG-CZ 3.66Å; F249-F418 HydrophobicContact CG-CZ 3.66Å; F249-F418 VanDerWaalsContact O-CD2 3.3Å; F249-F418 WeakPolarHBondContact O-CD2 2.92Å; I252-F418 HydrophobicContact CB-CD2 4.42Å; I252-F418 HydrophobicContact CB-CE2 4.46Å; I252-F418 HydrophobicContact CD1-CE2 3.86Å; P253-F418 HydrophobicContact CG-CB 4.01Å; I413-F418 PolarHBondContact O-N 3.05Å; Y414-F418 HydrophobicContact CD2-CD1 4.33Å; Y414-F418 HydrophobicContact CE2-CD1 4.39Å; F418-Q420 PolarHBondContact O-N 3.41Å; F418-L421 WeakPolarHBondContact O-CB 3.4Å; F418-L421 PolarHBondContact O-N 3.35Å; F418-L421 VanDerWaalsContact O-N 3.14Å; F418-L422 HydrophobicContact CD1-CD1 4.19Å; F418-L422 HydrophobicContact CE1-CD1 3.58Å; F418-L422 HydrophobicContact CE1-CG 4.28Å; F418-L422 HydrophobicContact CE2-CD1 4.33Å; F418-L422 HydrophobicContact CE2-CD2 4.31Å; F418-L422 HydrophobicContact CE2-CG 4.16Å; F418-L422 HydrophobicContact CZ-CD1 3.67Å; F418-L422 HydrophobicContact CZ-CD2 4.15Å; F418-L422 HydrophobicContact CZ-CG 3.98Å; F418-L422 PolarHBondContact O-N 3.33Å; F418-M484 HydrophobicContact CD1-CG 4.28Å; F418-M484 HydrophobicContact CD1-SD 4.13Å; F418-M484 HydrophobicContact CE1-SD 4.35Å |
| 419 | P | 96.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.4 | -33.8 | 178.5 | 12.9 | -21.6 | 0 | 0 | 0 | 112.8 | Y414 I415 L422 C423 M484 F488 | Y414-P419 WeakPolarHBondContact O-CD 3.1Å; I415-P419 WeakPolarHBondContact O-CG 3.17Å; P419-L422 PolarHBondContact O-N 3.13Å; P419-C423 WeakPolarHBondContact O-CB 3.41Å; P419-C423 PolarHBondContact O-N 3.01Å; P419-C423 PolarHBondContact O-SG 3.29Å; P419-C423 VanDerWaalsContact O-SG 3.38Å; P419-M484 HydrophobicContact CG-CG 4.05Å; P419-F488 HydrophobicContact CB-CB 3.74Å; P419-F488 HydrophobicContact CB-CD2 4.23Å; P419-F488 HydrophobicContact CB-CG 4.48Å |
| 420 | Q | 95.6 | Very high | 92 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -72 | -38.7 | -179.6 | -82.4 | 64.1 | -21.4 | 0 | 0 | 108.8 | F118 L130 I416 I417 F418 C423 V424 S487 | F118-Q420 HydrophobicContact CD1-CB 4.42Å; F118-Q420 HydrophobicContact CE1-CB 3.89Å; L130-Q420 HydrophobicContact CD2-CG 4.09Å; I416-Q420 WeakPolarHBondContact O-CG 3.33Å; I416-Q420 PolarHBondContact O-NE2 2.86Å; I416-Q420 PolarHBondContact O-OE1 3.38Å; I417-Q420 PolarHBondContact O-N 3.39Å; F418-Q420 PolarHBondContact O-N 3.41Å; Q420-C423 WeakPolarHBondContact O-CB 3.28Å; Q420-C423 PolarHBondContact O-N 3.18Å; Q420-V424 WeakPolarHBondContact O-CG2 3.5Å; Q420-V424 PolarHBondContact O-N 2.83Å; Q420-S487 PolarHBondContact NE2-OG 3.22Å; Q420-S487 PolarHBondContact OE1-OG 3.39Å |
| 421 | L | 95.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.8 | -45.7 | 175.3 | -177.1 | 65.7 | 0 | 0 | 0 | 111.4 | F102 M114 F118 I252 P253 F258 I417 F418 C423 V424 L425 | F102-L421 HydrophobicContact CD1-CD2 3.4Å; F102-L421 VanDerWaalsContact CD1-CD2 3.4Å; F102-L421 HydrophobicContact CD1-CG 3.9Å; F102-L421 HydrophobicContact CE1-CD2 3.42Å; F102-L421 VanDerWaalsContact CE1-CD2 3.42Å; F102-L421 HydrophobicContact CE1-CG 3.8Å; F102-L421 HydrophobicContact CG-CD2 4.44Å; F102-L421 HydrophobicContact CZ-CD2 4.46Å; M114-L421 HydrophobicContact CE-CB 4.16Å; M114-L421 HydrophobicContact CE-CD1 3.31Å; M114-L421 HydrophobicContact CE-CD2 3.44Å; M114-L421 VanDerWaalsContact CE-CD2 3.44Å; M114-L421 HydrophobicContact CE-CG 3.77Å; M114-L421 HydrophobicContact SD-CD1 3.96Å; F118-L421 HydrophobicContact CE1-CB 4.28Å; F118-L421 HydrophobicContact CZ-CB 3.99Å; F118-L421 HydrophobicContact CZ-CD1 4.06Å; I252-L421 HydrophobicContact CG2-CD2 4.11Å; P253-L421 HydrophobicContact CB-CD2 4.15Å; F258-L421 HydrophobicContact CE2-CD2 4.4Å; I417-L421 WeakPolarHBondContact O-CB 3.5Å; I417-L421 PolarHBondContact O-N 2.97Å; F418-L421 WeakPolarHBondContact O-CB 3.4Å; F418-L421 PolarHBondContact O-N 3.35Å; F418-L421 VanDerWaalsContact O-N 3.14Å; L421-C423 VanDerWaalsContact C-N 3.29Å; L421-C423 PolarHBondContact O-N 3.2Å; L421-V424 PolarHBondContact O-N 3.39Å; L421-L425 HydrophobicContact CD1-CD1 3.56Å; L421-L425 HydrophobicContact CD1-CG 4Å; L421-L425 HydrophobicContact CG-CD1 3.94Å; L421-L425 WeakPolarHBondContact O-CB 3.21Å; L421-L425 WeakPolarHBondContact O-CG 3.36Å; L421-L425 PolarHBondContact O-N 3.08Å |
| 422 | L | 96.2 | Very high | 92.9 | Very high | 39 Ų | 39 | 23.7 Ų | 23.7 | 20% | 0.204 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -56.2 | -47.8 | 174.9 | -72.4 | 175.1 | 0 | 0 | 0 | 110.9 | F102 F418 P419 F426 F488 | F102-L422 HydrophobicContact CE1-CD2 4.06Å; F102-L422 HydrophobicContact CZ-CD2 3.62Å; F418-L422 HydrophobicContact CD1-CD1 4.19Å; F418-L422 HydrophobicContact CE1-CD1 3.58Å; F418-L422 HydrophobicContact CE1-CG 4.28Å; F418-L422 HydrophobicContact CE2-CD1 4.33Å; F418-L422 HydrophobicContact CE2-CD2 4.31Å; F418-L422 HydrophobicContact CE2-CG 4.16Å; F418-L422 HydrophobicContact CZ-CD1 3.67Å; F418-L422 HydrophobicContact CZ-CD2 4.15Å; F418-L422 HydrophobicContact CZ-CG 3.98Å; F418-L422 PolarHBondContact O-N 3.33Å; P419-L422 PolarHBondContact O-N 3.13Å; L422-F426 HydrophobicContact CD2-CD2 4.07Å; L422-F426 HydrophobicContact CD2-CE2 4.22Å; L422-F426 PolarHBondContact O-N 2.62Å; L422-F488 HydrophobicContact CB-CD2 4.21Å; L422-F488 HydrophobicContact CB-CE2 3.75Å; L422-F488 HydrophobicContact CD1-CD2 4.24Å; L422-F488 HydrophobicContact CD1-CE2 4.12Å |
| 423 | C | 95.1 | Very high | 93 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.8 | -42.5 | 179 | -80 | 0 | 0 | 0 | 0 | 113.2 | Y122 P419 Q420 L421 I427 T430 N491 | Y122-C423 WeakPolarHBondContact OH-CB 3.47Å; P419-C423 WeakPolarHBondContact O-CB 3.41Å; P419-C423 PolarHBondContact O-N 3.01Å; P419-C423 PolarHBondContact O-SG 3.29Å; P419-C423 VanDerWaalsContact O-SG 3.38Å; Q420-C423 WeakPolarHBondContact O-CB 3.28Å; Q420-C423 PolarHBondContact O-N 3.18Å; L421-C423 VanDerWaalsContact C-N 3.29Å; L421-C423 PolarHBondContact O-N 3.2Å; C423-I427 PolarHBondContact O-N 3.34Å; C423-T430 HydrophobicContact CB-CG2 3.89Å; C423-T430 PolarHBondContact O-OG1 3.36Å; C423-N491 WeakPolarHBondContact CB-ND2 3.35Å |
| 424 | V | 93.6 | Very high | 93.1 | Very high | 14 Ų | 14 | 24.2 Ų | 24.2 | 9% | 0.085 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -72.7 | -37.3 | -178.5 | 172.5 | 0 | 0 | 0 | 0 | 112.7 | P117 F118 L121 Y122 Q420 L421 | P117-V424 HydrophobicContact CB-CG1 3.64Å; P117-V424 WeakPolarHBondContact O-CG1 3.44Å; F118-V424 HydrophobicContact CD1-CB 4.44Å; F118-V424 HydrophobicContact CD1-CG2 3.64Å; F118-V424 HydrophobicContact CE1-CG2 4.03Å; L121-V424 HydrophobicContact CB-CG1 4.07Å; L121-V424 HydrophobicContact CB-CG2 4.34Å; L121-V424 HydrophobicContact CD2-CB 4.08Å; L121-V424 HydrophobicContact CD2-CG1 3.97Å; L121-V424 HydrophobicContact CD2-CG2 3.82Å; Y122-V424 HydrophobicContact CD2-CG2 4Å; Y122-V424 HydrophobicContact CE1-CG2 4.12Å; Y122-V424 HydrophobicContact CE2-CG2 3.25Å; Y122-V424 WeakPolarHBondContact OH-CG2 3.4Å; Q420-V424 WeakPolarHBondContact O-CG2 3.5Å; Q420-V424 PolarHBondContact O-N 2.83Å; L421-V424 PolarHBondContact O-N 3.39Å |
| 425 | L | 92.5 | Very high | 93.1 | Very high | 24 Ų | 24 | 24.1 Ų | 24.1 | 13% | 0.126 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -87.7 | -37.3 | -173.4 | -66.4 | -178.5 | 0 | 0 | 0 | 113.3 | F102 M106 P117 L421 | F102-L425 HydrophobicContact CD1-CD1 3.77Å; F102-L425 HydrophobicContact CE1-CD1 4.41Å; M106-L425 HydrophobicContact CG-CD1 4.1Å; M106-L425 HydrophobicContact SD-CD1 3.99Å; M106-L425 HydrophobicContact SD-CD2 4.05Å; P117-L425 HydrophobicContact CB-CD2 4.35Å; L421-L425 HydrophobicContact CD1-CD1 3.56Å; L421-L425 HydrophobicContact CD1-CG 4Å; L421-L425 HydrophobicContact CG-CD1 3.94Å; L421-L425 WeakPolarHBondContact O-CB 3.21Å; L421-L425 WeakPolarHBondContact O-CG 3.36Å; L421-L425 PolarHBondContact O-N 3.08Å |
| 426 | F | 94.1 | Very high | 93.2 | Very high | 96 Ų | 96 | 26.7 Ų | 26.7 | 42% | 0.421 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -116.3 | -23.3 | -168.7 | -54.3 | -69.6 | 0 | 0 | 0 | 114.3 | F101 F102 L422 | F101-F426 HydrophobicContact CB-CZ 4.22Å; F101-F426 WeakPolarHBondContact O-CZ 3.13Å; F102-F426 AromaticContact CD1-CE2 3.95Å; F102-F426 HydrophobicContact CD1-CE2 3.95Å; F102-F426 HydrophobicContact CD1-CZ 4.28Å; F102-F426 AromaticContact CE1-CE2 3.54Å; F102-F426 HydrophobicContact CE1-CE2 3.54Å; F102-F426 HydrophobicContact CE1-CZ 4.27Å; F102-F426 AromaticContact CZ-CE2 3.87Å; F102-F426 HydrophobicContact CZ-CE2 3.87Å; L422-F426 HydrophobicContact CD2-CD2 4.07Å; L422-F426 HydrophobicContact CD2-CE2 4.22Å; L422-F426 PolarHBondContact O-N 2.62Å |
| 427 | I | 93.3 | Very high | 93.3 | Very high | 52 Ų | 52 | 27.4 Ų | 27.4 | 27% | 0.267 | 14% | 0.139 | S | C | . | . | trans | -102.1 | 114.9 | -177.1 | -49.3 | -59.8 | 0 | 0 | 0 | 111.1 | C423 T430 F488 I492 Y496 | C423-I427 PolarHBondContact O-N 3.34Å; I427-T430 HydrophobicContact CB-CG2 3.88Å; I427-T430 HydrophobicContact CG2-CG2 3.74Å; I427-F488 HydrophobicContact CG1-CE2 4.48Å; I427-F488 HydrophobicContact CG1-CZ 4.48Å; I427-I492 HydrophobicContact CG1-CD1 4.27Å; I427-I492 HydrophobicContact CG2-CD1 4.47Å; I427-I492 HydrophobicContact CG2-CG1 4.34Å; I427-Y496 HydrophobicContact CG2-CE2 4.31Å | ||
| 428 | K | 86.3 | Confident | 93.4 | Very high | 185 Ų | 185 | 27.3 Ų | 27.3 | 80% | 0.804 | 14% | 0.139 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | 136.7 | 177.1 | -65.1 | -176.5 | -179.6 | 178.9 | 0 | 110.8 | Y496 | K428-Y496 PolarHBondContact O-OH 3.37Š|
| 429 | G | 82.5 | Confident | 93.3 | Very high | 30 Ų | 30 | 27.9 Ų | 27.9 | 31% | 0.309 | 14% | 0.141 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 91.5 | 7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 430 | T | 91.4 | Very high | 93.3 | Very high | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.006 | 16% | 0.163 | C | C | . | . | trans | -69.5 | 144.7 | 168.4 | 61.3 | 0 | 0 | 0 | 0 | 110.8 | L121 Y122 C423 I427 S495 | L121-T430 WeakPolarHBondContact CD2-OG1 3.38Å; Y122-T430 PolarHBondContact OH-OG1 3.03Å; C423-T430 HydrophobicContact CB-CG2 3.89Å; C423-T430 PolarHBondContact O-OG1 3.36Å; I427-T430 HydrophobicContact CB-CG2 3.88Å; I427-T430 HydrophobicContact CG2-CG2 3.74Å; T430-S495 WeakPolarHBondContact CA-OG 3.45Å | ||
| 431 | N | 92.3 | Very high | 93.2 | Very high | 6 Ų | 6 | 37.3 Ų | 37.3 | 3% | 0.032 | 19% | 0.186 | C | C | . | . | trans | -141.6 | 175.9 | -174.8 | 65 | 47.5 | 0 | 0 | 0 | 112 | Y433 G434 A435 S495 A516 | N431-Y433 VanDerWaalsContact C-N 3.33Å; N431-Y433 PolarHBondContact O-N 2.99Å; N431-Y433 WeakPolarHBondContact OD1-CB 3.34Å; N431-Y433 PolarHBondContact OD1-N 3.38Å; N431-Y433 VanDerWaalsContact OD1-N 3.14Å; N431-G434 PolarHBondContact O-N 3.44Å; N431-G434 PolarHBondContact OD1-N 3.32Å; N431-A435 PolarHBondContact O-N 3.15Å; N431-S495 PolarHBondContact N-OG 3.28Å; N431-S495 WeakPolarHBondContact ND2-CA 3.29Å; N431-S495 PolarHBondContact ND2-O 3.02Å; N431-A516 HydrophobicContact CB-CB 4.35Å | ||
| 432 | T | 92.7 | Very high | 93.1 | Very high | 12 Ų | 12 | 37.3 Ų | 37.3 | 7% | 0.074 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.2 | -34.5 | -174.2 | -45.7 | 0 | 0 | 0 | 0 | 113.3 | Y122 M126 A435 I436 L514 | Y122-T432 WeakPolarHBondContact CA-OG1 3.35Å; Y122-T432 VanDerWaalsContact O-CG2 3.28Å; Y122-T432 WeakPolarHBondContact O-CG2 3.27Å; Y122-T432 PolarHBondContact O-OG1 2.99Å; M126-T432 HydrophobicContact CB-CG2 3.94Å; M126-T432 HydrophobicContact CG-CG2 4.43Å; T432-A435 PolarHBondContact O-N 2.96Å; T432-I436 HydrophobicContact CG2-CD1 4.13Å; T432-I436 WeakPolarHBondContact O-CG1 3.33Å; T432-I436 PolarHBondContact O-N 3.06Å; T432-L514 HydrophobicContact CG2-CD1 3.94Å |
| 433 | Y | 92.6 | Very high | 92.9 | Very high | 37 Ų | 37 | 37.6 Ų | 37.6 | 15% | 0.145 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64 | -46.4 | 177.5 | -68.4 | -71.7 | 0 | 0 | 0 | 111.6 | N431 A435 I436 A437 A498 F502 L511 D512 F513 L514 A516 | N431-Y433 VanDerWaalsContact C-N 3.33Å; N431-Y433 PolarHBondContact O-N 2.99Å; N431-Y433 WeakPolarHBondContact OD1-CB 3.34Å; N431-Y433 PolarHBondContact OD1-N 3.38Å; N431-Y433 VanDerWaalsContact OD1-N 3.14Å; Y433-A435 VanDerWaalsContact C-N 3.35Å; Y433-I436 PolarHBondContact O-N 3Å; Y433-A437 WeakPolarHBondContact O-CB 3.42Å; Y433-A437 PolarHBondContact O-N 2.83Å; Y433-A498 HydrophobicContact CD2-CB 4.21Å; Y433-A498 HydrophobicContact CG-CB 4.46Å; Y433-F502 HydrophobicContact CD2-CE2 4.43Å; Y433-F502 AromaticContact CE2-CE2 3.88Å; Y433-F502 HydrophobicContact CE2-CE2 3.88Å; Y433-F502 HydrophobicContact CE2-CZ 4.41Å; Y433-L511 PolarHBondContact OH-O 3.37Å; Y433-D512 WeakPolarHBondContact CE2-OD1 3.41Å; Y433-D512 WeakPolarHBondContact OH-CA 3.3Å; Y433-D512 PolarHBondContact OH-OD1 2.96Å; Y433-F513 HydrophobicContact CE1-CD1 4.3Å; Y433-F513 AromaticContact CE1-CE1 3.6Å; Y433-F513 HydrophobicContact CE1-CE1 3.6Å; Y433-F513 HydrophobicContact CE1-CE2 4.47Å; Y433-F513 AromaticContact CE1-CZ 3.7Å; Y433-F513 HydrophobicContact CE1-CZ 3.7Å; Y433-F513 WeakPolarHBondContact OH-CD1 3.48Å; Y433-F513 PolarHBondContact OH-N 3.06Å; Y433-L514 HydrophobicContact CD1-CD1 3.69Å; Y433-L514 HydrophobicContact CE1-CB 4.33Å; Y433-L514 HydrophobicContact CE1-CD1 3.51Å; Y433-L514 HydrophobicContact CE1-CG 3.92Å; Y433-L514 HydrophobicContact CE2-CB 4.26Å; Y433-L514 HydrophobicContact CG-CD1 4.28Å; Y433-L514 PolarHBondContact OH-N 3.42Å; Y433-A516 HydrophobicContact CD2-CB 3.84Å; Y433-A516 HydrophobicContact CE2-CB 3.78Å |
| 434 | G | 93.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.4 | -41.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | N431 I436 A437 G438 N491 S495 | N431-G434 PolarHBondContact O-N 3.44Å; N431-G434 PolarHBondContact OD1-N 3.32Å; G434-I436 PolarHBondContact O-N 2.87Å; G434-A437 PolarHBondContact O-N 2.56Å; G434-G438 PolarHBondContact O-N 3.31Å; G434-N491 VanDerWaalsContact C-OD1 3.26Å; G434-N491 WeakPolarHBondContact CA-O 3.49Å; G434-N491 VanDerWaalsContact O-CA 3.3Å; G434-N491 WeakPolarHBondContact O-CA 3.29Å; G434-S495 WeakPolarHBondContact CA-OG 3.43Å |
| 435 | A | 94.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.4 | -42.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y122 M126 N431 T432 Y433 Y439 N491 | Y122-A435 HydrophobicContact CD1-CB 4.04Å; Y122-A435 HydrophobicContact CD2-CB 3.61Å; Y122-A435 HydrophobicContact CE1-CB 4.06Å; Y122-A435 HydrophobicContact CE2-CB 3.61Å; Y122-A435 HydrophobicContact CG-CB 3.82Å; M126-A435 HydrophobicContact CE-CB 3.94Å; M126-A435 WeakPolarHBondContact CE-O 3.1Å; M126-A435 HydrophobicContact CG-CB 4.03Å; M126-A435 HydrophobicContact SD-CB 4.23Å; N431-A435 PolarHBondContact O-N 3.15Å; T432-A435 PolarHBondContact O-N 2.96Å; Y433-A435 VanDerWaalsContact C-N 3.35Å; A435-Y439 WeakPolarHBondContact O-CB 3.46Å; A435-Y439 PolarHBondContact O-N 3.29Å; A435-N491 PolarHBondContact N-OD1 3.16Å |
| 436 | I | 95.3 | Very high | 92.5 | Very high | 53 Ų | 53 | 42.5 Ų | 42.5 | 27% | 0.272 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -66.4 | -46 | 176 | -68.4 | 168.9 | 0 | 0 | 0 | 110.8 | M126 T432 Y433 G434 Y439 L440 L514 | M126-I436 HydrophobicContact CE-CG1 4.49Å; M126-I436 HydrophobicContact SD-CG1 3.5Å; M126-I436 VanDerWaalsContact SD-CG1 3.5Å; T432-I436 HydrophobicContact CG2-CD1 4.13Å; T432-I436 WeakPolarHBondContact O-CG1 3.33Å; T432-I436 PolarHBondContact O-N 3.06Å; Y433-I436 PolarHBondContact O-N 3Å; G434-I436 PolarHBondContact O-N 2.87Å; I436-Y439 WeakPolarHBondContact O-CB 3.32Å; I436-Y439 PolarHBondContact O-N 2.93Å; I436-L440 HydrophobicContact CG2-CD1 3.89Å; I436-L440 HydrophobicContact CG2-CG 4.32Å; I436-L440 WeakPolarHBondContact O-CG 3.26Å; I436-L440 PolarHBondContact O-N 2.56Å; I436-L514 HydrophobicContact CD1-CD1 3.55Å |
| 437 | A | 95.4 | Very high | 92.1 | Very high | 16 Ų | 16 | 42.2 Ų | 42.2 | 13% | 0.132 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.2 | -48.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | Y433 G434 Y439 L440 F441 T490 V494 | Y433-A437 WeakPolarHBondContact O-CB 3.42Å; Y433-A437 PolarHBondContact O-N 2.83Å; G434-A437 PolarHBondContact O-N 2.56Å; A437-Y439 VanDerWaalsContact C-N 3.32Å; A437-Y439 PolarHBondContact O-N 2.8Å; A437-L440 PolarHBondContact O-N 2.77Å; A437-F441 VanDerWaalsContact O-CD2 3.28Å; A437-F441 WeakPolarHBondContact O-CD2 3.38Å; A437-F441 PolarHBondContact O-N 3.02Å; A437-T490 HydrophobicContact CB-CG2 3.68Å; A437-V494 HydrophobicContact CB-CB 4.1Å; A437-V494 HydrophobicContact CB-CG1 3.96Å; A437-V494 HydrophobicContact CB-CG2 3.91Å |
| 438 | G | 95.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -55.9 | -45.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G434 L440 G442 S487 | G434-G438 PolarHBondContact O-N 3.31Å; G438-L440 PolarHBondContact O-N 3.25Å; G438-G442 PolarHBondContact O-N 2.85Å; G438-S487 WeakPolarHBondContact CA-O 3.49Å; G438-S487 WeakPolarHBondContact O-CB 3.08Å; G438-S487 PolarHBondContact O-OG 3.45Å; G438-S487 VanDerWaalsContact O-OG 3.12Å |
| 439 | Y | 95.1 | Very high | 91.7 | Very high | 21 Ų | 21 | 32 Ų | 32 | 8% | 0.082 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -56.7 | -51 | 174.9 | -177.8 | -75.8 | 0 | 0 | 0 | 112.2 | M126 L129 L130 P133 I416 A435 I436 A437 L443 | M126-Y439 HydrophobicContact CE-CD2 4.21Å; M126-Y439 HydrophobicContact CE-CG 4.38Å; L129-Y439 HydrophobicContact CD1-CE1 4.37Å; L129-Y439 HydrophobicContact CD2-CD1 4.14Å; L129-Y439 HydrophobicContact CD2-CD2 4.22Å; L129-Y439 HydrophobicContact CD2-CE1 4.27Å; L129-Y439 HydrophobicContact CD2-CE2 4.32Å; L129-Y439 HydrophobicContact CD2-CG 4.16Å; L129-Y439 HydrophobicContact CG-CD2 4.25Å; L129-Y439 HydrophobicContact CG-CE1 4.33Å; L129-Y439 HydrophobicContact CG-CE2 3.91Å; L130-Y439 HydrophobicContact CD2-CD2 3.94Å; L130-Y439 HydrophobicContact CD2-CE2 4.45Å; P133-Y439 HydrophobicContact CG-CE2 4.03Å; I416-Y439 HydrophobicContact CD1-CE2 4.33Å; I416-Y439 HydrophobicContact CG2-CD2 3.26Å; I416-Y439 HydrophobicContact CG2-CE2 3.6Å; I416-Y439 HydrophobicContact CG2-CG 4.09Å; A435-Y439 WeakPolarHBondContact O-CB 3.46Å; A435-Y439 PolarHBondContact O-N 3.29Å; I436-Y439 WeakPolarHBondContact O-CB 3.32Å; I436-Y439 PolarHBondContact O-N 2.93Å; A437-Y439 VanDerWaalsContact C-N 3.32Å; A437-Y439 PolarHBondContact O-N 2.8Å; Y439-L443 HydrophobicContact CE1-CD2 3.82Å; Y439-L443 VanDerWaalsContact O-CB 3.24Å; Y439-L443 WeakPolarHBondContact O-CB 3.45Å; Y439-L443 PolarHBondContact O-N 2.87Å |
| 440 | L | 95.1 | Very high | 91.6 | Very high | 87 Ų | 87 | 30.6 Ų | 30.6 | 46% | 0.455 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -66 | -48.1 | -176.5 | -70.6 | 174.8 | 0 | 0 | 0 | 111.9 | I436 A437 G438 L443 I444 | I436-L440 HydrophobicContact CG2-CD1 3.89Å; I436-L440 HydrophobicContact CG2-CG 4.32Å; I436-L440 WeakPolarHBondContact O-CG 3.26Å; I436-L440 PolarHBondContact O-N 2.56Å; A437-L440 PolarHBondContact O-N 2.77Å; G438-L440 PolarHBondContact O-N 3.25Å; L440-L443 PolarHBondContact O-N 3.4Å; L440-I444 WeakPolarHBondContact O-CB 3.39Å; L440-I444 WeakPolarHBondContact O-CD1 3.29Å; L440-I444 WeakPolarHBondContact O-CG1 3.34Å; L440-I444 PolarHBondContact O-N 3.43Å |
| 441 | F | 94.3 | Very high | 91 | Very high | 111 Ų | 111 | 30.9 Ų | 30.9 | 49% | 0.487 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -65.5 | -41.4 | 179.6 | -82.2 | -83.9 | 0 | 0 | 0 | 111.8 | A437 L445 T486 T490 | A437-F441 VanDerWaalsContact O-CD2 3.28Å; A437-F441 WeakPolarHBondContact O-CD2 3.38Å; A437-F441 PolarHBondContact O-N 3.02Å; F441-L445 WeakPolarHBondContact O-CB 3.48Å; F441-L445 WeakPolarHBondContact O-CG 3.21Å; F441-L445 PolarHBondContact O-N 3.24Å; F441-T486 HydrophobicContact CB-CG2 4.35Å; F441-T490 HydrophobicContact CD2-CG2 3.74Å; F441-T490 HydrophobicContact CE2-CG2 4.32Å; F441-T490 HydrophobicContact CG-CG2 4.33Å |
| 442 | G | 93.2 | Very high | 90 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.3 | -47.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G438 R446 | G438-G442 PolarHBondContact O-N 2.85Å; G442-R446 VanDerWaalsContact O-CB 3.3Å; G442-R446 WeakPolarHBondContact O-CB 3.4Å; G442-R446 PolarHBondContact O-N 3.49Å |
| 443 | L | 91.6 | Very high | 88.9 | Confident | 45 Ų | 45 | 36.8 Ų | 36.8 | 24% | 0.236 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.8 | -42.4 | 179.4 | -175.4 | 65.9 | 0 | 0 | 0 | 112.3 | L412 I416 Y439 L440 R446 I447 | L412-L443 HydrophobicContact CD2-CD1 4.24Å; I416-L443 HydrophobicContact CD1-CB 4.18Å; I416-L443 HydrophobicContact CD1-CD1 3.97Å; Y439-L443 HydrophobicContact CE1-CD2 3.82Å; Y439-L443 VanDerWaalsContact O-CB 3.24Å; Y439-L443 WeakPolarHBondContact O-CB 3.45Å; Y439-L443 PolarHBondContact O-N 2.87Å; L440-L443 PolarHBondContact O-N 3.4Å; L443-R446 PolarHBondContact O-N 3.08Å; L443-I447 HydrophobicContact CD1-CD1 3.89Å; L443-I447 HydrophobicContact CD1-CG1 4.21Å; L443-I447 HydrophobicContact CD2-CD1 4.44Å; L443-I447 HydrophobicContact CG-CD1 3.81Å; L443-I447 HydrophobicContact CG-CG1 4.44Å; L443-I447 WeakPolarHBondContact O-CG1 3.36Å; L443-I447 PolarHBondContact O-N 3.48Å |
| 444 | I | 92.4 | Very high | 87.8 | Confident | 96 Ų | 96 | 39.6 Ų | 39.6 | 49% | 0.492 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -61.5 | -50.8 | 177.7 | -72 | 165.1 | 0 | 0 | 0 | 110.2 | L440 R446 I447 T448 | L440-I444 WeakPolarHBondContact O-CB 3.39Å; L440-I444 WeakPolarHBondContact O-CD1 3.29Å; L440-I444 WeakPolarHBondContact O-CG1 3.34Å; L440-I444 PolarHBondContact O-N 3.43Å; I444-R446 PolarHBondContact O-N 3.26Å; I444-I447 PolarHBondContact O-N 3.09Å; I444-T448 HydrophobicContact CG2-CG2 4.2Å; I444-T448 WeakPolarHBondContact O-CB 3.33Å; I444-T448 WeakPolarHBondContact O-CG2 3.49Å; I444-T448 PolarHBondContact O-N 2.75Å; I444-T448 PolarHBondContact O-OG1 3.42Å |
| 445 | L | 91.1 | Very high | 86.7 | Confident | 31 Ų | 31 | 47.4 Ų | 47.4 | 16% | 0.162 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.9 | -36.7 | 178.4 | -72.1 | 179.2 | 0 | 0 | 0 | 111.7 | F441 T448 G449 I460 A483 T486 | F441-L445 WeakPolarHBondContact O-CB 3.48Å; F441-L445 WeakPolarHBondContact O-CG 3.21Å; F441-L445 PolarHBondContact O-N 3.24Å; L445-T448 WeakPolarHBondContact CA-OG1 3.48Å; L445-T448 PolarHBondContact O-OG1 2.89Å; L445-G449 PolarHBondContact O-N 3.13Å; L445-G449 VanDerWaalsContact O-N 3.09Å; L445-I460 HydrophobicContact CD2-CD1 4.39Å; L445-A483 HydrophobicContact CB-CB 3.86Å; L445-T486 HydrophobicContact CD1-CG2 3.64Å |
| 446 | R | 89.3 | Confident | 85.9 | Confident | 13 Ų | 13 | 50.7 Ų | 50.7 | 5% | 0.049 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.5 | -49.5 | 177.6 | 178.8 | 48.6 | -175 | 100.9 | 2.2 | 113.2 | D411 I415 G442 L443 I444 G449 G450 E451 | D411-R446 IonicContact OD1-CZ 3.46Å; D411-R446 IonicContact OD1-NE 3.82Å; D411-R446 PolarHBondContact OD1-NE 3.4Å; D411-R446 VanDerWaalsContact OD1-NE 3.12Å; D411-R446 IonicContact OD1-NH2 2.59Å; D411-R446 IonicContact OD2-CZ 3.23Å; D411-R446 IonicContact OD2-NE 3.12Å; D411-R446 PolarHBondContact OD2-NE 3.44Å; D411-R446 IonicContact OD2-NH2 3.08Å; D411-R446 PolarHBondContact OD2-NH2 3.38Å; I415-R446 HydrophobicContact CD1-CB 3.92Å; I415-R446 HydrophobicContact CD1-CG 3.65Å; I415-R446 HydrophobicContact CG2-CB 4.39Å; G442-R446 VanDerWaalsContact O-CB 3.3Å; G442-R446 WeakPolarHBondContact O-CB 3.4Å; G442-R446 PolarHBondContact O-N 3.49Å; L443-R446 PolarHBondContact O-N 3.08Å; I444-R446 PolarHBondContact O-N 3.26Å; R446-G449 PolarHBondContact O-N 2.9Å; R446-G450 PolarHBondContact NH1-O 3.43Å; R446-E451 IonicContact CZ-OE2 3.12Å; R446-E451 IonicContact NH1-OE2 2.61Å; R446-E451 IonicContact NH2-OE2 3.88Å; R446-E451 PolarHBondContact NH2-OE2 3.48Å |
| 447 | I | 87.5 | Confident | 85 | Confident | 90 Ų | 90 | 54.3 Ų | 54.3 | 46% | 0.462 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -65.3 | -43.8 | -179.6 | -67.5 | 171.4 | 0 | 0 | 0 | 110.1 | L443 I444 G449 G450 L456 | L443-I447 HydrophobicContact CD1-CD1 3.89Å; L443-I447 HydrophobicContact CD1-CG1 4.21Å; L443-I447 HydrophobicContact CD2-CD1 4.44Å; L443-I447 HydrophobicContact CG-CD1 3.81Å; L443-I447 HydrophobicContact CG-CG1 4.44Å; L443-I447 WeakPolarHBondContact O-CG1 3.36Å; L443-I447 PolarHBondContact O-N 3.48Å; I444-I447 PolarHBondContact O-N 3.09Å; I447-G449 PolarHBondContact O-N 3.27Å; I447-G450 PolarHBondContact O-N 3.49Å; I447-L456 WeakPolarHBondContact O-CD2 3.35Å |
| 448 | T | 86.9 | Confident | 84.4 | Confident | 21 Ų | 21 | 53.8 Ų | 53.8 | 13% | 0.129 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -68.1 | -21.9 | -179.3 | 54.9 | 0 | 0 | 0 | 0 | 113.7 | I444 L445 G450 L459 I460 | I444-T448 HydrophobicContact CG2-CG2 4.2Å; I444-T448 WeakPolarHBondContact O-CB 3.33Å; I444-T448 WeakPolarHBondContact O-CG2 3.49Å; I444-T448 PolarHBondContact O-N 2.75Å; I444-T448 PolarHBondContact O-OG1 3.42Å; L445-T448 WeakPolarHBondContact CA-OG1 3.48Å; L445-T448 PolarHBondContact O-OG1 2.89Å; T448-G450 PolarHBondContact O-N 3.46Å; T448-L459 HydrophobicContact CG2-CB 4.33Å; T448-L459 HydrophobicContact CG2-CD2 4.03Å; T448-L459 PolarHBondContact O-N 2.93Å; T448-I460 HydrophobicContact CG2-CD1 4.47Å; T448-I460 PolarHBondContact O-N 2.94Å; T448-I460 WeakPolarHBondContact OG1-CD1 3.34Å |
| 449 | G | 83.2 | Confident | 83.8 | Confident | 1 Ų | 1 | 60.1 Ų | 60.1 | 1% | 0.01 | 29% | 0.291 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.7 | -12.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 115 | L445 R446 I447 P458 Q475 | L445-G449 PolarHBondContact O-N 3.13Å; L445-G449 VanDerWaalsContact O-N 3.09Å; R446-G449 PolarHBondContact O-N 2.9Å; I447-G449 PolarHBondContact O-N 3.27Å; G449-P458 WeakPolarHBondContact O-CB 3.45Å; G449-Q475 VanDerWaalsContact O-CG 3.3Å; G449-Q475 WeakPolarHBondContact O-CG 3.33Å; G449-Q475 PolarHBondContact O-NE2 3.09Å; G449-Q475 VanDerWaalsContact O-NE2 3.13Å |
| 450 | G | 81.3 | Confident | 83.2 | Confident | 2 Ų | 2 | 62.2 Ų | 62.2 | 2% | 0.021 | 30% | 0.303 | C | S | . | . | trans | 82.3 | 162.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | R446 I447 T448 L456 | R446-G450 PolarHBondContact NH1-O 3.43Å; I447-G450 PolarHBondContact O-N 3.49Å; T448-G450 PolarHBondContact O-N 3.46Å; G450-L456 CarbonylContact C-O 3.54Å; G450-L456 VanDerWaalsContact CA-O 3.24Å; G450-L456 WeakPolarHBondContact CA-O 3.46Å | ||
| 451 | E | 78.8 | Confident | 82.6 | Confident | 7 Ų | 7 | 64.1 Ų | 64.1 | 3% | 0.033 | 31% | 0.305 | C | S | . | . | B | Isolated β-bridge | trans | -146.8 | 103.6 | 172.1 | -178.2 | 47.2 | -104.8 | 0 | 0 | 110.5 | L408 R446 Y453 L454 Y455 L456 | L408-E451 HydrophobicContact CD2-CG 3.97Å; R446-E451 IonicContact CZ-OE2 3.12Å; R446-E451 IonicContact NH1-OE2 2.61Å; R446-E451 IonicContact NH2-OE2 3.88Å; R446-E451 PolarHBondContact NH2-OE2 3.48Å; E451-Y453 VanDerWaalsContact C-N 3.26Å; E451-Y453 PolarHBondContact O-N 3.36Å; E451-Y453 WeakPolarHBondContact OE1-CD2 3.33Å; E451-Y453 PolarHBondContact OE1-N 2.84Å; E451-Y453 VanDerWaalsContact OE1-N 3.12Å; E451-L454 HydrophobicContact CB-CB 4.27Å; E451-L454 HydrophobicContact CB-CD1 4.48Å; E451-L454 HydrophobicContact CG-CB 4.03Å; E451-L454 HydrophobicContact CG-CD1 4.03Å; E451-L454 HydrophobicContact CG-CG 3.87Å; E451-L454 PolarHBondContact O-N 3.34Å; E451-L454 VanDerWaalsContact O-N 3.12Å; E451-Y455 PolarHBondContact O-N 3.34Å; E451-L456 HydrophobicContact CB-CB 4.24Å; E451-L456 PolarHBondContact N-O 3.26Å; E451-L456 PolarHBondContact O-N 2.98Å |
| 452 | P | 71.5 | Confident | 82.1 | Confident | 42 Ų | 42 | 60.1 Ų | 60.1 | 27% | 0.273 | 29% | 0.287 | S | S | . | . | G | 310 helix | trans | -53.5 | -39.5 | 179.6 | -29.2 | 36.2 | 0 | 0 | 0 | 113.9 | L454 Y455 I472 I474 | P452-L454 VanDerWaalsContact C-N 3.25Å; P452-L454 PolarHBondContact O-N 3.27Å; P452-Y455 PolarHBondContact O-N 3.08Å; P452-Y455 VanDerWaalsContact O-N 3.14Å; P452-I472 HydrophobicContact CB-CG2 3.78Å; P452-I472 HydrophobicContact CG-CG2 4.2Å; P452-I474 HydrophobicContact CG-CG1 4.27Å |
| 453 | Y | 68.6 | Low | 81.4 | Confident | 100 Ų | 100 | 64.8 Ų | 64.8 | 39% | 0.392 | 32% | 0.318 | S | S | . | . | G | 310 helix | trans | -69.4 | -22.5 | -177.7 | -62.7 | -66.7 | 0 | 0 | 0 | 113.8 | E451 | E451-Y453 VanDerWaalsContact C-N 3.26Å; E451-Y453 PolarHBondContact O-N 3.36Å; E451-Y453 WeakPolarHBondContact OE1-CD2 3.33Å; E451-Y453 PolarHBondContact OE1-N 2.84Å; E451-Y453 VanDerWaalsContact OE1-N 3.12Å |
| 454 | L | 70 | Confident | 80.5 | Confident | 96 Ų | 96 | 64.9 Ų | 64.9 | 50% | 0.503 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -102.4 | 8.7 | 176.9 | -63.2 | 178.8 | 0 | 0 | 0 | 112.3 | L408 E451 P452 L456 | L408-L454 HydrophobicContact CD1-CD1 4.23Å; L408-L454 HydrophobicContact CD1-CD2 3.9Å; L408-L454 HydrophobicContact CD1-CG 3.97Å; L408-L454 HydrophobicContact CD2-CD1 3.82Å; L408-L454 HydrophobicContact CD2-CG 4.28Å; E451-L454 HydrophobicContact CB-CB 4.27Å; E451-L454 HydrophobicContact CB-CD1 4.48Å; E451-L454 HydrophobicContact CG-CB 4.03Å; E451-L454 HydrophobicContact CG-CD1 4.03Å; E451-L454 HydrophobicContact CG-CG 3.87Å; E451-L454 PolarHBondContact O-N 3.34Å; E451-L454 VanDerWaalsContact O-N 3.12Å; P452-L454 VanDerWaalsContact C-N 3.25Å; P452-L454 PolarHBondContact O-N 3.27Å; L454-L456 HydrophobicContact CB-CB 4.43Å; L454-L456 PolarHBondContact O-N 3.01Å; L454-L456 VanDerWaalsContact O-N 3.15Å |
| 455 | Y | 71.1 | Confident | 79.7 | Confident | 164 Ų | 164 | 61.9 Ų | 61.9 | 64% | 0.643 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.7 | 28.6 | -172.5 | -58.8 | -83.1 | 0 | 0 | 0 | 113.2 | E451 P452 Q457 I472 | E451-Y455 PolarHBondContact O-N 3.34Å; P452-Y455 PolarHBondContact O-N 3.08Å; P452-Y455 VanDerWaalsContact O-N 3.14Å; Y455-Q457 PolarHBondContact O-N 2.99Å; Y455-I472 HydrophobicContact CD1-CD1 3.64Å; Y455-I472 HydrophobicContact CE1-CD1 3.76Å |
| 456 | L | 76 | Confident | 79 | Confident | 68 Ų | 68 | 63.7 Ų | 63.7 | 36% | 0.356 | 32% | 0.322 | S | S | . | . | B | Isolated β-bridge | trans | -91 | 107.5 | -178.1 | -164.7 | 143.5 | 0 | 0 | 0 | 109 | I447 G450 E451 L454 | I447-L456 WeakPolarHBondContact O-CD2 3.35Å; G450-L456 CarbonylContact C-O 3.54Å; G450-L456 VanDerWaalsContact CA-O 3.24Å; G450-L456 WeakPolarHBondContact CA-O 3.46Å; E451-L456 HydrophobicContact CB-CB 4.24Å; E451-L456 PolarHBondContact N-O 3.26Å; E451-L456 PolarHBondContact O-N 2.98Å; L454-L456 HydrophobicContact CB-CB 4.43Å; L454-L456 PolarHBondContact O-N 3.01Å; L454-L456 VanDerWaalsContact O-N 3.15Å |
| 457 | Q | 77.8 | Confident | 78.3 | Confident | 130 Ų | 130 | 66.5 Ų | 66.5 | 61% | 0.607 | 34% | 0.341 | S | S | * | . | trans | -68.6 | 141.2 | -178.9 | -70.4 | -173 | -23.2 | 0 | 0 | 111.5 | Y455 | Y455-Q457 PolarHBondContact O-N 2.99Š| ||
| 458 | P | 81.9 | Confident | 77.4 | Confident | 5 Ų | 5 | 65.1 Ų | 65.1 | 3% | 0.032 | 34% | 0.335 | C | S | . | . | trans | -67.4 | 135 | 176.2 | 27.4 | -32.7 | 0 | 0 | 0 | 111.2 | G449 Y461 Y473 | G449-P458 WeakPolarHBondContact O-CB 3.45Å; P458-Y461 HydrophobicContact CG-CD1 4.3Å; P458-Y461 HydrophobicContact CG-CE1 3.98Å; P458-Y461 PolarHBondContact O-OH 3.32Å; P458-Y473 VanDerWaalsContact CG-CB 3.44Å; P458-Y473 HydrophobicContact CG-CG 4.23Å | ||
| 459 | L | 83.4 | Confident | 76.3 | Confident | 133 Ų | 133 | 72.9 Ų | 72.9 | 70% | 0.696 | 37% | 0.37 | S | S | * | . | S | Bend | trans | -86.3 | -36.7 | 167.6 | -173.1 | 68.5 | 0 | 0 | 0 | 110.6 | T448 | T448-L459 HydrophobicContact CG2-CB 4.33Å; T448-L459 HydrophobicContact CG2-CD2 4.03Å; T448-L459 PolarHBondContact O-N 2.93Å |
| 460 | I | 82.4 | Confident | 75.3 | Confident | 64 Ų | 64 | 78.6 Ų | 78.6 | 33% | 0.328 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -100.4 | 114.5 | 175.1 | -61.4 | 175.8 | 0 | 0 | 0 | 108.4 | L445 T448 Y462 Q475 | L445-I460 HydrophobicContact CD2-CD1 4.39Å; T448-I460 HydrophobicContact CG2-CD1 4.47Å; T448-I460 PolarHBondContact O-N 2.94Å; T448-I460 WeakPolarHBondContact OG1-CD1 3.34Å; I460-Y462 HydrophobicContact CB-CE2 3.99Å; I460-Y462 HydrophobicContact CG2-CD1 4.31Å; I460-Y462 HydrophobicContact CG2-CD2 3.95Å; I460-Y462 HydrophobicContact CG2-CE1 3.98Å; I460-Y462 HydrophobicContact CG2-CE2 3.59Å; I460-Y462 HydrophobicContact CG2-CG 4.29Å; I460-Y462 PolarHBondContact O-N 2.87Å; I460-Q475 PolarHBondContact O-NE2 3.3Å |
| 461 | Y | 83.1 | Confident | 74.5 | Confident | 127 Ų | 127 | 84.2 Ų | 84.2 | 50% | 0.498 | 43% | 0.43 | S | S | . | . | trans | -86.8 | 102.6 | 174 | -61.5 | -90.5 | 0 | 0 | 0 | 108.5 | P458 Y473 | P458-Y461 HydrophobicContact CG-CD1 4.3Å; P458-Y461 HydrophobicContact CG-CE1 3.98Å; P458-Y461 PolarHBondContact O-OH 3.32Å; Y461-Y473 HydrophobicContact CD1-CD1 4.2Å; Y461-Y473 HydrophobicContact CD1-CE1 4.44Å; Y461-Y473 HydrophobicContact CD1-CG 4.46Å; Y461-Y473 AromaticContact CE1-CD1 3.87Å; Y461-Y473 HydrophobicContact CE1-CD1 3.87Å; Y461-Y473 AromaticContact CE1-CD2 3.94Å; Y461-Y473 HydrophobicContact CE1-CD2 3.94Å; Y461-Y473 AromaticContact CE1-CE1 4Å; Y461-Y473 HydrophobicContact CE1-CE1 4Å; Y461-Y473 HydrophobicContact CE1-CE2 4.06Å; Y461-Y473 AromaticContact CE1-CG 3.83Å; Y461-Y473 HydrophobicContact CE1-CG 3.83Å | ||
| 462 | Y | 83 | Confident | 74 | Confident | 28 Ų | 28 | 85 Ų | 85 | 11% | 0.11 | 43% | 0.434 | C | S | . | . | trans | -77.2 | 158.8 | 176.1 | -69.4 | -84.2 | 0 | 0 | 0 | 110.6 | I460 G464 C465 F477 F479 L482 | I460-Y462 HydrophobicContact CB-CE2 3.99Å; I460-Y462 HydrophobicContact CG2-CD1 4.31Å; I460-Y462 HydrophobicContact CG2-CD2 3.95Å; I460-Y462 HydrophobicContact CG2-CE1 3.98Å; I460-Y462 HydrophobicContact CG2-CE2 3.59Å; I460-Y462 HydrophobicContact CG2-CG 4.29Å; I460-Y462 PolarHBondContact O-N 2.87Å; Y462-G464 PolarHBondContact O-N 2.95Å; Y462-C465 WeakPolarHBondContact O-CB 3.42Å; Y462-C465 PolarHBondContact O-N 3.27Å; Y462-F477 AromaticContact CD1-CD1 3.68Å; Y462-F477 HydrophobicContact CD1-CD1 3.68Å; Y462-F477 HydrophobicContact CD1-CE1 4.02Å; Y462-F477 HydrophobicContact CD1-CG 4.25Å; Y462-F477 HydrophobicContact CE1-CD1 4.36Å; Y462-F477 HydrophobicContact CE1-CE1 4.37Å; Y462-F477 HydrophobicContact CG-CB 4.35Å; Y462-F477 AromaticContact CG-CD1 3.91Å; Y462-F477 HydrophobicContact CG-CD1 3.91Å; Y462-F477 HydrophobicContact CG-CG 4.3Å; Y462-F479 HydrophobicContact CD2-CB 3.95Å; Y462-F479 HydrophobicContact CE2-CB 3.88Å; Y462-F479 HydrophobicContact CG-CB 4.44Å; Y462-L482 HydrophobicContact CE1-CD2 3.68Å | ||
| 463 | P | 78.7 | Confident | 74.1 | Confident | 98 Ų | 98 | 86.9 Ų | 86.9 | 64% | 0.636 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.7 | 131.7 | -179.3 | -26.7 | 35.2 | 0 | 0 | 0 | 112.5 | ||
| 464 | G | 71.9 | Confident | 74.4 | Confident | 47 Ų | 47 | 84 Ų | 84 | 49% | 0.485 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 83.1 | 13.9 | -180 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y462 R476 | Y462-G464 PolarHBondContact O-N 2.95Å; G464-R476 WeakPolarHBondContact O-CB 3.33Å; G464-R476 VanDerWaalsContact O-CD 3.32Å; G464-R476 WeakPolarHBondContact O-CD 3.39Å; G464-R476 VanDerWaalsContact O-CG 3.3Å; G464-R476 WeakPolarHBondContact O-CG 3.17Å |
| 465 | C | 76.7 | Confident | 74.9 | Confident | 33 Ų | 33 | 80.1 Ų | 80.1 | 22% | 0.223 | 41% | 0.406 | C | S | . | . | trans | -63.8 | 134.7 | 170 | -170.6 | 0 | 0 | 0 | 0 | 111.1 | Y462 I474 | Y462-C465 WeakPolarHBondContact O-CB 3.42Å; Y462-C465 PolarHBondContact O-N 3.27Å; C465-I474 WeakPolarHBondContact CA-O 3.36Å; C465-I474 PolarHBondContact SG-O 3.48Å | ||
| 466 | Y | 75.9 | Confident | 75.4 | Confident | 69 Ų | 69 | 75.3 Ų | 75.3 | 27% | 0.271 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 145.4 | 178.8 | 67.8 | -81.3 | 0 | 0 | 0 | 110.5 | Y473 I474 R476 | Y466-Y473 WeakPolarHBondContact O-CA 3.45Å; Y466-I474 HydrophobicContact CD1-CB 4.4Å; Y466-I474 HydrophobicContact CE1-CB 3.83Å; Y466-I474 HydrophobicContact CE1-CG2 3.85Å; Y466-I474 HydrophobicContact CE2-CB 4.24Å; Y466-I474 HydrophobicContact CE2-CD1 4.13Å; Y466-I474 PolarHBondContact N-O 2.84Å; Y466-I474 VanDerWaalsContact N-O 3.16Å; Y466-I474 PolarHBondContact O-N 3.48Å; Y466-R476 HydrophobicContact CD1-CG 3.85Å; Y466-R476 HydrophobicContact CE1-CG 3.67Å |
| 467 | P | 75.6 | Confident | 75.9 | Confident | 71 Ų | 71 | 75.1 Ų | 75.1 | 46% | 0.461 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.7 | 132.7 | 171.6 | 30.9 | -32 | 0 | 0 | 0 | 110 | Y473 | P467-Y473 HydrophobicContact CB-CD1 4.35Å; P467-Y473 HydrophobicContact CB-CE1 4.17Å; P467-Y473 HydrophobicContact CG-CE1 4.49Å |
| 468 | D | 68.6 | Low | 76.4 | Confident | 62 Ų | 62 | 70.4 Ų | 70.4 | 33% | 0.332 | 36% | 0.364 | S | S | . | . | trans | -75.4 | 170.3 | 167 | -170.9 | 24.9 | 0 | 0 | 0 | 111.2 | N470 N471 I472 I474 | D468-N470 PolarHBondContact O-N 2.93Å; D468-N471 WeakPolarHBondContact O-CA 3.31Å; D468-N471 PolarHBondContact O-N 3.48Å; D468-I472 VanDerWaalsContact CB-O 3.26Å; D468-I472 WeakPolarHBondContact CB-O 3.26Å; D468-I472 PolarHBondContact N-O 3.39Å; D468-I474 HydrophobicContact CB-CD1 3.8Å; D468-I474 HydrophobicContact CB-CG1 4.22Å | ||
| 469 | E | 62.7 | Low | 76.7 | Confident | 184 Ų | 184 | 70.8 Ų | 70.8 | 86% | 0.86 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -25.7 | -178.4 | -63.5 | -173.5 | 168.8 | 0 | 0 | 113.4 | ||
| 470 | N | 62.6 | Low | 77.1 | Confident | 121 Ų | 121 | 65.4 Ų | 65.4 | 65% | 0.647 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | 15.1 | 176.8 | -64.2 | -53 | 0 | 0 | 0 | 114.2 | D468 I472 | D468-N470 PolarHBondContact O-N 2.93Å; N470-I472 HydrophobicContact CB-CD1 4.11Å; N470-I472 HydrophobicContact CB-CG1 4.14Å; N470-I472 PolarHBondContact O-N 2.96Å |
| 471 | N | 64.1 | Low | 77.6 | Confident | 119 Ų | 119 | 63.3 Ų | 63.3 | 64% | 0.636 | 33% | 0.327 | S | S | * | . | S | Bend | trans | 57.3 | 25.6 | -170.8 | -66.9 | -55.7 | 0 | 0 | 0 | 114.1 | D468 | D468-N471 WeakPolarHBondContact O-CA 3.31Å; D468-N471 PolarHBondContact O-N 3.48Å |
| 472 | I | 68.6 | Low | 78.2 | Confident | 23 Ų | 23 | 60.1 Ų | 60.1 | 12% | 0.118 | 32% | 0.318 | C | S | . | . | P | Polyproline II helix | trans | -91.4 | 121.5 | 173.9 | -59 | 174.8 | 0 | 0 | 0 | 107.6 | P452 Y455 D468 N470 I474 | P452-I472 HydrophobicContact CB-CG2 3.78Å; P452-I472 HydrophobicContact CG-CG2 4.2Å; Y455-I472 HydrophobicContact CD1-CD1 3.64Å; Y455-I472 HydrophobicContact CE1-CD1 3.76Å; D468-I472 VanDerWaalsContact CB-O 3.26Å; D468-I472 WeakPolarHBondContact CB-O 3.26Å; D468-I472 PolarHBondContact N-O 3.39Å; N470-I472 HydrophobicContact CB-CD1 4.11Å; N470-I472 HydrophobicContact CB-CG1 4.14Å; N470-I472 PolarHBondContact O-N 2.96Å; I472-I474 PolarHBondContact O-N 3.19Å |
| 473 | Y | 72.7 | Confident | 78.7 | Confident | 83 Ų | 83 | 58.8 Ų | 58.8 | 33% | 0.325 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.5 | 121 | -178.4 | -78.3 | -84.5 | 0 | 0 | 0 | 111.4 | P458 Y461 Y466 P467 | P458-Y473 VanDerWaalsContact CG-CB 3.44Å; P458-Y473 HydrophobicContact CG-CG 4.23Å; Y461-Y473 HydrophobicContact CD1-CD1 4.2Å; Y461-Y473 HydrophobicContact CD1-CE1 4.44Å; Y461-Y473 HydrophobicContact CD1-CG 4.46Å; Y461-Y473 AromaticContact CE1-CD1 3.87Å; Y461-Y473 HydrophobicContact CE1-CD1 3.87Å; Y461-Y473 AromaticContact CE1-CD2 3.94Å; Y461-Y473 HydrophobicContact CE1-CD2 3.94Å; Y461-Y473 AromaticContact CE1-CE1 4Å; Y461-Y473 HydrophobicContact CE1-CE1 4Å; Y461-Y473 HydrophobicContact CE1-CE2 4.06Å; Y461-Y473 AromaticContact CE1-CG 3.83Å; Y461-Y473 HydrophobicContact CE1-CG 3.83Å; Y466-Y473 WeakPolarHBondContact O-CA 3.45Å; P467-Y473 HydrophobicContact CB-CD1 4.35Å; P467-Y473 HydrophobicContact CB-CE1 4.17Å; P467-Y473 HydrophobicContact CG-CE1 4.49Å |
| 474 | I | 74.8 | Confident | 79.5 | Confident | 40 Ų | 40 | 54.7 Ų | 54.7 | 21% | 0.205 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.8 | 130.4 | 176.2 | -59.4 | 176.1 | 0 | 0 | 0 | 109.2 | P452 C465 Y466 D468 I472 | P452-I474 HydrophobicContact CG-CG1 4.27Å; C465-I474 WeakPolarHBondContact CA-O 3.36Å; C465-I474 PolarHBondContact SG-O 3.48Å; Y466-I474 HydrophobicContact CD1-CB 4.4Å; Y466-I474 HydrophobicContact CE1-CB 3.83Å; Y466-I474 HydrophobicContact CE1-CG2 3.85Å; Y466-I474 HydrophobicContact CE2-CB 4.24Å; Y466-I474 HydrophobicContact CE2-CD1 4.13Å; Y466-I474 PolarHBondContact N-O 2.84Å; Y466-I474 VanDerWaalsContact N-O 3.16Å; Y466-I474 PolarHBondContact O-N 3.48Å; D468-I474 HydrophobicContact CB-CD1 3.8Å; D468-I474 HydrophobicContact CB-CG1 4.22Å; I472-I474 PolarHBondContact O-N 3.19Å |
| 475 | Q | 81 | Confident | 80.7 | Confident | 13 Ų | 13 | 55.7 Ų | 55.7 | 6% | 0.061 | 28% | 0.279 | C | S | . | . | P | Polyproline II helix | trans | -86.9 | 125.6 | 178.2 | -58.2 | -73.3 | 0.7 | 0 | 0 | 110.3 | G449 I460 F479 | G449-Q475 VanDerWaalsContact O-CG 3.3Å; G449-Q475 WeakPolarHBondContact O-CG 3.33Å; G449-Q475 PolarHBondContact O-NE2 3.09Å; G449-Q475 VanDerWaalsContact O-NE2 3.13Å; I460-Q475 PolarHBondContact O-NE2 3.3Å; Q475-F479 HydrophobicContact CB-CD1 3.79Å; Q475-F479 HydrophobicContact CB-CE1 3.99Å; Q475-F479 HydrophobicContact CG-CD1 4.16Å; Q475-F479 HydrophobicContact CG-CE1 4.22Å |
| 476 | R | 82.6 | Confident | 81.6 | Confident | 63 Ų | 63 | 55.9 Ų | 55.9 | 24% | 0.238 | 28% | 0.279 | C | S | . | . | trans | -89.3 | -29.2 | 171.1 | -68.9 | -175.2 | 179.3 | 172.8 | 0.1 | 113.4 | Y238 T239 G464 Y466 | Y238-R476 WeakPolarHBondContact CB-O 3.27Å; T239-R476 WeakPolarHBondContact OG1-CA 3.47Å; T239-R476 PolarHBondContact OG1-O 3.15Å; T239-R476 VanDerWaalsContact OG1-O 3.13Å; G464-R476 WeakPolarHBondContact O-CB 3.33Å; G464-R476 VanDerWaalsContact O-CD 3.32Å; G464-R476 WeakPolarHBondContact O-CD 3.39Å; G464-R476 VanDerWaalsContact O-CG 3.3Å; G464-R476 WeakPolarHBondContact O-CG 3.17Å; Y466-R476 HydrophobicContact CD1-CG 3.85Å; Y466-R476 HydrophobicContact CE1-CG 3.67Å | ||
| 477 | F | 85.3 | Confident | 82.6 | Confident | 65 Ų | 65 | 52.6 Ų | 52.6 | 29% | 0.285 | 27% | 0.266 | S | S | . | . | S | Bend | trans | -63.5 | 141.9 | 176.7 | -176.6 | -92.2 | 0 | 0 | 0 | 110.5 | Y462 F479 L482 | Y462-F477 AromaticContact CD1-CD1 3.68Å; Y462-F477 HydrophobicContact CD1-CD1 3.68Å; Y462-F477 HydrophobicContact CD1-CE1 4.02Å; Y462-F477 HydrophobicContact CD1-CG 4.25Å; Y462-F477 HydrophobicContact CE1-CD1 4.36Å; Y462-F477 HydrophobicContact CE1-CE1 4.37Å; Y462-F477 HydrophobicContact CG-CB 4.35Å; Y462-F477 AromaticContact CG-CD1 3.91Å; Y462-F477 HydrophobicContact CG-CD1 3.91Å; Y462-F477 HydrophobicContact CG-CG 4.3Å; F477-F479 HydrophobicContact CD1-CB 4.03Å; F477-F479 PolarHBondContact O-N 3.22Å; F477-L482 HydrophobicContact CE1-CB 3.93Å; F477-L482 HydrophobicContact CE1-CD2 3.64Å; F477-L482 HydrophobicContact CE1-CG 4.32Å; F477-L482 HydrophobicContact CZ-CD2 4.19Å |
| 478 | P | 89 | Confident | 83.6 | Confident | 31 Ų | 31 | 50.9 Ų | 50.9 | 20% | 0.201 | 25% | 0.252 | C | S | . | . | trans | -76.1 | 65.5 | -177.9 | 33.4 | -34.5 | 0 | 0 | 0 | 111.1 | D242 K480 T481 L482 | D242-P478 HydrophobicContact CB-CB 3.68Å; D242-P478 VanDerWaalsContact OD2-CA 3.27Å; D242-P478 WeakPolarHBondContact OD2-CA 3.3Å; P478-K480 VanDerWaalsContact C-N 3.31Å; P478-K480 PolarHBondContact O-N 3.39Å; P478-T481 PolarHBondContact O-N 3.2Å; P478-L482 PolarHBondContact O-N 3.01Å; P478-L482 VanDerWaalsContact O-N 3.08Å | ||
| 479 | F | 89.1 | Confident | 84.9 | Confident | 13 Ų | 13 | 53 Ų | 53 | 6% | 0.057 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -71.7 | -25.6 | -170 | 79.9 | -84.2 | 0 | 0 | 0 | 112.4 | D242 Y462 Q475 F477 L482 A483 | D242-F479 PolarHBondContact OD2-N 3.23Å; Y462-F479 HydrophobicContact CD2-CB 3.95Å; Y462-F479 HydrophobicContact CE2-CB 3.88Å; Y462-F479 HydrophobicContact CG-CB 4.44Å; Q475-F479 HydrophobicContact CB-CD1 3.79Å; Q475-F479 HydrophobicContact CB-CE1 3.99Å; Q475-F479 HydrophobicContact CG-CD1 4.16Å; Q475-F479 HydrophobicContact CG-CE1 4.22Å; F477-F479 HydrophobicContact CD1-CB 4.03Å; F477-F479 PolarHBondContact O-N 3.22Å; F479-L482 PolarHBondContact O-N 2.8Å; F479-A483 WeakPolarHBondContact O-CB 3.37Å; F479-A483 PolarHBondContact O-N 2.86Å |
| 480 | K | 91 | Very high | 86.5 | Confident | 20 Ų | 20 | 45.3 Ų | 45.3 | 9% | 0.087 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -70.4 | -44.1 | 178.3 | -60.6 | 169.4 | -179.4 | 149.6 | 0 | 110 | D242 L246 Y407 Y414 I415 P478 L482 A483 M484 | D242-K480 WeakPolarHBondContact OD2-CB 3.47Å; D242-K480 PolarHBondContact OD2-N 3.38Å; L246-K480 HydrophobicContact CD1-CD 3.78Å; Y407-K480 HydrophobicContact CE1-CD 3.9Å; Y407-K480 WeakPolarHBondContact OH-CD 3.3Å; Y407-K480 WeakPolarHBondContact OH-CE 3.46Å; Y407-K480 PolarHBondContact OH-NZ 3.46Å; Y414-K480 HydrophobicContact CD1-CB 4.43Å; Y414-K480 HydrophobicContact CE1-CB 4.3Å; I415-K480 HydrophobicContact CD1-CB 4.13Å; I415-K480 HydrophobicContact CD1-CG 4.34Å; P478-K480 VanDerWaalsContact C-N 3.31Å; P478-K480 PolarHBondContact O-N 3.39Å; K480-L482 VanDerWaalsContact C-N 3.35Å; K480-A483 PolarHBondContact O-N 2.9Å; K480-M484 WeakPolarHBondContact O-CB 3.41Å; K480-M484 PolarHBondContact O-N 2.94Å |
| 481 | T | 93.6 | Very high | 88.1 | Confident | 20 Ų | 20 | 39.5 Ų | 39.5 | 12% | 0.123 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.7 | -40.2 | 172.6 | -63 | 0 | 0 | 0 | 0 | 111.3 | D242 L245 Y414 P478 A483 M484 L485 | D242-T481 WeakPolarHBondContact OD1-CB 3.39Å; D242-T481 PolarHBondContact OD1-N 2.91Å; D242-T481 PolarHBondContact OD1-OG1 3.26Å; L245-T481 HydrophobicContact CD1-CG2 4.05Å; Y414-T481 PolarHBondContact OH-OG1 2.86Å; P478-T481 PolarHBondContact O-N 3.2Å; T481-A483 PolarHBondContact O-N 3.23Å; T481-M484 HydrophobicContact CG2-CE 4.45Å; T481-M484 PolarHBondContact O-N 3.17Å; T481-L485 HydrophobicContact CG2-CD1 4.03Å; T481-L485 HydrophobicContact CG2-CG 4.33Å; T481-L485 WeakPolarHBondContact O-CB 3.26Å; T481-L485 VanDerWaalsContact O-CG 3.29Å; T481-L485 WeakPolarHBondContact O-CG 3.35Å; T481-L485 PolarHBondContact O-N 2.76Å |
| 482 | L | 93.9 | Very high | 89.7 | Confident | 59 Ų | 59 | 35.4 Ų | 35.4 | 31% | 0.309 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -59.8 | -45.9 | 172.5 | 178.8 | 68.6 | 0 | 0 | 0 | 111.8 | Y462 F477 P478 F479 K480 L485 T486 | Y462-L482 HydrophobicContact CE1-CD2 3.68Å; F477-L482 HydrophobicContact CE1-CB 3.93Å; F477-L482 HydrophobicContact CE1-CD2 3.64Å; F477-L482 HydrophobicContact CE1-CG 4.32Å; F477-L482 HydrophobicContact CZ-CD2 4.19Å; P478-L482 PolarHBondContact O-N 3.01Å; P478-L482 VanDerWaalsContact O-N 3.08Å; F479-L482 PolarHBondContact O-N 2.8Å; K480-L482 VanDerWaalsContact C-N 3.35Å; L482-L485 PolarHBondContact O-N 3.3Å; L482-T486 WeakPolarHBondContact O-CB 3.36Å; L482-T486 PolarHBondContact O-N 3.24Å; L482-T486 PolarHBondContact O-OG1 3.49Å |
| 483 | A | 94 | Very high | 91 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.7 | -42.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | I415 L445 F479 K480 T481 T486 S487 | I415-A483 HydrophobicContact CD1-CB 4.29Å; I415-A483 HydrophobicContact CG1-CB 4.41Å; I415-A483 HydrophobicContact CG2-CB 3.81Å; L445-A483 HydrophobicContact CB-CB 3.86Å; F479-A483 WeakPolarHBondContact O-CB 3.37Å; F479-A483 PolarHBondContact O-N 2.86Å; K480-A483 PolarHBondContact O-N 2.9Å; T481-A483 PolarHBondContact O-N 3.23Å; A483-T486 PolarHBondContact O-N 3.4Å; A483-S487 WeakPolarHBondContact O-CB 3.32Å; A483-S487 PolarHBondContact O-N 3.5Å |
| 484 | M | 96.1 | Very high | 92.1 | Very high | 12 Ų | 12 | 37.6 Ų | 37.6 | 6% | 0.059 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.6 | -50.3 | 174.9 | -178.2 | -78.3 | -69.7 | 0 | 0 | 111.6 | Y414 F418 P419 K480 T481 T486 S487 F488 | Y414-M484 HydrophobicContact CD1-CB 4.45Å; Y414-M484 HydrophobicContact CD2-CG 4.07Å; Y414-M484 HydrophobicContact CE1-CB 4.11Å; Y414-M484 HydrophobicContact CE1-CG 4.48Å; Y414-M484 HydrophobicContact CE2-CB 4.26Å; Y414-M484 HydrophobicContact CE2-CE 3.82Å; Y414-M484 HydrophobicContact CE2-CG 3.75Å; Y414-M484 HydrophobicContact CE2-SD 4.48Å; Y414-M484 WeakPolarHBondContact O-CG 3.46Å; Y414-M484 WeakPolarHBondContact OH-CE 3.46Å; F418-M484 HydrophobicContact CD1-CG 4.28Å; F418-M484 HydrophobicContact CD1-SD 4.13Å; F418-M484 HydrophobicContact CE1-SD 4.35Å; P419-M484 HydrophobicContact CG-CG 4.05Å; K480-M484 WeakPolarHBondContact O-CB 3.41Å; K480-M484 PolarHBondContact O-N 2.94Å; T481-M484 HydrophobicContact CG2-CE 4.45Å; T481-M484 PolarHBondContact O-N 3.17Å; M484-T486 VanDerWaalsContact C-N 3.3Å; M484-T486 PolarHBondContact O-N 3.05Å; M484-S487 WeakPolarHBondContact O-CB 3.45Å; M484-S487 PolarHBondContact O-N 3.19Å; M484-F488 PolarHBondContact O-N 3.27Å |
| 485 | L | 96.5 | Very high | 93 | Very high | 69 Ų | 69 | 35.7 Ų | 35.7 | 36% | 0.361 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -62 | -39.6 | 178 | -71.2 | 174 | 0 | 0 | 0 | 111.4 | T481 L482 F488 F489 | T481-L485 HydrophobicContact CG2-CD1 4.03Å; T481-L485 HydrophobicContact CG2-CG 4.33Å; T481-L485 WeakPolarHBondContact O-CB 3.26Å; T481-L485 VanDerWaalsContact O-CG 3.29Å; T481-L485 WeakPolarHBondContact O-CG 3.35Å; T481-L485 PolarHBondContact O-N 2.76Å; L482-L485 PolarHBondContact O-N 3.3Å; L485-F488 WeakPolarHBondContact O-CB 3.43Å; L485-F488 PolarHBondContact O-N 2.95Å; L485-F489 HydrophobicContact CB-CD2 4.29Å; L485-F489 HydrophobicContact CB-CE2 4.22Å; L485-F489 HydrophobicContact CD2-CE2 4.18Å; L485-F489 WeakPolarHBondContact O-CD2 3.46Å; L485-F489 PolarHBondContact O-N 3.47Å |
| 486 | T | 95.9 | Very high | 93.6 | Very high | 37 Ų | 37 | 40.3 Ų | 40.3 | 23% | 0.227 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -65.2 | -41.2 | 176.7 | -56 | 0 | 0 | 0 | 0 | 111.4 | F441 L445 L482 A483 M484 T490 | F441-T486 HydrophobicContact CB-CG2 4.35Å; L445-T486 HydrophobicContact CD1-CG2 3.64Å; L482-T486 WeakPolarHBondContact O-CB 3.36Å; L482-T486 PolarHBondContact O-N 3.24Å; L482-T486 PolarHBondContact O-OG1 3.49Å; A483-T486 PolarHBondContact O-N 3.4Å; M484-T486 VanDerWaalsContact C-N 3.3Å; M484-T486 PolarHBondContact O-N 3.05Å; T486-T490 WeakPolarHBondContact O-CB 3.44Å; T486-T490 PolarHBondContact O-N 3.44Å; T486-T490 PolarHBondContact O-OG1 3.42Å |
| 487 | S | 96.1 | Very high | 94 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -58.8 | -46.5 | 172.8 | 179.9 | 0 | 0 | 0 | 0 | 111 | I415 Q420 G438 A483 M484 N491 | I415-S487 WeakPolarHBondContact O-CB 3.49Å; I415-S487 PolarHBondContact O-OG 3.19Å; Q420-S487 PolarHBondContact NE2-OG 3.22Å; Q420-S487 PolarHBondContact OE1-OG 3.39Å; G438-S487 WeakPolarHBondContact CA-O 3.49Å; G438-S487 WeakPolarHBondContact O-CB 3.08Å; G438-S487 PolarHBondContact O-OG 3.45Å; G438-S487 VanDerWaalsContact O-OG 3.12Å; A483-S487 WeakPolarHBondContact O-CB 3.32Å; A483-S487 PolarHBondContact O-N 3.5Å; M484-S487 WeakPolarHBondContact O-CB 3.45Å; M484-S487 PolarHBondContact O-N 3.19Å; S487-N491 WeakPolarHBondContact O-CB 3.4Å; S487-N491 PolarHBondContact O-N 3.06Å |
| 488 | F | 96.9 | Very high | 94.3 | Very high | 35 Ų | 35 | 39.1 Ų | 39.1 | 15% | 0.154 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.5 | -57.3 | 177.8 | -177 | -113.7 | 0 | 0 | 0 | 113 | P419 L422 I427 M484 L485 T490 N491 I492 | P419-F488 HydrophobicContact CB-CB 3.74Å; P419-F488 HydrophobicContact CB-CD2 4.23Å; P419-F488 HydrophobicContact CB-CG 4.48Å; L422-F488 HydrophobicContact CB-CD2 4.21Å; L422-F488 HydrophobicContact CB-CE2 3.75Å; L422-F488 HydrophobicContact CD1-CD2 4.24Å; L422-F488 HydrophobicContact CD1-CE2 4.12Å; I427-F488 HydrophobicContact CG1-CE2 4.48Å; I427-F488 HydrophobicContact CG1-CZ 4.48Å; M484-F488 PolarHBondContact O-N 3.27Å; L485-F488 WeakPolarHBondContact O-CB 3.43Å; L485-F488 PolarHBondContact O-N 2.95Å; F488-T490 PolarHBondContact O-N 3.27Å; F488-N491 WeakPolarHBondContact O-CB 3.16Å; F488-N491 PolarHBondContact O-N 2.9Å; F488-I492 HydrophobicContact CD1-CD1 4.14Å; F488-I492 HydrophobicContact CD2-CD1 4.41Å; F488-I492 HydrophobicContact CE1-CD1 3.59Å; F488-I492 HydrophobicContact CE2-CD1 3.9Å; F488-I492 HydrophobicContact CZ-CD1 3.47Å; F488-I492 VanDerWaalsContact CZ-CD1 3.47Å; F488-I492 PolarHBondContact O-N 3.49Å; F488-I492 VanDerWaalsContact O-N 3.16Å |
| 489 | F | 97.1 | Very high | 94.2 | Very high | 105 Ų | 105 | 41.2 Ų | 41.2 | 46% | 0.461 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -67 | -38.6 | -176.4 | -71.5 | -61.9 | 0 | 0 | 0 | 111.9 | L485 N491 I492 I493 | L485-F489 HydrophobicContact CB-CD2 4.29Å; L485-F489 HydrophobicContact CB-CE2 4.22Å; L485-F489 HydrophobicContact CD2-CE2 4.18Å; L485-F489 WeakPolarHBondContact O-CD2 3.46Å; L485-F489 PolarHBondContact O-N 3.47Å; F489-N491 VanDerWaalsContact C-N 3.32Å; F489-N491 PolarHBondContact O-N 3.13Å; F489-I492 PolarHBondContact O-N 2.99Å; F489-I493 HydrophobicContact CB-CD1 4.39Å; F489-I493 WeakPolarHBondContact O-CB 3.35Å; F489-I493 VanDerWaalsContact O-CG1 3.25Å; F489-I493 WeakPolarHBondContact O-CG1 3.46Å; F489-I493 PolarHBondContact O-N 3.17Å |
| 490 | T | 96.6 | Very high | 94.2 | Very high | 23 Ų | 23 | 48 Ų | 48 | 14% | 0.141 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.8 | -43 | 174.8 | -61.8 | 0 | 0 | 0 | 0 | 110.9 | A437 F441 T486 F488 I492 I493 V494 | A437-T490 HydrophobicContact CB-CG2 3.68Å; F441-T490 HydrophobicContact CD2-CG2 3.74Å; F441-T490 HydrophobicContact CE2-CG2 4.32Å; F441-T490 HydrophobicContact CG-CG2 4.33Å; T486-T490 WeakPolarHBondContact O-CB 3.44Å; T486-T490 PolarHBondContact O-N 3.44Å; T486-T490 PolarHBondContact O-OG1 3.42Å; F488-T490 PolarHBondContact O-N 3.27Å; T490-I492 VanDerWaalsContact C-N 3.33Å; T490-I492 PolarHBondContact O-N 2.83Å; T490-I493 PolarHBondContact O-N 3.31Å; T490-V494 HydrophobicContact CG2-CG2 3.92Å; T490-V494 VanDerWaalsContact O-CB 3.27Å; T490-V494 WeakPolarHBondContact O-CB 3.35Å; T490-V494 WeakPolarHBondContact O-CG2 3.35Å; T490-V494 PolarHBondContact O-N 3.39Å |
| 491 | N | 96.1 | Very high | 94 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59 | -45.9 | 177.2 | -176.3 | -7.5 | 0 | 0 | 0 | 111.6 | Y122 C423 G434 A435 S487 F488 F489 S495 | Y122-N491 PolarHBondContact OH-ND2 3.21Å; C423-N491 WeakPolarHBondContact CB-ND2 3.35Å; G434-N491 VanDerWaalsContact C-OD1 3.26Å; G434-N491 WeakPolarHBondContact CA-O 3.49Å; G434-N491 VanDerWaalsContact O-CA 3.3Å; G434-N491 WeakPolarHBondContact O-CA 3.29Å; A435-N491 PolarHBondContact N-OD1 3.16Å; S487-N491 WeakPolarHBondContact O-CB 3.4Å; S487-N491 PolarHBondContact O-N 3.06Å; F488-N491 WeakPolarHBondContact O-CB 3.16Å; F488-N491 PolarHBondContact O-N 2.9Å; F489-N491 VanDerWaalsContact C-N 3.32Å; F489-N491 PolarHBondContact O-N 3.13Å; N491-S495 WeakPolarHBondContact O-CB 3.46Å; N491-S495 PolarHBondContact O-N 2.75Å; N491-S495 PolarHBondContact O-OG 2.75Å; N491-S495 PolarHBondContact OD1-OG 3.31Å |
| 492 | I | 96 | Very high | 93.7 | Very high | 33 Ų | 33 | 49.2 Ų | 49.2 | 17% | 0.169 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.6 | -59 | 177 | -66.5 | 177.4 | 0 | 0 | 0 | 110.7 | I427 F488 F489 T490 V494 S495 Y496 | I427-I492 HydrophobicContact CG1-CD1 4.27Å; I427-I492 HydrophobicContact CG2-CD1 4.47Å; I427-I492 HydrophobicContact CG2-CG1 4.34Å; F488-I492 HydrophobicContact CD1-CD1 4.14Å; F488-I492 HydrophobicContact CD2-CD1 4.41Å; F488-I492 HydrophobicContact CE1-CD1 3.59Å; F488-I492 HydrophobicContact CE2-CD1 3.9Å; F488-I492 HydrophobicContact CZ-CD1 3.47Å; F488-I492 VanDerWaalsContact CZ-CD1 3.47Å; F488-I492 PolarHBondContact O-N 3.49Å; F488-I492 VanDerWaalsContact O-N 3.16Å; F489-I492 PolarHBondContact O-N 2.99Å; T490-I492 VanDerWaalsContact C-N 3.33Å; T490-I492 PolarHBondContact O-N 2.83Å; I492-V494 PolarHBondContact O-N 2.82Å; I492-S495 PolarHBondContact O-N 3.41Å; I492-S495 VanDerWaalsContact O-N 3.16Å; I492-Y496 HydrophobicContact CG2-CD2 3.7Å; I492-Y496 HydrophobicContact CG2-CE2 3.79Å; I492-Y496 VanDerWaalsContact O-CD2 3.25Å; I492-Y496 WeakPolarHBondContact O-CD2 3.48Å; I492-Y496 PolarHBondContact O-N 2.86Å |
| 493 | I | 96.2 | Very high | 93.2 | Very high | 109 Ų | 109 | 51.2 Ų | 51.2 | 56% | 0.559 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -58.2 | -49.2 | -173.2 | -67.4 | 165.9 | 0 | 0 | 0 | 110.6 | F489 T490 Y496 L497 | F489-I493 HydrophobicContact CB-CD1 4.39Å; F489-I493 WeakPolarHBondContact O-CB 3.35Å; F489-I493 VanDerWaalsContact O-CG1 3.25Å; F489-I493 WeakPolarHBondContact O-CG1 3.46Å; F489-I493 PolarHBondContact O-N 3.17Å; T490-I493 PolarHBondContact O-N 3.31Å; I493-Y496 PolarHBondContact O-N 3.16Å; I493-L497 WeakPolarHBondContact O-CB 3.01Å; I493-L497 PolarHBondContact O-N 3.05Å |
| 494 | V | 95.6 | Very high | 92.8 | Very high | 42 Ų | 42 | 53.8 Ų | 53.8 | 26% | 0.255 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -68.8 | -36 | -179.1 | 176.1 | 0 | 0 | 0 | 0 | 111.1 | A437 T490 I492 A498 | A437-V494 HydrophobicContact CB-CB 4.1Å; A437-V494 HydrophobicContact CB-CG1 3.96Å; A437-V494 HydrophobicContact CB-CG2 3.91Å; T490-V494 HydrophobicContact CG2-CG2 3.92Å; T490-V494 VanDerWaalsContact O-CB 3.27Å; T490-V494 WeakPolarHBondContact O-CB 3.35Å; T490-V494 WeakPolarHBondContact O-CG2 3.35Å; T490-V494 PolarHBondContact O-N 3.39Å; I492-V494 PolarHBondContact O-N 2.82Å; V494-A498 WeakPolarHBondContact O-CB 3.47Å; V494-A498 PolarHBondContact O-N 3.49Å |
| 495 | S | 94 | Very high | 92 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.5 | -50.8 | 174.8 | -69.7 | 0 | 0 | 0 | 0 | 111.8 | T430 N431 G434 N491 I492 A498 K499 | T430-S495 WeakPolarHBondContact CA-OG 3.45Å; N431-S495 PolarHBondContact N-OG 3.28Å; N431-S495 WeakPolarHBondContact ND2-CA 3.29Å; N431-S495 PolarHBondContact ND2-O 3.02Å; G434-S495 WeakPolarHBondContact CA-OG 3.43Å; N491-S495 WeakPolarHBondContact O-CB 3.46Å; N491-S495 PolarHBondContact O-N 2.75Å; N491-S495 PolarHBondContact O-OG 2.75Å; N491-S495 PolarHBondContact OD1-OG 3.31Å; I492-S495 PolarHBondContact O-N 3.41Å; I492-S495 VanDerWaalsContact O-N 3.16Å; S495-A498 PolarHBondContact O-N 3.31Å; S495-K499 WeakPolarHBondContact O-CB 3.22Å; S495-K499 PolarHBondContact O-N 2.83Å |
| 496 | Y | 93.3 | Very high | 91.4 | Very high | 111 Ų | 111 | 57.3 Ų | 57.3 | 44% | 0.435 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | -180 | -80.9 | -79 | 0 | 0 | 0 | 112.1 | I427 K428 I492 I493 K499 Y500 | I427-Y496 HydrophobicContact CG2-CE2 4.31Å; K428-Y496 PolarHBondContact O-OH 3.37Å; I492-Y496 HydrophobicContact CG2-CD2 3.7Å; I492-Y496 HydrophobicContact CG2-CE2 3.79Å; I492-Y496 VanDerWaalsContact O-CD2 3.25Å; I492-Y496 WeakPolarHBondContact O-CD2 3.48Å; I492-Y496 PolarHBondContact O-N 2.86Å; I493-Y496 PolarHBondContact O-N 3.16Å; Y496-K499 PolarHBondContact O-N 3.27Å; Y496-Y500 WeakPolarHBondContact O-CB 3.43Å; Y496-Y500 PolarHBondContact O-N 3.35Å |
| 497 | L | 92.8 | Very high | 90.8 | Very high | 92 Ų | 92 | 58 Ų | 58 | 48% | 0.482 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.7 | -48.3 | 175 | 180 | 62.5 | 0 | 0 | 0 | 111.2 | I493 K499 Y500 L501 | I493-L497 WeakPolarHBondContact O-CB 3.01Å; I493-L497 PolarHBondContact O-N 3.05Å; L497-K499 VanDerWaalsContact C-N 3.31Å; L497-K499 PolarHBondContact O-N 2.74Å; L497-Y500 PolarHBondContact O-N 3.45Å; L497-L501 HydrophobicContact CD1-CD1 4Å; L497-L501 HydrophobicContact CD1-CG 4.07Å; L497-L501 HydrophobicContact CG-CD1 3.87Å; L497-L501 HydrophobicContact CG-CG 4.35Å; L497-L501 WeakPolarHBondContact O-CB 3.49Å; L497-L501 VanDerWaalsContact O-CG 3.24Å; L497-L501 WeakPolarHBondContact O-CG 3.35Å; L497-L501 PolarHBondContact O-N 2.89Å |
| 498 | A | 89.6 | Confident | 90 | Very high | 11 Ų | 11 | 61.2 Ų | 61.2 | 9% | 0.091 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -59.4 | -45.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | Y433 V494 S495 Y500 L501 F502 | Y433-A498 HydrophobicContact CD2-CB 4.21Å; Y433-A498 HydrophobicContact CG-CB 4.46Å; V494-A498 WeakPolarHBondContact O-CB 3.47Å; V494-A498 PolarHBondContact O-N 3.49Å; S495-A498 PolarHBondContact O-N 3.31Å; A498-Y500 PolarHBondContact O-N 3.33Å; A498-L501 PolarHBondContact O-N 3.21Å; A498-F502 WeakPolarHBondContact O-CD2 3.44Å; A498-F502 PolarHBondContact O-N 3.29Å; A498-F502 VanDerWaalsContact O-N 3.08Å |
| 499 | K | 87.8 | Confident | 89 | Confident | 74 Ų | 74 | 63.7 Ų | 63.7 | 32% | 0.322 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -56.6 | -51.4 | 176 | -174.7 | 178.6 | 178.4 | -177.4 | 0 | 111.5 | S495 Y496 L497 L501 F502 E503 V517 | S495-K499 WeakPolarHBondContact O-CB 3.22Å; S495-K499 PolarHBondContact O-N 2.83Å; Y496-K499 PolarHBondContact O-N 3.27Å; L497-K499 VanDerWaalsContact C-N 3.31Å; L497-K499 PolarHBondContact O-N 2.74Å; K499-L501 PolarHBondContact O-N 3.28Å; K499-F502 PolarHBondContact O-N 3.08Å; K499-E503 WeakPolarHBondContact CE-OE1 3.32Å; K499-E503 VanDerWaalsContact CE-OE2 3.29Å; K499-E503 WeakPolarHBondContact CE-OE2 3.3Å; K499-E503 HydrophobicContact CG-CG 4.32Å; K499-E503 IonicContact NZ-OE1 3.42Å; K499-E503 WeakPolarHBondContact O-CB 3.33Å; K499-E503 WeakPolarHBondContact O-CG 3.45Å; K499-E503 PolarHBondContact O-N 2.66Å; K499-V517 HydrophobicContact CG-CG1 4.38Å |
| 500 | Y | 88.3 | Confident | 88 | Confident | 155 Ų | 155 | 68.2 Ų | 68.2 | 61% | 0.608 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -58.4 | -48.3 | 178.3 | 175.7 | -100.3 | 0 | 0 | 0 | 111.8 | Y496 L497 A498 F502 E503 S504 | Y496-Y500 WeakPolarHBondContact O-CB 3.43Å; Y496-Y500 PolarHBondContact O-N 3.35Å; L497-Y500 PolarHBondContact O-N 3.45Å; A498-Y500 PolarHBondContact O-N 3.33Å; Y500-F502 VanDerWaalsContact C-N 3.35Å; Y500-F502 PolarHBondContact O-N 2.94Å; Y500-E503 PolarHBondContact O-N 3.02Å; Y500-S504 WeakPolarHBondContact O-CB 3.42Å; Y500-S504 PolarHBondContact O-N 3.25Å; Y500-S504 PolarHBondContact O-OG 2.68Å |
| 501 | L | 88 | Confident | 87.2 | Confident | 46 Ų | 46 | 71.5 Ų | 71.5 | 24% | 0.241 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -64.2 | -35.4 | -176.6 | -71.9 | 172 | 0 | 0 | 0 | 113.7 | L497 A498 K499 S504 T506 L507 | L497-L501 HydrophobicContact CD1-CD1 4Å; L497-L501 HydrophobicContact CD1-CG 4.07Å; L497-L501 HydrophobicContact CG-CD1 3.87Å; L497-L501 HydrophobicContact CG-CG 4.35Å; L497-L501 WeakPolarHBondContact O-CB 3.49Å; L497-L501 VanDerWaalsContact O-CG 3.24Å; L497-L501 WeakPolarHBondContact O-CG 3.35Å; L497-L501 PolarHBondContact O-N 2.89Å; A498-L501 PolarHBondContact O-N 3.21Å; K499-L501 PolarHBondContact O-N 3.28Å; L501-S504 PolarHBondContact O-OG 3.33Å; L501-T506 HydrophobicContact CD2-CG2 4.08Å; L501-T506 PolarHBondContact O-N 3Å; L501-L507 HydrophobicContact CB-CD1 3.65Å; L501-L507 HydrophobicContact CB-CG 3.97Å; L501-L507 HydrophobicContact CD1-CD1 3.97Å; L501-L507 HydrophobicContact CG-CD1 4.41Å; L501-L507 PolarHBondContact O-N 3.31Å |
| 502 | F | 86.8 | Confident | 86.4 | Confident | 20 Ų | 20 | 71.8 Ų | 71.8 | 9% | 0.088 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -78.6 | -40.7 | 175.5 | -75.4 | -64.8 | 0 | 0 | 0 | 112 | Y433 A498 K499 Y500 G505 L507 L511 D512 V517 V518 | Y433-F502 HydrophobicContact CD2-CE2 4.43Å; Y433-F502 AromaticContact CE2-CE2 3.88Å; Y433-F502 HydrophobicContact CE2-CE2 3.88Å; Y433-F502 HydrophobicContact CE2-CZ 4.41Å; A498-F502 WeakPolarHBondContact O-CD2 3.44Å; A498-F502 PolarHBondContact O-N 3.29Å; A498-F502 VanDerWaalsContact O-N 3.08Å; K499-F502 PolarHBondContact O-N 3.08Å; Y500-F502 VanDerWaalsContact C-N 3.35Å; Y500-F502 PolarHBondContact O-N 2.94Å; F502-G505 PolarHBondContact O-N 3.49Å; F502-L507 HydrophobicContact CD1-CB 3.8Å; F502-L507 HydrophobicContact CE1-CB 3.84Å; F502-L507 HydrophobicContact CE1-CD1 4.29Å; F502-L507 HydrophobicContact CE2-CD1 4.38Å; F502-L507 HydrophobicContact CG-CB 4.47Å; F502-L507 HydrophobicContact CZ-CD1 4.16Å; F502-L511 HydrophobicContact CE1-CB 4.23Å; F502-D512 HydrophobicContact CD1-CB 4.36Å; F502-D512 HydrophobicContact CE1-CB 3.82Å; F502-D512 HydrophobicContact CE2-CB 4.42Å; F502-D512 HydrophobicContact CZ-CB 3.86Å; F502-V517 HydrophobicContact CB-CB 4.3Å; F502-V517 HydrophobicContact CB-CG1 3.81Å; F502-V517 HydrophobicContact CD2-CB 3.89Å; F502-V517 HydrophobicContact CD2-CG1 4.2Å; F502-V517 HydrophobicContact CD2-CG2 3.86Å; F502-V517 HydrophobicContact CE2-CG2 4.39Å; F502-V517 HydrophobicContact CG-CB 4.34Å; F502-V517 HydrophobicContact CG-CG1 4.37Å; F502-V518 HydrophobicContact CB-CG2 4.15Å; F502-V518 HydrophobicContact CD1-CG2 4.14Å; F502-V518 HydrophobicContact CG-CG2 4.27Å |
| 503 | E | 84.6 | Confident | 85.6 | Confident | 102 Ų | 102 | 77 Ų | 77 | 48% | 0.477 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -71.9 | -31.9 | 179.4 | -71.9 | -179.2 | 170.7 | 0 | 0 | 112.7 | K499 Y500 G505 | K499-E503 WeakPolarHBondContact CE-OE1 3.32Å; K499-E503 VanDerWaalsContact CE-OE2 3.29Å; K499-E503 WeakPolarHBondContact CE-OE2 3.3Å; K499-E503 HydrophobicContact CG-CG 4.32Å; K499-E503 IonicContact NZ-OE1 3.42Å; K499-E503 WeakPolarHBondContact O-CB 3.33Å; K499-E503 WeakPolarHBondContact O-CG 3.45Å; K499-E503 PolarHBondContact O-N 2.66Å; Y500-E503 PolarHBondContact O-N 3.02Å; E503-G505 PolarHBondContact O-N 2.94Å |
| 504 | S | 85 | Confident | 84.8 | Confident | 54 Ų | 54 | 73.7 Ų | 73.7 | 38% | 0.378 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.5 | -8.3 | 175.7 | 67.8 | 0 | 0 | 0 | 0 | 113.6 | Y500 L501 T506 | Y500-S504 WeakPolarHBondContact O-CB 3.42Å; Y500-S504 PolarHBondContact O-N 3.25Å; Y500-S504 PolarHBondContact O-OG 2.68Å; L501-S504 PolarHBondContact O-OG 3.33Å; S504-T506 PolarHBondContact O-N 3.11Å; S504-T506 WeakPolarHBondContact OG-CB 3.49Å; S504-T506 PolarHBondContact OG-N 3.17Å; S504-T506 PolarHBondContact OG-OG1 3.05Å |
| 505 | G | 78.9 | Confident | 83.8 | Confident | 59 Ų | 59 | 76.7 Ų | 76.7 | 61% | 0.608 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.5 | 9.8 | -174 | 0 | 0 | 0 | 0 | 0 | 114.2 | F502 E503 L507 | F502-G505 PolarHBondContact O-N 3.49Å; E503-G505 PolarHBondContact O-N 2.94Å; G505-L507 VanDerWaalsContact C-N 3.35Å |
| 506 | T | 83.9 | Confident | 82.9 | Confident | 95 Ų | 95 | 77.1 Ų | 77.1 | 58% | 0.583 | 40% | 0.402 | S | S | * | . | S | Bend | trans | -67.9 | -37.6 | 175.7 | -52.9 | 0 | 0 | 0 | 0 | 111.1 | L501 S504 | L501-T506 HydrophobicContact CD2-CG2 4.08Å; L501-T506 PolarHBondContact O-N 3Å; S504-T506 PolarHBondContact O-N 3.11Å; S504-T506 WeakPolarHBondContact OG-CB 3.49Å; S504-T506 PolarHBondContact OG-N 3.17Å; S504-T506 PolarHBondContact OG-OG1 3.05Å |
| 507 | L | 83.8 | Confident | 82 | Confident | 53 Ų | 53 | 72.4 Ų | 72.4 | 28% | 0.277 | 39% | 0.385 | S | S | . | . | S | Bend | trans | -101.4 | 130.2 | 170.3 | -72.4 | 175.7 | 0 | 0 | 0 | 110.7 | L501 F502 G505 L511 | L501-L507 HydrophobicContact CB-CD1 3.65Å; L501-L507 HydrophobicContact CB-CG 3.97Å; L501-L507 HydrophobicContact CD1-CD1 3.97Å; L501-L507 HydrophobicContact CG-CD1 4.41Å; L501-L507 PolarHBondContact O-N 3.31Å; F502-L507 HydrophobicContact CD1-CB 3.8Å; F502-L507 HydrophobicContact CE1-CB 3.84Å; F502-L507 HydrophobicContact CE1-CD1 4.29Å; F502-L507 HydrophobicContact CE2-CD1 4.38Å; F502-L507 HydrophobicContact CG-CB 4.47Å; F502-L507 HydrophobicContact CZ-CD1 4.16Å; G505-L507 VanDerWaalsContact C-N 3.35Å; L507-L511 HydrophobicContact CD2-CD1 4Å |
| 508 | P | 78.9 | Confident | 80.6 | Confident | 67 Ų | 67 | 70 Ų | 70 | 44% | 0.435 | 37% | 0.373 | S | S | . | . | trans | -63.3 | 140.7 | 174.4 | 21.3 | -31.1 | 0 | 0 | 0 | 111.1 | K510 L511 | P508-K510 PolarHBondContact O-N 3.12Å; P508-L511 HydrophobicContact CG-CD1 3.64Å; P508-L511 HydrophobicContact CG-CG 3.94Å; P508-L511 WeakPolarHBondContact O-CB 3.44Å; P508-L511 PolarHBondContact O-N 2.73Å | ||
| 509 | P | 75.8 | Confident | 79.3 | Confident | 86 Ų | 86 | 70.7 Ų | 70.7 | 56% | 0.558 | 38% | 0.379 | S | S | * | . | G | 310 helix | trans | -52.6 | -27.3 | 178.4 | -32.5 | 37.5 | 0 | 0 | 0 | 115.3 | L511 D512 V518 | P509-L511 PolarHBondContact O-N 3.05Å; P509-D512 WeakPolarHBondContact O-CB 3.35Å; P509-D512 PolarHBondContact O-N 3.05Å; P509-D512 VanDerWaalsContact O-N 3.08Å; P509-V518 HydrophobicContact CB-CG1 4.19Å; P509-V518 HydrophobicContact CB-CG2 4.29Å |
| 510 | K | 76.1 | Confident | 78.1 | Confident | 200 Ų | 200 | 71.2 Ų | 71.2 | 87% | 0.87 | 38% | 0.379 | S | S | * | . | G | 310 helix | trans | -63.8 | -19.8 | 177.3 | -62.8 | -177.2 | -179.7 | 179.5 | 0 | 113.4 | P508 D512 | P508-K510 PolarHBondContact O-N 3.12Å; K510-D512 VanDerWaalsContact C-N 3.33Å |
| 511 | L | 78.8 | Confident | 76.7 | Confident | 92 Ų | 92 | 69.5 Ų | 69.5 | 48% | 0.482 | 37% | 0.373 | S | S | . | . | G | 310 helix | trans | -85.3 | -4.6 | 176.3 | -66.4 | 175.2 | 0 | 0 | 0 | 112.9 | Y433 F502 L507 P508 P509 F513 | Y433-L511 PolarHBondContact OH-O 3.37Å; F502-L511 HydrophobicContact CE1-CB 4.23Å; L507-L511 HydrophobicContact CD2-CD1 4Å; P508-L511 HydrophobicContact CG-CD1 3.64Å; P508-L511 HydrophobicContact CG-CG 3.94Å; P508-L511 WeakPolarHBondContact O-CB 3.44Å; P508-L511 PolarHBondContact O-N 2.73Å; P509-L511 PolarHBondContact O-N 3.05Å; L511-F513 WeakPolarHBondContact O-CD1 3.44Å; L511-F513 PolarHBondContact O-N 3.43Å |
| 512 | D | 80.1 | Confident | 75.3 | Confident | 7 Ų | 7 | 70.4 Ų | 70.4 | 4% | 0.037 | 38% | 0.382 | C | S | . | . | trans | -78.3 | 61.2 | 171.4 | -170 | 10.5 | 0 | 0 | 0 | 111.1 | Y433 F502 P509 K510 L514 D515 A516 V517 V518 | Y433-D512 WeakPolarHBondContact CE2-OD1 3.41Å; Y433-D512 WeakPolarHBondContact OH-CA 3.3Å; Y433-D512 PolarHBondContact OH-OD1 2.96Å; F502-D512 HydrophobicContact CD1-CB 4.36Å; F502-D512 HydrophobicContact CE1-CB 3.82Å; F502-D512 HydrophobicContact CE2-CB 4.42Å; F502-D512 HydrophobicContact CZ-CB 3.86Å; P509-D512 WeakPolarHBondContact O-CB 3.35Å; P509-D512 PolarHBondContact O-N 3.05Å; P509-D512 VanDerWaalsContact O-N 3.08Å; K510-D512 VanDerWaalsContact C-N 3.33Å; D512-L514 PolarHBondContact O-N 3.05Å; D512-D515 PolarHBondContact O-N 3.16Å; D512-D515 PolarHBondContact OD1-N 2.98Å; D512-A516 PolarHBondContact OD1-N 3.26Å; D512-A516 PolarHBondContact OD2-N 2.77Å; D512-V517 PolarHBondContact OD2-N 2.72Å; D512-V518 HydrophobicContact CB-CB 4.44Å; D512-V518 HydrophobicContact CB-CG2 4.1Å; D512-V518 PolarHBondContact OD2-N 3.43Å | ||
| 513 | F | 79.3 | Confident | 73.9 | Confident | 143 Ų | 143 | 77 Ų | 77 | 63% | 0.627 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.4 | -12.3 | -176.7 | 67.9 | -92.5 | 0 | 0 | 0 | 114.3 | Y433 L511 | Y433-F513 HydrophobicContact CE1-CD1 4.3Å; Y433-F513 AromaticContact CE1-CE1 3.6Å; Y433-F513 HydrophobicContact CE1-CE1 3.6Å; Y433-F513 HydrophobicContact CE1-CE2 4.47Å; Y433-F513 AromaticContact CE1-CZ 3.7Å; Y433-F513 HydrophobicContact CE1-CZ 3.7Å; Y433-F513 WeakPolarHBondContact OH-CD1 3.48Å; Y433-F513 PolarHBondContact OH-N 3.06Å; L511-F513 WeakPolarHBondContact O-CD1 3.44Å; L511-F513 PolarHBondContact O-N 3.43Å |
| 514 | L | 78.9 | Confident | 72.7 | Confident | 38 Ų | 38 | 76.3 Ų | 76.3 | 20% | 0.199 | 40% | 0.404 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | 1 | 174.7 | -64.3 | 179.4 | 0 | 0 | 0 | 112.6 | T432 Y433 I436 D512 A516 | T432-L514 HydrophobicContact CG2-CD1 3.94Å; Y433-L514 HydrophobicContact CD1-CD1 3.69Å; Y433-L514 HydrophobicContact CE1-CB 4.33Å; Y433-L514 HydrophobicContact CE1-CD1 3.51Å; Y433-L514 HydrophobicContact CE1-CG 3.92Å; Y433-L514 HydrophobicContact CE2-CB 4.26Å; Y433-L514 HydrophobicContact CG-CD1 4.28Å; Y433-L514 PolarHBondContact OH-N 3.42Å; I436-L514 HydrophobicContact CD1-CD1 3.55Å; D512-L514 PolarHBondContact O-N 3.05Å; L514-A516 HydrophobicContact CB-CB 4.08Å; L514-A516 PolarHBondContact O-N 2.79Å; L514-A516 VanDerWaalsContact O-N 3.13Å |
| 515 | D | 74.3 | Confident | 71.4 | Confident | 106 Ų | 106 | 78 Ų | 78 | 57% | 0.567 | 41% | 0.405 | S | S | * | . | trans | 50.3 | 34.5 | -175.2 | -68.4 | -47.7 | 0 | 0 | 0 | 112.2 | D512 A519 | D512-D515 PolarHBondContact O-N 3.16Å; D512-D515 PolarHBondContact OD1-N 2.98Å; D515-A519 HydrophobicContact CB-CB 3.73Å | ||
| 516 | A | 75.8 | Confident | 70 | Confident | 9 Ų | 9 | 81.2 Ų | 81.2 | 7% | 0.074 | 41% | 0.406 | C | S | . | . | S | Bend | trans | -90.8 | -22.6 | -165.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | N431 Y433 D512 L514 | N431-A516 HydrophobicContact CB-CB 4.35Å; Y433-A516 HydrophobicContact CD2-CB 3.84Å; Y433-A516 HydrophobicContact CE2-CB 3.78Å; D512-A516 PolarHBondContact OD1-N 3.26Å; D512-A516 PolarHBondContact OD2-N 2.77Å; L514-A516 HydrophobicContact CB-CB 4.08Å; L514-A516 PolarHBondContact O-N 2.79Å; L514-A516 VanDerWaalsContact O-N 3.13Å |
| 517 | V | 73.7 | Confident | 68.5 | Low | 12 Ų | 12 | 81.6 Ų | 81.6 | 7% | 0.073 | 40% | 0.404 | C | S | . | . | S | Bend | trans | -124.8 | -58.7 | -173.1 | -176.3 | 0 | 0 | 0 | 0 | 111.6 | K499 F502 D512 R520 Y521 | K499-V517 HydrophobicContact CG-CG1 4.38Å; F502-V517 HydrophobicContact CB-CB 4.3Å; F502-V517 HydrophobicContact CB-CG1 3.81Å; F502-V517 HydrophobicContact CD2-CB 3.89Å; F502-V517 HydrophobicContact CD2-CG1 4.2Å; F502-V517 HydrophobicContact CD2-CG2 3.86Å; F502-V517 HydrophobicContact CE2-CG2 4.39Å; F502-V517 HydrophobicContact CG-CB 4.34Å; F502-V517 HydrophobicContact CG-CG1 4.37Å; D512-V517 PolarHBondContact OD2-N 2.72Å; V517-R520 PolarHBondContact O-N 3.39Å; V517-Y521 WeakPolarHBondContact O-CB 3.06Å; V517-Y521 PolarHBondContact O-N 2.82Å |
| 518 | V | 64.8 | Low | 67 | Low | 41 Ų | 41 | 84.9 Ų | 84.9 | 25% | 0.248 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -74.1 | -44.8 | -172.1 | -177.8 | 0 | 0 | 0 | 0 | 112 | F502 P509 D512 R520 Y521 S522 | F502-V518 HydrophobicContact CB-CG2 4.15Å; F502-V518 HydrophobicContact CD1-CG2 4.14Å; F502-V518 HydrophobicContact CG-CG2 4.27Å; P509-V518 HydrophobicContact CB-CG1 4.19Å; P509-V518 HydrophobicContact CB-CG2 4.29Å; D512-V518 HydrophobicContact CB-CB 4.44Å; D512-V518 HydrophobicContact CB-CG2 4.1Å; D512-V518 PolarHBondContact OD2-N 3.43Å; V518-R520 PolarHBondContact O-N 2.88Å; V518-Y521 PolarHBondContact O-N 3.03Å; V518-S522 PolarHBondContact O-N 3.28Å; V518-S522 PolarHBondContact O-OG 3.09Å |
| 519 | A | 62.3 | Low | 65.7 | Low | 26 Ų | 26 | 84.4 Ų | 84.4 | 22% | 0.215 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -65.4 | -27.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | D515 R523 | D515-A519 HydrophobicContact CB-CB 3.73Å; A519-R523 PolarHBondContact O-N 3.17Å; A519-R523 PolarHBondContact O-NE 2.94Å |
| 520 | R | 63.2 | Low | 64.4 | Low | 85 Ų | 85 | 84.3 Ų | 84.3 | 32% | 0.321 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -80.3 | -44.5 | 177.7 | -169.1 | 175.9 | 174.9 | 166.5 | 2.9 | 112 | V517 V518 S522 R523 E524 | V517-R520 PolarHBondContact O-N 3.39Å; V518-R520 PolarHBondContact O-N 2.88Å; R520-S522 VanDerWaalsContact C-N 3.27Å; R520-S522 PolarHBondContact O-N 3.42Å; R520-R523 PolarHBondContact O-N 3.48Å; R520-E524 IonicContact NE-OE1 2.7Å; R520-E524 PolarHBondContact O-N 3.09Å |
| 521 | Y | 58.3 | Low | 62.9 | Low | 119 Ų | 119 | 80 Ų | 80 | 47% | 0.467 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -55.1 | -45 | 171.8 | -176.2 | -94.2 | 0 | 0 | 0 | 111.3 | V517 V518 R523 E524 H525 | V517-Y521 WeakPolarHBondContact O-CB 3.06Å; V517-Y521 PolarHBondContact O-N 2.82Å; V518-Y521 PolarHBondContact O-N 3.03Å; Y521-R523 PolarHBondContact O-N 3.4Å; Y521-E524 PolarHBondContact O-N 2.89Å; Y521-H525 AromaticContact CD1-CD2 3.73Å; Y521-H525 AromaticContact CD2-CD2 3.9Å; Y521-H525 AromaticContact CE1-CD2 3.41Å; Y521-H525 VanDerWaalsContact CE1-CD2 3.41Å; Y521-H525 WeakPolarHBondContact CE1-CD2 3.34Å; Y521-H525 AromaticContact CE1-NE2 3.73Å; Y521-H525 AromaticContact CE2-CD2 3.59Å; Y521-H525 AromaticContact CE2-NE2 3.3Å; Y521-H525 VanDerWaalsContact CE2-NE2 3.3Å; Y521-H525 WeakPolarHBondContact CE2-NE2 3.42Å; Y521-H525 AromaticContact CG-CD2 3.97Å; Y521-H525 AromaticContact CZ-CD2 3.33Å; Y521-H525 AromaticContact CZ-NE2 3.12Å; Y521-H525 WeakPolarHBondContact O-CB 3.42Å; Y521-H525 PolarHBondContact O-CD2 3.12Å; Y521-H525 VanDerWaalsContact O-CD2 3.31Å; Y521-H525 PolarHBondContact O-N 3.38Å; Y521-H525 PolarHBondContact OH-NE2 2.96Å |
| 522 | S | 57.3 | Low | 61.5 | Low | 64 Ų | 64 | 80.4 Ų | 80.4 | 45% | 0.448 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 178.1 | -57.5 | 0 | 0 | 0 | 0 | 112.9 | V518 R520 M526 | V518-S522 PolarHBondContact O-N 3.28Å; V518-S522 PolarHBondContact O-OG 3.09Å; R520-S522 VanDerWaalsContact C-N 3.27Å; R520-S522 PolarHBondContact O-N 3.42Å; S522-M526 WeakPolarHBondContact O-CB 3.45Å; S522-M526 PolarHBondContact O-N 2.79Å |
| 523 | R | 58.6 | Low | 59.8 | Low | 158 Ų | 158 | 88.1 Ų | 88.1 | 60% | 0.596 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -66.4 | -46.7 | 175.2 | -91.8 | -176.9 | -89.2 | 177.5 | -8.6 | 112.7 | A519 R520 Y521 H525 M526 D527 | A519-R523 PolarHBondContact O-N 3.17Å; A519-R523 PolarHBondContact O-NE 2.94Å; R520-R523 PolarHBondContact O-N 3.48Å; Y521-R523 PolarHBondContact O-N 3.4Å; R523-H525 VanDerWaalsContact C-N 3.29Å; R523-H525 PolarHBondContact O-N 3.49Å; R523-M526 PolarHBondContact O-N 3.38Å; R523-D527 PolarHBondContact O-N 3.45Å |
| 524 | E | 59.8 | Low | 58.2 | Low | 89 Ų | 89 | 84.6 Ų | 84.6 | 42% | 0.416 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.9 | -35.8 | 178.2 | -74.8 | -177.6 | -168.8 | 0 | 0 | 112.2 | R520 Y521 K528 | R520-E524 IonicContact NE-OE1 2.7Å; R520-E524 PolarHBondContact O-N 3.09Å; Y521-E524 PolarHBondContact O-N 2.89Å; E524-K528 WeakPolarHBondContact O-CB 3.21Å; E524-K528 VanDerWaalsContact O-CG 3.27Å; E524-K528 WeakPolarHBondContact O-CG 3.37Å; E524-K528 PolarHBondContact O-N 3.15Å; E524-K528 VanDerWaalsContact O-N 3.08Å |
| 525 | H | 56 | Low | 56.5 | Low | 88 Ų | 88 | 89.1 Ų | 89.1 | 41% | 0.407 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -73.6 | -36.7 | 174.2 | -86 | -76.3 | 0 | 0 | 0 | 113.1 | Y521 R523 A529 | Y521-H525 AromaticContact CD1-CD2 3.73Å; Y521-H525 AromaticContact CD2-CD2 3.9Å; Y521-H525 AromaticContact CE1-CD2 3.41Å; Y521-H525 VanDerWaalsContact CE1-CD2 3.41Å; Y521-H525 WeakPolarHBondContact CE1-CD2 3.34Å; Y521-H525 AromaticContact CE1-NE2 3.73Å; Y521-H525 AromaticContact CE2-CD2 3.59Å; Y521-H525 AromaticContact CE2-NE2 3.3Å; Y521-H525 VanDerWaalsContact CE2-NE2 3.3Å; Y521-H525 WeakPolarHBondContact CE2-NE2 3.42Å; Y521-H525 AromaticContact CG-CD2 3.97Å; Y521-H525 AromaticContact CZ-CD2 3.33Å; Y521-H525 AromaticContact CZ-NE2 3.12Å; Y521-H525 WeakPolarHBondContact O-CB 3.42Å; Y521-H525 PolarHBondContact O-CD2 3.12Å; Y521-H525 VanDerWaalsContact O-CD2 3.31Å; Y521-H525 PolarHBondContact O-N 3.38Å; Y521-H525 PolarHBondContact OH-NE2 2.96Å; R523-H525 VanDerWaalsContact C-N 3.29Å; R523-H525 PolarHBondContact O-N 3.49Å; H525-A529 VanDerWaalsContact O-CB 3.23Å; H525-A529 WeakPolarHBondContact O-CB 3.39Å; H525-A529 PolarHBondContact O-N 3.38Å |
| 526 | M | 50.6 | Low | 54.9 | Low | 128 Ų | 128 | 90.2 Ų | 90.2 | 63% | 0.631 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.2 | -45.3 | 171.4 | -93 | -175.6 | 65.2 | 0 | 0 | 112 | S522 R523 A529 T530 | S522-M526 WeakPolarHBondContact O-CB 3.45Å; S522-M526 PolarHBondContact O-N 2.79Å; R523-M526 PolarHBondContact O-N 3.38Å; M526-A529 PolarHBondContact O-N 3.27Å; M526-T530 VanDerWaalsContact O-CB 3.31Å; M526-T530 WeakPolarHBondContact O-CB 3.26Å; M526-T530 PolarHBondContact O-N 2.88Å; M526-T530 PolarHBondContact O-OG1 3.39Å |
| 527 | D | 51.3 | Low | 53.2 | Low | 102 Ų | 102 | 95.6 Ų | 95.6 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.3 | -42.6 | 179.1 | -75.3 | -15.9 | 0 | 0 | 0 | 111 | R523 T530 L531 | R523-D527 PolarHBondContact O-N 3.45Å; D527-T530 PolarHBondContact O-N 3.33Å; D527-L531 WeakPolarHBondContact O-CB 3.3Å; D527-L531 VanDerWaalsContact O-CG 3.27Å; D527-L531 WeakPolarHBondContact O-CG 3.5Å; D527-L531 PolarHBondContact O-N 2.63Å |
| 528 | K | 53.5 | Low | 51.6 | Low | 123 Ų | 123 | 101.1 Ų | 101.1 | 54% | 0.535 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 172.9 | -74.7 | 173.7 | -176.7 | 171.7 | 0 | 112.4 | E524 T530 L531 V532 | E524-K528 WeakPolarHBondContact O-CB 3.21Å; E524-K528 VanDerWaalsContact O-CG 3.27Å; E524-K528 WeakPolarHBondContact O-CG 3.37Å; E524-K528 PolarHBondContact O-N 3.15Å; E524-K528 VanDerWaalsContact O-N 3.08Å; K528-T530 VanDerWaalsContact C-N 3.29Å; K528-T530 PolarHBondContact O-N 3.37Å; K528-L531 PolarHBondContact O-N 3.07Å; K528-V532 WeakPolarHBondContact O-CB 3.39Å; K528-V532 WeakPolarHBondContact O-CG2 3.38Å; K528-V532 PolarHBondContact O-N 2.87Å |
| 529 | A | 50.8 | Low | 50.4 | Low | 57 Ų | 57 | 106.4 Ų | 106.4 | 47% | 0.471 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67 | -32.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | H525 M526 K533 | H525-A529 VanDerWaalsContact O-CB 3.23Å; H525-A529 WeakPolarHBondContact O-CB 3.39Å; H525-A529 PolarHBondContact O-N 3.38Å; M526-A529 PolarHBondContact O-N 3.27Å; A529-K533 WeakPolarHBondContact O-CB 3.22Å; A529-K533 PolarHBondContact O-N 3.14Å |
| 530 | T | 48.2 | Very low | 49.2 | Very low | 83 Ų | 83 | 112.2 Ų | 112.2 | 51% | 0.509 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -72.8 | -42.1 | 176.6 | -53.2 | 0 | 0 | 0 | 0 | 110.6 | M526 D527 K528 K533 S534 | M526-T530 VanDerWaalsContact O-CB 3.31Å; M526-T530 WeakPolarHBondContact O-CB 3.26Å; M526-T530 PolarHBondContact O-N 2.88Å; M526-T530 PolarHBondContact O-OG1 3.39Å; D527-T530 PolarHBondContact O-N 3.33Å; K528-T530 VanDerWaalsContact C-N 3.29Å; K528-T530 PolarHBondContact O-N 3.37Å; T530-K533 PolarHBondContact O-N 3.01Å; T530-S534 PolarHBondContact O-N 3.05Å; T530-S534 PolarHBondContact O-OG 3.04Å |
| 531 | L | 45.8 | Very low | 48.2 | Very low | 110 Ų | 110 | 117.1 Ų | 117.1 | 58% | 0.576 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64.1 | -42.9 | 173.5 | -73.1 | 167.9 | 0 | 0 | 0 | 112.1 | D527 K528 K533 S534 D535 | D527-L531 WeakPolarHBondContact O-CB 3.3Å; D527-L531 VanDerWaalsContact O-CG 3.27Å; D527-L531 WeakPolarHBondContact O-CG 3.5Å; D527-L531 PolarHBondContact O-N 2.63Å; K528-L531 PolarHBondContact O-N 3.07Å; L531-K533 VanDerWaalsContact C-N 3.29Å; L531-K533 PolarHBondContact O-N 3.12Å; L531-S534 VanDerWaalsContact CA-OG 3.27Å; L531-S534 WeakPolarHBondContact CA-OG 3.49Å; L531-S534 PolarHBondContact O-N 2.75Å; L531-S534 VanDerWaalsContact O-N 3.16Å; L531-S534 PolarHBondContact O-OG 2.75Å; L531-D535 PolarHBondContact O-N 3.21Å; L531-D535 VanDerWaalsContact O-N 3.11Å |
| 532 | V | 48.9 | Very low | 47 | Very low | 100 Ų | 100 | 119.3 Ų | 119.3 | 61% | 0.606 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.2 | -30.2 | 174.7 | 172 | 0 | 0 | 0 | 0 | 111.8 | K528 | K528-V532 WeakPolarHBondContact O-CB 3.39Å; K528-V532 WeakPolarHBondContact O-CG2 3.38Å; K528-V532 PolarHBondContact O-N 2.87Å |
| 533 | K | 44.7 | Very low | 46 | Very low | 170 Ų | 170 | 120.1 Ų | 120.1 | 74% | 0.739 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.5 | -34.4 | 170.8 | -94 | -175.2 | 173.2 | -177.8 | 0 | 112.7 | A529 T530 L531 D535 N536 | A529-K533 WeakPolarHBondContact O-CB 3.22Å; A529-K533 PolarHBondContact O-N 3.14Å; T530-K533 PolarHBondContact O-N 3.01Å; L531-K533 VanDerWaalsContact C-N 3.29Å; L531-K533 PolarHBondContact O-N 3.12Å; K533-D535 VanDerWaalsContact C-N 3.34Å; K533-N536 PolarHBondContact O-N 3.16Å |
| 534 | S | 45.1 | Very low | 44.8 | Very low | 69 Ų | 69 | 118.7 Ų | 118.7 | 48% | 0.483 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -74.9 | -20.1 | 177.4 | 52.3 | 0 | 0 | 0 | 0 | 114.1 | T530 L531 N536 | T530-S534 PolarHBondContact O-N 3.05Å; T530-S534 PolarHBondContact O-OG 3.04Å; L531-S534 VanDerWaalsContact CA-OG 3.27Å; L531-S534 WeakPolarHBondContact CA-OG 3.49Å; L531-S534 PolarHBondContact O-N 2.75Å; L531-S534 VanDerWaalsContact O-N 3.16Å; L531-S534 PolarHBondContact O-OG 2.75Å; S534-N536 PolarHBondContact O-N 3.23Å |
| 535 | D | 44 | Very low | 43.5 | Very low | 133 Ų | 133 | 121 Ų | 121 | 71% | 0.711 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -1.6 | 172.8 | -74.9 | -22.3 | 0 | 0 | 0 | 113.6 | L531 K533 | L531-D535 PolarHBondContact O-N 3.21Å; L531-D535 VanDerWaalsContact O-N 3.11Å; K533-D535 VanDerWaalsContact C-N 3.34Å |
| 536 | N | 40.5 | Very low | 42.2 | Very low | 129 Ų | 129 | 123.7 Ų | 123.7 | 69% | 0.69 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -97.6 | 76.5 | 164.1 | -75 | -37 | 0 | 0 | 0 | 109.6 | K533 S534 V538 | K533-N536 PolarHBondContact O-N 3.16Å; S534-N536 PolarHBondContact O-N 3.23Å; N536-V538 PolarHBondContact O-N 3.47Å |
| 537 | I | 39.3 | Very low | 41.2 | Very low | 121 Ų | 121 | 123.2 Ų | 123.2 | 62% | 0.621 | 69% | 0.689 | S | S | * | * | trans | -65 | 106.3 | 173.7 | -60.7 | 173.9 | 0 | 0 | 0 | 108.9 | L539 | I537-L539 HydrophobicContact CG2-CD1 4.09Å; I537-L539 HydrophobicContact CG2-CG 4.24Å | ||
| 538 | V | 40.3 | Very low | 40.2 | Very low | 129 Ų | 129 | 130 Ų | 130 | 78% | 0.782 | 71% | 0.707 | S | S | * | * | trans | -80.4 | 112.1 | 154.3 | 179.4 | 0 | 0 | 0 | 0 | 106.5 | N536 N540 | N536-V538 PolarHBondContact O-N 3.47Å; V538-N540 PolarHBondContact O-N 3.21Å | ||
| 539 | L | 39.1 | Very low | 39.1 | Very low | 151 Ų | 151 | 133.3 Ų | 133.3 | 79% | 0.791 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | 19.1 | -162 | -129.9 | 116.2 | 0 | 0 | 0 | 116.5 | I537 | I537-L539 HydrophobicContact CG2-CD1 4.09Å; I537-L539 HydrophobicContact CG2-CG 4.24Å |
| 540 | N | 37.5 | Very low | 38.1 | Very low | 149 Ų | 149 | 135.9 Ų | 135.9 | 80% | 0.797 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.5 | 4.4 | -165.5 | -89.5 | 1.7 | 0 | 0 | 0 | 117.3 | V538 | V538-N540 PolarHBondContact O-N 3.21Š|
| 541 | E | 41.6 | Very low | 37.4 | Very low | 187 Ų | 187 | 140.5 Ų | 140.5 | 87% | 0.874 | 76% | 0.759 | S | S | * | * | trans | -132.2 | 31.8 | -178.4 | -68.2 | -166.4 | 174.3 | 0 | 0 | 115.5 | ||||
| 542 | L | 34.6 | Very low | 36.7 | Very low | 165 Ų | 165 | 139.4 Ų | 139.4 | 86% | 0.864 | 76% | 0.761 | S | S | * | * | trans | -101.6 | 107.9 | 167.5 | -73.4 | 168.7 | 0 | 0 | 0 | 110.2 | ||||
| 543 | A | 35.2 | Very low | 35.9 | Very low | 82 Ų | 82 | 143.6 Ų | 143.6 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | -56.8 | 144 | 167.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | V545 | A543-V545 PolarHBondContact O-N 3.28Å; A543-V545 VanDerWaalsContact O-N 3.15Å | ||
| 544 | P | 34.1 | Very low | 35.2 | Very low | 128 Ų | 128 | 140.2 Ų | 140.2 | 83% | 0.831 | 78% | 0.776 | S | S | * | * | trans | -69.6 | 115.2 | -174.3 | 27.1 | -32.2 | 0 | 0 | 0 | 110.7 | ||||
| 545 | V | 32 | Very low | 34.5 | Very low | 137 Ų | 137 | 142.1 Ų | 142.1 | 83% | 0.83 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 117.4 | 166.8 | 177.3 | 0 | 0 | 0 | 0 | 107.8 | A543 | A543-V545 PolarHBondContact O-N 3.28Å; A543-V545 VanDerWaalsContact O-N 3.15Å |
| 546 | N | 28.6 | Very low | 34 | Very low | 145 Ų | 145 | 141.8 Ų | 141.8 | 78% | 0.775 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 132.3 | 175.8 | -84.2 | -29.2 | 0 | 0 | 0 | 111.3 | R548 | N546-R548 PolarHBondContact O-N 3.37Š|
| 547 | P | 31.1 | Very low | 33.6 | Very low | 118 Ų | 118 | 145 Ų | 145 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 117.9 | 179 | 27.1 | -30.3 | 0 | 0 | 0 | 110.7 | ||
| 548 | R | 29.6 | Very low | 33.1 | Very low | 245 Ų | 245 | 145.7 Ų | 145.7 | 93% | 0.925 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 126.1 | 161.2 | -87.4 | -176.5 | 173.3 | 171.9 | -1.6 | 108.7 | N546 S550 | N546-R548 PolarHBondContact O-N 3.37Å; R548-S550 PolarHBondContact O-N 3.47Å |
| 549 | H | 30.3 | Very low | 32.6 | Very low | 191 Ų | 191 | 146.3 Ų | 146.3 | 88% | 0.884 | 81% | 0.81 | S | S | * | * | trans | -46 | 118.1 | 177.9 | -77.3 | -93.4 | 0 | 0 | 0 | 113.2 | ||||
| 550 | S | 30.4 | Very low | 32 | Very low | 112 Ų | 112 | 147.3 Ų | 147.3 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | trans | -85 | 117.3 | 159.1 | 47.5 | 0 | 0 | 0 | 0 | 108.7 | R548 S552 | R548-S550 PolarHBondContact O-N 3.47Å; S550-S552 PolarHBondContact O-N 2.97Å | ||
| 551 | L | 32.4 | Very low | 31.6 | Very low | 179 Ų | 179 | 147.9 Ų | 147.9 | 94% | 0.937 | 81% | 0.806 | S | S | * | * | trans | -69.7 | 105.8 | 166 | -91.5 | 145.8 | 0 | 0 | 0 | 107.9 | ||||
| 552 | S | 32 | Very low | 31.1 | Very low | 87 Ų | 87 | 143.1 Ų | 143.1 | 61% | 0.608 | 80% | 0.798 | S | S | * | * | trans | -79.8 | 126.9 | 173.9 | 64.3 | 0 | 0 | 0 | 0 | 110.8 | S550 S554 | S550-S552 PolarHBondContact O-N 2.97Å; S552-S554 VanDerWaalsContact C-N 3.32Å; S552-S554 PolarHBondContact O-N 3.34Å; S552-S554 PolarHBondContact OG-OG 3.33Å | ||
| 553 | L | 31.3 | Very low | 30.8 | Very low | 188 Ų | 188 | 145.2 Ų | 145.2 | 98% | 0.984 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -72.1 | 79.1 | 172.5 | -142.6 | 126 | 0 | 0 | 0 | 109.1 | ||
| 554 | S | 29.6 | Very low | 30.5 | Very low | 99 Ų | 99 | 148.2 Ų | 148.2 | 69% | 0.692 | 81% | 0.806 | S | S | * | * | trans | -154.6 | 20.8 | 178.6 | 59.3 | 0 | 0 | 0 | 0 | 115.7 | S552 | S552-S554 VanDerWaalsContact C-N 3.32Å; S552-S554 PolarHBondContact O-N 3.34Å; S552-S554 PolarHBondContact OG-OG 3.33Å | ||
| 555 | S | 30.7 | Very low | 30.2 | Very low | 110 Ų | 110 | 152.1 Ų | 152.1 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -127.6 | 74.6 | 173.6 | 54.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 556 | T | 32.6 | Very low | 30 | Very low | 126 Ų | 126 | 152.7 Ų | 152.7 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | -130.8 | 17.8 | 170.2 | -45.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 557 | F | 33.1 | Very low | 30 | Very low | 195 Ų | 195 | 152.5 Ų | 152.5 | 86% | 0.855 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -142.7 | 94.5 | 168.5 | -75.7 | -78.5 | 0 | 0 | 0 | 109.8 | ||
| 558 | T | 28.8 | Very low | 29.9 | Very low | 136 Ų | 136 | 152.4 Ų | 152.4 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | 172.7 | 133.3 | 132.4 | 29.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 559 | N | 29.1 | Very low | 29.7 | Very low | 143 Ų | 143 | 146.1 Ų | 146.1 | 77% | 0.765 | 80% | 0.804 | S | S | * | * | trans | 65.2 | 111.9 | 159.7 | -71.1 | -18.1 | 0 | 0 | 0 | 119.5 | ||||
| 560 | K | 27.4 | Very low | 30.4 | Very low | 171 Ų | 171 | 142.5 Ų | 142.5 | 74% | 0.743 | 80% | 0.797 | S | S | * | * | 65.2 | 119.4 | 72.4 | -86.4 | -165.6 | 173.2 | -170.5 | 0 | 113.5 | |||||
| 561 | E | 29.1 | Very low | 30.3 | Very low | 162 Ų | 162 | 145.8 Ų | 145.8 | 76% | 0.757 | 80% | 0.8 | S | S | * | * | trans | 74.3 | 98.4 | 157.4 | -65.6 | 163.5 | -158.4 | 0 | 0 | 114.7 | ||||
| 562 | A | 30.2 | Very low | 30.1 | Very low | 86 Ų | 86 | 144.7 Ų | 144.7 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | 54.7 | 94.8 | 79.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 563 | F | 29 | Very low | 30 | Very low | 209 Ų | 209 | 145.1 Ų | 145.1 | 92% | 0.917 | 80% | 0.798 | S | S | * | * | trans | -166 | 108.1 | 141.9 | -99.5 | -69.6 | 0 | 0 | 0 | 109.5 | ||||
| 564 | N | 28.4 | Very low | 29.9 | Very low | 146 Ų | 146 | 143.2 Ų | 143.2 | 78% | 0.781 | 79% | 0.788 | S | S | * | * | trans | -87.8 | 131.3 | 160.5 | -91 | -26.4 | 0 | 0 | 0 | 108.2 | ||||
| 565 | Y | 27.3 | Very low | 30.1 | Very low | 209 Ų | 209 | 144.1 Ų | 144.1 | 82% | 0.82 | 79% | 0.79 | S | S | * | * | trans | 36.6 | 114.3 | 139.5 | -81.2 | -92.1 | 0 | 0 | 0 | 119.6 | ||||
| 566 | V | 28.8 | Very low | 30.2 | Very low | 149 Ų | 149 | 146.5 Ų | 146.5 | 90% | 0.903 | 79% | 0.789 | S | S | * | * | -143.7 | 141.4 | 127.4 | -179.7 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 567 | D | 29.1 | Very low | 30.3 | Very low | 142 Ų | 142 | 146.7 Ų | 146.7 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | trans | -54.5 | 166 | -177.8 | -95.6 | -46.5 | 0 | 0 | 0 | 119.5 | ||||
| 568 | S | 27.9 | Very low | 30.3 | Very low | 116 Ų | 116 | 148.8 Ų | 148.8 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | 93.1 | 119.6 | 144.5 | 71.1 | 0 | 0 | 0 | 0 | 120 | ||||
| 569 | S | 26.1 | Very low | 30.4 | Very low | 113 Ų | 113 | 149.4 Ų | 149.4 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | -101.3 | 175.1 | 149.5 | -33.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 570 | P | 44.7 | Very low | 30.4 | Very low | 115 Ų | 115 | 149.7 Ų | 149.7 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | cis | -133.7 | 170.7 | -13.7 | 37.1 | -19.6 | 0 | 0 | 0 | 113.3 | ||||
| 571 | E | 28.6 | Very low | 30.6 | Very low | 181 Ų | 181 | 148.6 Ų | 148.6 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | 163.5 | 114.6 | 145.5 | -93 | 173.2 | -174.4 | 0 | 0 | 108.7 | ||||
| 572 | L | 28.3 | Very low | 30.7 | Very low | 155 Ų | 155 | 147.8 Ų | 147.8 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | 68.9 | 124.2 | 88.7 | -100.3 | 156.8 | 0 | 0 | 0 | 116.1 | |||||
| 573 | S | 29.9 | Very low | 30.7 | Very low | 97 Ų | 97 | 151.6 Ų | 151.6 | 68% | 0.678 | 82% | 0.818 | S | S | * | * | trans | 66.1 | 107.6 | 157.3 | 59.5 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 574 | N | 30 | Very low | 30.8 | Very low | 148 Ų | 148 | 147.8 Ų | 147.8 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | 82.2 | 133.1 | 87.6 | -88.4 | -1.8 | 0 | 0 | 0 | 114.1 | |||||
| 575 | T | 32.1 | Very low | 31 | Very low | 117 Ų | 117 | 147.9 Ų | 147.9 | 72% | 0.718 | 81% | 0.814 | S | S | * | * | trans | 65.7 | 143.4 | 151.1 | 48.3 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 576 | E | 33.8 | Very low | 31.3 | Very low | 161 Ų | 161 | 143.2 Ų | 143.2 | 75% | 0.752 | 81% | 0.814 | S | S | * | * | cis | -175 | 161.8 | -9.1 | -117 | 171.3 | 174.1 | 0 | 0 | 103.7 | ||||
| 577 | D | 34.2 | Very low | 31.5 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 69% | 0.69 | 81% | 0.806 | S | S | * | * | trans | 67.8 | 90.6 | 154.4 | -59.4 | -12 | 0 | 0 | 0 | 121.2 | ||||
| 578 | N | 33.5 | Very low | 31.7 | Very low | 239 Ų | 239 | 142.8 Ų | 142.8 | 100% | 1.278 | 81% | 0.81 | S | S | * | * | 168.5 | 0 | 98.4 | -94.2 | -50.4 | 0 | 0 | 0 | 111.6 |
Retrieved 578 of 578 residues in 501.3 ms
(Link to these results)