| 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 | 63.8 | Low | 74.5 | Confident | 203 Ų | 203 | 107.2 Ų | 107.2 | 100% | 1 | 57% | 0.567 | S | S | * | * | 0 | -51.3 | 0 | -155 | 173.3 | -79.3 | 0 | 0 | 111.9 | A3 I4 F5 | M1-A3 PolarHBondContact O-N 3.21Å; M1-I4 PolarHBondContact O-N 3.32Å; M1-F5 WeakPolarHBondContact O-CB 3.47Å; M1-F5 PolarHBondContact O-N 3.25Å | |||
| 2 | A | 64.7 | Low | 75.7 | Confident | 76 Ų | 76 | 109.7 Ų | 109.7 | 63% | 0.628 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -58.6 | -42.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | F5 M6 | A2-F5 PolarHBondContact O-N 3.18Å; A2-M6 WeakPolarHBondContact O-CG 3.47Å; A2-M6 PolarHBondContact O-N 3.46Å |
| 3 | A | 67.7 | Low | 76.5 | Confident | 74 Ų | 74 | 102.7 Ų | 102.7 | 61% | 0.612 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.7 | -48.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | M1 F5 M6 E7 | M1-A3 PolarHBondContact O-N 3.21Å; A3-F5 VanDerWaalsContact C-N 3.28Å; A3-F5 PolarHBondContact O-N 2.95Å; A3-M6 PolarHBondContact O-N 3.09Å; A3-M6 VanDerWaalsContact O-N 3.14Å; A3-E7 WeakPolarHBondContact O-CB 3.38Å; A3-E7 PolarHBondContact O-N 2.84Å |
| 4 | I | 71 | Confident | 77.2 | Confident | 114 Ų | 114 | 99.9 Ų | 99.9 | 59% | 0.585 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.4 | -39.7 | 176.1 | -59.9 | 171 | 0 | 0 | 0 | 110.9 | M1 T8 | M1-I4 PolarHBondContact O-N 3.32Å; I4-T8 WeakPolarHBondContact O-CG2 3.41Å; I4-T8 PolarHBondContact O-N 2.99Å; I4-T8 PolarHBondContact O-OG1 2.99Å |
| 5 | F | 68.1 | Low | 78 | Confident | 145 Ų | 145 | 100.6 Ų | 100.6 | 64% | 0.636 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.5 | -39.8 | 176 | -174.8 | -95.7 | 0 | 0 | 0 | 112.3 | M1 A2 A3 T8 F9 | M1-F5 WeakPolarHBondContact O-CB 3.47Å; M1-F5 PolarHBondContact O-N 3.25Å; A2-F5 PolarHBondContact O-N 3.18Å; A3-F5 VanDerWaalsContact C-N 3.28Å; A3-F5 PolarHBondContact O-N 2.95Å; F5-T8 WeakPolarHBondContact CA-OG1 3.3Å; F5-T8 PolarHBondContact O-OG1 3Å; F5-T8 VanDerWaalsContact O-OG1 3.06Å; F5-F9 VanDerWaalsContact O-CB 3.29Å; F5-F9 WeakPolarHBondContact O-CB 3.48Å; F5-F9 PolarHBondContact O-N 3.25Å |
| 6 | M | 71.8 | Confident | 78.8 | Confident | 117 Ų | 117 | 96.5 Ų | 96.5 | 58% | 0.576 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67.6 | -39.6 | 176.2 | -75.3 | -168.7 | 75.7 | 0 | 0 | 112.5 | A2 A3 F9 K10 | A2-M6 WeakPolarHBondContact O-CG 3.47Å; A2-M6 PolarHBondContact O-N 3.46Å; A3-M6 PolarHBondContact O-N 3.09Å; A3-M6 VanDerWaalsContact O-N 3.14Å; M6-F9 PolarHBondContact O-N 3.11Å; M6-K10 WeakPolarHBondContact O-CG 3.44Å; M6-K10 PolarHBondContact O-N 3.31Å |
| 7 | E | 77.2 | Confident | 79.4 | Confident | 126 Ų | 126 | 93.1 Ų | 93.1 | 59% | 0.589 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.5 | -52.4 | 177.1 | -167 | 169.3 | -162.5 | 0 | 0 | 110.5 | A3 F9 K10 D11 | A3-E7 WeakPolarHBondContact O-CB 3.38Å; A3-E7 PolarHBondContact O-N 2.84Å; E7-F9 PolarHBondContact O-N 3.37Å; E7-K10 PolarHBondContact O-N 2.91Å; E7-K10 VanDerWaalsContact O-N 3.13Å; E7-D11 PolarHBondContact O-N 2.99Å |
| 8 | T | 84 | Confident | 80 | Confident | 63 Ų | 63 | 91 Ų | 91 | 39% | 0.387 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.5 | -29.4 | 175.8 | 48.8 | 0 | 0 | 0 | 0 | 113.9 | I4 F5 K12 | I4-T8 WeakPolarHBondContact O-CG2 3.41Å; I4-T8 PolarHBondContact O-N 2.99Å; I4-T8 PolarHBondContact O-OG1 2.99Å; F5-T8 WeakPolarHBondContact CA-OG1 3.3Å; F5-T8 PolarHBondContact O-OG1 3Å; F5-T8 VanDerWaalsContact O-OG1 3.06Å; T8-K12 VanDerWaalsContact O-CG 3.31Å; T8-K12 WeakPolarHBondContact O-CG 3.5Å; T8-K12 PolarHBondContact O-N 3.37Å |
| 9 | F | 82.1 | Confident | 80.7 | Confident | 52 Ų | 52 | 90.3 Ų | 90.3 | 23% | 0.228 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -70.3 | -47.2 | 173.7 | -178.8 | -93.7 | 0 | 0 | 0 | 112.1 | F5 M6 E7 D11 K12 L13 N260 E261 I262 | F5-F9 VanDerWaalsContact O-CB 3.29Å; F5-F9 WeakPolarHBondContact O-CB 3.48Å; F5-F9 PolarHBondContact O-N 3.25Å; M6-F9 PolarHBondContact O-N 3.11Å; E7-F9 PolarHBondContact O-N 3.37Å; F9-D11 VanDerWaalsContact C-N 3.31Å; F9-D11 PolarHBondContact O-N 3.3Å; F9-K12 PolarHBondContact O-N 3.37Å; F9-L13 PolarHBondContact O-N 3.02Å; F9-N260 WeakPolarHBondContact CE2-OD1 3.18Å; F9-N260 WeakPolarHBondContact CZ-OD1 3.28Å; F9-E261 HydrophobicContact CZ-CB 4.15Å; F9-I262 HydrophobicContact CD2-CD1 3.8Å; F9-I262 HydrophobicContact CD2-CG1 4.44Å; F9-I262 HydrophobicContact CE2-CD1 3.46Å; F9-I262 VanDerWaalsContact CE2-CD1 3.46Å; F9-I262 HydrophobicContact CE2-CG1 3.71Å; F9-I262 HydrophobicContact CZ-CD1 4.14Å; F9-I262 HydrophobicContact CZ-CG1 3.89Å |
| 10 | K | 83.6 | Confident | 81.3 | Confident | 117 Ų | 117 | 86.3 Ų | 86.3 | 51% | 0.509 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.3 | -42.2 | 176.7 | -75.7 | -171.9 | 176 | -162.1 | 0 | 111.2 | M6 E7 K12 L13 L14 | M6-K10 WeakPolarHBondContact O-CG 3.44Å; M6-K10 PolarHBondContact O-N 3.31Å; E7-K10 PolarHBondContact O-N 2.91Å; E7-K10 VanDerWaalsContact O-N 3.13Å; K10-K12 PolarHBondContact O-N 3.33Å; K10-L13 PolarHBondContact O-N 2.9Å; K10-L14 WeakPolarHBondContact O-CB 3.41Å; K10-L14 PolarHBondContact O-N 3.45Å |
| 11 | D | 86.1 | Confident | 81.8 | Confident | 92 Ų | 92 | 82.9 Ų | 82.9 | 49% | 0.492 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 178 | -65.5 | -20.7 | 0 | 0 | 0 | 112.2 | E7 F9 L14 L15 | E7-D11 PolarHBondContact O-N 2.99Å; F9-D11 VanDerWaalsContact C-N 3.31Å; F9-D11 PolarHBondContact O-N 3.3Å; D11-L14 PolarHBondContact O-N 2.9Å; D11-L15 WeakPolarHBondContact O-CB 3.28Å; D11-L15 PolarHBondContact O-N 3.34Å |
| 12 | K | 88.1 | Confident | 83.3 | Confident | 137 Ų | 137 | 77 Ų | 77 | 60% | 0.596 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -63.8 | -41.8 | 176.7 | -76.7 | 175.4 | -178.4 | 179.1 | 0 | 112.3 | T8 F9 K10 L16 I262 | T8-K12 VanDerWaalsContact O-CG 3.31Å; T8-K12 WeakPolarHBondContact O-CG 3.5Å; T8-K12 PolarHBondContact O-N 3.37Å; F9-K12 PolarHBondContact O-N 3.37Å; K10-K12 PolarHBondContact O-N 3.33Å; K12-L16 WeakPolarHBondContact O-CB 3.31Å; K12-L16 PolarHBondContact O-N 2.95Å; K12-I262 HydrophobicContact CB-CD1 4.22Å |
| 13 | L | 87 | Confident | 84.8 | Confident | 19 Ų | 19 | 74.8 Ų | 74.8 | 10% | 0.099 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -66 | -42.4 | 178 | -179.1 | 62.1 | 0 | 0 | 0 | 111.3 | F9 K10 L16 L17 E261 I262 T265 | F9-L13 PolarHBondContact O-N 3.02Å; K10-L13 PolarHBondContact O-N 2.9Å; L13-L16 WeakPolarHBondContact O-CB 3.38Å; L13-L16 PolarHBondContact O-N 2.96Å; L13-L17 HydrophobicContact CG-CD1 4.35Å; L13-L17 WeakPolarHBondContact O-CG 3.45Å; L13-L17 PolarHBondContact O-N 3.3Å; L13-E261 HydrophobicContact CD1-CG 4.38Å; L13-E261 HydrophobicContact CD2-CG 3.96Å; L13-I262 HydrophobicContact CD1-CG1 4.4Å; L13-T265 HydrophobicContact CD1-CG2 4.18Å |
| 14 | L | 86.1 | Confident | 86.1 | Confident | 63 Ų | 63 | 72 Ų | 72 | 33% | 0.33 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.1 | -49 | 177.3 | -173 | 65.1 | 0 | 0 | 0 | 111.4 | K10 D11 L16 L17 H18 D81 | K10-L14 WeakPolarHBondContact O-CB 3.41Å; K10-L14 PolarHBondContact O-N 3.45Å; D11-L14 PolarHBondContact O-N 2.9Å; L14-L16 VanDerWaalsContact C-N 3.28Å; L14-L16 PolarHBondContact O-N 3.22Å; L14-L17 WeakPolarHBondContact O-CB 3.45Å; L14-L17 PolarHBondContact O-N 2.87Å; L14-L17 VanDerWaalsContact O-N 3.15Å; L14-H18 PolarHBondContact O-N 3.32Å; L14-D81 WeakPolarHBondContact CD1-OD1 3.34Å |
| 15 | L | 88.9 | Confident | 87.3 | Confident | 111 Ų | 111 | 68.4 Ų | 68.4 | 58% | 0.581 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -57.1 | -43.6 | 176.3 | -179.6 | 64.4 | 0 | 0 | 0 | 111.6 | D11 H18 C19 | D11-L15 WeakPolarHBondContact O-CB 3.28Å; D11-L15 PolarHBondContact O-N 3.34Å; L15-H18 PolarHBondContact O-N 3.37Å; L15-C19 PolarHBondContact O-N 3.23Å; L15-C19 PolarHBondContact O-SG 3.5Å |
| 16 | L | 90.1 | Very high | 88.7 | Confident | 35 Ų | 35 | 64.8 Ų | 64.8 | 18% | 0.183 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.9 | -46.3 | 176.9 | 175.5 | 63.3 | 0 | 0 | 0 | 111.8 | K12 L13 L14 H18 C19 I20 I262 T265 F266 | K12-L16 WeakPolarHBondContact O-CB 3.31Å; K12-L16 PolarHBondContact O-N 2.95Å; L13-L16 WeakPolarHBondContact O-CB 3.38Å; L13-L16 PolarHBondContact O-N 2.96Å; L14-L16 VanDerWaalsContact C-N 3.28Å; L14-L16 PolarHBondContact O-N 3.22Å; L16-H18 VanDerWaalsContact C-N 3.33Å; L16-H18 PolarHBondContact O-N 3.46Å; L16-C19 PolarHBondContact O-N 3.47Å; L16-I20 HydrophobicContact CD1-CD1 3.9Å; L16-I20 HydrophobicContact CD1-CG1 4.3Å; L16-I20 HydrophobicContact CG-CD1 3.82Å; L16-I20 WeakPolarHBondContact O-CD1 3.26Å; L16-I20 VanDerWaalsContact O-CG1 3.27Å; L16-I20 WeakPolarHBondContact O-CG1 3.38Å; L16-I20 PolarHBondContact O-N 2.82Å; L16-I262 HydrophobicContact CD2-CG2 3.94Å; L16-T265 HydrophobicContact CD2-CG2 4.36Å; L16-F266 HydrophobicContact CD1-CD2 4.17Å; L16-F266 HydrophobicContact CD2-CB 4.05Å |
| 17 | L | 89.1 | Confident | 89.9 | Confident | 38 Ų | 38 | 60.4 Ų | 60.4 | 20% | 0.199 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60.5 | -41.7 | 176.9 | -74.8 | 167.6 | 0 | 0 | 0 | 111.6 | L13 L14 I20 A21 T265 | L13-L17 HydrophobicContact CG-CD1 4.35Å; L13-L17 WeakPolarHBondContact O-CG 3.45Å; L13-L17 PolarHBondContact O-N 3.3Å; L14-L17 WeakPolarHBondContact O-CB 3.45Å; L14-L17 PolarHBondContact O-N 2.87Å; L14-L17 VanDerWaalsContact O-N 3.15Å; L17-I20 PolarHBondContact O-N 3.33Å; L17-A21 WeakPolarHBondContact O-CB 3.4Å; L17-A21 PolarHBondContact O-N 2.84Å; L17-T265 HydrophobicContact CD2-CG2 3.56Å; L17-T265 HydrophobicContact CG-CG2 4.16Å |
| 18 | H | 90.2 | Very high | 90.8 | Very high | 56 Ų | 56 | 54.4 Ų | 54.4 | 26% | 0.259 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -63.4 | -46.1 | 175.2 | -69.7 | 172.4 | 0 | 0 | 0 | 112.1 | L14 L15 L16 I20 A21 V22 D81 | L14-H18 PolarHBondContact O-N 3.32Å; L15-H18 PolarHBondContact O-N 3.37Å; L16-H18 VanDerWaalsContact C-N 3.33Å; L16-H18 PolarHBondContact O-N 3.46Å; H18-I20 VanDerWaalsContact C-N 3.31Å; H18-I20 PolarHBondContact O-N 2.84Å; H18-A21 PolarHBondContact O-N 3.29Å; H18-V22 WeakPolarHBondContact O-CB 3.47Å; H18-V22 VanDerWaalsContact O-CG2 3.31Å; H18-V22 WeakPolarHBondContact O-CG2 3.16Å; H18-V22 PolarHBondContact O-N 2.9Å; H18-D81 IonicContact CD2-OD1 2.87Å; H18-D81 IonicContact CE1-OD1 2.9Å; H18-D81 IonicContact CE1-OD2 2.74Å; H18-D81 PolarHBondContact CE1-OD2 3.06Å; H18-D81 IonicContact NE2-OD1 3.07Å; H18-D81 PolarHBondContact NE2-OD1 2.93Å; H18-D81 IonicContact NE2-OD2 2.91Å; H18-D81 PolarHBondContact NE2-OD2 2.97Å |
| 19 | C | 92.9 | Very high | 91.5 | Very high | 77 Ų | 77 | 56.8 Ų | 56.8 | 52% | 0.52 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -58.9 | -43.8 | 176.4 | -70.6 | 0 | 0 | 0 | 0 | 111.8 | L15 L16 A23 | L15-C19 PolarHBondContact O-N 3.23Å; L15-C19 PolarHBondContact O-SG 3.5Å; L16-C19 PolarHBondContact O-N 3.47Å; C19-A23 WeakPolarHBondContact O-CB 3.33Å; C19-A23 PolarHBondContact O-N 3.46Å |
| 20 | I | 92.8 | Very high | 92.2 | Very high | 11 Ų | 11 | 58.2 Ų | 58.2 | 6% | 0.056 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.6 | -47.2 | 176.2 | -70.1 | 162.1 | 0 | 0 | 0 | 110.5 | L16 L17 H18 V22 A23 L24 T265 N269 | L16-I20 HydrophobicContact CD1-CD1 3.9Å; L16-I20 HydrophobicContact CD1-CG1 4.3Å; L16-I20 HydrophobicContact CG-CD1 3.82Å; L16-I20 WeakPolarHBondContact O-CD1 3.26Å; L16-I20 VanDerWaalsContact O-CG1 3.27Å; L16-I20 WeakPolarHBondContact O-CG1 3.38Å; L16-I20 PolarHBondContact O-N 2.82Å; L17-I20 PolarHBondContact O-N 3.33Å; H18-I20 VanDerWaalsContact C-N 3.31Å; H18-I20 PolarHBondContact O-N 2.84Å; I20-V22 PolarHBondContact O-N 3.18Å; I20-A23 PolarHBondContact O-N 2.85Å; I20-L24 HydrophobicContact CG2-CD1 3.89Å; I20-L24 HydrophobicContact CG2-CG 4.38Å; I20-L24 WeakPolarHBondContact O-CB 3.28Å; I20-L24 WeakPolarHBondContact O-CG 3.41Å; I20-L24 PolarHBondContact O-N 2.8Å; I20-T265 HydrophobicContact CD1-CG2 4.37Å; I20-N269 HydrophobicContact CD1-CB 3.82Å; I20-N269 HydrophobicContact CG1-CB 4.36Å; I20-N269 HydrophobicContact CG2-CB 3.69Å |
| 21 | A | 92 | Very high | 92.8 | Very high | 15 Ų | 15 | 52.7 Ų | 52.7 | 12% | 0.124 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63 | -43.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L17 H18 A23 L24 L25 L78 | L17-A21 WeakPolarHBondContact O-CB 3.4Å; L17-A21 PolarHBondContact O-N 2.84Å; H18-A21 PolarHBondContact O-N 3.29Å; A21-A23 PolarHBondContact O-N 3.37Å; A21-L24 PolarHBondContact O-N 3.49Å; A21-L25 VanDerWaalsContact O-CB 3.28Å; A21-L25 WeakPolarHBondContact O-CB 3.41Å; A21-L25 PolarHBondContact O-N 2.79Å; A21-L78 HydrophobicContact CB-CD1 4.28Å; A21-L78 HydrophobicContact CB-CD2 3.78Å; A21-L78 HydrophobicContact CB-CG 3.83Å |
| 22 | V | 94.8 | Very high | 93.4 | Very high | 78 Ų | 78 | 50.2 Ų | 50.2 | 47% | 0.473 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -63 | -42 | 175.1 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | H18 I20 L25 T26 L78 | H18-V22 WeakPolarHBondContact O-CB 3.47Å; H18-V22 VanDerWaalsContact O-CG2 3.31Å; H18-V22 WeakPolarHBondContact O-CG2 3.16Å; H18-V22 PolarHBondContact O-N 2.9Å; I20-V22 PolarHBondContact O-N 3.18Å; V22-L25 PolarHBondContact O-N 3.32Å; V22-T26 HydrophobicContact CG1-CG2 4.47Å; V22-T26 WeakPolarHBondContact O-CB 3.32Å; V22-T26 WeakPolarHBondContact O-CG2 3.24Å; V22-T26 PolarHBondContact O-N 2.96Å; V22-T26 PolarHBondContact O-OG1 3.22Å; V22-L78 HydrophobicContact CG2-CD1 4.44Å |
| 23 | A | 96.3 | Very high | 93.7 | Very high | 31 Ų | 31 | 47.1 Ų | 47.1 | 26% | 0.256 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | C19 I20 A21 T26 L27 | C19-A23 WeakPolarHBondContact O-CB 3.33Å; C19-A23 PolarHBondContact O-N 3.46Å; I20-A23 PolarHBondContact O-N 2.85Å; A21-A23 PolarHBondContact O-N 3.37Å; A23-T26 WeakPolarHBondContact CA-OG1 3.15Å; A23-T26 PolarHBondContact O-OG1 3.39Å; A23-L27 WeakPolarHBondContact O-CB 3.36Å; A23-L27 VanDerWaalsContact O-CG 3.25Å; A23-L27 WeakPolarHBondContact O-CG 3.37Å; A23-L27 PolarHBondContact O-N 2.94Å |
| 24 | L | 95.5 | Very high | 94.1 | Very high | 15 Ų | 15 | 46.7 Ų | 46.7 | 8% | 0.079 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -68.7 | -36.7 | 177.2 | -70.8 | 175.1 | 0 | 0 | 0 | 112.6 | I20 A21 G28 Y70 A74 H272 I273 A276 | I20-L24 HydrophobicContact CG2-CD1 3.89Å; I20-L24 HydrophobicContact CG2-CG 4.38Å; I20-L24 WeakPolarHBondContact O-CB 3.28Å; I20-L24 WeakPolarHBondContact O-CG 3.41Å; I20-L24 PolarHBondContact O-N 2.8Å; A21-L24 PolarHBondContact O-N 3.49Å; L24-G28 WeakPolarHBondContact O-CA 3.48Å; L24-G28 PolarHBondContact O-N 2.87Å; L24-Y70 HydrophobicContact CD1-CD1 4.45Å; L24-Y70 HydrophobicContact CD2-CD1 4.1Å; L24-Y70 HydrophobicContact CD2-CE1 4.4Å; L24-Y70 HydrophobicContact CD2-CG 4.49Å; L24-A74 HydrophobicContact CB-CB 4.02Å; L24-H272 HydrophobicContact CD1-CB 4.26Å; L24-H272 HydrophobicContact CD2-CB 3.99Å; L24-I273 HydrophobicContact CD2-CG1 4.02Å; L24-I273 HydrophobicContact CG-CG1 4.4Å; L24-A276 HydrophobicContact CD2-CB 4.26Å |
| 25 | L | 95.9 | Very high | 94.5 | Very high | 39 Ų | 39 | 43.8 Ų | 43.8 | 20% | 0.204 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -65.6 | -46.1 | 176.9 | -171 | 154.2 | 0 | 0 | 0 | 110.8 | A21 V22 G28 F29 F71 A74 L75 L78 | A21-L25 VanDerWaalsContact O-CB 3.28Å; A21-L25 WeakPolarHBondContact O-CB 3.41Å; A21-L25 PolarHBondContact O-N 2.79Å; V22-L25 PolarHBondContact O-N 3.32Å; L25-G28 PolarHBondContact O-N 3.39Å; L25-F29 WeakPolarHBondContact O-CB 3.44Å; L25-F29 PolarHBondContact O-N 2.93Å; L25-F71 HydrophobicContact CD2-CD2 4.3Å; L25-F71 HydrophobicContact CD2-CE2 3.85Å; L25-F71 HydrophobicContact CG-CD2 4.03Å; L25-F71 HydrophobicContact CG-CE2 3.93Å; L25-A74 HydrophobicContact CB-CB 4.15Å; L25-L75 HydrophobicContact CD1-CB 4.18Å; L25-L75 HydrophobicContact CD1-CD1 4.16Å; L25-L78 HydrophobicContact CD1-CD1 4.06Å |
| 26 | T | 97.1 | Very high | 94.7 | Very high | 68 Ų | 68 | 40.9 Ų | 40.9 | 42% | 0.417 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -65.2 | -47 | 177.8 | 51.7 | 0 | 0 | 0 | 0 | 111.9 | V22 A23 G28 F29 L30 | V22-T26 HydrophobicContact CG1-CG2 4.47Å; V22-T26 WeakPolarHBondContact O-CB 3.32Å; V22-T26 WeakPolarHBondContact O-CG2 3.24Å; V22-T26 PolarHBondContact O-N 2.96Å; V22-T26 PolarHBondContact O-OG1 3.22Å; A23-T26 WeakPolarHBondContact CA-OG1 3.15Å; A23-T26 PolarHBondContact O-OG1 3.39Å; T26-G28 PolarHBondContact O-N 3.32Å; T26-F29 PolarHBondContact O-N 3.1Å; T26-L30 WeakPolarHBondContact O-CB 3.47Å; T26-L30 VanDerWaalsContact O-CG 3.31Å; T26-L30 WeakPolarHBondContact O-CG 3.44Å; T26-L30 PolarHBondContact O-N 2.91Å |
| 27 | L | 97.4 | Very high | 94.8 | Very high | 26 Ų | 26 | 41.3 Ų | 41.3 | 14% | 0.136 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64 | -40 | 175.2 | -70.4 | 173.5 | 0 | 0 | 0 | 112.1 | A23 L30 S31 I273 A276 L277 V280 | A23-L27 WeakPolarHBondContact O-CB 3.36Å; A23-L27 VanDerWaalsContact O-CG 3.25Å; A23-L27 WeakPolarHBondContact O-CG 3.37Å; A23-L27 PolarHBondContact O-N 2.94Å; L27-L30 PolarHBondContact O-N 2.88Å; L27-S31 WeakPolarHBondContact O-CB 3.2Å; L27-S31 PolarHBondContact O-N 2.93Å; L27-I273 HydrophobicContact CD1-CG2 4.1Å; L27-A276 HydrophobicContact CB-CB 3.81Å; L27-A276 HydrophobicContact CD1-CB 4.12Å; L27-L277 HydrophobicContact CD1-CB 4.42Å; L27-L277 HydrophobicContact CD2-CD1 4.17Å; L27-V280 HydrophobicContact CD2-CG2 4.25Å; L27-V280 VanDerWaalsContact O-CG2 3.31Å; L27-V280 WeakPolarHBondContact O-CG2 3.3Å |
| 28 | G | 96.7 | Very high | 94.8 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.3 | -48.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L24 L25 T26 S31 I32 | L24-G28 WeakPolarHBondContact O-CA 3.48Å; L24-G28 PolarHBondContact O-N 2.87Å; L25-G28 PolarHBondContact O-N 3.39Å; T26-G28 PolarHBondContact O-N 3.32Å; G28-S31 WeakPolarHBondContact O-CB 3.36Å; G28-S31 PolarHBondContact O-N 2.87Å; G28-I32 VanDerWaalsContact O-CG1 3.31Å; G28-I32 WeakPolarHBondContact O-CG1 3.44Å; G28-I32 PolarHBondContact O-N 3.08Å |
| 29 | F | 97.6 | Very high | 94.9 | Very high | 112 Ų | 112 | 38.2 Ų | 38.2 | 49% | 0.491 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -59.7 | -48.2 | 175.3 | 179.8 | -102 | 0 | 0 | 0 | 112.3 | L25 T26 S31 I32 V33 F71 | L25-F29 WeakPolarHBondContact O-CB 3.44Å; L25-F29 PolarHBondContact O-N 2.93Å; T26-F29 PolarHBondContact O-N 3.1Å; F29-S31 VanDerWaalsContact C-N 3.28Å; F29-S31 PolarHBondContact O-N 3.21Å; F29-I32 PolarHBondContact O-N 3.21Å; F29-V33 HydrophobicContact CD1-CG2 4.35Å; F29-V33 HydrophobicContact CE1-CG2 3.92Å; F29-V33 HydrophobicContact CE2-CG2 4.15Å; F29-V33 HydrophobicContact CZ-CG2 3.81Å; F29-V33 WeakPolarHBondContact O-CG2 3.33Å; F29-V33 PolarHBondContact O-N 3.1Å; F29-F71 HydrophobicContact CB-CD2 4.03Å; F29-F71 HydrophobicContact CB-CE2 4.11Å; F29-F71 HydrophobicContact CD2-CE2 4.34Å |
| 30 | L | 97.5 | Very high | 94.7 | Very high | 82 Ų | 82 | 39.3 Ų | 39.3 | 43% | 0.429 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -59.7 | -39.1 | 176.5 | -72.9 | 173.9 | 0 | 0 | 0 | 111.9 | T26 L27 V33 S34 V280 | T26-L30 WeakPolarHBondContact O-CB 3.47Å; T26-L30 VanDerWaalsContact O-CG 3.31Å; T26-L30 WeakPolarHBondContact O-CG 3.44Å; T26-L30 PolarHBondContact O-N 2.91Å; L27-L30 PolarHBondContact O-N 2.88Å; L30-V33 PolarHBondContact O-N 3.38Å; L30-S34 WeakPolarHBondContact O-CB 3.26Å; L30-S34 PolarHBondContact O-N 3.42Å; L30-S34 PolarHBondContact O-OG 2.92Å; L30-V280 HydrophobicContact CB-CG1 4.32Å; L30-V280 HydrophobicContact CB-CG2 3.87Å |
| 31 | S | 97 | Very high | 94.5 | Very high | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.007 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.6 | -42.7 | 176.6 | -170.4 | 0 | 0 | 0 | 0 | 111.7 | L27 G28 F29 S34 S35 D63 A279 | L27-S31 WeakPolarHBondContact O-CB 3.2Å; L27-S31 PolarHBondContact O-N 2.93Å; G28-S31 WeakPolarHBondContact O-CB 3.36Å; G28-S31 PolarHBondContact O-N 2.87Å; F29-S31 VanDerWaalsContact C-N 3.28Å; F29-S31 PolarHBondContact O-N 3.21Å; S31-S34 WeakPolarHBondContact CA-OG 3.17Å; S31-S34 PolarHBondContact O-OG 3.44Å; S31-S35 WeakPolarHBondContact O-CB 3.37Å; S31-S35 PolarHBondContact O-N 3.26Å; S31-S35 PolarHBondContact O-OG 3.36Å; S31-D63 PolarHBondContact OG-O 3.12Å; S31-A279 VanDerWaalsContact OG-CB 3.26Å; S31-A279 WeakPolarHBondContact OG-CB 3.01Å |
| 32 | I | 97.3 | Very high | 94.2 | Very high | 41 Ų | 41 | 38.8 Ų | 38.8 | 21% | 0.21 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.9 | -51.2 | 176.4 | -66.4 | 164.3 | 0 | 0 | 0 | 110.3 | G28 F29 S36 L64 M68 F71 | G28-I32 VanDerWaalsContact O-CG1 3.31Å; G28-I32 WeakPolarHBondContact O-CG1 3.44Å; G28-I32 PolarHBondContact O-N 3.08Å; F29-I32 PolarHBondContact O-N 3.21Å; I32-S36 WeakPolarHBondContact O-CB 3.35Å; I32-S36 PolarHBondContact O-N 3.03Å; I32-S36 PolarHBondContact O-OG 2.98Å; I32-L64 HydrophobicContact CB-CD1 4.3Å; I32-L64 HydrophobicContact CG1-CD1 4.39Å; I32-L64 HydrophobicContact CG2-CD1 4.03Å; I32-M68 HydrophobicContact CD1-CG 4.15Å; I32-M68 HydrophobicContact CG1-CG 4.04Å; I32-F71 HydrophobicContact CD1-CB 4.01Å; I32-F71 HydrophobicContact CD1-CG 4.24Å |
| 33 | V | 96.1 | Very high | 93.7 | Very high | 72 Ų | 72 | 41.3 Ų | 41.3 | 44% | 0.436 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.5 | -48.4 | -178.2 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | F29 L30 S37 | F29-V33 HydrophobicContact CD1-CG2 4.35Å; F29-V33 HydrophobicContact CE1-CG2 3.92Å; F29-V33 HydrophobicContact CE2-CG2 4.15Å; F29-V33 HydrophobicContact CZ-CG2 3.81Å; F29-V33 WeakPolarHBondContact O-CG2 3.33Å; F29-V33 PolarHBondContact O-N 3.1Å; L30-V33 PolarHBondContact O-N 3.38Å; V33-S37 WeakPolarHBondContact O-CB 3.39Å; V33-S37 PolarHBondContact O-N 3.12Å; V33-S37 PolarHBondContact O-OG 3.4Å |
| 34 | S | 94.4 | Very high | 93.2 | Very high | 9 Ų | 9 | 46.4 Ų | 46.4 | 6% | 0.063 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -69.6 | -43.7 | -175.9 | 61 | 0 | 0 | 0 | 0 | 112.8 | L30 S31 S37 V38 Y283 | L30-S34 WeakPolarHBondContact O-CB 3.26Å; L30-S34 PolarHBondContact O-N 3.42Å; L30-S34 PolarHBondContact O-OG 2.92Å; S31-S34 WeakPolarHBondContact CA-OG 3.17Å; S31-S34 PolarHBondContact O-OG 3.44Å; S34-S37 WeakPolarHBondContact O-CB 3.35Å; S34-S37 PolarHBondContact O-N 3.19Å; S34-V38 PolarHBondContact O-N 2.92Å; S34-Y283 WeakPolarHBondContact O-CD2 3.38Å |
| 35 | S | 94.5 | Very high | 92.6 | Very high | 3 Ų | 3 | 46.5 Ų | 46.5 | 2% | 0.021 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -68.4 | -40.7 | 177.8 | -58.3 | 0 | 0 | 0 | 0 | 111.9 | S31 S37 V38 L39 D63 L64 | S31-S35 WeakPolarHBondContact O-CB 3.37Å; S31-S35 PolarHBondContact O-N 3.26Å; S31-S35 PolarHBondContact O-OG 3.36Å; S35-S37 VanDerWaalsContact C-N 3.27Å; S35-S37 PolarHBondContact O-N 2.98Å; S35-V38 PolarHBondContact O-N 3.41Å; S35-L39 WeakPolarHBondContact O-CG 3.27Å; S35-L39 PolarHBondContact O-N 3.06Å; S35-D63 VanDerWaalsContact OG-CB 3.27Å; S35-D63 WeakPolarHBondContact OG-CB 3.39Å; S35-L64 PolarHBondContact OG-N 3.06Å |
| 36 | S | 93.9 | Very high | 91.9 | Very high | 49 Ų | 49 | 53 Ų | 53 | 34% | 0.343 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -60.9 | -39.2 | 172.9 | -60.6 | 0 | 0 | 0 | 0 | 111.4 | I32 L39 F40 | I32-S36 WeakPolarHBondContact O-CB 3.35Å; I32-S36 PolarHBondContact O-N 3.03Å; I32-S36 PolarHBondContact O-OG 2.98Å; S36-L39 PolarHBondContact O-N 3.23Å; S36-F40 VanDerWaalsContact O-CB 3.24Å; S36-F40 WeakPolarHBondContact O-CB 3.01Å; S36-F40 PolarHBondContact O-N 2.93Å |
| 37 | S | 90.9 | Very high | 90.8 | Very high | 45 Ų | 45 | 53.1 Ų | 53.1 | 32% | 0.315 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.8 | -44.2 | 175.6 | -61.9 | 0 | 0 | 0 | 0 | 112 | V33 S34 S35 F40 M41 | V33-S37 WeakPolarHBondContact O-CB 3.39Å; V33-S37 PolarHBondContact O-N 3.12Å; V33-S37 PolarHBondContact O-OG 3.4Å; S34-S37 WeakPolarHBondContact O-CB 3.35Å; S34-S37 PolarHBondContact O-N 3.19Å; S35-S37 VanDerWaalsContact C-N 3.27Å; S35-S37 PolarHBondContact O-N 2.98Å; S37-F40 PolarHBondContact O-N 3.37Å; S37-M41 WeakPolarHBondContact O-CB 3.39Å; S37-M41 WeakPolarHBondContact O-CG 3.48Å; S37-M41 PolarHBondContact O-N 3.26Å |
| 38 | V | 90 | Very high | 89.9 | Confident | 9 Ų | 9 | 52 Ų | 52 | 6% | 0.055 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.6 | -49.7 | 175.4 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | S34 S35 F40 M41 V42 S60 Y283 F293 | S34-V38 PolarHBondContact O-N 2.92Å; S35-V38 PolarHBondContact O-N 3.41Å; V38-F40 VanDerWaalsContact C-N 3.33Å; V38-F40 PolarHBondContact O-N 3Å; V38-M41 PolarHBondContact O-N 3.42Å; V38-V42 HydrophobicContact CG1-CG2 4.23Å; V38-V42 WeakPolarHBondContact O-CG2 3.43Å; V38-V42 PolarHBondContact O-N 3.37Å; V38-S60 VanDerWaalsContact CG1-OG 3.23Å; V38-S60 WeakPolarHBondContact CG1-OG 3.32Å; V38-Y283 HydrophobicContact CG2-CD2 3.46Å; V38-Y283 VanDerWaalsContact CG2-CD2 3.46Å; V38-Y283 HydrophobicContact CG2-CE2 4.1Å; V38-Y283 HydrophobicContact CG2-CG 4.48Å; V38-F293 HydrophobicContact CB-CE2 4.36Å; V38-F293 HydrophobicContact CB-CZ 4.43Å; V38-F293 HydrophobicContact CG1-CE2 4.2Å; V38-F293 HydrophobicContact CG2-CE2 3.97Å; V38-F293 HydrophobicContact CG2-CZ 3.7Å |
| 39 | L | 91.2 | Very high | 89 | Confident | 19 Ų | 19 | 58.5 Ų | 58.5 | 10% | 0.099 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.9 | -47.3 | 179.9 | -68.9 | 173.7 | 0 | 0 | 0 | 110.7 | S35 S36 M41 V42 F43 I57 I61 L64 | S35-L39 WeakPolarHBondContact O-CG 3.27Å; S35-L39 PolarHBondContact O-N 3.06Å; S36-L39 PolarHBondContact O-N 3.23Å; L39-M41 VanDerWaalsContact C-N 3.34Å; L39-M41 PolarHBondContact O-N 3.02Å; L39-V42 PolarHBondContact O-N 3.5Å; L39-F43 HydrophobicContact CB-CD2 4.35Å; L39-F43 HydrophobicContact CB-CE2 4.21Å; L39-F43 WeakPolarHBondContact O-CB 3.4Å; L39-F43 WeakPolarHBondContact O-CD2 3.48Å; L39-F43 WeakPolarHBondContact O-CG 3.48Å; L39-F43 PolarHBondContact O-N 3.48Å; L39-I57 HydrophobicContact CD2-CG2 4.08Å; L39-I61 HydrophobicContact CD1-CG1 4.34Å; L39-I61 HydrophobicContact CD2-CG1 4.03Å; L39-L64 HydrophobicContact CD1-CD2 3.86Å |
| 40 | F | 90.4 | Very high | 87.9 | Confident | 101 Ų | 101 | 54.8 Ų | 54.8 | 44% | 0.443 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -57.9 | -44.5 | 176 | 178.2 | -103.9 | 0 | 0 | 0 | 112.3 | S36 S37 V38 F43 K44 V300 | S36-F40 VanDerWaalsContact O-CB 3.24Å; S36-F40 WeakPolarHBondContact O-CB 3.01Å; S36-F40 PolarHBondContact O-N 2.93Å; S37-F40 PolarHBondContact O-N 3.37Å; V38-F40 VanDerWaalsContact C-N 3.33Å; V38-F40 PolarHBondContact O-N 3Å; F40-F43 PolarHBondContact O-N 3.32Å; F40-K44 HydrophobicContact CD2-CG 4.3Å; F40-K44 HydrophobicContact CE1-CG 4.12Å; F40-K44 HydrophobicContact CE2-CD 4.39Å; F40-K44 HydrophobicContact CE2-CG 3.9Å; F40-K44 HydrophobicContact CZ-CD 4.37Å; F40-K44 HydrophobicContact CZ-CG 3.8Å; F40-K44 WeakPolarHBondContact O-CB 3.42Å; F40-K44 WeakPolarHBondContact O-CG 3.36Å; F40-K44 PolarHBondContact O-N 3.31Å; F40-V300 HydrophobicContact CE1-CG1 3.81Å |
| 41 | M | 87.3 | Confident | 86.8 | Confident | 9 Ų | 9 | 54 Ų | 54 | 4% | 0.044 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 176.9 | -70.8 | -66.5 | 140.2 | 0 | 0 | 112.1 | S37 V38 L39 K44 A45 L48 F293 Q297 V300 L301 | S37-M41 WeakPolarHBondContact O-CB 3.39Å; S37-M41 WeakPolarHBondContact O-CG 3.48Å; S37-M41 PolarHBondContact O-N 3.26Å; V38-M41 PolarHBondContact O-N 3.42Å; L39-M41 VanDerWaalsContact C-N 3.34Å; L39-M41 PolarHBondContact O-N 3.02Å; M41-K44 PolarHBondContact O-N 3.15Å; M41-A45 VanDerWaalsContact O-CB 3.3Å; M41-A45 WeakPolarHBondContact O-CB 3.48Å; M41-A45 PolarHBondContact O-N 2.81Å; M41-L48 HydrophobicContact CB-CD1 4.23Å; M41-F293 HydrophobicContact CB-CE2 4.06Å; M41-F293 HydrophobicContact CB-CZ 4.47Å; M41-F293 HydrophobicContact CG-CZ 4.43Å; M41-Q297 HydrophobicContact SD-CB 4.46Å; M41-V300 HydrophobicContact CE-CB 3.74Å; M41-V300 HydrophobicContact CE-CG1 3.43Å; M41-V300 VanDerWaalsContact CE-CG1 3.43Å; M41-V300 HydrophobicContact CE-CG2 4.5Å; M41-V300 HydrophobicContact SD-CB 3.66Å; M41-V300 HydrophobicContact SD-CG1 3.93Å; M41-V300 HydrophobicContact SD-CG2 3.89Å; M41-L301 HydrophobicContact CE-CD2 3.93Å; M41-L301 HydrophobicContact CE-CG 4.06Å |
| 42 | V | 86.1 | Confident | 85.6 | Confident | 5 Ų | 5 | 54.1 Ų | 54.1 | 3% | 0.03 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 178.3 | 174.8 | 0 | 0 | 0 | 0 | 111.5 | V38 L39 L48 F53 I57 | V38-V42 HydrophobicContact CG1-CG2 4.23Å; V38-V42 WeakPolarHBondContact O-CG2 3.43Å; V38-V42 PolarHBondContact O-N 3.37Å; L39-V42 PolarHBondContact O-N 3.5Å; V42-L48 HydrophobicContact CG2-CB 4.21Å; V42-L48 HydrophobicContact CG2-CD1 4.15Å; V42-F53 HydrophobicContact CG2-CD1 4.22Å; V42-I57 HydrophobicContact CB-CG1 4.42Å; V42-I57 HydrophobicContact CG1-CD1 3.55Å; V42-I57 HydrophobicContact CG1-CG1 3.67Å |
| 43 | F | 85.5 | Confident | 84.7 | Confident | 132 Ų | 132 | 52.2 Ų | 52.2 | 58% | 0.579 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -67.8 | -37 | 174.3 | -75 | -59.1 | 0 | 0 | 0 | 112.3 | L39 F40 R49 | L39-F43 HydrophobicContact CB-CD2 4.35Å; L39-F43 HydrophobicContact CB-CE2 4.21Å; L39-F43 WeakPolarHBondContact O-CB 3.4Å; L39-F43 WeakPolarHBondContact O-CD2 3.48Å; L39-F43 WeakPolarHBondContact O-CG 3.48Å; L39-F43 PolarHBondContact O-N 3.48Å; F40-F43 PolarHBondContact O-N 3.32Å; F43-R49 PolarHBondContact O-NH2 2.86Å |
| 44 | K | 85.1 | Confident | 84 | Confident | 137 Ų | 137 | 51.8 Ų | 51.8 | 60% | 0.596 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -78.9 | -40.9 | 179.2 | -73 | -69 | -176.1 | -179.9 | 0 | 113.2 | F40 M41 K46 V300 | F40-K44 HydrophobicContact CD2-CG 4.3Å; F40-K44 HydrophobicContact CE1-CG 4.12Å; F40-K44 HydrophobicContact CE2-CD 4.39Å; F40-K44 HydrophobicContact CE2-CG 3.9Å; F40-K44 HydrophobicContact CZ-CD 4.37Å; F40-K44 HydrophobicContact CZ-CG 3.8Å; F40-K44 WeakPolarHBondContact O-CB 3.42Å; F40-K44 WeakPolarHBondContact O-CG 3.36Å; F40-K44 PolarHBondContact O-N 3.31Å; M41-K44 PolarHBondContact O-N 3.15Å; K44-K46 PolarHBondContact O-N 3.09Å; K44-V300 HydrophobicContact CB-CG2 4.27Å |
| 45 | A | 83.7 | Confident | 83.5 | Confident | 17 Ų | 17 | 51.6 Ų | 51.6 | 14% | 0.14 | 26% | 0.257 | C | S | . | . | trans | -94.7 | 102 | -174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | M41 A47 L48 A296 | M41-A45 VanDerWaalsContact O-CB 3.3Å; M41-A45 WeakPolarHBondContact O-CB 3.48Å; M41-A45 PolarHBondContact O-N 2.81Å; A45-A47 PolarHBondContact O-N 3.34Å; A45-L48 HydrophobicContact CB-CB 4.47Å; A45-L48 HydrophobicContact CB-CD1 3.97Å; A45-L48 HydrophobicContact CB-CG 3.91Å; A45-L48 PolarHBondContact O-N 3.23Å; A45-A296 HydrophobicContact CB-CB 3.83Å | ||
| 46 | K | 79.4 | Confident | 82.9 | Confident | 175 Ų | 175 | 52 Ų | 52 | 76% | 0.761 | 26% | 0.259 | S | S | * | . | G | 310 helix | trans | -52.3 | -31.6 | 174.6 | -68.3 | -174.9 | -178.7 | -179.8 | 0 | 113.1 | K44 L48 R49 | K44-K46 PolarHBondContact O-N 3.09Å; K46-L48 PolarHBondContact O-N 2.63Å; K46-R49 WeakPolarHBondContact O-CB 3.26Å; K46-R49 PolarHBondContact O-N 2.78Å |
| 47 | A | 75.8 | Confident | 82.7 | Confident | 72 Ų | 72 | 51.1 Ų | 51.1 | 60% | 0.595 | 25% | 0.25 | S | C | * | . | G | 310 helix | trans | -62.4 | -27.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | A45 R49 | A45-A47 PolarHBondContact O-N 3.34Å; A47-R49 VanDerWaalsContact C-N 3.31Å |
| 48 | L | 77.7 | Confident | 82.7 | Confident | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 24% | 0.243 | C | C | . | . | G | 310 helix | trans | -85.1 | -1.2 | 175.4 | -56.1 | 179.2 | 0 | 0 | 0 | 112.1 | M41 V42 A45 K46 S50 F53 E292 F293 A296 | M41-L48 HydrophobicContact CB-CD1 4.23Å; V42-L48 HydrophobicContact CG2-CB 4.21Å; V42-L48 HydrophobicContact CG2-CD1 4.15Å; A45-L48 HydrophobicContact CB-CB 4.47Å; A45-L48 HydrophobicContact CB-CD1 3.97Å; A45-L48 HydrophobicContact CB-CG 3.91Å; A45-L48 PolarHBondContact O-N 3.23Å; K46-L48 PolarHBondContact O-N 2.63Å; L48-S50 PolarHBondContact O-N 2.89Å; L48-F53 HydrophobicContact CB-CD1 4.13Å; L48-F53 HydrophobicContact CB-CD2 4.17Å; L48-F53 HydrophobicContact CB-CE1 4.16Å; L48-F53 HydrophobicContact CB-CE2 4.19Å; L48-F53 HydrophobicContact CB-CG 4.19Å; L48-F53 HydrophobicContact CB-CZ 4.23Å; L48-F53 HydrophobicContact CD2-CD1 4.47Å; L48-F53 HydrophobicContact CD2-CD2 4.48Å; L48-F53 HydrophobicContact CD2-CE1 3.67Å; L48-F53 HydrophobicContact CD2-CE2 3.67Å; L48-F53 HydrophobicContact CD2-CZ 3.22Å; L48-F53 HydrophobicContact CG-CE1 4.33Å; L48-F53 HydrophobicContact CG-CZ 4.24Å; L48-F53 WeakPolarHBondContact O-CB 3.34Å; L48-F53 WeakPolarHBondContact O-CD2 3.49Å; L48-F53 WeakPolarHBondContact O-CG 3.38Å; L48-E292 HydrophobicContact CD2-CB 4.29Å; L48-F293 HydrophobicContact CD1-CD2 4.08Å; L48-A296 HydrophobicContact CD1-CB 3.63Å; L48-A296 HydrophobicContact CD2-CB 4.11Å; L48-A296 HydrophobicContact CG-CB 3.95Å |
| 49 | R | 77.4 | Confident | 82.9 | Confident | 137 Ų | 137 | 50.2 Ų | 50.2 | 52% | 0.517 | 24% | 0.244 | S | C | . | . | trans | -87.9 | 51.2 | 177 | -58.4 | -177.6 | -170.2 | 176.8 | -0.6 | 110.7 | F43 K46 A47 | F43-R49 PolarHBondContact O-NH2 2.86Å; K46-R49 WeakPolarHBondContact O-CB 3.26Å; K46-R49 PolarHBondContact O-N 2.78Å; A47-R49 VanDerWaalsContact C-N 3.31Å | ||
| 50 | S | 74.8 | Confident | 82.9 | Confident | 35 Ų | 35 | 49.8 Ų | 49.8 | 25% | 0.245 | 24% | 0.242 | C | C | . | . | S | Bend | trans | -100.1 | 170.8 | 178.3 | 87.6 | 0 | 0 | 0 | 0 | 111.5 | L48 Y52 F53 M54 | L48-S50 PolarHBondContact O-N 2.89Å; S50-Y52 VanDerWaalsContact C-N 3.31Å; S50-Y52 PolarHBondContact O-N 2.75Å; S50-F53 PolarHBondContact O-N 3.39Å; S50-F53 WeakPolarHBondContact OG-CD2 3.31Å; S50-M54 PolarHBondContact O-N 3.35Å |
| 51 | R | 74.5 | Confident | 83.2 | Confident | 64 Ų | 64 | 49.6 Ų | 49.6 | 24% | 0.242 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -55.3 | -46.8 | -177.9 | -46.5 | -171.1 | -176.9 | -167.6 | -2.4 | 111.8 | F53 M54 Y126 R127 V129 I131 | R51-F53 VanDerWaalsContact C-N 3.3Å; R51-F53 PolarHBondContact O-N 3.22Å; R51-M54 WeakPolarHBondContact O-CB 3.35Å; R51-M54 PolarHBondContact O-N 2.69Å; R51-M54 VanDerWaalsContact O-N 3.14Å; R51-Y126 PolarHBondContact NH1-O 2.91Å; R51-R127 VanDerWaalsContact CZ-O 3.28Å; R51-R127 VanDerWaalsContact NH1-C 3.26Å; R51-R127 PolarHBondContact NH1-O 2.87Å; R51-R127 PolarHBondContact NH2-O 3.02Å; R51-V129 PolarHBondContact NH1-O 3.44Å; R51-I131 HydrophobicContact CB-CG1 4.23Å; R51-I131 HydrophobicContact CG-CD1 3.99Å; R51-I131 HydrophobicContact CG-CG1 3.7Å |
| 52 | Y | 71.3 | Confident | 83.6 | Confident | 4 Ų | 4 | 49.3 Ų | 49.3 | 2% | 0.016 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -57.8 | -37.6 | 175.3 | 156.9 | -111.1 | 0 | 0 | 0 | 113.9 | S50 M54 T55 M56 V230 T233 L234 | S50-Y52 VanDerWaalsContact C-N 3.31Å; S50-Y52 PolarHBondContact O-N 2.75Å; Y52-M54 VanDerWaalsContact C-N 3.27Å; Y52-M54 PolarHBondContact O-N 2.92Å; Y52-T55 PolarHBondContact O-OG1 3.12Å; Y52-T55 VanDerWaalsContact O-OG1 3.09Å; Y52-M56 HydrophobicContact CD1-CE 3.74Å; Y52-M56 HydrophobicContact CD2-CE 4.31Å; Y52-M56 HydrophobicContact CE1-CE 3.04Å; Y52-M56 HydrophobicContact CE1-SD 4.22Å; Y52-M56 HydrophobicContact CE2-CE 3.7Å; Y52-M56 HydrophobicContact CE2-CG 4.45Å; Y52-M56 HydrophobicContact CE2-SD 3.98Å; Y52-M56 HydrophobicContact CG-CE 4.34Å; Y52-M56 VanDerWaalsContact CZ-SD 3.6Å; Y52-M56 WeakPolarHBondContact OH-CE 3.21Å; Y52-M56 PolarHBondContact OH-SD 3.49Å; Y52-V230 HydrophobicContact CD1-CG1 3.67Å; Y52-V230 HydrophobicContact CD2-CB 3.79Å; Y52-V230 HydrophobicContact CD2-CG1 3.69Å; Y52-V230 HydrophobicContact CD2-CG2 4.25Å; Y52-V230 HydrophobicContact CE1-CB 4.45Å; Y52-V230 HydrophobicContact CE1-CG1 3.83Å; Y52-V230 HydrophobicContact CE2-CB 3.69Å; Y52-V230 HydrophobicContact CE2-CG1 3.86Å; Y52-V230 HydrophobicContact CE2-CG2 4.49Å; Y52-V230 HydrophobicContact CG-CB 4.21Å; Y52-V230 HydrophobicContact CG-CG1 3.57Å; Y52-T233 WeakPolarHBondContact OH-CB 3.31Å; Y52-T233 WeakPolarHBondContact OH-CG2 3.34Å; Y52-L234 HydrophobicContact CD2-CD1 3.96Å; Y52-L234 HydrophobicContact CD2-CD2 4.16Å; Y52-L234 HydrophobicContact CD2-CG 4.19Å; Y52-L234 HydrophobicContact CE2-CD1 3.9Å; Y52-L234 HydrophobicContact CE2-CD2 3.52Å; Y52-L234 HydrophobicContact CE2-CG 3.61Å |
| 53 | F | 78.2 | Confident | 84.1 | Confident | 2 Ų | 2 | 49.2 Ų | 49.2 | 1% | 0.009 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -76 | -15 | -179.4 | -79.4 | -83.7 | 0 | 0 | 0 | 112.6 | V42 L48 S50 R51 M56 I57 F293 | V42-F53 HydrophobicContact CG2-CD1 4.22Å; L48-F53 HydrophobicContact CB-CD1 4.13Å; L48-F53 HydrophobicContact CB-CD2 4.17Å; L48-F53 HydrophobicContact CB-CE1 4.16Å; L48-F53 HydrophobicContact CB-CE2 4.19Å; L48-F53 HydrophobicContact CB-CG 4.19Å; L48-F53 HydrophobicContact CB-CZ 4.23Å; L48-F53 HydrophobicContact CD2-CD1 4.47Å; L48-F53 HydrophobicContact CD2-CD2 4.48Å; L48-F53 HydrophobicContact CD2-CE1 3.67Å; L48-F53 HydrophobicContact CD2-CE2 3.67Å; L48-F53 HydrophobicContact CD2-CZ 3.22Å; L48-F53 HydrophobicContact CG-CE1 4.33Å; L48-F53 HydrophobicContact CG-CZ 4.24Å; L48-F53 WeakPolarHBondContact O-CB 3.34Å; L48-F53 WeakPolarHBondContact O-CD2 3.49Å; L48-F53 WeakPolarHBondContact O-CG 3.38Å; S50-F53 PolarHBondContact O-N 3.39Å; S50-F53 WeakPolarHBondContact OG-CD2 3.31Å; R51-F53 VanDerWaalsContact C-N 3.3Å; R51-F53 PolarHBondContact O-N 3.22Å; F53-M56 HydrophobicContact CD1-CE 3.17Å; F53-M56 HydrophobicContact CE1-CE 3.25Å; F53-M56 HydrophobicContact CG-CE 3.83Å; F53-M56 HydrophobicContact CZ-CE 3.98Å; F53-M56 CarbonylContact O-C 3.32Å; F53-M56 PolarHBondContact O-N 3.35Å; F53-I57 WeakPolarHBondContact O-CG1 3.39Å; F53-I57 PolarHBondContact O-N 2.97Å; F53-F293 HydrophobicContact CE1-CD2 4.49Å |
| 54 | M | 82 | Confident | 84.6 | Confident | 63 Ų | 63 | 44.6 Ų | 44.6 | 31% | 0.31 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.4 | -45.9 | 177.8 | -70.6 | -61 | -60.1 | 0 | 0 | 112.7 | S50 R51 Y52 M56 I57 A58 I131 H135 | S50-M54 PolarHBondContact O-N 3.35Å; R51-M54 WeakPolarHBondContact O-CB 3.35Å; R51-M54 PolarHBondContact O-N 2.69Å; R51-M54 VanDerWaalsContact O-N 3.14Å; Y52-M54 VanDerWaalsContact C-N 3.27Å; Y52-M54 PolarHBondContact O-N 2.92Å; M54-M56 VanDerWaalsContact C-N 3.27Å; M54-M56 PolarHBondContact O-N 3.09Å; M54-I57 PolarHBondContact O-N 3.27Å; M54-I57 HydrophobicContact SD-CD1 4Å; M54-A58 PolarHBondContact O-N 3.3Å; M54-I131 HydrophobicContact CG-CG2 3.8Å; M54-H135 HydrophobicContact CB-CB 4.49Å |
| 55 | T | 83.3 | Confident | 85.1 | Confident | 4 Ų | 4 | 40.5 Ų | 40.5 | 3% | 0.025 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66 | -33.5 | 174.4 | 46.2 | 0 | 0 | 0 | 0 | 111.3 | Y52 A58 I59 L112 V139 | Y52-T55 PolarHBondContact O-OG1 3.12Å; Y52-T55 VanDerWaalsContact O-OG1 3.09Å; T55-A58 PolarHBondContact O-N 3.13Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.26Å; T55-I59 PolarHBondContact O-N 2.9Å; T55-L112 HydrophobicContact CG2-CD2 4.35Å; T55-L112 WeakPolarHBondContact OG1-CD2 3.24Å; T55-V139 HydrophobicContact CG2-CG2 4.44Å |
| 56 | M | 83.1 | Confident | 85.7 | Confident | 13 Ų | 13 | 39.8 Ų | 39.8 | 6% | 0.064 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -70.9 | -35.1 | 173.9 | -73.6 | -161.4 | -60.4 | 0 | 0 | 113.2 | Y52 F53 M54 A58 I59 S60 V286 | Y52-M56 HydrophobicContact CD1-CE 3.74Å; Y52-M56 HydrophobicContact CD2-CE 4.31Å; Y52-M56 HydrophobicContact CE1-CE 3.04Å; Y52-M56 HydrophobicContact CE1-SD 4.22Å; Y52-M56 HydrophobicContact CE2-CE 3.7Å; Y52-M56 HydrophobicContact CE2-CG 4.45Å; Y52-M56 HydrophobicContact CE2-SD 3.98Å; Y52-M56 HydrophobicContact CG-CE 4.34Å; Y52-M56 VanDerWaalsContact CZ-SD 3.6Å; Y52-M56 WeakPolarHBondContact OH-CE 3.21Å; Y52-M56 PolarHBondContact OH-SD 3.49Å; F53-M56 HydrophobicContact CD1-CE 3.17Å; F53-M56 HydrophobicContact CE1-CE 3.25Å; F53-M56 HydrophobicContact CG-CE 3.83Å; F53-M56 HydrophobicContact CZ-CE 3.98Å; F53-M56 CarbonylContact O-C 3.32Å; F53-M56 PolarHBondContact O-N 3.35Å; M54-M56 VanDerWaalsContact C-N 3.27Å; M54-M56 PolarHBondContact O-N 3.09Å; M56-A58 VanDerWaalsContact C-N 3.32Å; M56-I59 PolarHBondContact O-N 3.21Å; M56-S60 WeakPolarHBondContact O-CB 3.19Å; M56-S60 PolarHBondContact O-N 3.19Å; M56-S60 PolarHBondContact O-OG 2.89Å; M56-V286 HydrophobicContact SD-CG1 4.39Å; M56-V286 HydrophobicContact SD-CG2 3.65Å |
| 57 | I | 89.3 | Confident | 86.6 | Confident | 30 Ų | 30 | 31.5 Ų | 31.5 | 15% | 0.154 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.3 | -46.7 | 170.9 | -69.3 | 162.2 | 0 | 0 | 0 | 109.1 | L39 V42 F53 M54 I59 S60 I61 | L39-I57 HydrophobicContact CD2-CG2 4.08Å; V42-I57 HydrophobicContact CB-CG1 4.42Å; V42-I57 HydrophobicContact CG1-CD1 3.55Å; V42-I57 HydrophobicContact CG1-CG1 3.67Å; F53-I57 WeakPolarHBondContact O-CG1 3.39Å; F53-I57 PolarHBondContact O-N 2.97Å; M54-I57 PolarHBondContact O-N 3.27Å; M54-I57 HydrophobicContact SD-CD1 4Å; I57-I59 VanDerWaalsContact C-N 3.33Å; I57-I59 PolarHBondContact O-N 3.49Å; I57-S60 PolarHBondContact O-N 2.92Å; I57-I61 HydrophobicContact CG2-CD1 3.77Å; I57-I61 HydrophobicContact CG2-CG1 4.33Å; I57-I61 VanDerWaalsContact O-CG1 3.29Å; I57-I61 WeakPolarHBondContact O-CG1 3.37Å; I57-I61 PolarHBondContact O-N 3.02Å |
| 58 | A | 91.3 | Very high | 87.6 | Confident | 21 Ų | 21 | 31.7 Ų | 31.7 | 17% | 0.174 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.8 | -43.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | M54 T55 M56 I61 N62 V139 | M54-A58 PolarHBondContact O-N 3.3Å; T55-A58 PolarHBondContact O-N 3.13Å; M56-A58 VanDerWaalsContact C-N 3.32Å; A58-I61 PolarHBondContact O-N 3.43Å; A58-N62 PolarHBondContact O-N 3.32Å; A58-V139 HydrophobicContact CB-CG1 3.89Å; A58-V139 HydrophobicContact CB-CG2 4.16Å |
| 59 | I | 92.6 | Very high | 88.4 | Confident | 14 Ų | 14 | 32.3 Ų | 32.3 | 7% | 0.072 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.1 | -47.9 | 173.4 | -70.9 | 164.2 | 0 | 0 | 0 | 110.8 | T55 M56 I57 I61 N62 D63 L112 N282 | T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.26Å; T55-I59 PolarHBondContact O-N 2.9Å; M56-I59 PolarHBondContact O-N 3.21Å; I57-I59 VanDerWaalsContact C-N 3.33Å; I57-I59 PolarHBondContact O-N 3.49Å; I59-I61 VanDerWaalsContact C-N 3.31Å; I59-I61 PolarHBondContact O-N 3.49Å; I59-N62 CarbonylContact O-C 3.56Å; I59-N62 WeakPolarHBondContact O-CA 3.46Å; I59-N62 WeakPolarHBondContact O-CB 3.31Å; I59-N62 PolarHBondContact O-N 2.9Å; I59-N62 VanDerWaalsContact O-N 3.09Å; I59-D63 VanDerWaalsContact CG2-OD2 3.28Å; I59-D63 WeakPolarHBondContact CG2-OD2 3.22Å; I59-D63 WeakPolarHBondContact O-CB 3.45Å; I59-D63 PolarHBondContact O-N 3.38Å; I59-L112 HydrophobicContact CD1-CD1 3.45Å; I59-L112 VanDerWaalsContact CD1-CD1 3.45Å; I59-L112 HydrophobicContact CD1-CD2 4.27Å; I59-L112 HydrophobicContact CD1-CG 3.89Å; I59-N282 WeakPolarHBondContact CG2-ND2 3.44Å |
| 60 | S | 93.2 | Very high | 89.2 | Confident | 10 Ų | 10 | 26.1 Ų | 26.1 | 7% | 0.07 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -64.7 | -32.5 | 179.4 | -61.2 | 0 | 0 | 0 | 0 | 113.3 | V38 M56 I57 L64 | V38-S60 VanDerWaalsContact CG1-OG 3.23Å; V38-S60 WeakPolarHBondContact CG1-OG 3.32Å; M56-S60 WeakPolarHBondContact O-CB 3.19Å; M56-S60 PolarHBondContact O-N 3.19Å; M56-S60 PolarHBondContact O-OG 2.89Å; I57-S60 PolarHBondContact O-N 2.92Å; S60-L64 VanDerWaalsContact O-CB 3.27Å; S60-L64 WeakPolarHBondContact O-CB 3.35Å; S60-L64 PolarHBondContact O-N 3.42Å |
| 61 | I | 94.9 | Very high | 90.1 | Very high | 96 Ų | 96 | 27.1 Ų | 27.1 | 49% | 0.492 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -66 | -44.8 | 171.6 | -69.4 | 167.6 | 0 | 0 | 0 | 109.9 | L39 I57 A58 I59 L64 L65 | L39-I61 HydrophobicContact CD1-CG1 4.34Å; L39-I61 HydrophobicContact CD2-CG1 4.03Å; I57-I61 HydrophobicContact CG2-CD1 3.77Å; I57-I61 HydrophobicContact CG2-CG1 4.33Å; I57-I61 VanDerWaalsContact O-CG1 3.29Å; I57-I61 WeakPolarHBondContact O-CG1 3.37Å; I57-I61 PolarHBondContact O-N 3.02Å; A58-I61 PolarHBondContact O-N 3.43Å; I59-I61 VanDerWaalsContact C-N 3.31Å; I59-I61 PolarHBondContact O-N 3.49Å; I61-L64 PolarHBondContact O-N 2.79Å; I61-L65 WeakPolarHBondContact O-CB 3.29Å; I61-L65 PolarHBondContact O-N 3.23Å |
| 62 | N | 95.9 | Very high | 91 | Very high | 3 Ų | 3 | 29.2 Ų | 29.2 | 2% | 0.016 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.4 | -43 | 175.6 | -174.8 | 76.3 | 0 | 0 | 0 | 112.1 | A58 I59 L65 T66 C101 N104 | A58-N62 PolarHBondContact O-N 3.32Å; I59-N62 CarbonylContact O-C 3.56Å; I59-N62 WeakPolarHBondContact O-CA 3.46Å; I59-N62 WeakPolarHBondContact O-CB 3.31Å; I59-N62 PolarHBondContact O-N 2.9Å; I59-N62 VanDerWaalsContact O-N 3.09Å; N62-L65 PolarHBondContact O-N 2.93Å; N62-T66 VanDerWaalsContact O-CB 3.28Å; N62-T66 WeakPolarHBondContact O-CB 3.4Å; N62-T66 PolarHBondContact O-N 2.66Å; N62-T66 PolarHBondContact O-OG1 2.96Å; N62-C101 PolarHBondContact ND2-O 2.96Å; N62-N104 WeakPolarHBondContact OD1-CB 3.21Å; N62-N104 PolarHBondContact OD1-ND2 2.94Å |
| 63 | D | 96.2 | Very high | 91.9 | Very high | 4 Ų | 4 | 31.3 Ų | 31.3 | 2% | 0.021 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -66.8 | -38.7 | -179.8 | -68.5 | -16.1 | 0 | 0 | 0 | 111.2 | S31 S35 I59 T66 G67 A279 N282 | S31-D63 PolarHBondContact OG-O 3.12Å; S35-D63 VanDerWaalsContact OG-CB 3.27Å; S35-D63 WeakPolarHBondContact OG-CB 3.39Å; I59-D63 VanDerWaalsContact CG2-OD2 3.28Å; I59-D63 WeakPolarHBondContact CG2-OD2 3.22Å; I59-D63 WeakPolarHBondContact O-CB 3.45Å; I59-D63 PolarHBondContact O-N 3.38Å; D63-T66 WeakPolarHBondContact O-CB 3.49Å; D63-T66 PolarHBondContact O-N 3.37Å; D63-G67 PolarHBondContact O-N 3.29Å; D63-A279 HydrophobicContact CB-CB 3.78Å; D63-N282 PolarHBondContact OD1-ND2 2.89Å; D63-N282 WeakPolarHBondContact OD2-CB 3.24Å; D63-N282 PolarHBondContact OD2-ND2 3.41Å |
| 64 | L | 96.7 | Very high | 92.5 | Very high | 35 Ų | 35 | 31.6 Ų | 31.6 | 18% | 0.183 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.6 | -49.2 | 171.4 | 179.3 | 59.9 | 0 | 0 | 0 | 111 | I32 S35 L39 S60 I61 T66 G67 M68 | I32-L64 HydrophobicContact CB-CD1 4.3Å; I32-L64 HydrophobicContact CG1-CD1 4.39Å; I32-L64 HydrophobicContact CG2-CD1 4.03Å; S35-L64 PolarHBondContact OG-N 3.06Å; L39-L64 HydrophobicContact CD1-CD2 3.86Å; S60-L64 VanDerWaalsContact O-CB 3.27Å; S60-L64 WeakPolarHBondContact O-CB 3.35Å; S60-L64 PolarHBondContact O-N 3.42Å; I61-L64 PolarHBondContact O-N 2.79Å; L64-T66 VanDerWaalsContact C-N 3.33Å; L64-T66 PolarHBondContact O-N 3.17Å; L64-G67 PolarHBondContact O-N 3.23Å; L64-M68 HydrophobicContact CG-CE 4.17Å; L64-M68 WeakPolarHBondContact O-CG 3.49Å; L64-M68 PolarHBondContact O-N 3.01Å |
| 65 | L | 96.5 | Very high | 93 | Very high | 51 Ų | 51 | 32 Ų | 32 | 27% | 0.267 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -60.5 | -44.5 | 177 | -177.3 | 62.9 | 0 | 0 | 0 | 111.3 | I61 N62 G67 M68 V69 F100 | I61-L65 WeakPolarHBondContact O-CB 3.29Å; I61-L65 PolarHBondContact O-N 3.23Å; N62-L65 PolarHBondContact O-N 2.93Å; L65-G67 VanDerWaalsContact C-N 3.31Å; L65-G67 PolarHBondContact O-N 2.92Å; L65-M68 HydrophobicContact CB-CE 4.48Å; L65-M68 HydrophobicContact CD1-CE 4.02Å; L65-M68 PolarHBondContact O-N 2.8Å; L65-V69 HydrophobicContact CD1-CG2 4.23Å; L65-V69 HydrophobicContact CG-CG2 4.41Å; L65-V69 VanDerWaalsContact O-CG2 3.29Å; L65-V69 WeakPolarHBondContact O-CG2 3.46Å; L65-V69 PolarHBondContact O-N 3.15Å; L65-F100 HydrophobicContact CD2-CD1 3.85Å; L65-F100 HydrophobicContact CD2-CE1 3.84Å |
| 66 | T | 96.3 | Very high | 93.2 | Very high | 1 Ų | 1 | 36.4 Ų | 36.4 | 1% | 0.006 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -56.6 | -46.9 | 175.4 | -59.4 | 0 | 0 | 0 | 0 | 110.6 | N62 D63 L64 V69 Y70 C101 T275 A279 | N62-T66 VanDerWaalsContact O-CB 3.28Å; N62-T66 WeakPolarHBondContact O-CB 3.4Å; N62-T66 PolarHBondContact O-N 2.66Å; N62-T66 PolarHBondContact O-OG1 2.96Å; D63-T66 WeakPolarHBondContact O-CB 3.49Å; D63-T66 PolarHBondContact O-N 3.37Å; L64-T66 VanDerWaalsContact C-N 3.33Å; L64-T66 PolarHBondContact O-N 3.17Å; T66-V69 PolarHBondContact O-N 2.91Å; T66-Y70 HydrophobicContact CG2-CD2 3.62Å; T66-Y70 HydrophobicContact CG2-CE2 3.51Å; T66-Y70 WeakPolarHBondContact O-CD2 3.44Å; T66-Y70 PolarHBondContact O-N 3.4Å; T66-C101 HydrophobicContact CG2-CB 4.45Å; T66-C101 WeakPolarHBondContact OG1-CB 3.23Å; T66-T275 HydrophobicContact CG2-CG2 4.07Å; T66-A279 HydrophobicContact CG2-CB 4.19Å |
| 67 | G | 96.8 | Very high | 93.3 | Very high | 1 Ų | 1 | 36.7 Ų | 36.7 | 1% | 0.01 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.5 | -47.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | D63 L64 L65 F71 | D63-G67 PolarHBondContact O-N 3.29Å; L64-G67 PolarHBondContact O-N 3.23Å; L65-G67 VanDerWaalsContact C-N 3.31Å; L65-G67 PolarHBondContact O-N 2.92Å; G67-F71 WeakPolarHBondContact O-CB 3.49Å; G67-F71 PolarHBondContact O-N 2.93Å |
| 68 | M | 96.7 | Very high | 93.2 | Very high | 76 Ų | 76 | 37.9 Ų | 37.9 | 37% | 0.374 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -60.9 | -46.9 | 177.5 | -70.3 | -172.6 | -63.3 | 0 | 0 | 112.1 | I32 L64 L65 F71 I72 | I32-M68 HydrophobicContact CD1-CG 4.15Å; I32-M68 HydrophobicContact CG1-CG 4.04Å; L64-M68 HydrophobicContact CG-CE 4.17Å; L64-M68 WeakPolarHBondContact O-CG 3.49Å; L64-M68 PolarHBondContact O-N 3.01Å; L65-M68 HydrophobicContact CB-CE 4.48Å; L65-M68 HydrophobicContact CD1-CE 4.02Å; L65-M68 PolarHBondContact O-N 2.8Å; M68-F71 PolarHBondContact O-N 3.49Å; M68-I72 WeakPolarHBondContact O-CB 3.36Å; M68-I72 VanDerWaalsContact O-CG1 3.26Å; M68-I72 WeakPolarHBondContact O-CG1 3.4Å; M68-I72 PolarHBondContact O-N 3.25Å |
| 69 | V | 94.5 | Very high | 93 | Very high | 14 Ų | 14 | 43.2 Ų | 43.2 | 9% | 0.085 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.2 | -49 | -178.8 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | L65 T66 F71 I72 L73 L97 L98 | L65-V69 HydrophobicContact CD1-CG2 4.23Å; L65-V69 HydrophobicContact CG-CG2 4.41Å; L65-V69 VanDerWaalsContact O-CG2 3.29Å; L65-V69 WeakPolarHBondContact O-CG2 3.46Å; L65-V69 PolarHBondContact O-N 3.15Å; T66-V69 PolarHBondContact O-N 2.91Å; V69-F71 PolarHBondContact O-N 3.4Å; V69-I72 PolarHBondContact O-N 3.48Å; V69-L73 HydrophobicContact CG1-CD1 3.68Å; V69-L73 HydrophobicContact CG1-CG 4.34Å; V69-L73 WeakPolarHBondContact O-CB 3.35Å; V69-L73 VanDerWaalsContact O-CG 3.28Å; V69-L73 WeakPolarHBondContact O-CG 3.33Å; V69-L73 PolarHBondContact O-N 2.97Å; V69-L97 HydrophobicContact CG1-CB 4.47Å; V69-L97 HydrophobicContact CG2-CB 4.21Å; V69-L98 HydrophobicContact CG1-CD2 3.47Å; V69-L98 VanDerWaalsContact CG1-CD2 3.47Å; V69-L98 HydrophobicContact CG1-CG 3.84Å |
| 70 | Y | 94.5 | Very high | 92.4 | Very high | 7 Ų | 7 | 44.9 Ų | 44.9 | 3% | 0.027 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.6 | -39.3 | 178.6 | -77.3 | -58.2 | 0 | 0 | 0 | 112.7 | L24 T66 A74 L98 H272 T275 A276 | L24-Y70 HydrophobicContact CD1-CD1 4.45Å; L24-Y70 HydrophobicContact CD2-CD1 4.1Å; L24-Y70 HydrophobicContact CD2-CE1 4.4Å; L24-Y70 HydrophobicContact CD2-CG 4.49Å; T66-Y70 HydrophobicContact CG2-CD2 3.62Å; T66-Y70 HydrophobicContact CG2-CE2 3.51Å; T66-Y70 WeakPolarHBondContact O-CD2 3.44Å; T66-Y70 PolarHBondContact O-N 3.4Å; Y70-A74 WeakPolarHBondContact O-CB 3.27Å; Y70-A74 PolarHBondContact O-N 3.47Å; Y70-L98 HydrophobicContact CD1-CD2 3.82Å; Y70-L98 HydrophobicContact CE1-CD2 3.34Å; Y70-L98 HydrophobicContact CE2-CD2 4.35Å; Y70-L98 HydrophobicContact CG-CD2 4.47Å; Y70-H272 HydrophobicContact CE1-CB 3.59Å; Y70-H272 AromaticContact CE1-CG 3.81Å; Y70-H272 AromaticContact CE1-ND1 3.55Å; Y70-H272 AromaticContact CZ-ND1 3.7Å; Y70-H272 WeakPolarHBondContact OH-CA 3.21Å; Y70-H272 PolarHBondContact OH-ND1 3.39Å; Y70-T275 HydrophobicContact CE2-CG2 4.04Å; Y70-A276 HydrophobicContact CD2-CB 3.88Å; Y70-A276 HydrophobicContact CE2-CB 4.16Å; Y70-A276 HydrophobicContact CG-CB 4.46Å |
| 71 | F | 95 | Very high | 91.2 | Very high | 57 Ų | 57 | 47 Ų | 47 | 25% | 0.25 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.8 | -50 | 176.9 | -175.7 | -91.5 | 0 | 0 | 0 | 111.5 | L25 F29 I32 G67 M68 V69 L75 | L25-F71 HydrophobicContact CD2-CD2 4.3Å; L25-F71 HydrophobicContact CD2-CE2 3.85Å; L25-F71 HydrophobicContact CG-CD2 4.03Å; L25-F71 HydrophobicContact CG-CE2 3.93Å; F29-F71 HydrophobicContact CB-CD2 4.03Å; F29-F71 HydrophobicContact CB-CE2 4.11Å; F29-F71 HydrophobicContact CD2-CE2 4.34Å; I32-F71 HydrophobicContact CD1-CB 4.01Å; I32-F71 HydrophobicContact CD1-CG 4.24Å; G67-F71 WeakPolarHBondContact O-CB 3.49Å; G67-F71 PolarHBondContact O-N 2.93Å; M68-F71 PolarHBondContact O-N 3.49Å; V69-F71 PolarHBondContact O-N 3.4Å; F71-L75 HydrophobicContact CE1-CD2 4.14Å; F71-L75 WeakPolarHBondContact O-CB 3.34Å; F71-L75 PolarHBondContact O-N 2.97Å |
| 72 | I | 93.1 | Very high | 89.7 | Confident | 107 Ų | 107 | 46.4 Ų | 46.4 | 55% | 0.549 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.6 | -47.1 | -178.9 | -67.8 | 167.5 | 0 | 0 | 0 | 110.9 | M68 V69 Y76 | M68-I72 WeakPolarHBondContact O-CB 3.36Å; M68-I72 VanDerWaalsContact O-CG1 3.26Å; M68-I72 WeakPolarHBondContact O-CG1 3.4Å; M68-I72 PolarHBondContact O-N 3.25Å; V69-I72 PolarHBondContact O-N 3.48Å; I72-Y76 VanDerWaalsContact O-CB 3.23Å; I72-Y76 WeakPolarHBondContact O-CB 3.48Å; I72-Y76 PolarHBondContact O-N 2.91Å |
| 73 | L | 89.8 | Confident | 88.1 | Confident | 48 Ų | 48 | 51.9 Ų | 51.9 | 25% | 0.251 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -68 | -40.2 | -177.8 | -68.5 | 177.6 | 0 | 0 | 0 | 112.3 | V69 G77 K94 L98 | V69-L73 HydrophobicContact CG1-CD1 3.68Å; V69-L73 HydrophobicContact CG1-CG 4.34Å; V69-L73 WeakPolarHBondContact O-CB 3.35Å; V69-L73 VanDerWaalsContact O-CG 3.28Å; V69-L73 WeakPolarHBondContact O-CG 3.33Å; V69-L73 PolarHBondContact O-N 2.97Å; L73-G77 PolarHBondContact O-N 3.48Å; L73-K94 HydrophobicContact CD2-CB 4.5Å; L73-L98 HydrophobicContact CD1-CD1 3.59Å; L73-L98 HydrophobicContact CD1-CD2 4.04Å; L73-L98 HydrophobicContact CD1-CG 3.77Å |
| 74 | A | 91.3 | Very high | 86.5 | Confident | 9 Ų | 9 | 53.3 Ų | 53.3 | 7% | 0.074 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.3 | -43 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L24 L25 Y70 G77 L78 | L24-A74 HydrophobicContact CB-CB 4.02Å; L25-A74 HydrophobicContact CB-CB 4.15Å; Y70-A74 WeakPolarHBondContact O-CB 3.27Å; Y70-A74 PolarHBondContact O-N 3.47Å; A74-G77 PolarHBondContact O-N 2.59Å; A74-L78 PolarHBondContact O-N 3.06Å |
| 75 | L | 92 | Very high | 85.1 | Confident | 72 Ų | 72 | 58.3 Ų | 58.3 | 38% | 0.377 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.3 | -46.6 | 175.3 | 179.8 | 63 | 0 | 0 | 0 | 111 | L25 F71 G77 L78 L79 | L25-L75 HydrophobicContact CD1-CB 4.18Å; L25-L75 HydrophobicContact CD1-CD1 4.16Å; F71-L75 HydrophobicContact CE1-CD2 4.14Å; F71-L75 WeakPolarHBondContact O-CB 3.34Å; F71-L75 PolarHBondContact O-N 2.97Å; L75-G77 VanDerWaalsContact C-N 3.28Å; L75-G77 PolarHBondContact O-N 2.78Å; L75-L78 PolarHBondContact O-N 3.09Å; L75-L79 HydrophobicContact CD1-CD1 4.44Å; L75-L79 HydrophobicContact CG-CD1 4.22Å; L75-L79 WeakPolarHBondContact O-CG 3.45Å; L75-L79 PolarHBondContact O-N 3.35Å; L75-L79 VanDerWaalsContact O-N 3.1Å |
| 76 | Y | 87.6 | Confident | 84.1 | Confident | 96 Ų | 96 | 60 Ų | 60 | 38% | 0.376 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.4 | -38.3 | 176.4 | -172.7 | -101.9 | 0 | 0 | 0 | 111.7 | I72 L79 M80 F164 | I72-Y76 VanDerWaalsContact O-CB 3.23Å; I72-Y76 WeakPolarHBondContact O-CB 3.48Å; I72-Y76 PolarHBondContact O-N 2.91Å; Y76-L79 PolarHBondContact O-N 2.96Å; Y76-M80 HydrophobicContact CD1-CG 4.19Å; Y76-M80 HydrophobicContact CD2-CG 4.35Å; Y76-M80 HydrophobicContact CE1-CG 3.81Å; Y76-M80 HydrophobicContact CE2-CG 3.99Å; Y76-M80 HydrophobicContact CE2-SD 4.44Å; Y76-M80 HydrophobicContact CG-CG 4.45Å; Y76-M80 WeakPolarHBondContact O-CB 3.17Å; Y76-M80 VanDerWaalsContact O-CG 3.28Å; Y76-M80 WeakPolarHBondContact O-CG 2.9Å; Y76-M80 PolarHBondContact O-N 3.2Å; Y76-M80 VanDerWaalsContact O-N 3.13Å; Y76-F164 AromaticContact CD1-CE2 3.56Å; Y76-F164 HydrophobicContact CD1-CE2 3.56Å; Y76-F164 AromaticContact CD1-CZ 3.6Å; Y76-F164 HydrophobicContact CD1-CZ 3.6Å; Y76-F164 HydrophobicContact CE1-CD2 4.38Å; Y76-F164 AromaticContact CE1-CE2 3.62Å; Y76-F164 HydrophobicContact CE1-CE2 3.62Å; Y76-F164 HydrophobicContact CE1-CZ 4.01Å |
| 77 | G | 85.1 | Confident | 83.2 | Confident | 19 Ų | 19 | 64.4 Ų | 64.4 | 20% | 0.196 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | L73 A74 L75 L79 M80 | L73-G77 PolarHBondContact O-N 3.48Å; A74-G77 PolarHBondContact O-N 2.59Å; L75-G77 VanDerWaalsContact C-N 3.28Å; L75-G77 PolarHBondContact O-N 2.78Å; G77-L79 VanDerWaalsContact C-N 3.34Å; G77-L79 PolarHBondContact O-N 3.36Å; G77-M80 PolarHBondContact O-N 3.32Å |
| 78 | L | 87.5 | Confident | 82.5 | Confident | 55 Ų | 55 | 65.2 Ų | 65.2 | 29% | 0.288 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.8 | -35.3 | 175.8 | -70.7 | 170.8 | 0 | 0 | 0 | 112.6 | A21 V22 L25 A74 L75 M80 | A21-L78 HydrophobicContact CB-CD1 4.28Å; A21-L78 HydrophobicContact CB-CD2 3.78Å; A21-L78 HydrophobicContact CB-CG 3.83Å; V22-L78 HydrophobicContact CG2-CD1 4.44Å; L25-L78 HydrophobicContact CD1-CD1 4.06Å; A74-L78 PolarHBondContact O-N 3.06Å; L75-L78 PolarHBondContact O-N 3.09Å; L78-M80 VanDerWaalsContact C-N 3.31Å; L78-M80 PolarHBondContact O-N 3.07Å |
| 79 | L | 87 | Confident | 81.8 | Confident | 132 Ų | 132 | 65.7 Ų | 65.7 | 69% | 0.691 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -73.9 | -22.3 | 178.6 | -67.9 | 173.1 | 0 | 0 | 0 | 113.2 | L75 Y76 G77 | L75-L79 HydrophobicContact CD1-CD1 4.44Å; L75-L79 HydrophobicContact CG-CD1 4.22Å; L75-L79 WeakPolarHBondContact O-CG 3.45Å; L75-L79 PolarHBondContact O-N 3.35Å; L75-L79 VanDerWaalsContact O-N 3.1Å; Y76-L79 PolarHBondContact O-N 2.96Å; G77-L79 VanDerWaalsContact C-N 3.34Å; G77-L79 PolarHBondContact O-N 3.36Å |
| 80 | M | 79.2 | Confident | 81.4 | Confident | 49 Ų | 49 | 69.5 Ų | 69.5 | 24% | 0.241 | 39% | 0.388 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.7 | 19.4 | -174.5 | -66.4 | -68.2 | -75.6 | 0 | 0 | 113.2 | Y76 G77 L78 G82 K83 S84 | Y76-M80 HydrophobicContact CD1-CG 4.19Å; Y76-M80 HydrophobicContact CD2-CG 4.35Å; Y76-M80 HydrophobicContact CE1-CG 3.81Å; Y76-M80 HydrophobicContact CE2-CG 3.99Å; Y76-M80 HydrophobicContact CE2-SD 4.44Å; Y76-M80 HydrophobicContact CG-CG 4.45Å; Y76-M80 WeakPolarHBondContact O-CB 3.17Å; Y76-M80 VanDerWaalsContact O-CG 3.28Å; Y76-M80 WeakPolarHBondContact O-CG 2.9Å; Y76-M80 PolarHBondContact O-N 3.2Å; Y76-M80 VanDerWaalsContact O-N 3.13Å; G77-M80 PolarHBondContact O-N 3.32Å; L78-M80 VanDerWaalsContact C-N 3.31Å; L78-M80 PolarHBondContact O-N 3.07Å; M80-G82 VanDerWaalsContact C-N 3.26Å; M80-G82 PolarHBondContact O-N 3.31Å; M80-G82 VanDerWaalsContact O-N 3.13Å; M80-K83 HydrophobicContact CE-CB 4.03Å; M80-K83 HydrophobicContact CE-CD 3.61Å; M80-K83 HydrophobicContact CE-CG 4.43Å; M80-K83 CarbonylContact O-C 3.55Å; M80-K83 WeakPolarHBondContact O-CA 3.08Å; M80-K83 PolarHBondContact O-N 2.98Å; M80-K83 HydrophobicContact SD-CD 4.35Å; M80-S84 PolarHBondContact O-N 2.79Å |
| 81 | D | 68.6 | Low | 81.1 | Confident | 55 Ų | 55 | 69.1 Ų | 69.1 | 29% | 0.294 | 39% | 0.387 | S | S | . | . | G | 310 helix | trans | -51.1 | -41 | -172.7 | -155.5 | 35.8 | 0 | 0 | 0 | 113.7 | L14 H18 K83 S84 | L14-D81 WeakPolarHBondContact CD1-OD1 3.34Å; H18-D81 IonicContact CD2-OD1 2.87Å; H18-D81 IonicContact CE1-OD1 2.9Å; H18-D81 IonicContact CE1-OD2 2.74Å; H18-D81 PolarHBondContact CE1-OD2 3.06Å; H18-D81 IonicContact NE2-OD1 3.07Å; H18-D81 PolarHBondContact NE2-OD1 2.93Å; H18-D81 IonicContact NE2-OD2 2.91Å; H18-D81 PolarHBondContact NE2-OD2 2.97Å; D81-K83 PolarHBondContact O-N 3.27Å; D81-S84 PolarHBondContact O-OG 3.45Å |
| 82 | G | 62.8 | Low | 81 | Confident | 84 Ų | 84 | 66.6 Ų | 66.6 | 87% | 0.866 | 38% | 0.376 | S | S | * | . | G | 310 helix | trans | -76 | -0.3 | 177 | 0 | 0 | 0 | 0 | 0 | 115.9 | M80 | M80-G82 VanDerWaalsContact C-N 3.26Å; M80-G82 PolarHBondContact O-N 3.31Å; M80-G82 VanDerWaalsContact O-N 3.13Å |
| 83 | K | 63 | Low | 80.9 | Confident | 117 Ų | 117 | 64.5 Ų | 64.5 | 51% | 0.509 | 37% | 0.37 | S | S | . | . | G | 310 helix | trans | -126 | 15.6 | -178.1 | -70.4 | -176.7 | 179.6 | 177 | 0 | 112.1 | M80 D81 E85 N86 | M80-K83 HydrophobicContact CE-CB 4.03Å; M80-K83 HydrophobicContact CE-CD 3.61Å; M80-K83 HydrophobicContact CE-CG 4.43Å; M80-K83 CarbonylContact O-C 3.55Å; M80-K83 WeakPolarHBondContact O-CA 3.08Å; M80-K83 PolarHBondContact O-N 2.98Å; M80-K83 HydrophobicContact SD-CD 4.35Å; D81-K83 PolarHBondContact O-N 3.27Å; K83-E85 VanDerWaalsContact C-N 3.26Å; K83-E85 PolarHBondContact O-N 3.4Å; K83-N86 WeakPolarHBondContact CB-ND2 3.47Å; K83-N86 WeakPolarHBondContact CG-ND2 3.19Å; K83-N86 VanDerWaalsContact O-CB 3.25Å; K83-N86 WeakPolarHBondContact O-CB 3.27Å; K83-N86 PolarHBondContact O-N 3.29Å |
| 84 | S | 63.5 | Low | 80.8 | Confident | 34 Ų | 34 | 65 Ų | 65 | 24% | 0.238 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | -29.7 | -172 | 58.8 | 0 | 0 | 0 | 0 | 114.4 | M80 D81 N86 N165 | M80-S84 PolarHBondContact O-N 2.79Å; D81-S84 PolarHBondContact O-OG 3.45Å; S84-N86 VanDerWaalsContact C-N 3.34Å; S84-N165 PolarHBondContact O-N 2.87Å |
| 85 | E | 65.8 | Low | 80.8 | Confident | 141 Ų | 141 | 64.7 Ų | 64.7 | 66% | 0.659 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -8 | 175.5 | -68.1 | -176.1 | 179.7 | 0 | 0 | 113.4 | K83 | K83-E85 VanDerWaalsContact C-N 3.26Å; K83-E85 PolarHBondContact O-N 3.4Å |
| 86 | N | 75.4 | Confident | 80.9 | Confident | 85 Ų | 85 | 61.7 Ų | 61.7 | 46% | 0.455 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -66.3 | 138.5 | -177.4 | -73 | -14.4 | 0 | 0 | 0 | 111 | K83 S84 D88 F164 | K83-N86 WeakPolarHBondContact CB-ND2 3.47Å; K83-N86 WeakPolarHBondContact CG-ND2 3.19Å; K83-N86 VanDerWaalsContact O-CB 3.25Å; K83-N86 WeakPolarHBondContact O-CB 3.27Å; K83-N86 PolarHBondContact O-N 3.29Å; S84-N86 VanDerWaalsContact C-N 3.34Å; N86-D88 PolarHBondContact O-N 2.93Å; N86-F164 PolarHBondContact O-N 3.14Å |
| 87 | P | 77.9 | Confident | 81.1 | Confident | 94 Ų | 94 | 61.5 Ų | 61.5 | 61% | 0.61 | 36% | 0.357 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -60 | 123.5 | 174 | 20.9 | -30.5 | 0 | 0 | 0 | 111.5 | V161 | P87-V161 HydrophobicContact CB-CG1 3.04Å; P87-V161 HydrophobicContact CG-CG1 4.39Å |
| 88 | D | 81.5 | Confident | 81.5 | Confident | 19 Ų | 19 | 61.1 Ų | 61.1 | 10% | 0.102 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 104.2 | 173.6 | -172.4 | 3 | 0 | 0 | 0 | 110.7 | N86 N90 C91 K94 I162 F164 | N86-D88 PolarHBondContact O-N 2.93Å; D88-N90 PolarHBondContact O-N 3.44Å; D88-N90 WeakPolarHBondContact OD1-CA 3.26Å; D88-N90 WeakPolarHBondContact OD1-CB 3.28Å; D88-N90 PolarHBondContact OD1-N 3.39Å; D88-C91 HydrophobicContact CB-CB 4.25Å; D88-C91 WeakPolarHBondContact O-CB 3.17Å; D88-C91 PolarHBondContact O-N 3.33Å; D88-K94 IonicContact OD1-NZ 3.87Å; D88-K94 IonicContact OD2-NZ 3.17Å; D88-K94 PolarHBondContact OD2-NZ 3.41Å; D88-I162 PolarHBondContact N-O 3.4Å; D88-F164 HydrophobicContact CB-CB 4.42Å |
| 89 | S | 82.5 | Confident | 81.8 | Confident | 85 Ų | 85 | 58.7 Ų | 58.7 | 59% | 0.594 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -18.8 | 175 | 56.4 | 0 | 0 | 0 | 0 | 113.3 | ||
| 90 | N | 86.7 | Confident | 82.2 | Confident | 94 Ų | 94 | 54.2 Ų | 54.2 | 50% | 0.503 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | 9.9 | 178.9 | -70 | -31.7 | 0 | 0 | 0 | 112.7 | D88 C92 P93 K94 | D88-N90 PolarHBondContact O-N 3.44Å; D88-N90 WeakPolarHBondContact OD1-CA 3.26Å; D88-N90 WeakPolarHBondContact OD1-CB 3.28Å; D88-N90 PolarHBondContact OD1-N 3.39Å; N90-C92 PolarHBondContact O-N 3.13Å; N90-P93 WeakPolarHBondContact O-CD 3.16Å; N90-K94 VanDerWaalsContact O-CG 3.28Å; N90-K94 WeakPolarHBondContact O-CG 3.19Å; N90-K94 PolarHBondContact O-N 3.09Å |
| 91 | C | 88.7 | Confident | 83 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58.4 | -47.7 | -178.7 | 169.2 | 0 | 0 | 0 | 0 | 112.6 | D88 K94 S95 I162 C167 | D88-C91 HydrophobicContact CB-CB 4.25Å; D88-C91 WeakPolarHBondContact O-CB 3.17Å; D88-C91 PolarHBondContact O-N 3.33Å; C91-K94 PolarHBondContact O-N 2.96Å; C91-S95 VanDerWaalsContact O-CB 3.27Å; C91-S95 WeakPolarHBondContact O-CB 3.38Å; C91-S95 PolarHBondContact O-N 3.14Å; C91-S95 PolarHBondContact O-OG 3.38Å; C91-I162 HydrophobicContact CB-CB 4.21Å; C91-C167 VanDerWaalsContact C-SG 3.58Å; C91-C167 WeakPolarHBondContact CA-SG 3.29Å; C91-C167 HydrophobicContact CB-CB 4.03Å; C91-C167 WeakPolarHBondContact CB-SG 3.22Å; C91-C167 PolarHBondContact O-SG 2.96Å; C91-C167 VanDerWaalsContact O-SG 3.32Å; C91-C167 WeakPolarHBondContact SG-CA 3.37Å; C91-C167 WeakPolarHBondContact SG-CB 3.49Å; C91-C167 CovalentContact SG-SG 2.03Å; C91-C167 PolarHBondContact SG-SG 3.35Å |
| 92 | C | 91.8 | Very high | 84.1 | Confident | 3 Ų | 3 | 49.6 Ų | 49.6 | 2% | 0.02 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -68.6 | -42.8 | -175.5 | -69.4 | 0 | 0 | 0 | 0 | 114.3 | N90 K94 S95 A96 C172 | N90-C92 PolarHBondContact O-N 3.13Å; C92-K94 PolarHBondContact O-N 3.09Å; C92-S95 PolarHBondContact O-N 3.36Å; C92-A96 PolarHBondContact O-N 3.27Å; C92-C172 WeakPolarHBondContact CA-SG 3.33Å; C92-C172 HydrophobicContact CB-CB 3.89Å; C92-C172 WeakPolarHBondContact CB-SG 3.45Å; C92-C172 VanDerWaalsContact SG-CA 3.57Å; C92-C172 WeakPolarHBondContact SG-CB 3.29Å; C92-C172 CovalentContact SG-SG 2.05Å; C92-C172 PolarHBondContact SG-SG 3.43Å |
| 93 | P | 90.7 | Very high | 85.6 | Confident | 64 Ų | 64 | 45.7 Ų | 45.7 | 42% | 0.416 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -55.2 | -45 | 168.1 | -28.4 | 35.1 | 0 | 0 | 0 | 113.8 | N90 A96 | N90-P93 WeakPolarHBondContact O-CD 3.16Å; P93-A96 WeakPolarHBondContact O-CB 3.36Å; P93-A96 PolarHBondContact O-N 3.15Å |
| 94 | K | 89.1 | Confident | 87.2 | Confident | 59 Ų | 59 | 40.5 Ų | 40.5 | 26% | 0.257 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.5 | -44.1 | 176.6 | -68.5 | 170 | -172.1 | 170.2 | 0 | 111.5 | L73 D88 N90 C91 C92 A96 L97 | L73-K94 HydrophobicContact CD2-CB 4.5Å; D88-K94 IonicContact OD1-NZ 3.87Å; D88-K94 IonicContact OD2-NZ 3.17Å; D88-K94 PolarHBondContact OD2-NZ 3.41Å; N90-K94 VanDerWaalsContact O-CG 3.28Å; N90-K94 WeakPolarHBondContact O-CG 3.19Å; N90-K94 PolarHBondContact O-N 3.09Å; C91-K94 PolarHBondContact O-N 2.96Å; C92-K94 PolarHBondContact O-N 3.09Å; K94-A96 VanDerWaalsContact C-N 3.25Å; K94-A96 PolarHBondContact O-N 2.94Å; K94-L97 PolarHBondContact O-N 2.87Å |
| 95 | S | 90.7 | Very high | 88.6 | Confident | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.007 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.6 | -23.9 | 179.9 | -65 | 0 | 0 | 0 | 0 | 113.4 | C91 C92 L97 L98 S99 C167 G168 | C91-S95 VanDerWaalsContact O-CB 3.27Å; C91-S95 WeakPolarHBondContact O-CB 3.38Å; C91-S95 PolarHBondContact O-N 3.14Å; C91-S95 PolarHBondContact O-OG 3.38Å; C92-S95 PolarHBondContact O-N 3.36Å; S95-L97 VanDerWaalsContact C-N 3.3Å; S95-L97 PolarHBondContact O-N 3.05Å; S95-L98 WeakPolarHBondContact O-CB 3.29Å; S95-L98 PolarHBondContact O-N 3.36Å; S95-S99 PolarHBondContact O-N 2.94Å; S95-C167 PolarHBondContact OG-SG 3.06Å; S95-G168 VanDerWaalsContact OG-CA 3.27Å; S95-G168 WeakPolarHBondContact OG-CA 3.25Å; S95-G168 PolarHBondContact OG-N 2.83Å |
| 96 | A | 93.4 | Very high | 90 | Very high | 9 Ų | 9 | 32.5 Ų | 32.5 | 7% | 0.074 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.5 | -36 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | C92 P93 K94 S99 F100 S150 V154 | C92-A96 PolarHBondContact O-N 3.27Å; P93-A96 WeakPolarHBondContact O-CB 3.36Å; P93-A96 PolarHBondContact O-N 3.15Å; K94-A96 VanDerWaalsContact C-N 3.25Å; K94-A96 PolarHBondContact O-N 2.94Å; A96-S99 WeakPolarHBondContact O-CB 3.38Å; A96-S99 PolarHBondContact O-N 3.27Å; A96-F100 PolarHBondContact O-N 3.47Å; A96-S150 WeakPolarHBondContact CB-O 3.28Å; A96-S150 WeakPolarHBondContact O-CB 3.14Å; A96-S150 PolarHBondContact O-OG 3.38Å; A96-V154 HydrophobicContact CB-CG2 3.35Å |
| 97 | L | 93 | Very high | 91 | Very high | 92 Ų | 92 | 29.1 Ų | 29.1 | 48% | 0.482 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -67.2 | -37.7 | 174.7 | -68.4 | 176.3 | 0 | 0 | 0 | 112.1 | V69 K94 S95 F100 C101 | V69-L97 HydrophobicContact CG1-CB 4.47Å; V69-L97 HydrophobicContact CG2-CB 4.21Å; K94-L97 PolarHBondContact O-N 2.87Å; S95-L97 VanDerWaalsContact C-N 3.3Å; S95-L97 PolarHBondContact O-N 3.05Å; L97-F100 WeakPolarHBondContact O-CB 3.42Å; L97-F100 PolarHBondContact O-N 3.33Å; L97-C101 PolarHBondContact O-N 3.38Å; L97-C101 PolarHBondContact O-SG 3.32Å |
| 98 | L | 92.8 | Very high | 91.7 | Very high | 12 Ų | 12 | 25.1 Ų | 25.1 | 6% | 0.063 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.3 | -43.5 | 172.1 | -72.7 | 173.6 | 0 | 0 | 0 | 111.4 | V69 Y70 L73 S95 F100 C101 N102 | V69-L98 HydrophobicContact CG1-CD2 3.47Å; V69-L98 VanDerWaalsContact CG1-CD2 3.47Å; V69-L98 HydrophobicContact CG1-CG 3.84Å; Y70-L98 HydrophobicContact CD1-CD2 3.82Å; Y70-L98 HydrophobicContact CE1-CD2 3.34Å; Y70-L98 HydrophobicContact CE2-CD2 4.35Å; Y70-L98 HydrophobicContact CG-CD2 4.47Å; L73-L98 HydrophobicContact CD1-CD1 3.59Å; L73-L98 HydrophobicContact CD1-CD2 4.04Å; L73-L98 HydrophobicContact CD1-CG 3.77Å; S95-L98 WeakPolarHBondContact O-CB 3.29Å; S95-L98 PolarHBondContact O-N 3.36Å; L98-F100 VanDerWaalsContact C-N 3.31Å; L98-F100 PolarHBondContact O-N 3.48Å; L98-C101 PolarHBondContact O-N 2.97Å; L98-N102 WeakPolarHBondContact O-CB 3.19Å; L98-N102 PolarHBondContact O-N 3.44Å |
| 99 | S | 93.5 | Very high | 92.3 | Very high | 4 Ų | 4 | 24.2 Ų | 24.2 | 3% | 0.028 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.5 | -45.6 | 173.8 | -173.8 | 0 | 0 | 0 | 0 | 111 | S95 A96 N103 | S95-S99 PolarHBondContact O-N 2.94Å; A96-S99 WeakPolarHBondContact O-CB 3.38Å; A96-S99 PolarHBondContact O-N 3.27Å; S99-N103 WeakPolarHBondContact O-CB 3.3Å; S99-N103 PolarHBondContact O-N 2.98Å; S99-N103 PolarHBondContact O-ND2 3.38Å; S99-N103 PolarHBondContact OG-ND2 2.96Å; S99-N103 VanDerWaalsContact OG-ND2 3.14Å |
| 100 | F | 95.8 | Very high | 92.8 | Very high | 37 Ų | 37 | 21.7 Ų | 21.7 | 16% | 0.162 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -58.6 | -56 | 178 | 178.9 | -98 | 0 | 0 | 0 | 110.9 | L65 A96 L97 L98 N102 N103 N104 L147 S150 | L65-F100 HydrophobicContact CD2-CD1 3.85Å; L65-F100 HydrophobicContact CD2-CE1 3.84Å; A96-F100 PolarHBondContact O-N 3.47Å; L97-F100 WeakPolarHBondContact O-CB 3.42Å; L97-F100 PolarHBondContact O-N 3.33Å; L98-F100 VanDerWaalsContact C-N 3.31Å; L98-F100 PolarHBondContact O-N 3.48Å; F100-N102 VanDerWaalsContact C-N 3.32Å; F100-N102 PolarHBondContact O-N 3.35Å; F100-N103 PolarHBondContact O-N 3.21Å; F100-N104 HydrophobicContact CE1-CB 4.32Å; F100-N104 HydrophobicContact CZ-CB 4.3Å; F100-N104 WeakPolarHBondContact O-CB 2.99Å; F100-N104 PolarHBondContact O-N 2.92Å; F100-L147 HydrophobicContact CD2-CB 4.39Å; F100-L147 HydrophobicContact CE2-CB 4.17Å; F100-S150 WeakPolarHBondContact CA-OG 3.4Å; F100-S150 WeakPolarHBondContact CB-OG 3.21Å; F100-S150 PolarHBondContact N-OG 3.24Å |
| 101 | C | 94.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -58.1 | -44 | -176.7 | -68 | 0 | 0 | 0 | 0 | 112.3 | N62 T66 L97 L98 A105 | N62-C101 PolarHBondContact ND2-O 2.96Å; T66-C101 HydrophobicContact CG2-CB 4.45Å; T66-C101 WeakPolarHBondContact OG1-CB 3.23Å; L97-C101 PolarHBondContact O-N 3.38Å; L97-C101 PolarHBondContact O-SG 3.32Å; L98-C101 PolarHBondContact O-N 2.97Å; C101-A105 WeakPolarHBondContact O-CB 3.47Å; C101-A105 PolarHBondContact O-N 2.68Å; C101-A105 VanDerWaalsContact O-N 3.08Å |
| 102 | N | 93.7 | Very high | 93.2 | Very high | 8 Ų | 8 | 17.4 Ų | 17.4 | 4% | 0.043 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -67.6 | -49.2 | -179.4 | -175 | 16.9 | 0 | 0 | 0 | 111.9 | L98 F100 A105 L106 Q245 T275 | L98-N102 WeakPolarHBondContact O-CB 3.19Å; L98-N102 PolarHBondContact O-N 3.44Å; F100-N102 VanDerWaalsContact C-N 3.32Å; F100-N102 PolarHBondContact O-N 3.35Å; N102-A105 PolarHBondContact O-N 3.2Å; N102-L106 PolarHBondContact O-N 2.96Å; N102-Q245 PolarHBondContact OD1-NE2 2.92Å; N102-Q245 PolarHBondContact OD1-OE1 2.79Å; N102-T275 HydrophobicContact CB-CG2 4.33Å |
| 103 | N | 94.3 | Very high | 93.2 | Very high | 2 Ų | 2 | 17.4 Ų | 17.4 | 1% | 0.011 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -69.4 | -37.2 | -179.7 | -66.8 | -47.9 | 0 | 0 | 0 | 111.5 | S99 F100 A105 L106 M107 L149 M182 R249 | S99-N103 WeakPolarHBondContact O-CB 3.3Å; S99-N103 PolarHBondContact O-N 2.98Å; S99-N103 PolarHBondContact O-ND2 3.38Å; S99-N103 PolarHBondContact OG-ND2 2.96Å; S99-N103 VanDerWaalsContact OG-ND2 3.14Å; F100-N103 PolarHBondContact O-N 3.21Å; N103-A105 VanDerWaalsContact C-N 3.32Å; N103-A105 PolarHBondContact O-N 3.43Å; N103-L106 PolarHBondContact O-N 2.89Å; N103-M107 WeakPolarHBondContact O-CB 3.36Å; N103-M107 VanDerWaalsContact O-CG 3.31Å; N103-M107 WeakPolarHBondContact O-CG 3.41Å; N103-M107 PolarHBondContact O-N 3.28Å; N103-L149 HydrophobicContact CB-CD1 4.39Å; N103-M182 WeakPolarHBondContact ND2-CE 3.37Å; N103-R249 PolarHBondContact OD1-NH2 3.34Å |
| 104 | N | 95.3 | Very high | 93.2 | Very high | 7 Ų | 7 | 16.8 Ų | 16.8 | 4% | 0.037 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -69.3 | -29.3 | 179.2 | -167.8 | 53.9 | 0 | 0 | 0 | 112.5 | N62 F100 S108 S146 | N62-N104 WeakPolarHBondContact OD1-CB 3.21Å; N62-N104 PolarHBondContact OD1-ND2 2.94Å; F100-N104 HydrophobicContact CE1-CB 4.32Å; F100-N104 HydrophobicContact CZ-CB 4.3Å; F100-N104 WeakPolarHBondContact O-CB 2.99Å; F100-N104 PolarHBondContact O-N 2.92Å; N104-S108 VanDerWaalsContact O-CB 3.22Å; N104-S108 WeakPolarHBondContact O-CB 3.27Å; N104-S108 PolarHBondContact O-N 3.46Å; N104-S108 PolarHBondContact O-OG 3.19Å; N104-S146 WeakPolarHBondContact CA-OG 3.44Å; N104-S146 PolarHBondContact N-OG 2.95Å |
| 105 | A | 94.3 | Very high | 93.3 | Very high | 7 Ų | 7 | 14.2 Ų | 14.2 | 6% | 0.058 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -62.2 | -46.5 | 170 | 0 | 0 | 0 | 0 | 0 | 111.8 | C101 N102 N103 S108 A109 | C101-A105 WeakPolarHBondContact O-CB 3.47Å; C101-A105 PolarHBondContact O-N 2.68Å; C101-A105 VanDerWaalsContact O-N 3.08Å; N102-A105 PolarHBondContact O-N 3.2Å; N103-A105 VanDerWaalsContact C-N 3.32Å; N103-A105 PolarHBondContact O-N 3.43Å; A105-S108 PolarHBondContact O-N 3.44Å; A105-A109 PolarHBondContact O-N 3.04Å |
| 106 | L | 94.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -64.7 | -46 | 176.2 | 177.5 | 61.8 | 0 | 0 | 0 | 111.6 | N102 N103 S108 A109 V110 N186 A190 I193 Q245 | N102-L106 PolarHBondContact O-N 2.96Å; N103-L106 PolarHBondContact O-N 2.89Å; L106-S108 VanDerWaalsContact C-N 3.3Å; L106-S108 PolarHBondContact O-N 3.38Å; L106-A109 WeakPolarHBondContact O-CA 3.43Å; L106-A109 WeakPolarHBondContact O-CB 3.33Å; L106-A109 PolarHBondContact O-N 3.49Å; L106-V110 PolarHBondContact O-N 3.41Å; L106-V110 VanDerWaalsContact O-N 3.09Å; L106-N186 HydrophobicContact CD2-CB 3.78Å; L106-N186 WeakPolarHBondContact CD2-O 3.16Å; L106-A190 HydrophobicContact CD1-CB 3.99Å; L106-I193 HydrophobicContact CD1-CD1 3.78Å; L106-Q245 HydrophobicContact CB-CG 4.37Å; L106-Q245 HydrophobicContact CD1-CB 4.44Å; L106-Q245 HydrophobicContact CD1-CG 4.31Å |
| 107 | M | 94.8 | Very high | 93 | Very high | 15 Ų | 15 | 16.6 Ų | 16.6 | 7% | 0.074 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -68.6 | -29.5 | -179.6 | -66.9 | -56.6 | -57.7 | 0 | 0 | 112.5 | N103 A109 V110 A111 V142 Y145 L189 | N103-M107 WeakPolarHBondContact O-CB 3.36Å; N103-M107 VanDerWaalsContact O-CG 3.31Å; N103-M107 WeakPolarHBondContact O-CG 3.41Å; N103-M107 PolarHBondContact O-N 3.28Å; M107-A109 VanDerWaalsContact C-N 3.28Å; M107-A109 PolarHBondContact O-N 2.87Å; M107-V110 HydrophobicContact CE-CB 4.32Å; M107-V110 HydrophobicContact CE-CG1 4.48Å; M107-V110 HydrophobicContact CE-CG2 4.18Å; M107-V110 WeakPolarHBondContact O-CA 3.37Å; M107-V110 VanDerWaalsContact O-CB 3.29Å; M107-V110 WeakPolarHBondContact O-CB 3.46Å; M107-V110 PolarHBondContact O-N 3.49Å; M107-V110 VanDerWaalsContact O-N 3.13Å; M107-V110 HydrophobicContact SD-CG2 4.01Å; M107-A111 PolarHBondContact O-N 3.12Å; M107-V142 HydrophobicContact CB-CB 3.84Å; M107-V142 HydrophobicContact CB-CG1 4.36Å; M107-V142 HydrophobicContact CE-CB 4.44Å; M107-V142 HydrophobicContact CE-CG1 4.08Å; M107-V142 WeakPolarHBondContact O-CG1 3.42Å; M107-Y145 HydrophobicContact CE-CD1 4.14Å; M107-Y145 HydrophobicContact CE-CG 4.33Å; M107-Y145 HydrophobicContact CG-CD1 3.58Å; M107-Y145 HydrophobicContact CG-CE1 3.96Å; M107-Y145 HydrophobicContact SD-CD1 3.78Å; M107-Y145 HydrophobicContact SD-CE1 3.81Å; M107-L189 HydrophobicContact SD-CD1 4.31Å |
| 108 | S | 93.2 | Very high | 92.9 | Very high | 9 Ų | 9 | 14 Ų | 14 | 6% | 0.063 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.6 | -34.9 | 168.8 | -63.8 | 0 | 0 | 0 | 0 | 112 | N104 A105 L106 V110 A111 L112 | N104-S108 VanDerWaalsContact O-CB 3.22Å; N104-S108 WeakPolarHBondContact O-CB 3.27Å; N104-S108 PolarHBondContact O-N 3.46Å; N104-S108 PolarHBondContact O-OG 3.19Å; A105-S108 PolarHBondContact O-N 3.44Å; L106-S108 VanDerWaalsContact C-N 3.3Å; L106-S108 PolarHBondContact O-N 3.38Å; S108-V110 VanDerWaalsContact C-N 3.35Å; S108-A111 PolarHBondContact O-N 2.89Å; S108-L112 WeakPolarHBondContact O-CG 3.44Å; S108-L112 PolarHBondContact O-N 2.86Å |
| 109 | A | 93.5 | Very high | 92.7 | Very high | 1 Ų | 1 | 13.7 Ų | 13.7 | 1% | 0.008 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -69.9 | -30 | 172 | 0 | 0 | 0 | 0 | 0 | 113 | A105 L106 M107 S113 I193 T238 V241 | A105-A109 PolarHBondContact O-N 3.04Å; L106-A109 WeakPolarHBondContact O-CA 3.43Å; L106-A109 WeakPolarHBondContact O-CB 3.33Å; L106-A109 PolarHBondContact O-N 3.49Å; M107-A109 VanDerWaalsContact C-N 3.28Å; M107-A109 PolarHBondContact O-N 2.87Å; A109-S113 WeakPolarHBondContact O-CB 3.42Å; A109-S113 PolarHBondContact O-N 3.41Å; A109-S113 VanDerWaalsContact O-N 3.09Å; A109-S113 PolarHBondContact O-OG 3.01Å; A109-I193 HydrophobicContact CB-CD1 4.16Å; A109-T238 HydrophobicContact CB-CG2 4.44Å; A109-V241 HydrophobicContact CB-CB 4.34Å; A109-V241 HydrophobicContact CB-CG1 3.8Å |
| 110 | V | 93.7 | Very high | 92.4 | Very high | 32 Ų | 32 | 13.5 Ų | 13.5 | 19% | 0.194 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.2 | -51.9 | 167.5 | 178.9 | 0 | 0 | 0 | 0 | 109.7 | L106 M107 S108 L112 S113 V114 I193 | L106-V110 PolarHBondContact O-N 3.41Å; L106-V110 VanDerWaalsContact O-N 3.09Å; M107-V110 HydrophobicContact CE-CB 4.32Å; M107-V110 HydrophobicContact CE-CG1 4.48Å; M107-V110 HydrophobicContact CE-CG2 4.18Å; M107-V110 WeakPolarHBondContact O-CA 3.37Å; M107-V110 VanDerWaalsContact O-CB 3.29Å; M107-V110 WeakPolarHBondContact O-CB 3.46Å; M107-V110 PolarHBondContact O-N 3.49Å; M107-V110 VanDerWaalsContact O-N 3.13Å; M107-V110 HydrophobicContact SD-CG2 4.01Å; S108-V110 VanDerWaalsContact C-N 3.35Å; V110-L112 VanDerWaalsContact C-N 3.33Å; V110-L112 PolarHBondContact O-N 2.87Å; V110-S113 PolarHBondContact O-N 3.39Å; V110-V114 HydrophobicContact CG1-CG2 4.28Å; V110-V114 WeakPolarHBondContact O-CG2 3.31Å; V110-V114 PolarHBondContact O-N 3.37Å; V110-I193 HydrophobicContact CG2-CD1 3.63Å; V110-I193 HydrophobicContact CG2-CG1 4.1Å |
| 111 | A | 92.9 | Very high | 92.1 | Very high | 3 Ų | 3 | 15 Ų | 15 | 3% | 0.025 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -55.6 | -46.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | M107 S108 S113 V114 D115 L138 V142 | M107-A111 PolarHBondContact O-N 3.12Å; S108-A111 PolarHBondContact O-N 2.89Å; A111-S113 PolarHBondContact O-N 2.9Å; A111-V114 PolarHBondContact O-N 3.4Å; A111-D115 VanDerWaalsContact O-CB 3.26Å; A111-D115 WeakPolarHBondContact O-CB 3.48Å; A111-D115 PolarHBondContact O-N 2.85Å; A111-L138 HydrophobicContact CB-CD1 4.43Å; A111-L138 HydrophobicContact CB-CD2 4.03Å; A111-L138 HydrophobicContact CB-CG 3.92Å; A111-V142 HydrophobicContact CB-CG1 4.01Å; A111-V142 HydrophobicContact CB-CG2 4.17Å |
| 112 | L | 91.2 | Very high | 91.8 | Very high | 1 Ų | 1 | 20.5 Ų | 20.5 | 1% | 0.005 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.8 | -30.3 | 175.5 | -75.5 | -176.8 | 0 | 0 | 0 | 113.8 | T55 I59 S108 V110 R116 L234 V237 T238 | T55-L112 HydrophobicContact CG2-CD2 4.35Å; T55-L112 WeakPolarHBondContact OG1-CD2 3.24Å; I59-L112 HydrophobicContact CD1-CD1 3.45Å; I59-L112 VanDerWaalsContact CD1-CD1 3.45Å; I59-L112 HydrophobicContact CD1-CD2 4.27Å; I59-L112 HydrophobicContact CD1-CG 3.89Å; S108-L112 WeakPolarHBondContact O-CG 3.44Å; S108-L112 PolarHBondContact O-N 2.86Å; V110-L112 VanDerWaalsContact C-N 3.33Å; V110-L112 PolarHBondContact O-N 2.87Å; L112-R116 WeakPolarHBondContact O-CB 3.2Å; L112-R116 VanDerWaalsContact O-CG 3.31Å; L112-R116 WeakPolarHBondContact O-CG 3.26Å; L112-R116 PolarHBondContact O-N 3.3Å; L112-R116 PolarHBondContact O-NE 2.94Å; L112-R116 VanDerWaalsContact O-NE 3.12Å; L112-L234 HydrophobicContact CD1-CD2 4.13Å; L112-L234 HydrophobicContact CD2-CD2 3.64Å; L112-L234 HydrophobicContact CG-CD2 4.44Å; L112-V237 HydrophobicContact CD1-CG1 3.89Å; L112-T238 HydrophobicContact CB-CG2 3.92Å; L112-T238 HydrophobicContact CD1-CG2 3.82Å |
| 113 | S | 91.9 | Very high | 91.5 | Very high | 3 Ų | 3 | 21.2 Ų | 21.2 | 2% | 0.021 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -81.5 | -41.2 | -179.1 | -58.6 | 0 | 0 | 0 | 0 | 111.3 | A109 V110 A111 R116 I117 I193 N197 | A109-S113 WeakPolarHBondContact O-CB 3.42Å; A109-S113 PolarHBondContact O-N 3.41Å; A109-S113 VanDerWaalsContact O-N 3.09Å; A109-S113 PolarHBondContact O-OG 3.01Å; V110-S113 PolarHBondContact O-N 3.39Å; A111-S113 PolarHBondContact O-N 2.9Å; S113-R116 PolarHBondContact O-N 3.44Å; S113-R116 PolarHBondContact OG-NH2 3.35Å; S113-I117 VanDerWaalsContact O-CG1 3.26Å; S113-I117 WeakPolarHBondContact O-CG1 3.46Å; S113-I117 PolarHBondContact O-N 2.93Å; S113-I193 WeakPolarHBondContact OG-CG2 3.36Å; S113-N197 PolarHBondContact OG-ND2 3.26Å |
| 114 | V | 91.4 | Very high | 91.1 | Very high | 51 Ų | 51 | 26.7 Ų | 26.7 | 31% | 0.309 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -60.7 | -47.4 | 172 | 173 | 0 | 0 | 0 | 0 | 110.9 | V110 A111 R116 I117 I118 L138 | V110-V114 HydrophobicContact CG1-CG2 4.28Å; V110-V114 WeakPolarHBondContact O-CG2 3.31Å; V110-V114 PolarHBondContact O-N 3.37Å; A111-V114 PolarHBondContact O-N 3.4Å; V114-R116 VanDerWaalsContact C-N 3.31Å; V114-R116 PolarHBondContact O-N 3.33Å; V114-I117 PolarHBondContact O-N 2.89Å; V114-I118 HydrophobicContact CG1-CD1 3.84Å; V114-I118 WeakPolarHBondContact O-CG1 3.48Å; V114-I118 PolarHBondContact O-N 3.45Å; V114-L138 HydrophobicContact CB-CD1 4.45Å; V114-L138 HydrophobicContact CG1-CD1 4.2Å; V114-L138 HydrophobicContact CG1-CD2 4.45Å |
| 115 | D | 89.8 | Confident | 90.8 | Very high | 4 Ų | 4 | 31.7 Ų | 31.7 | 2% | 0.021 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -52.3 | -49.2 | 175.7 | 177.6 | 78.4 | 0 | 0 | 0 | 111.5 | A111 I118 A119 Y126 H135 | A111-D115 VanDerWaalsContact O-CB 3.26Å; A111-D115 WeakPolarHBondContact O-CB 3.48Å; A111-D115 PolarHBondContact O-N 2.85Å; D115-I118 PolarHBondContact O-N 3.37Å; D115-A119 WeakPolarHBondContact O-CB 3.22Å; D115-A119 PolarHBondContact O-N 2.72Å; D115-Y126 VanDerWaalsContact OD1-CE2 3.27Å; D115-Y126 WeakPolarHBondContact OD1-CE2 3.3Å; D115-Y126 PolarHBondContact OD1-OH 3.43Å; D115-H135 IonicContact OD1-CD2 3.83Å; D115-H135 IonicContact OD1-CE1 2.79Å; D115-H135 IonicContact OD1-NE2 3.62Å; D115-H135 PolarHBondContact OD1-NE2 3.37Å |
| 116 | R | 89.1 | Confident | 90.4 | Very high | 10 Ų | 10 | 32 Ų | 32 | 4% | 0.038 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -67.2 | -39.1 | 179.5 | -79.7 | -173.6 | -66.9 | -171.6 | -8.3 | 114.3 | L112 S113 V114 A119 A120 N197 L200 Q227 L234 T238 | L112-R116 WeakPolarHBondContact O-CB 3.2Å; L112-R116 VanDerWaalsContact O-CG 3.31Å; L112-R116 WeakPolarHBondContact O-CG 3.26Å; L112-R116 PolarHBondContact O-N 3.3Å; L112-R116 PolarHBondContact O-NE 2.94Å; L112-R116 VanDerWaalsContact O-NE 3.12Å; S113-R116 PolarHBondContact O-N 3.44Å; S113-R116 PolarHBondContact OG-NH2 3.35Å; V114-R116 VanDerWaalsContact C-N 3.31Å; V114-R116 PolarHBondContact O-N 3.33Å; R116-A119 PolarHBondContact O-N 2.83Å; R116-A120 WeakPolarHBondContact O-CB 3.28Å; R116-A120 PolarHBondContact O-N 3.44Å; R116-N197 PolarHBondContact NE-OD1 3.45Å; R116-N197 PolarHBondContact NH1-OD1 3.36Å; R116-N197 PolarHBondContact NH2-ND2 3.2Å; R116-N197 VanDerWaalsContact NH2-ND2 3.12Å; R116-N197 PolarHBondContact NH2-OD1 3.27Å; R116-L200 HydrophobicContact CB-CD2 3.58Å; R116-L200 HydrophobicContact CG-CD2 4.32Å; R116-Q227 PolarHBondContact O-NE2 3.16Å; R116-Q227 VanDerWaalsContact O-NE2 3.12Å; R116-L234 HydrophobicContact CG-CD1 3.82Å; R116-L234 PolarHBondContact NH1-O 3.36Å; R116-T238 PolarHBondContact NH1-OG1 3.17Å; R116-T238 VanDerWaalsContact NH2-CB 3.34Å; R116-T238 PolarHBondContact NH2-OG1 3.42Å |
| 117 | I | 90.3 | Very high | 89.9 | Confident | 50 Ų | 50 | 39.1 Ų | 39.1 | 26% | 0.256 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.7 | -49 | 176.6 | -71.8 | 164.4 | 0 | 0 | 0 | 109.2 | S113 V114 A119 A120 C121 L196 | S113-I117 VanDerWaalsContact O-CG1 3.26Å; S113-I117 WeakPolarHBondContact O-CG1 3.46Å; S113-I117 PolarHBondContact O-N 2.93Å; V114-I117 PolarHBondContact O-N 2.89Å; I117-A119 VanDerWaalsContact C-N 3.33Å; I117-A119 PolarHBondContact O-N 3.47Å; I117-A120 PolarHBondContact O-N 2.9Å; I117-C121 WeakPolarHBondContact O-CB 3.39Å; I117-C121 PolarHBondContact O-N 3.03Å; I117-C121 PolarHBondContact O-SG 3.28Å; I117-L196 HydrophobicContact CD1-CB 4.27Å; I117-L196 HydrophobicContact CD1-CD1 4.11Å; I117-L196 HydrophobicContact CD1-CD2 3.97Å; I117-L196 HydrophobicContact CD1-CG 4.35Å |
| 118 | I | 90.3 | Very high | 89.6 | Confident | 37 Ų | 37 | 44.1 Ų | 44.1 | 19% | 0.19 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.1 | -42.3 | 179.6 | -69.4 | 172 | 0 | 0 | 0 | 110.7 | V114 D115 A120 H122 F125 Y126 F134 | V114-I118 HydrophobicContact CG1-CD1 3.84Å; V114-I118 WeakPolarHBondContact O-CG1 3.48Å; V114-I118 PolarHBondContact O-N 3.45Å; D115-I118 PolarHBondContact O-N 3.37Å; I118-A120 PolarHBondContact O-N 2.88Å; I118-H122 CarbonylContact O-C 3.6Å; I118-H122 WeakPolarHBondContact O-CA 3.29Å; I118-H122 PolarHBondContact O-N 3.45Å; I118-F125 HydrophobicContact CG2-CD1 3.97Å; I118-F125 HydrophobicContact CG2-CE1 4.24Å; I118-Y126 HydrophobicContact CG2-CD2 4.21Å; I118-F134 HydrophobicContact CB-CZ 4.32Å; I118-F134 HydrophobicContact CD1-CE2 3.37Å; I118-F134 HydrophobicContact CD1-CZ 3.48Å; I118-F134 VanDerWaalsContact CD1-CZ 3.48Å; I118-F134 HydrophobicContact CG1-CZ 4.46Å; I118-F134 HydrophobicContact CG2-CZ 4.33Å |
| 119 | A | 88 | Confident | 89.4 | Confident | 6 Ų | 6 | 44.6 Ų | 44.6 | 5% | 0.05 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.6 | -27.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | D115 R116 I117 Y126 Q227 | D115-A119 WeakPolarHBondContact O-CB 3.22Å; D115-A119 PolarHBondContact O-N 2.72Å; R116-A119 PolarHBondContact O-N 2.83Å; I117-A119 VanDerWaalsContact C-N 3.33Å; I117-A119 PolarHBondContact O-N 3.47Å; A119-Y126 HydrophobicContact CB-CD1 3.89Å; A119-Y126 HydrophobicContact CB-CD2 3.88Å; A119-Y126 HydrophobicContact CB-CE1 4.1Å; A119-Y126 HydrophobicContact CB-CE2 4.08Å; A119-Y126 HydrophobicContact CB-CG 3.79Å; A119-Q227 HydrophobicContact CB-CG 4.02Å; A119-Q227 PolarHBondContact O-NE2 3.41Å |
| 120 | A | 87.5 | Confident | 89.1 | Confident | 1 Ų | 1 | 46.8 Ų | 46.8 | 1% | 0.008 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -90 | -41.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | R116 I117 I118 L200 Y203 Q227 | R116-A120 WeakPolarHBondContact O-CB 3.28Å; R116-A120 PolarHBondContact O-N 3.44Å; I117-A120 PolarHBondContact O-N 2.9Å; I118-A120 PolarHBondContact O-N 2.88Å; A120-L200 HydrophobicContact CB-CD1 3.42Å; A120-L200 VanDerWaalsContact CB-CD1 3.42Å; A120-Y203 HydrophobicContact CB-CE1 4.35Å; A120-Q227 VanDerWaalsContact CA-NE2 3.28Å |
| 121 | C | 88.4 | Confident | 88.6 | Confident | 68 Ų | 68 | 47.3 Ų | 47.3 | 46% | 0.459 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -80.1 | -36 | -179 | -65.1 | 0 | 0 | 0 | 0 | 111.5 | I117 | I117-C121 WeakPolarHBondContact O-CB 3.39Å; I117-C121 PolarHBondContact O-N 3.03Å; I117-C121 PolarHBondContact O-SG 3.28Å |
| 122 | H | 89.8 | Confident | 88.3 | Confident | 115 Ų | 115 | 55.7 Ų | 55.7 | 53% | 0.532 | 28% | 0.275 | S | S | . | . | trans | -131.3 | 62 | -174.3 | -56.1 | -74.6 | 0 | 0 | 0 | 112.7 | I118 L124 F125 Y126 | I118-H122 CarbonylContact O-C 3.6Å; I118-H122 WeakPolarHBondContact O-CA 3.29Å; I118-H122 PolarHBondContact O-N 3.45Å; H122-L124 VanDerWaalsContact C-N 3.3Å; H122-L124 PolarHBondContact O-N 2.75Å; H122-F125 HydrophobicContact CB-CB 3.96Å; H122-F125 PolarHBondContact O-N 3.01Å; H122-Y126 WeakPolarHBondContact O-CB 3.33Å; H122-Y126 PolarHBondContact O-N 2.89Å | ||
| 123 | P | 86.2 | Confident | 88.2 | Confident | 23 Ų | 23 | 63.5 Ų | 63.5 | 15% | 0.149 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.8 | -32.7 | -174.7 | 23.2 | -33.5 | 0 | 0 | 0 | 113.9 | R127 K223 Y224 | P123-R127 WeakPolarHBondContact O-CB 3.37Å; P123-R127 PolarHBondContact O-N 3.1Å; P123-K223 HydrophobicContact CB-CG 4.32Å; P123-K223 HydrophobicContact CG-CD 4.39Å; P123-K223 HydrophobicContact CG-CG 3.97Å; P123-Y224 HydrophobicContact CG-CE1 4.38Å |
| 124 | L | 86.6 | Confident | 88.1 | Confident | 118 Ų | 118 | 64.6 Ų | 64.6 | 62% | 0.618 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -69.8 | -43.9 | 177.6 | -66.7 | 177.7 | 0 | 0 | 0 | 111.9 | H122 R127 N128 | H122-L124 VanDerWaalsContact C-N 3.3Å; H122-L124 PolarHBondContact O-N 2.75Å; L124-R127 PolarHBondContact O-N 3.23Å; L124-N128 WeakPolarHBondContact O-CB 3.49Å; L124-N128 VanDerWaalsContact O-CG 3.29Å; L124-N128 PolarHBondContact O-N 3.22Å; L124-N128 VanDerWaalsContact O-N 3.1Å |
| 125 | F | 88.5 | Confident | 88.1 | Confident | 111 Ų | 111 | 62.2 Ų | 62.2 | 49% | 0.487 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.9 | -48.8 | 173.6 | 174 | -98.1 | 0 | 0 | 0 | 110.4 | I118 H122 R127 N128 V129 | I118-F125 HydrophobicContact CG2-CD1 3.97Å; I118-F125 HydrophobicContact CG2-CE1 4.24Å; H122-F125 HydrophobicContact CB-CB 3.96Å; H122-F125 PolarHBondContact O-N 3.01Å; F125-R127 PolarHBondContact O-N 3.31Å; F125-N128 PolarHBondContact O-N 3.09Å; F125-N128 VanDerWaalsContact O-N 3.08Å; F125-V129 HydrophobicContact CE1-CB 4.32Å; F125-V129 HydrophobicContact CE1-CG1 4.29Å; F125-V129 HydrophobicContact CE1-CG2 4.49Å; F125-V129 HydrophobicContact CE2-CB 4.41Å; F125-V129 HydrophobicContact CE2-CG2 4.45Å; F125-V129 HydrophobicContact CZ-CB 4.17Å; F125-V129 HydrophobicContact CZ-CG2 4.02Å; F125-V129 WeakPolarHBondContact O-CB 3.42Å; F125-V129 WeakPolarHBondContact O-CG1 2.81Å; F125-V129 PolarHBondContact O-N 3.22Å |
| 126 | Y | 87.2 | Confident | 88.1 | Confident | 13 Ų | 13 | 65.6 Ų | 65.6 | 5% | 0.051 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -58.5 | -34.2 | -179.7 | -172.6 | -96.1 | 0 | 0 | 0 | 112.9 | R51 D115 I118 A119 H122 F134 H135 | R51-Y126 PolarHBondContact NH1-O 2.91Å; D115-Y126 VanDerWaalsContact OD1-CE2 3.27Å; D115-Y126 WeakPolarHBondContact OD1-CE2 3.3Å; D115-Y126 PolarHBondContact OD1-OH 3.43Å; I118-Y126 HydrophobicContact CG2-CD2 4.21Å; A119-Y126 HydrophobicContact CB-CD1 3.89Å; A119-Y126 HydrophobicContact CB-CD2 3.88Å; A119-Y126 HydrophobicContact CB-CE1 4.1Å; A119-Y126 HydrophobicContact CB-CE2 4.08Å; A119-Y126 HydrophobicContact CB-CG 3.79Å; H122-Y126 WeakPolarHBondContact O-CB 3.33Å; H122-Y126 PolarHBondContact O-N 2.89Å; Y126-F134 HydrophobicContact CD2-CE1 4.31Å; Y126-F134 HydrophobicContact CE2-CD1 4.45Å; Y126-F134 HydrophobicContact CE2-CE1 4.01Å; Y126-H135 AromaticContact CE2-CE1 3.93Å; Y126-H135 AromaticContact CE2-NE2 3.94Å; Y126-H135 PolarHBondContact OH-NE2 2.92Å |
| 127 | R | 84.7 | Confident | 88.4 | Confident | 151 Ų | 151 | 68.6 Ų | 68.6 | 57% | 0.57 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -76.5 | -33 | 176.3 | -166.7 | 178.8 | 76.1 | 171.8 | 4.7 | 113.5 | R51 P123 L124 F125 | R51-R127 VanDerWaalsContact CZ-O 3.28Å; R51-R127 VanDerWaalsContact NH1-C 3.26Å; R51-R127 PolarHBondContact NH1-O 2.87Å; R51-R127 PolarHBondContact NH2-O 3.02Å; P123-R127 WeakPolarHBondContact O-CB 3.37Å; P123-R127 PolarHBondContact O-N 3.1Å; L124-R127 PolarHBondContact O-N 3.23Å; F125-R127 PolarHBondContact O-N 3.31Å |
| 128 | N | 87.8 | Confident | 88.5 | Confident | 120 Ų | 120 | 67.3 Ų | 67.3 | 64% | 0.642 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -92.6 | -23.5 | -173.8 | -67 | -6.7 | 0 | 0 | 0 | 113.1 | L124 F125 | L124-N128 WeakPolarHBondContact O-CB 3.49Å; L124-N128 VanDerWaalsContact O-CG 3.29Å; L124-N128 PolarHBondContact O-N 3.22Å; L124-N128 VanDerWaalsContact O-N 3.1Å; F125-N128 PolarHBondContact O-N 3.09Å; F125-N128 VanDerWaalsContact O-N 3.08Å |
| 129 | V | 87.9 | Confident | 88.6 | Confident | 18 Ų | 18 | 67.1 Ų | 67.1 | 11% | 0.109 | 33% | 0.33 | C | S | . | . | S | Bend | trans | -69.8 | 140.4 | 177.5 | 74.5 | 0 | 0 | 0 | 0 | 110.8 | R51 F125 K133 F134 | R51-V129 PolarHBondContact NH1-O 3.44Å; F125-V129 HydrophobicContact CE1-CB 4.32Å; F125-V129 HydrophobicContact CE1-CG1 4.29Å; F125-V129 HydrophobicContact CE1-CG2 4.49Å; F125-V129 HydrophobicContact CE2-CB 4.41Å; F125-V129 HydrophobicContact CE2-CG2 4.45Å; F125-V129 HydrophobicContact CZ-CB 4.17Å; F125-V129 HydrophobicContact CZ-CG2 4.02Å; F125-V129 WeakPolarHBondContact O-CB 3.42Å; F125-V129 WeakPolarHBondContact O-CG1 2.81Å; F125-V129 PolarHBondContact O-N 3.22Å; V129-K133 HydrophobicContact CG2-CB 4.07Å; V129-F134 HydrophobicContact CG1-CB 3.99Å; V129-F134 HydrophobicContact CG1-CG 4.38Å; V129-F134 HydrophobicContact CG2-CB 3.89Å |
| 130 | S | 87.5 | Confident | 88.9 | Confident | 48 Ų | 48 | 68.4 Ų | 68.4 | 34% | 0.336 | 34% | 0.344 | S | S | . | . | trans | -78.4 | 152 | 175.1 | 68.1 | 0 | 0 | 0 | 0 | 111.1 | Y132 K133 F134 | S130-Y132 PolarHBondContact O-N 3.26Å; S130-K133 PolarHBondContact O-N 3Å; S130-K133 VanDerWaalsContact OG-CG 3.32Å; S130-K133 WeakPolarHBondContact OG-CG 3.28Å; S130-F134 PolarHBondContact O-N 2.91Å | ||
| 131 | I | 84.5 | Confident | 89.3 | Confident | 42 Ų | 42 | 73.6 Ų | 73.6 | 22% | 0.215 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -54 | -43.6 | 177.7 | -64.6 | 168.8 | 0 | 0 | 0 | 111 | R51 M54 K133 F134 H135 I136 | R51-I131 HydrophobicContact CB-CG1 4.23Å; R51-I131 HydrophobicContact CG-CD1 3.99Å; R51-I131 HydrophobicContact CG-CG1 3.7Å; M54-I131 HydrophobicContact CG-CG2 3.8Å; I131-K133 VanDerWaalsContact C-N 3.27Å; I131-K133 PolarHBondContact O-N 3.33Å; I131-F134 PolarHBondContact O-N 3.06Å; I131-H135 HydrophobicContact CG2-CB 4.11Å; I131-H135 PolarHBondContact O-N 2.97Å; I131-I136 PolarHBondContact O-N 2.81Å |
| 132 | Y | 86.6 | Confident | 89.6 | Confident | 179 Ų | 179 | 70.5 Ų | 70.5 | 70% | 0.702 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -65.1 | -27.2 | -178.8 | -61.3 | -86.1 | 0 | 0 | 0 | 113.7 | S130 I136 P137 | S130-Y132 PolarHBondContact O-N 3.26Å; Y132-I136 HydrophobicContact CD1-CD1 3.34Å; Y132-I136 HydrophobicContact CE1-CD1 3.82Å; Y132-I136 HydrophobicContact CG-CD1 4.11Å; Y132-P137 VanDerWaalsContact O-CD 3.27Å; Y132-P137 WeakPolarHBondContact O-CD 3.24Å |
| 133 | K | 89.5 | Confident | 89.8 | Confident | 166 Ų | 166 | 67.1 Ų | 67.1 | 72% | 0.722 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -88.8 | -15.5 | -178.5 | -73.9 | -177.2 | 177.8 | -173.6 | 0 | 113.6 | V129 S130 I131 | V129-K133 HydrophobicContact CG2-CB 4.07Å; S130-K133 PolarHBondContact O-N 3Å; S130-K133 VanDerWaalsContact OG-CG 3.32Å; S130-K133 WeakPolarHBondContact OG-CG 3.28Å; I131-K133 VanDerWaalsContact C-N 3.27Å; I131-K133 PolarHBondContact O-N 3.33Å |
| 134 | F | 89.8 | Confident | 90.3 | Very high | 26 Ų | 26 | 68.8 Ų | 68.8 | 11% | 0.114 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -126.9 | -62 | -174.7 | 178.2 | -111.7 | 0 | 0 | 0 | 113 | I118 Y126 V129 S130 I131 P137 L138 | I118-F134 HydrophobicContact CB-CZ 4.32Å; I118-F134 HydrophobicContact CD1-CE2 3.37Å; I118-F134 HydrophobicContact CD1-CZ 3.48Å; I118-F134 VanDerWaalsContact CD1-CZ 3.48Å; I118-F134 HydrophobicContact CG1-CZ 4.46Å; I118-F134 HydrophobicContact CG2-CZ 4.33Å; Y126-F134 HydrophobicContact CD2-CE1 4.31Å; Y126-F134 HydrophobicContact CE2-CD1 4.45Å; Y126-F134 HydrophobicContact CE2-CE1 4.01Å; V129-F134 HydrophobicContact CG1-CB 3.99Å; V129-F134 HydrophobicContact CG1-CG 4.38Å; V129-F134 HydrophobicContact CG2-CB 3.89Å; S130-F134 PolarHBondContact O-N 2.91Å; I131-F134 PolarHBondContact O-N 3.06Å; F134-P137 WeakPolarHBondContact O-CD 3.19Å; F134-L138 HydrophobicContact CZ-CD2 4.23Å; F134-L138 VanDerWaalsContact O-CB 3.31Å; F134-L138 WeakPolarHBondContact O-CB 3.14Å; F134-L138 PolarHBondContact O-N 3.49Å; F134-L138 VanDerWaalsContact O-N 3.09Å |
| 135 | H | 90.3 | Very high | 90.7 | Very high | 1 Ų | 1 | 67 Ų | 67 | 1% | 0.005 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67.2 | -42 | -174.7 | -67.3 | 89.7 | 0 | 0 | 0 | 113.2 | M54 D115 Y126 I131 L138 V139 | M54-H135 HydrophobicContact CB-CB 4.49Å; D115-H135 IonicContact OD1-CD2 3.83Å; D115-H135 IonicContact OD1-CE1 2.79Å; D115-H135 IonicContact OD1-NE2 3.62Å; D115-H135 PolarHBondContact OD1-NE2 3.37Å; Y126-H135 AromaticContact CE2-CE1 3.93Å; Y126-H135 AromaticContact CE2-NE2 3.94Å; Y126-H135 PolarHBondContact OH-NE2 2.92Å; I131-H135 HydrophobicContact CG2-CB 4.11Å; I131-H135 PolarHBondContact O-N 2.97Å; H135-L138 PolarHBondContact O-N 3.38Å; H135-V139 WeakPolarHBondContact O-CG2 3.28Å; H135-V139 PolarHBondContact O-N 2.88Å |
| 136 | I | 90.8 | Very high | 91 | Very high | 75 Ų | 75 | 61.7 Ų | 61.7 | 39% | 0.385 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -65.9 | -49.6 | -179.5 | -63.8 | -178.5 | 0 | 0 | 0 | 111.6 | I131 Y132 L138 V139 G140 | I131-I136 PolarHBondContact O-N 2.81Å; Y132-I136 HydrophobicContact CD1-CD1 3.34Å; Y132-I136 HydrophobicContact CE1-CD1 3.82Å; Y132-I136 HydrophobicContact CG-CD1 4.11Å; I136-L138 VanDerWaalsContact C-N 3.29Å; I136-L138 PolarHBondContact O-N 3.4Å; I136-V139 PolarHBondContact O-N 2.92Å; I136-G140 PolarHBondContact O-N 3.33Å |
| 137 | P | 93.7 | Very high | 91.5 | Very high | 72 Ų | 72 | 65.7 Ų | 65.7 | 47% | 0.468 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58.1 | -40.2 | 173.8 | -27.4 | 35.1 | 0 | 0 | 0 | 113 | Y132 F134 G140 L141 | Y132-P137 VanDerWaalsContact O-CD 3.27Å; Y132-P137 WeakPolarHBondContact O-CD 3.24Å; F134-P137 WeakPolarHBondContact O-CD 3.19Å; P137-G140 PolarHBondContact O-N 2.96Å; P137-L141 WeakPolarHBondContact O-CB 3.36Å; P137-L141 PolarHBondContact O-N 3.5Å |
| 138 | L | 93.1 | Very high | 92 | Very high | 24 Ų | 24 | 62.3 Ų | 62.3 | 13% | 0.126 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62 | -48.3 | 177.8 | -178.2 | 63.4 | 0 | 0 | 0 | 111.5 | A111 V114 F134 H135 I136 G140 L141 V142 | A111-L138 HydrophobicContact CB-CD1 4.43Å; A111-L138 HydrophobicContact CB-CD2 4.03Å; A111-L138 HydrophobicContact CB-CG 3.92Å; V114-L138 HydrophobicContact CB-CD1 4.45Å; V114-L138 HydrophobicContact CG1-CD1 4.2Å; V114-L138 HydrophobicContact CG1-CD2 4.45Å; F134-L138 HydrophobicContact CZ-CD2 4.23Å; F134-L138 VanDerWaalsContact O-CB 3.31Å; F134-L138 WeakPolarHBondContact O-CB 3.14Å; F134-L138 PolarHBondContact O-N 3.49Å; F134-L138 VanDerWaalsContact O-N 3.09Å; H135-L138 PolarHBondContact O-N 3.38Å; I136-L138 VanDerWaalsContact C-N 3.29Å; I136-L138 PolarHBondContact O-N 3.4Å; L138-G140 VanDerWaalsContact C-N 3.35Å; L138-L141 PolarHBondContact O-N 2.89Å; L138-V142 WeakPolarHBondContact O-CG2 3.11Å; L138-V142 PolarHBondContact O-N 3.49Å; L138-V142 VanDerWaalsContact O-N 3.16Å |
| 139 | V | 92.7 | Very high | 92.3 | Very high | 32 Ų | 32 | 57.9 Ų | 57.9 | 19% | 0.194 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 175.6 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | T55 A58 H135 I136 L141 V142 T143 | T55-V139 HydrophobicContact CG2-CG2 4.44Å; A58-V139 HydrophobicContact CB-CG1 3.89Å; A58-V139 HydrophobicContact CB-CG2 4.16Å; H135-V139 WeakPolarHBondContact O-CG2 3.28Å; H135-V139 PolarHBondContact O-N 2.88Å; I136-V139 PolarHBondContact O-N 2.92Å; V139-L141 VanDerWaalsContact C-N 3.33Å; V139-L141 PolarHBondContact O-N 3.48Å; V139-V142 WeakPolarHBondContact O-CG2 3.41Å; V139-V142 PolarHBondContact O-N 3.39Å; V139-T143 HydrophobicContact CG1-CG2 4.14Å; V139-T143 WeakPolarHBondContact O-CB 3.19Å; V139-T143 VanDerWaalsContact O-CG2 3.24Å; V139-T143 WeakPolarHBondContact O-CG2 3.49Å; V139-T143 PolarHBondContact O-N 3.35Å; V139-T143 PolarHBondContact O-OG1 3.43Å |
| 140 | G | 94.2 | Very high | 92.6 | Very high | 33 Ų | 33 | 57.4 Ų | 57.4 | 34% | 0.34 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.6 | -37.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | I136 P137 L138 T143 S144 | I136-G140 PolarHBondContact O-N 3.33Å; P137-G140 PolarHBondContact O-N 2.96Å; L138-G140 VanDerWaalsContact C-N 3.35Å; G140-T143 WeakPolarHBondContact CA-OG1 3.38Å; G140-T143 PolarHBondContact O-OG1 2.85Å; G140-T143 VanDerWaalsContact O-OG1 3.12Å; G140-S144 WeakPolarHBondContact O-CB 3.43Å; G140-S144 PolarHBondContact O-N 3.37Å; G140-S144 PolarHBondContact O-OG 3.32Å; G140-S144 VanDerWaalsContact O-OG 3.14Å |
| 141 | L | 95.3 | Very high | 93 | Very high | 110 Ų | 110 | 58.5 Ų | 58.5 | 58% | 0.576 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -69.2 | -43.6 | 177.2 | -173.5 | 156.2 | 0 | 0 | 0 | 111.7 | P137 L138 V139 S144 Y145 | P137-L141 WeakPolarHBondContact O-CB 3.36Å; P137-L141 PolarHBondContact O-N 3.5Å; L138-L141 PolarHBondContact O-N 2.89Å; V139-L141 VanDerWaalsContact C-N 3.33Å; V139-L141 PolarHBondContact O-N 3.48Å; L141-S144 PolarHBondContact O-OG 3.12Å; L141-Y145 PolarHBondContact O-N 2.81Å |
| 142 | V | 94.3 | Very high | 93.4 | Very high | 4 Ų | 4 | 57.8 Ų | 57.8 | 2% | 0.024 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -71.3 | -35.3 | -179.5 | -64.5 | 0 | 0 | 0 | 0 | 112.4 | M107 A111 L138 V139 S146 | M107-V142 HydrophobicContact CB-CB 3.84Å; M107-V142 HydrophobicContact CB-CG1 4.36Å; M107-V142 HydrophobicContact CE-CB 4.44Å; M107-V142 HydrophobicContact CE-CG1 4.08Å; M107-V142 WeakPolarHBondContact O-CG1 3.42Å; A111-V142 HydrophobicContact CB-CG1 4.01Å; A111-V142 HydrophobicContact CB-CG2 4.17Å; L138-V142 WeakPolarHBondContact O-CG2 3.11Å; L138-V142 PolarHBondContact O-N 3.49Å; L138-V142 VanDerWaalsContact O-N 3.16Å; V139-V142 WeakPolarHBondContact O-CG2 3.41Å; V139-V142 PolarHBondContact O-N 3.39Å; V142-S146 PolarHBondContact O-N 2.84Å; V142-S146 PolarHBondContact O-OG 2.93Å |
| 143 | T | 95.1 | Very high | 93.7 | Very high | 44 Ų | 44 | 49.3 Ų | 49.3 | 27% | 0.27 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -72.7 | -38 | 175.6 | 58.8 | 0 | 0 | 0 | 0 | 111.6 | V139 G140 S146 L147 | V139-T143 HydrophobicContact CG1-CG2 4.14Å; V139-T143 WeakPolarHBondContact O-CB 3.19Å; V139-T143 VanDerWaalsContact O-CG2 3.24Å; V139-T143 WeakPolarHBondContact O-CG2 3.49Å; V139-T143 PolarHBondContact O-N 3.35Å; V139-T143 PolarHBondContact O-OG1 3.43Å; G140-T143 WeakPolarHBondContact CA-OG1 3.38Å; G140-T143 PolarHBondContact O-OG1 2.85Å; G140-T143 VanDerWaalsContact O-OG1 3.12Å; T143-S146 PolarHBondContact O-N 3.36Å; T143-L147 WeakPolarHBondContact O-CB 3.33Å; T143-L147 PolarHBondContact O-N 2.94Å |
| 144 | S | 96.2 | Very high | 93.9 | Very high | 57 Ų | 57 | 43.8 Ų | 43.8 | 40% | 0.399 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.1 | -41.9 | 177.6 | 68.5 | 0 | 0 | 0 | 0 | 111.9 | G140 L141 S146 L147 S148 | G140-S144 WeakPolarHBondContact O-CB 3.43Å; G140-S144 PolarHBondContact O-N 3.37Å; G140-S144 PolarHBondContact O-OG 3.32Å; G140-S144 VanDerWaalsContact O-OG 3.14Å; L141-S144 PolarHBondContact O-OG 3.12Å; S144-S146 VanDerWaalsContact C-N 3.31Å; S144-S146 PolarHBondContact O-N 3.4Å; S144-L147 PolarHBondContact O-N 3.08Å; S144-S148 WeakPolarHBondContact O-CB 3.31Å; S144-S148 PolarHBondContact O-N 3.24Å; S144-S148 PolarHBondContact O-OG 2.94Å; S144-S148 VanDerWaalsContact O-OG 3.06Å |
| 145 | Y | 94.5 | Very high | 94.1 | Very high | 80 Ų | 80 | 48.3 Ų | 48.3 | 31% | 0.314 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -56.2 | -46.8 | 172.8 | 175.4 | -90.5 | 0 | 0 | 0 | 111.9 | M107 L141 L147 S148 L149 | M107-Y145 HydrophobicContact CE-CD1 4.14Å; M107-Y145 HydrophobicContact CE-CG 4.33Å; M107-Y145 HydrophobicContact CG-CD1 3.58Å; M107-Y145 HydrophobicContact CG-CE1 3.96Å; M107-Y145 HydrophobicContact SD-CD1 3.78Å; M107-Y145 HydrophobicContact SD-CE1 3.81Å; L141-Y145 PolarHBondContact O-N 2.81Å; Y145-L147 VanDerWaalsContact C-N 3.32Å; Y145-L147 PolarHBondContact O-N 3.31Å; Y145-S148 PolarHBondContact O-N 2.88Å; Y145-L149 HydrophobicContact CD1-CD1 4.01Å; Y145-L149 HydrophobicContact CE1-CD1 3.33Å; Y145-L149 HydrophobicContact CE1-CG 4.23Å; Y145-L149 PolarHBondContact O-N 3.35Å; Y145-L149 VanDerWaalsContact O-N 3.09Å |
| 146 | S | 95.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -67.2 | -36.6 | -178.7 | -53.8 | 0 | 0 | 0 | 0 | 111.7 | N104 V142 T143 S144 S150 | N104-S146 WeakPolarHBondContact CA-OG 3.44Å; N104-S146 PolarHBondContact N-OG 2.95Å; V142-S146 PolarHBondContact O-N 2.84Å; V142-S146 PolarHBondContact O-OG 2.93Å; T143-S146 PolarHBondContact O-N 3.36Å; S144-S146 VanDerWaalsContact C-N 3.31Å; S144-S146 PolarHBondContact O-N 3.4Å; S146-S150 WeakPolarHBondContact O-CB 3.23Å; S146-S150 PolarHBondContact O-N 2.92Å; S146-S150 VanDerWaalsContact O-N 3.16Å; S146-S150 PolarHBondContact O-OG 3.35Å |
| 147 | L | 96.6 | Very high | 94.1 | Very high | 97 Ų | 97 | 47 Ų | 47 | 51% | 0.508 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65.7 | -47.1 | 173.7 | -178.1 | 61.3 | 0 | 0 | 0 | 111.4 | F100 T143 S144 Y145 L149 S150 V151 | F100-L147 HydrophobicContact CD2-CB 4.39Å; F100-L147 HydrophobicContact CE2-CB 4.17Å; T143-L147 WeakPolarHBondContact O-CB 3.33Å; T143-L147 PolarHBondContact O-N 2.94Å; S144-L147 PolarHBondContact O-N 3.08Å; Y145-L147 VanDerWaalsContact C-N 3.32Å; Y145-L147 PolarHBondContact O-N 3.31Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L147-L149 PolarHBondContact O-N 2.63Å; L147-S150 WeakPolarHBondContact O-CB 3.44Å; L147-S150 PolarHBondContact O-N 3.15Å; L147-V151 HydrophobicContact CD1-CG2 4.31Å; L147-V151 HydrophobicContact CG-CG2 4.45Å; L147-V151 WeakPolarHBondContact O-CG2 3.42Å; L147-V151 PolarHBondContact O-N 2.82Å |
| 148 | S | 96.1 | Very high | 93.9 | Very high | 80 Ų | 80 | 53.4 Ų | 53.4 | 56% | 0.559 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -57.8 | -44 | 178.2 | -64.3 | 0 | 0 | 0 | 0 | 112.1 | S144 Y145 S150 V151 A152 | S144-S148 WeakPolarHBondContact O-CB 3.31Å; S144-S148 PolarHBondContact O-N 3.24Å; S144-S148 PolarHBondContact O-OG 2.94Å; S144-S148 VanDerWaalsContact O-OG 3.06Å; Y145-S148 PolarHBondContact O-N 2.88Å; S148-S150 VanDerWaalsContact C-N 3.3Å; S148-S150 PolarHBondContact O-N 3.4Å; S148-V151 PolarHBondContact O-N 2.86Å; S148-A152 WeakPolarHBondContact O-CB 3.5Å; S148-A152 PolarHBondContact O-N 3.06Å |
| 149 | L | 92.9 | Very high | 93.6 | Very high | 28 Ų | 28 | 55.5 Ų | 55.5 | 15% | 0.147 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.7 | -37.5 | 174.5 | -74.4 | 178.8 | 0 | 0 | 0 | 112.5 | N103 Y145 L147 A152 T153 M182 | N103-L149 HydrophobicContact CB-CD1 4.39Å; Y145-L149 HydrophobicContact CD1-CD1 4.01Å; Y145-L149 HydrophobicContact CE1-CD1 3.33Å; Y145-L149 HydrophobicContact CE1-CG 4.23Å; Y145-L149 PolarHBondContact O-N 3.35Å; Y145-L149 VanDerWaalsContact O-N 3.09Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L147-L149 PolarHBondContact O-N 2.63Å; L149-A152 WeakPolarHBondContact O-CB 3.47Å; L149-A152 PolarHBondContact O-N 3.09Å; L149-T153 PolarHBondContact O-N 3.14Å; L149-T153 PolarHBondContact O-OG1 2.97Å; L149-T153 VanDerWaalsContact O-OG1 3.07Å; L149-M182 HydrophobicContact CB-CE 4.44Å; L149-M182 HydrophobicContact CD1-CE 3.87Å; L149-M182 HydrophobicContact CD2-CE 4.33Å; L149-M182 HydrophobicContact CG-CE 4.47Å |
| 150 | S | 95.2 | Very high | 93.3 | Very high | 7 Ų | 7 | 56.6 Ų | 56.6 | 5% | 0.049 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -71.2 | -40.2 | -179.6 | -55.1 | 0 | 0 | 0 | 0 | 111.9 | A96 F100 S146 L147 S148 A152 T153 V154 | A96-S150 WeakPolarHBondContact CB-O 3.28Å; A96-S150 WeakPolarHBondContact O-CB 3.14Å; A96-S150 PolarHBondContact O-OG 3.38Å; F100-S150 WeakPolarHBondContact CA-OG 3.4Å; F100-S150 WeakPolarHBondContact CB-OG 3.21Å; F100-S150 PolarHBondContact N-OG 3.24Å; S146-S150 WeakPolarHBondContact O-CB 3.23Å; S146-S150 PolarHBondContact O-N 2.92Å; S146-S150 VanDerWaalsContact O-N 3.16Å; S146-S150 PolarHBondContact O-OG 3.35Å; L147-S150 WeakPolarHBondContact O-CB 3.44Å; L147-S150 PolarHBondContact O-N 3.15Å; S148-S150 VanDerWaalsContact C-N 3.3Å; S148-S150 PolarHBondContact O-N 3.4Å; S150-A152 VanDerWaalsContact C-N 3.32Å; S150-T153 WeakPolarHBondContact O-CB 3.47Å; S150-T153 PolarHBondContact O-N 3.24Å; S150-V154 PolarHBondContact O-N 3.12Å |
| 151 | V | 95.8 | Very high | 92.9 | Very high | 72 Ų | 72 | 59.3 Ų | 59.3 | 44% | 0.436 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 171.6 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | L147 S148 T153 V154 I155 | L147-V151 HydrophobicContact CD1-CG2 4.31Å; L147-V151 HydrophobicContact CG-CG2 4.45Å; L147-V151 WeakPolarHBondContact O-CG2 3.42Å; L147-V151 PolarHBondContact O-N 2.82Å; S148-V151 PolarHBondContact O-N 2.86Å; V151-T153 VanDerWaalsContact C-N 3.31Å; V151-T153 PolarHBondContact O-N 3.34Å; V151-V154 PolarHBondContact O-N 3.47Å; V151-V154 VanDerWaalsContact O-N 3.11Å; V151-I155 HydrophobicContact CG1-CD1 3.7Å; V151-I155 HydrophobicContact CG1-CG1 4.31Å; V151-I155 WeakPolarHBondContact O-CG1 3.24Å; V151-I155 PolarHBondContact O-N 2.99Å |
| 152 | A | 93.8 | Very high | 92.4 | Very high | 27 Ų | 27 | 54.7 Ų | 54.7 | 22% | 0.223 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60 | -39.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | S148 L149 S150 V154 I155 Q156 W173 | S148-A152 WeakPolarHBondContact O-CB 3.5Å; S148-A152 PolarHBondContact O-N 3.06Å; L149-A152 WeakPolarHBondContact O-CB 3.47Å; L149-A152 PolarHBondContact O-N 3.09Å; S150-A152 VanDerWaalsContact C-N 3.32Å; A152-V154 VanDerWaalsContact C-N 3.32Å; A152-V154 PolarHBondContact O-N 2.84Å; A152-I155 PolarHBondContact O-N 2.87Å; A152-Q156 WeakPolarHBondContact O-CB 3.39Å; A152-Q156 WeakPolarHBondContact O-CG 3.14Å; A152-Q156 PolarHBondContact O-N 3.48Å; A152-W173 HydrophobicContact CB-CH2 4.21Å |
| 153 | T | 92.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.3 | -41.4 | 173.2 | -57.4 | 0 | 0 | 0 | 0 | 112.1 | L149 S150 V151 G157 P169 C172 | L149-T153 PolarHBondContact O-N 3.14Å; L149-T153 PolarHBondContact O-OG1 2.97Å; L149-T153 VanDerWaalsContact O-OG1 3.07Å; S150-T153 WeakPolarHBondContact O-CB 3.47Å; S150-T153 PolarHBondContact O-N 3.24Å; V151-T153 VanDerWaalsContact C-N 3.31Å; V151-T153 PolarHBondContact O-N 3.34Å; T153-G157 PolarHBondContact O-N 2.9Å; T153-P169 HydrophobicContact CG2-CB 3.92Å; T153-C172 HydrophobicContact CG2-CB 3.66Å |
| 154 | V | 93.4 | Very high | 90.6 | Very high | 51 Ų | 51 | 56.9 Ų | 56.9 | 31% | 0.309 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -67.7 | -48.3 | 177.3 | -179.5 | 0 | 0 | 0 | 0 | 111.1 | A96 S150 V151 A152 G157 Y158 | A96-V154 HydrophobicContact CB-CG2 3.35Å; S150-V154 PolarHBondContact O-N 3.12Å; V151-V154 PolarHBondContact O-N 3.47Å; V151-V154 VanDerWaalsContact O-N 3.11Å; A152-V154 VanDerWaalsContact C-N 3.32Å; A152-V154 PolarHBondContact O-N 2.84Å; V154-G157 CarbonylContact O-C 3.56Å; V154-G157 PolarHBondContact O-N 3.46Å; V154-Y158 PolarHBondContact O-N 3.17Å; V154-Y158 VanDerWaalsContact O-N 3.07Å |
| 155 | I | 93.6 | Very high | 89.6 | Confident | 121 Ų | 121 | 56.4 Ų | 56.4 | 62% | 0.621 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -62.8 | -47.1 | -176.8 | -66.6 | 170.8 | 0 | 0 | 0 | 110.6 | V151 A152 G157 Y158 | V151-I155 HydrophobicContact CG1-CD1 3.7Å; V151-I155 HydrophobicContact CG1-CG1 4.31Å; V151-I155 WeakPolarHBondContact O-CG1 3.24Å; V151-I155 PolarHBondContact O-N 2.99Å; A152-I155 PolarHBondContact O-N 2.87Å; I155-G157 VanDerWaalsContact C-N 3.3Å; I155-G157 PolarHBondContact O-N 2.98Å; I155-Y158 WeakPolarHBondContact O-CB 3.29Å; I155-Y158 PolarHBondContact O-N 2.93Å |
| 156 | Q | 91.6 | Very high | 88.9 | Confident | 47 Ų | 47 | 56 Ų | 56 | 22% | 0.22 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -70.8 | -28.1 | 178.2 | -66.5 | -159.1 | 26.1 | 0 | 0 | 112.9 | A152 Y158 C172 W173 N174 | A152-Q156 WeakPolarHBondContact O-CB 3.39Å; A152-Q156 WeakPolarHBondContact O-CG 3.14Å; A152-Q156 PolarHBondContact O-N 3.48Å; Q156-Y158 VanDerWaalsContact C-N 3.31Å; Q156-C172 CarbonylContact C-O 3.41Å; Q156-C172 VanDerWaalsContact O-O 3.1Å; Q156-W173 VanDerWaalsContact CD-CE3 3.45Å; Q156-N174 PolarHBondContact O-OD1 3.08Å |
| 157 | G | 90 | Very high | 88.3 | Confident | 2 Ų | 2 | 57.4 Ų | 57.4 | 2% | 0.021 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | -2.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | T153 V154 I155 G159 K160 C172 | T153-G157 PolarHBondContact O-N 2.9Å; V154-G157 CarbonylContact O-C 3.56Å; V154-G157 PolarHBondContact O-N 3.46Å; I155-G157 VanDerWaalsContact C-N 3.3Å; I155-G157 PolarHBondContact O-N 2.98Å; G157-G159 PolarHBondContact O-N 3.44Å; G157-K160 WeakPolarHBondContact O-CB 3.41Å; G157-K160 PolarHBondContact O-N 3.36Å; G157-K160 VanDerWaalsContact O-N 3.1Å; G157-C172 VanDerWaalsContact CA-O 3.27Å; G157-C172 WeakPolarHBondContact CA-O 3.42Å; G157-C172 PolarHBondContact N-O 3.37Å; G157-C172 VanDerWaalsContact N-O 3.16Å |
| 158 | Y | 89.6 | Confident | 87.9 | Confident | 206 Ų | 206 | 52.8 Ų | 52.8 | 81% | 0.808 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | 128.5 | -172.7 | -173.6 | -98.5 | 0 | 0 | 0 | 111.6 | V154 I155 Q156 K160 | V154-Y158 PolarHBondContact O-N 3.17Å; V154-Y158 VanDerWaalsContact O-N 3.07Å; I155-Y158 WeakPolarHBondContact O-CB 3.29Å; I155-Y158 PolarHBondContact O-N 2.93Å; Q156-Y158 VanDerWaalsContact C-N 3.31Å; Y158-K160 PolarHBondContact O-N 2.91Å |
| 159 | G | 85.2 | Confident | 87.6 | Confident | 68 Ų | 68 | 49.3 Ų | 49.3 | 70% | 0.701 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.1 | -3.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | G157 V161 | G157-G159 PolarHBondContact O-N 3.44Å; G159-V161 PolarHBondContact O-N 3.06Å |
| 160 | K | 88 | Confident | 87.4 | Confident | 54 Ų | 54 | 48.5 Ų | 48.5 | 24% | 0.235 | 27% | 0.268 | C | S | . | . | trans | -75.8 | 126.6 | 175.8 | -70.6 | -173.9 | -179.7 | 164.4 | 0 | 111.3 | G157 Y158 I162 C172 W173 N174 | G157-K160 WeakPolarHBondContact O-CB 3.41Å; G157-K160 PolarHBondContact O-N 3.36Å; G157-K160 VanDerWaalsContact O-N 3.1Å; Y158-K160 PolarHBondContact O-N 2.91Å; K160-I162 HydrophobicContact CB-CD1 4.41Å; K160-I162 HydrophobicContact CB-CG1 4.36Å; K160-C172 PolarHBondContact NZ-O 2.98Å; K160-W173 PolarHBondContact NZ-O 3.01Å; K160-N174 WeakPolarHBondContact CE-OD1 3.39Å; K160-N174 PolarHBondContact NZ-OD1 3.27Å | ||
| 161 | V | 85.3 | Confident | 87.1 | Confident | 91 Ų | 91 | 51.1 Ų | 51.1 | 55% | 0.552 | 28% | 0.281 | S | S | * | . | trans | -97.2 | 109.6 | 174.6 | -178.8 | 0 | 0 | 0 | 0 | 108.2 | P87 G159 | P87-V161 HydrophobicContact CB-CG1 3.04Å; P87-V161 HydrophobicContact CG-CG1 4.39Å; G159-V161 PolarHBondContact O-N 3.06Å | ||
| 162 | I | 85.4 | Confident | 86.9 | Confident | 13 Ų | 13 | 47.7 Ų | 47.7 | 7% | 0.067 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 134.9 | -177.4 | -61.1 | 167 | 0 | 0 | 0 | 107.8 | D88 C91 K160 F164 K166 L171 | D88-I162 PolarHBondContact N-O 3.4Å; C91-I162 HydrophobicContact CB-CB 4.21Å; K160-I162 HydrophobicContact CB-CD1 4.41Å; K160-I162 HydrophobicContact CB-CG1 4.36Å; I162-F164 PolarHBondContact O-N 3.32Å; I162-K166 HydrophobicContact CG2-CB 4.41Å; I162-L171 HydrophobicContact CD1-CB 3.77Å; I162-L171 HydrophobicContact CG2-CD1 3.85Å |
| 163 | P | 78.6 | Confident | 86.7 | Confident | 53 Ų | 53 | 47.9 Ų | 47.9 | 34% | 0.344 | 26% | 0.255 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -55.1 | 136.3 | 173.1 | -26 | 35 | 0 | 0 | 0 | 111.1 | N165 K166 C167 | P163-N165 VanDerWaalsContact C-N 3.28Å; P163-N165 WeakPolarHBondContact CB-OD1 3.38Å; P163-N165 PolarHBondContact O-N 3.34Å; P163-K166 PolarHBondContact O-N 3.42Å; P163-C167 PolarHBondContact O-N 3.4Å |
| 164 | F | 73.2 | Confident | 86.5 | Confident | 41 Ų | 41 | 53.2 Ų | 53.2 | 18% | 0.18 | 28% | 0.284 | C | S | . | . | G | 310 helix | trans | -54.5 | -42.8 | -174.6 | 175 | -96.7 | 0 | 0 | 0 | 112.8 | Y76 N86 D88 I162 K166 C167 | Y76-F164 AromaticContact CD1-CE2 3.56Å; Y76-F164 HydrophobicContact CD1-CE2 3.56Å; Y76-F164 AromaticContact CD1-CZ 3.6Å; Y76-F164 HydrophobicContact CD1-CZ 3.6Å; Y76-F164 HydrophobicContact CE1-CD2 4.38Å; Y76-F164 AromaticContact CE1-CE2 3.62Å; Y76-F164 HydrophobicContact CE1-CE2 3.62Å; Y76-F164 HydrophobicContact CE1-CZ 4.01Å; N86-F164 PolarHBondContact O-N 3.14Å; D88-F164 HydrophobicContact CB-CB 4.42Å; I162-F164 PolarHBondContact O-N 3.32Å; F164-K166 PolarHBondContact O-N 3.32Å; F164-C167 VanDerWaalsContact O-CB 3.24Å; F164-C167 WeakPolarHBondContact O-CB 3.38Å; F164-C167 PolarHBondContact O-N 2.68Å; F164-C167 VanDerWaalsContact O-N 3.15Å |
| 165 | N | 75 | Confident | 86.3 | Confident | 46 Ų | 46 | 53.2 Ų | 53.2 | 25% | 0.246 | 29% | 0.286 | C | S | . | . | G | 310 helix | trans | -65.6 | -18.2 | 179.1 | 65.4 | -8.6 | 0 | 0 | 0 | 115 | S84 P163 | S84-N165 PolarHBondContact O-N 2.87Å; P163-N165 VanDerWaalsContact C-N 3.28Å; P163-N165 WeakPolarHBondContact CB-OD1 3.38Å; P163-N165 PolarHBondContact O-N 3.34Å |
| 166 | K | 79.3 | Confident | 86 | Confident | 71 Ų | 71 | 51.6 Ų | 51.6 | 31% | 0.309 | 28% | 0.282 | S | S | . | . | G | 310 helix | trans | -103.5 | -0.6 | 178.3 | -71.6 | 176.4 | -175.5 | 177.5 | 0 | 112.2 | I162 P163 F164 G168 L171 E261 | I162-K166 HydrophobicContact CG2-CB 4.41Å; P163-K166 PolarHBondContact O-N 3.42Å; F164-K166 PolarHBondContact O-N 3.32Å; K166-G168 PolarHBondContact O-N 2.97Å; K166-L171 HydrophobicContact CB-CD1 4Å; K166-L171 WeakPolarHBondContact O-CD1 3.19Å; K166-E261 WeakPolarHBondContact CE-OE1 3.21Å; K166-E261 IonicContact NZ-OE1 2.78Å; K166-E261 PolarHBondContact NZ-OE1 2.86Å |
| 167 | C | 84 | Confident | 86 | Confident | 30 Ų | 30 | 55.4 Ų | 55.4 | 20% | 0.203 | 30% | 0.298 | C | S | . | . | trans | -59.6 | 123.8 | -172.4 | -172.5 | 0 | 0 | 0 | 0 | 112.4 | C91 S95 P163 F164 | C91-C167 VanDerWaalsContact C-SG 3.58Å; C91-C167 WeakPolarHBondContact CA-SG 3.29Å; C91-C167 HydrophobicContact CB-CB 4.03Å; C91-C167 WeakPolarHBondContact CB-SG 3.22Å; C91-C167 PolarHBondContact O-SG 2.96Å; C91-C167 VanDerWaalsContact O-SG 3.32Å; C91-C167 WeakPolarHBondContact SG-CA 3.37Å; C91-C167 WeakPolarHBondContact SG-CB 3.49Å; C91-C167 CovalentContact SG-SG 2.03Å; C91-C167 PolarHBondContact SG-SG 3.35Å; S95-C167 PolarHBondContact OG-SG 3.06Å; P163-C167 PolarHBondContact O-N 3.4Å; F164-C167 VanDerWaalsContact O-CB 3.24Å; F164-C167 WeakPolarHBondContact O-CB 3.38Å; F164-C167 PolarHBondContact O-N 2.68Å; F164-C167 VanDerWaalsContact O-N 3.15Å | ||
| 168 | G | 87.1 | Confident | 86.1 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 31% | 0.311 | C | S | . | . | trans | -173.4 | 168.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S95 K166 E170 L171 Y268 | S95-G168 VanDerWaalsContact OG-CA 3.27Å; S95-G168 WeakPolarHBondContact OG-CA 3.25Å; S95-G168 PolarHBondContact OG-N 2.83Å; K166-G168 PolarHBondContact O-N 2.97Å; G168-E170 VanDerWaalsContact C-N 3.26Å; G168-E170 PolarHBondContact O-N 3.23Å; G168-L171 PolarHBondContact O-N 3.43Å; G168-Y268 WeakPolarHBondContact CA-OH 3.37Å | ||
| 169 | P | 89 | Confident | 86.1 | Confident | 8 Ų | 8 | 48.5 Ų | 48.5 | 5% | 0.052 | 28% | 0.275 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -25.5 | -164.9 | 23 | -31.2 | 0 | 0 | 0 | 113.6 | T153 C172 | T153-P169 HydrophobicContact CG2-CB 3.92Å; P169-C172 WeakPolarHBondContact O-CB 3.04Å; P169-C172 PolarHBondContact O-N 2.97Å |
| 170 | E | 88.8 | Confident | 86.5 | Confident | 11 Ų | 11 | 48.1 Ų | 48.1 | 5% | 0.051 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.2 | -37.6 | -178.9 | -66.6 | 79.4 | 179.7 | 0 | 0 | 112.6 | G168 C172 W173 V179 Q183 R252 | G168-E170 VanDerWaalsContact C-N 3.26Å; G168-E170 PolarHBondContact O-N 3.23Å; E170-C172 PolarHBondContact O-N 3.02Å; E170-W173 PolarHBondContact O-N 3.34Å; E170-V179 HydrophobicContact CB-CG1 3.84Å; E170-V179 HydrophobicContact CB-CG2 4.43Å; E170-V179 HydrophobicContact CG-CG1 3.79Å; E170-V179 VanDerWaalsContact O-CG2 3.3Å; E170-V179 WeakPolarHBondContact O-CG2 3Å; E170-Q183 PolarHBondContact OE1-NE2 2.97Å; E170-R252 VanDerWaalsContact CD-CZ 3.41Å; E170-R252 VanDerWaalsContact CD-NH2 3.31Å; E170-R252 HydrophobicContact CG-CG 4.48Å; E170-R252 IonicContact OE1-CZ 3.2Å; E170-R252 VanDerWaalsContact OE1-CZ 3.27Å; E170-R252 IonicContact OE1-NE 3.36Å; E170-R252 PolarHBondContact OE1-NE 2.84Å; E170-R252 IonicContact OE1-NH2 3.59Å; E170-R252 PolarHBondContact OE1-NH2 3.08Å; E170-R252 VanDerWaalsContact OE1-NH2 3.07Å; E170-R252 IonicContact OE2-CZ 3.51Å; E170-R252 IonicContact OE2-NE 3.98Å; E170-R252 PolarHBondContact OE2-NE 3.32Å; E170-R252 IonicContact OE2-NH1 3.27Å; E170-R252 IonicContact OE2-NH2 2.75Å; E170-R252 PolarHBondContact OE2-NH2 2.8Å |
| 171 | L | 88.9 | Confident | 86.7 | Confident | 61 Ų | 61 | 49.6 Ų | 49.6 | 32% | 0.319 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -15.1 | 178.7 | -64.9 | 179.1 | 0 | 0 | 0 | 113 | I162 K166 G168 W173 | I162-L171 HydrophobicContact CD1-CB 3.77Å; I162-L171 HydrophobicContact CG2-CD1 3.85Å; K166-L171 HydrophobicContact CB-CD1 4Å; K166-L171 WeakPolarHBondContact O-CD1 3.19Å; G168-L171 PolarHBondContact O-N 3.43Å; L171-W173 VanDerWaalsContact C-N 3.33Å |
| 172 | C | 91.7 | Very high | 87 | Confident | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -21.7 | 176.2 | -63.3 | 0 | 0 | 0 | 0 | 112.6 | C92 T153 Q156 G157 K160 P169 E170 | C92-C172 WeakPolarHBondContact CA-SG 3.33Å; C92-C172 HydrophobicContact CB-CB 3.89Å; C92-C172 WeakPolarHBondContact CB-SG 3.45Å; C92-C172 VanDerWaalsContact SG-CA 3.57Å; C92-C172 WeakPolarHBondContact SG-CB 3.29Å; C92-C172 CovalentContact SG-SG 2.05Å; C92-C172 PolarHBondContact SG-SG 3.43Å; T153-C172 HydrophobicContact CG2-CB 3.66Å; Q156-C172 CarbonylContact C-O 3.41Å; Q156-C172 VanDerWaalsContact O-O 3.1Å; G157-C172 VanDerWaalsContact CA-O 3.27Å; G157-C172 WeakPolarHBondContact CA-O 3.42Å; G157-C172 PolarHBondContact N-O 3.37Å; G157-C172 VanDerWaalsContact N-O 3.16Å; K160-C172 PolarHBondContact NZ-O 2.98Å; P169-C172 WeakPolarHBondContact O-CB 3.04Å; P169-C172 PolarHBondContact O-N 2.97Å; E170-C172 PolarHBondContact O-N 3.02Å |
| 173 | W | 90.6 | Very high | 87.3 | Confident | 32 Ų | 32 | 45.9 Ų | 45.9 | 12% | 0.121 | 24% | 0.238 | C | C | . | . | S | Bend | trans | -70.7 | 141.9 | 177.2 | -69 | 81.5 | 0 | 0 | 0 | 111.7 | A152 Q156 K160 E170 L171 S175 N178 V179 M182 | A152-W173 HydrophobicContact CB-CH2 4.21Å; Q156-W173 VanDerWaalsContact CD-CE3 3.45Å; K160-W173 PolarHBondContact NZ-O 3.01Å; E170-W173 PolarHBondContact O-N 3.34Å; L171-W173 VanDerWaalsContact C-N 3.33Å; W173-S175 VanDerWaalsContact C-N 3.27Å; W173-S175 PolarHBondContact O-N 2.78Å; W173-N178 HydrophobicContact CD2-CB 4.49Å; W173-N178 HydrophobicContact CE3-CB 3.74Å; W173-N178 HydrophobicContact CZ3-CB 4.33Å; W173-V179 HydrophobicContact CB-CG2 3.63Å; W173-V179 HydrophobicContact CG-CG2 3.98Å; W173-M182 HydrophobicContact CZ2-SD 3.78Å |
| 174 | N | 87.8 | Confident | 88 | Confident | 112 Ų | 112 | 47.5 Ų | 47.5 | 60% | 0.599 | 24% | 0.241 | S | C | * | . | S | Bend | trans | -71.8 | -19.6 | -177.8 | -77.6 | -17.7 | 0 | 0 | 0 | 114.4 | Q156 K160 | Q156-N174 PolarHBondContact O-OD1 3.08Å; K160-N174 WeakPolarHBondContact CE-OD1 3.39Å; K160-N174 PolarHBondContact NZ-OD1 3.27Å |
| 175 | S | 89.6 | Confident | 89 | Confident | 50 Ų | 50 | 50.8 Ų | 50.8 | 35% | 0.35 | 26% | 0.259 | S | S | . | . | trans | -137.6 | 133.3 | -178.1 | 176.2 | 0 | 0 | 0 | 0 | 110.4 | W173 F177 N178 V179 | W173-S175 VanDerWaalsContact C-N 3.27Å; W173-S175 PolarHBondContact O-N 2.78Å; S175-F177 PolarHBondContact O-N 3.09Å; S175-F177 WeakPolarHBondContact OG-CB 3.42Å; S175-F177 PolarHBondContact OG-N 3.01Å; S175-N178 WeakPolarHBondContact O-CB 3.27Å; S175-N178 PolarHBondContact O-N 3.43Å; S175-V179 PolarHBondContact O-N 2.92Å | ||
| 176 | T | 87.6 | Confident | 89.9 | Confident | 88 Ų | 88 | 48.6 Ų | 48.6 | 54% | 0.54 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -58.6 | -31.7 | 172.6 | -39.6 | 0 | 0 | 0 | 0 | 111.3 | N178 V179 Y180 | T176-N178 VanDerWaalsContact C-N 3.31Å; T176-N178 PolarHBondContact O-N 3.39Å; T176-V179 WeakPolarHBondContact O-CB 3.48Å; T176-V179 PolarHBondContact O-N 3.2Å; T176-Y180 HydrophobicContact CG2-CD2 3.87Å; T176-Y180 HydrophobicContact CG2-CE2 3.52Å; T176-Y180 WeakPolarHBondContact O-CD2 3.49Å; T176-Y180 PolarHBondContact O-N 3.23Å |
| 177 | F | 91.8 | Very high | 90.6 | Very high | 126 Ų | 126 | 46.9 Ų | 46.9 | 55% | 0.553 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -58.6 | -42.9 | 174.6 | 178.5 | -98.6 | 0 | 0 | 0 | 112 | S175 V179 Y180 M181 | S175-F177 PolarHBondContact O-N 3.09Å; S175-F177 WeakPolarHBondContact OG-CB 3.42Å; S175-F177 PolarHBondContact OG-N 3.01Å; F177-V179 VanDerWaalsContact C-N 3.31Å; F177-V179 PolarHBondContact O-N 3.39Å; F177-Y180 PolarHBondContact O-N 3.36Å; F177-M181 HydrophobicContact CD1-CG 4.11Å; F177-M181 HydrophobicContact CD2-CE 4.35Å; F177-M181 HydrophobicContact CE1-CG 3.69Å; F177-M181 HydrophobicContact CE2-CE 3.48Å; F177-M181 VanDerWaalsContact CE2-CE 3.48Å; F177-M181 HydrophobicContact CE2-CG 4.12Å; F177-M181 HydrophobicContact CZ-CE 3.58Å; F177-M181 HydrophobicContact CZ-CG 3.7Å; F177-M181 HydrophobicContact CZ-SD 4.2Å; F177-M181 WeakPolarHBondContact O-CB 3.46Å; F177-M181 WeakPolarHBondContact O-CG 3.45Å; F177-M181 PolarHBondContact O-N 3.37Å |
| 178 | N | 90.5 | Very high | 91.1 | Very high | 56 Ų | 56 | 47.9 Ų | 47.9 | 30% | 0.299 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -65.1 | -37.8 | 178 | -67.4 | -16.1 | 0 | 0 | 0 | 111.4 | W173 S175 T176 M181 M182 | W173-N178 HydrophobicContact CD2-CB 4.49Å; W173-N178 HydrophobicContact CE3-CB 3.74Å; W173-N178 HydrophobicContact CZ3-CB 4.33Å; S175-N178 WeakPolarHBondContact O-CB 3.27Å; S175-N178 PolarHBondContact O-N 3.43Å; T176-N178 VanDerWaalsContact C-N 3.31Å; T176-N178 PolarHBondContact O-N 3.39Å; N178-M181 PolarHBondContact O-N 2.89Å; N178-M182 VanDerWaalsContact O-CB 3.29Å; N178-M182 WeakPolarHBondContact O-CB 3.29Å; N178-M182 PolarHBondContact O-N 2.84Å |
| 179 | V | 91 | Very high | 91.5 | Very high | 8 Ų | 8 | 50.7 Ų | 50.7 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.3 | -51.2 | 174.8 | -178.9 | 0 | 0 | 0 | 0 | 110.2 | E170 W173 S175 T176 F177 M181 M182 Q183 L256 | E170-V179 HydrophobicContact CB-CG1 3.84Å; E170-V179 HydrophobicContact CB-CG2 4.43Å; E170-V179 HydrophobicContact CG-CG1 3.79Å; E170-V179 VanDerWaalsContact O-CG2 3.3Å; E170-V179 WeakPolarHBondContact O-CG2 3Å; W173-V179 HydrophobicContact CB-CG2 3.63Å; W173-V179 HydrophobicContact CG-CG2 3.98Å; S175-V179 PolarHBondContact O-N 2.92Å; T176-V179 WeakPolarHBondContact O-CB 3.48Å; T176-V179 PolarHBondContact O-N 3.2Å; F177-V179 VanDerWaalsContact C-N 3.31Å; F177-V179 PolarHBondContact O-N 3.39Å; V179-M181 PolarHBondContact O-N 2.84Å; V179-M182 PolarHBondContact O-N 2.84Å; V179-Q183 HydrophobicContact CG1-CG 4.43Å; V179-Q183 VanDerWaalsContact O-CG 3.29Å; V179-Q183 WeakPolarHBondContact O-CG 3.37Å; V179-Q183 PolarHBondContact O-N 2.86Å; V179-L256 HydrophobicContact CG1-CD1 3.96Å |
| 180 | Y | 93.2 | Very high | 91.8 | Very high | 59 Ų | 59 | 50.3 Ų | 50.3 | 23% | 0.231 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -57.5 | -49.4 | 177.3 | -80.4 | -68 | 0 | 0 | 0 | 111.7 | T176 F177 M182 Q183 H184 L253 L256 | T176-Y180 HydrophobicContact CG2-CD2 3.87Å; T176-Y180 HydrophobicContact CG2-CE2 3.52Å; T176-Y180 WeakPolarHBondContact O-CD2 3.49Å; T176-Y180 PolarHBondContact O-N 3.23Å; F177-Y180 PolarHBondContact O-N 3.36Å; Y180-M182 PolarHBondContact O-N 3.46Å; Y180-Q183 PolarHBondContact O-N 3.32Å; Y180-H184 WeakPolarHBondContact O-CB 3.49Å; Y180-H184 PolarHBondContact O-CD2 3.42Å; Y180-H184 PolarHBondContact O-N 2.89Å; Y180-L253 HydrophobicContact CD1-CD2 3.48Å; Y180-L253 VanDerWaalsContact CD1-CD2 3.48Å; Y180-L253 HydrophobicContact CE1-CD2 3.71Å; Y180-L256 HydrophobicContact CE1-CD1 4.08Å; Y180-L256 HydrophobicContact CE2-CD1 4.45Å; Y180-L256 WeakPolarHBondContact OH-CB 3.48Å |
| 181 | M | 92.6 | Very high | 92.1 | Very high | 86 Ų | 86 | 54 Ų | 54 | 42% | 0.424 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.9 | -46.2 | 179.3 | -75.3 | -63.1 | 148.4 | 0 | 0 | 112 | F177 N178 V179 Q183 H184 L185 | F177-M181 HydrophobicContact CD1-CG 4.11Å; F177-M181 HydrophobicContact CD2-CE 4.35Å; F177-M181 HydrophobicContact CE1-CG 3.69Å; F177-M181 HydrophobicContact CE2-CE 3.48Å; F177-M181 VanDerWaalsContact CE2-CE 3.48Å; F177-M181 HydrophobicContact CE2-CG 4.12Å; F177-M181 HydrophobicContact CZ-CE 3.58Å; F177-M181 HydrophobicContact CZ-CG 3.7Å; F177-M181 HydrophobicContact CZ-SD 4.2Å; F177-M181 WeakPolarHBondContact O-CB 3.46Å; F177-M181 WeakPolarHBondContact O-CG 3.45Å; F177-M181 PolarHBondContact O-N 3.37Å; N178-M181 PolarHBondContact O-N 2.89Å; V179-M181 PolarHBondContact O-N 2.84Å; M181-Q183 PolarHBondContact O-N 3.15Å; M181-H184 PolarHBondContact O-N 2.72Å; M181-L185 WeakPolarHBondContact O-CB 3.26Å; M181-L185 VanDerWaalsContact O-CG 3.26Å; M181-L185 WeakPolarHBondContact O-CG 3.23Å; M181-L185 PolarHBondContact O-N 3.48Å |
| 182 | M | 91.1 | Very high | 92.4 | Very high | 22 Ų | 22 | 54 Ų | 54 | 11% | 0.108 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.3 | -43 | 177.3 | -174.9 | -162.2 | 178.7 | 0 | 0 | 112 | N103 L149 W173 N178 V179 Y180 N186 | N103-M182 WeakPolarHBondContact ND2-CE 3.37Å; L149-M182 HydrophobicContact CB-CE 4.44Å; L149-M182 HydrophobicContact CD1-CE 3.87Å; L149-M182 HydrophobicContact CD2-CE 4.33Å; L149-M182 HydrophobicContact CG-CE 4.47Å; W173-M182 HydrophobicContact CZ2-SD 3.78Å; N178-M182 VanDerWaalsContact O-CB 3.29Å; N178-M182 WeakPolarHBondContact O-CB 3.29Å; N178-M182 PolarHBondContact O-N 2.84Å; V179-M182 PolarHBondContact O-N 2.84Å; Y180-M182 PolarHBondContact O-N 3.46Å; M182-N186 PolarHBondContact O-N 3.03Å; M182-N186 VanDerWaalsContact O-N 3.1Å; M182-N186 PolarHBondContact O-ND2 3.4Å |
| 183 | Q | 92.2 | Very high | 92.6 | Very high | 3 Ų | 3 | 54.3 Ų | 54.3 | 1% | 0.014 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.2 | -42.2 | 178.9 | -66 | -61.2 | -12.3 | 0 | 0 | 111.6 | E170 V179 Y180 M181 N186 M187 L253 | E170-Q183 PolarHBondContact OE1-NE2 2.97Å; V179-Q183 HydrophobicContact CG1-CG 4.43Å; V179-Q183 VanDerWaalsContact O-CG 3.29Å; V179-Q183 WeakPolarHBondContact O-CG 3.37Å; V179-Q183 PolarHBondContact O-N 2.86Å; Y180-Q183 PolarHBondContact O-N 3.32Å; M181-Q183 PolarHBondContact O-N 3.15Å; Q183-N186 PolarHBondContact O-N 2.94Å; Q183-M187 WeakPolarHBondContact O-CB 3.44Å; Q183-M187 PolarHBondContact O-N 3.11Å; Q183-L253 HydrophobicContact CB-CD2 3.82Å; Q183-L253 HydrophobicContact CB-CG 4.22Å; Q183-L253 HydrophobicContact CG-CD2 4.27Å |
| 184 | H | 93.9 | Very high | 92.7 | Very high | 88 Ų | 88 | 56.7 Ų | 56.7 | 41% | 0.407 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 176 | -77.3 | -61.7 | 0 | 0 | 0 | 112.7 | Y180 M181 M187 A188 | Y180-H184 WeakPolarHBondContact O-CB 3.49Å; Y180-H184 PolarHBondContact O-CD2 3.42Å; Y180-H184 PolarHBondContact O-N 2.89Å; M181-H184 PolarHBondContact O-N 2.72Å; H184-M187 PolarHBondContact O-N 3.23Å; H184-A188 WeakPolarHBondContact O-CB 3.46Å; H184-A188 PolarHBondContact O-N 3.18Å |
| 185 | L | 93.6 | Very high | 93.1 | Very high | 109 Ų | 109 | 57 Ų | 57 | 57% | 0.571 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -60.8 | -46.6 | 175.9 | -74.5 | 171.9 | 0 | 0 | 0 | 111.7 | M181 M187 A188 L189 | M181-L185 WeakPolarHBondContact O-CB 3.26Å; M181-L185 VanDerWaalsContact O-CG 3.26Å; M181-L185 WeakPolarHBondContact O-CG 3.23Å; M181-L185 PolarHBondContact O-N 3.48Å; L185-M187 VanDerWaalsContact C-N 3.32Å; L185-M187 PolarHBondContact O-N 2.86Å; L185-A188 PolarHBondContact O-N 3.43Å; L185-L189 WeakPolarHBondContact O-CG 3.27Å; L185-L189 PolarHBondContact O-N 3.17Å |
| 186 | N | 93.2 | Very high | 93.2 | Very high | 1 Ų | 1 | 58.5 Ų | 58.5 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65.8 | -35.8 | 177.1 | -74.9 | -53.2 | 0 | 0 | 0 | 112.5 | L106 M182 Q183 L189 A190 R249 | L106-N186 HydrophobicContact CD2-CB 3.78Å; L106-N186 WeakPolarHBondContact CD2-O 3.16Å; M182-N186 PolarHBondContact O-N 3.03Å; M182-N186 VanDerWaalsContact O-N 3.1Å; M182-N186 PolarHBondContact O-ND2 3.4Å; Q183-N186 PolarHBondContact O-N 2.94Å; N186-L189 WeakPolarHBondContact O-CB 3.36Å; N186-L189 PolarHBondContact O-N 3.21Å; N186-A190 PolarHBondContact O-N 3.39Å; N186-R249 PolarHBondContact ND2-NH1 2.05Å |
| 187 | M | 93.9 | Very high | 93.4 | Very high | 34 Ų | 34 | 55 Ų | 55 | 17% | 0.167 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -66.5 | -42.1 | 174.5 | -172.7 | 165.8 | 65.8 | 0 | 0 | 111.3 | Q183 H184 L185 L189 A190 F191 L253 | Q183-M187 WeakPolarHBondContact O-CB 3.44Å; Q183-M187 PolarHBondContact O-N 3.11Å; H184-M187 PolarHBondContact O-N 3.23Å; L185-M187 VanDerWaalsContact C-N 3.32Å; L185-M187 PolarHBondContact O-N 2.86Å; M187-L189 VanDerWaalsContact C-N 3.32Å; M187-L189 PolarHBondContact O-N 3.06Å; M187-A190 WeakPolarHBondContact O-CB 3.45Å; M187-A190 PolarHBondContact O-N 3.29Å; M187-A190 VanDerWaalsContact O-N 3.15Å; M187-F191 HydrophobicContact CG-CD2 3.8Å; M187-F191 HydrophobicContact CG-CE2 3.55Å; M187-F191 WeakPolarHBondContact O-CD2 3.43Å; M187-F191 PolarHBondContact O-N 3.31Å; M187-F191 HydrophobicContact SD-CE2 4.11Å; M187-L253 HydrophobicContact CE-CD1 4.34Å |
| 188 | A | 95.8 | Very high | 93.4 | Very high | 52 Ų | 52 | 52.8 Ų | 52.8 | 43% | 0.43 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.1 | -39.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | H184 L185 F191 S192 | H184-A188 WeakPolarHBondContact O-CB 3.46Å; H184-A188 PolarHBondContact O-N 3.18Å; L185-A188 PolarHBondContact O-N 3.43Å; A188-F191 PolarHBondContact O-N 3.47Å; A188-S192 WeakPolarHBondContact O-CB 3.28Å; A188-S192 PolarHBondContact O-N 3.37Å; A188-S192 PolarHBondContact O-OG 2.91Å |
| 189 | L | 94.9 | Very high | 93.6 | Very high | 58 Ų | 58 | 54.3 Ų | 54.3 | 30% | 0.304 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.2 | -45.7 | 171.5 | -72.4 | 172.6 | 0 | 0 | 0 | 111.6 | M107 L185 N186 M187 F191 S192 I193 | M107-L189 HydrophobicContact SD-CD1 4.31Å; L185-L189 WeakPolarHBondContact O-CG 3.27Å; L185-L189 PolarHBondContact O-N 3.17Å; N186-L189 WeakPolarHBondContact O-CB 3.36Å; N186-L189 PolarHBondContact O-N 3.21Å; M187-L189 VanDerWaalsContact C-N 3.32Å; M187-L189 PolarHBondContact O-N 3.06Å; L189-F191 PolarHBondContact O-N 3.21Å; L189-S192 WeakPolarHBondContact O-CB 3.48Å; L189-S192 PolarHBondContact O-N 2.83Å; L189-I193 VanDerWaalsContact O-CG1 3.27Å; L189-I193 WeakPolarHBondContact O-CG1 3.48Å; L189-I193 PolarHBondContact O-N 3.29Å |
| 190 | A | 95.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | L106 N186 M187 S192 I193 F194 V242 I246 | L106-A190 HydrophobicContact CD1-CB 3.99Å; N186-A190 PolarHBondContact O-N 3.39Å; M187-A190 WeakPolarHBondContact O-CB 3.45Å; M187-A190 PolarHBondContact O-N 3.29Å; M187-A190 VanDerWaalsContact O-N 3.15Å; A190-S192 PolarHBondContact O-N 3.35Å; A190-I193 WeakPolarHBondContact O-CB 3.31Å; A190-I193 PolarHBondContact O-N 3.4Å; A190-F194 PolarHBondContact O-N 2.94Å; A190-V242 HydrophobicContact CB-CG1 4.23Å; A190-V242 VanDerWaalsContact O-CG1 3.24Å; A190-V242 WeakPolarHBondContact O-CG1 3.37Å; A190-I246 HydrophobicContact CB-CD1 4.22Å; A190-I246 HydrophobicContact CB-CG1 3.68Å |
| 191 | F | 95.4 | Very high | 93.4 | Very high | 88 Ų | 88 | 53.5 Ų | 53.5 | 39% | 0.386 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.3 | -41.2 | 173.2 | -79.8 | -67 | 0 | 0 | 0 | 112.2 | M187 A188 L189 I193 F194 F195 I246 | M187-F191 HydrophobicContact CG-CD2 3.8Å; M187-F191 HydrophobicContact CG-CE2 3.55Å; M187-F191 WeakPolarHBondContact O-CD2 3.43Å; M187-F191 PolarHBondContact O-N 3.31Å; M187-F191 HydrophobicContact SD-CE2 4.11Å; A188-F191 PolarHBondContact O-N 3.47Å; L189-F191 PolarHBondContact O-N 3.21Å; F191-I193 VanDerWaalsContact C-N 3.33Å; F191-I193 PolarHBondContact O-N 2.86Å; F191-F194 WeakPolarHBondContact O-CB 3.17Å; F191-F194 PolarHBondContact O-N 3.49Å; F191-F194 VanDerWaalsContact O-N 3.13Å; F191-F195 WeakPolarHBondContact O-CD2 3.38Å; F191-F195 PolarHBondContact O-N 2.88Å; F191-I246 HydrophobicContact CD1-CD1 3.98Å; F191-I246 HydrophobicContact CE1-CD1 3.87Å; F191-I246 HydrophobicContact CE2-CD1 4.41Å; F191-I246 HydrophobicContact CE2-CG2 4.33Å; F191-I246 HydrophobicContact CG-CD1 4.3Å; F191-I246 HydrophobicContact CZ-CD1 4.09Å; F191-I246 HydrophobicContact CZ-CG2 3.98Å |
| 192 | S | 95.5 | Very high | 93.4 | Very high | 63 Ų | 63 | 52.9 Ų | 52.9 | 44% | 0.441 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 176.4 | -60.4 | 0 | 0 | 0 | 0 | 111.3 | A188 L189 A190 F194 F195 L196 | A188-S192 WeakPolarHBondContact O-CB 3.28Å; A188-S192 PolarHBondContact O-N 3.37Å; A188-S192 PolarHBondContact O-OG 2.91Å; L189-S192 WeakPolarHBondContact O-CB 3.48Å; L189-S192 PolarHBondContact O-N 2.83Å; A190-S192 PolarHBondContact O-N 3.35Å; S192-F194 VanDerWaalsContact C-N 3.32Å; S192-F194 PolarHBondContact O-N 3.41Å; S192-F195 PolarHBondContact O-N 3.27Å; S192-L196 WeakPolarHBondContact O-CB 3.2Å; S192-L196 WeakPolarHBondContact O-CG 3.39Å; S192-L196 PolarHBondContact O-N 2.89Å |
| 193 | I | 94.6 | Very high | 93.5 | Very high | 5 Ų | 5 | 56.5 Ų | 56.5 | 3% | 0.026 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -58.3 | -45.3 | 174 | -65.8 | 163.2 | 0 | 0 | 0 | 110.6 | L106 A109 V110 S113 L189 A190 F191 L196 N197 V242 | L106-I193 HydrophobicContact CD1-CD1 3.78Å; A109-I193 HydrophobicContact CB-CD1 4.16Å; V110-I193 HydrophobicContact CG2-CD1 3.63Å; V110-I193 HydrophobicContact CG2-CG1 4.1Å; S113-I193 WeakPolarHBondContact OG-CG2 3.36Å; L189-I193 VanDerWaalsContact O-CG1 3.27Å; L189-I193 WeakPolarHBondContact O-CG1 3.48Å; L189-I193 PolarHBondContact O-N 3.29Å; A190-I193 WeakPolarHBondContact O-CB 3.31Å; A190-I193 PolarHBondContact O-N 3.4Å; F191-I193 VanDerWaalsContact C-N 3.33Å; F191-I193 PolarHBondContact O-N 2.86Å; I193-L196 PolarHBondContact O-N 3.43Å; I193-N197 VanDerWaalsContact CG2-ND2 3.34Å; I193-N197 WeakPolarHBondContact CG2-ND2 3.45Å; I193-N197 WeakPolarHBondContact O-CB 3.35Å; I193-N197 PolarHBondContact O-N 2.81Å; I193-N197 PolarHBondContact O-ND2 3.31Å; I193-V242 HydrophobicContact CB-CG2 3.86Å; I193-V242 HydrophobicContact CD1-CG2 4.35Å; I193-V242 HydrophobicContact CG2-CG2 3.47Å; I193-V242 VanDerWaalsContact CG2-CG2 3.47Å |
| 194 | F | 93.8 | Very high | 93.3 | Very high | 83 Ų | 83 | 57 Ų | 57 | 36% | 0.364 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.2 | -52.4 | 178.7 | -179.1 | -98.3 | 0 | 0 | 0 | 111.7 | A190 F191 S192 L196 N197 L198 V242 | A190-F194 PolarHBondContact O-N 2.94Å; F191-F194 WeakPolarHBondContact O-CB 3.17Å; F191-F194 PolarHBondContact O-N 3.49Å; F191-F194 VanDerWaalsContact O-N 3.13Å; S192-F194 VanDerWaalsContact C-N 3.32Å; S192-F194 PolarHBondContact O-N 3.41Å; F194-L196 PolarHBondContact O-N 3.5Å; F194-N197 PolarHBondContact O-N 3.36Å; F194-L198 HydrophobicContact CE1-CD2 4.45Å; F194-L198 PolarHBondContact O-N 3.17Å; F194-V242 HydrophobicContact CB-CG1 4.04Å |
| 195 | F | 94.7 | Very high | 93.1 | Very high | 118 Ų | 118 | 60.8 Ų | 60.8 | 52% | 0.518 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.6 | -38.5 | -178.5 | -75.1 | -67.1 | 0 | 0 | 0 | 113 | F191 S192 N197 L198 T199 | F191-F195 WeakPolarHBondContact O-CD2 3.38Å; F191-F195 PolarHBondContact O-N 2.88Å; S192-F195 PolarHBondContact O-N 3.27Å; F195-N197 VanDerWaalsContact C-N 3.28Å; F195-N197 PolarHBondContact O-N 3.46Å; F195-L198 PolarHBondContact O-N 2.91Å; F195-T199 WeakPolarHBondContact O-CB 3.49Å; F195-T199 PolarHBondContact O-N 2.89Å; F195-T199 PolarHBondContact O-OG1 2.69Å |
| 196 | L | 93.2 | Very high | 93.1 | Very high | 82 Ų | 82 | 64.1 Ų | 64.1 | 43% | 0.429 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.9 | -42 | 174 | -74.5 | 173.7 | 0 | 0 | 0 | 111.1 | I117 S192 I193 F194 T199 L200 | I117-L196 HydrophobicContact CD1-CB 4.27Å; I117-L196 HydrophobicContact CD1-CD1 4.11Å; I117-L196 HydrophobicContact CD1-CD2 3.97Å; I117-L196 HydrophobicContact CD1-CG 4.35Å; S192-L196 WeakPolarHBondContact O-CB 3.2Å; S192-L196 WeakPolarHBondContact O-CG 3.39Å; S192-L196 PolarHBondContact O-N 2.89Å; I193-L196 PolarHBondContact O-N 3.43Å; F194-L196 PolarHBondContact O-N 3.5Å; L196-T199 PolarHBondContact O-N 3.21Å; L196-L200 WeakPolarHBondContact O-CB 3.44Å; L196-L200 PolarHBondContact O-N 3.45Å |
| 197 | N | 91.6 | Very high | 92.9 | Very high | 13 Ų | 13 | 64.8 Ų | 64.8 | 7% | 0.07 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -70.4 | -41 | 178.6 | -80.5 | -57.1 | 0 | 0 | 0 | 113.9 | S113 R116 I193 F194 F195 T199 L200 V201 | S113-N197 PolarHBondContact OG-ND2 3.26Å; R116-N197 PolarHBondContact NE-OD1 3.45Å; R116-N197 PolarHBondContact NH1-OD1 3.36Å; R116-N197 PolarHBondContact NH2-ND2 3.2Å; R116-N197 VanDerWaalsContact NH2-ND2 3.12Å; R116-N197 PolarHBondContact NH2-OD1 3.27Å; I193-N197 VanDerWaalsContact CG2-ND2 3.34Å; I193-N197 WeakPolarHBondContact CG2-ND2 3.45Å; I193-N197 WeakPolarHBondContact O-CB 3.35Å; I193-N197 PolarHBondContact O-N 2.81Å; I193-N197 PolarHBondContact O-ND2 3.31Å; F194-N197 PolarHBondContact O-N 3.36Å; F195-N197 VanDerWaalsContact C-N 3.28Å; F195-N197 PolarHBondContact O-N 3.46Å; N197-T199 VanDerWaalsContact C-N 3.33Å; N197-L200 PolarHBondContact O-N 3.26Å; N197-V201 WeakPolarHBondContact O-CG2 3.2Å; N197-V201 PolarHBondContact O-N 3.06Å |
| 198 | L | 92.1 | Very high | 92.7 | Very high | 81 Ų | 81 | 64 Ų | 64 | 42% | 0.424 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.6 | -47.6 | 173.3 | -178.7 | 59.9 | 0 | 0 | 0 | 110.6 | F194 F195 L200 V201 I202 | F194-L198 HydrophobicContact CE1-CD2 4.45Å; F194-L198 PolarHBondContact O-N 3.17Å; F195-L198 PolarHBondContact O-N 2.91Å; L198-L200 VanDerWaalsContact C-N 3.31Å; L198-L200 PolarHBondContact O-N 2.71Å; L198-V201 PolarHBondContact O-N 3.39Å; L198-I202 HydrophobicContact CD1-CD1 4.16Å; L198-I202 HydrophobicContact CG-CD1 4.01Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 2.94Å |
| 199 | T | 93.3 | Very high | 92.6 | Very high | 88 Ų | 88 | 67.9 Ų | 67.9 | 54% | 0.54 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -58.6 | -43.6 | 177.2 | -58.1 | 0 | 0 | 0 | 0 | 111.4 | F195 L196 N197 I202 Y203 | F195-T199 WeakPolarHBondContact O-CB 3.49Å; F195-T199 PolarHBondContact O-N 2.89Å; F195-T199 PolarHBondContact O-OG1 2.69Å; L196-T199 PolarHBondContact O-N 3.21Å; N197-T199 VanDerWaalsContact C-N 3.33Å; T199-I202 PolarHBondContact O-N 3.45Å; T199-Y203 VanDerWaalsContact O-CB 3.26Å; T199-Y203 WeakPolarHBondContact O-CB 3.05Å; T199-Y203 PolarHBondContact O-N 3.23Å |
| 200 | L | 91.1 | Very high | 92.5 | Very high | 19 Ų | 19 | 68.2 Ų | 68.2 | 10% | 0.099 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 177 | -173.2 | 76.7 | 0 | 0 | 0 | 112.6 | R116 A120 L196 N197 L198 I202 Y203 T204 | R116-L200 HydrophobicContact CB-CD2 3.58Å; R116-L200 HydrophobicContact CG-CD2 4.32Å; A120-L200 HydrophobicContact CB-CD1 3.42Å; A120-L200 VanDerWaalsContact CB-CD1 3.42Å; L196-L200 WeakPolarHBondContact O-CB 3.44Å; L196-L200 PolarHBondContact O-N 3.45Å; N197-L200 PolarHBondContact O-N 3.26Å; L198-L200 VanDerWaalsContact C-N 3.31Å; L198-L200 PolarHBondContact O-N 2.71Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 3.43Å; L200-Y203 PolarHBondContact O-N 3.39Å; L200-T204 HydrophobicContact CG-CG2 4.41Å; L200-T204 WeakPolarHBondContact O-CB 3.4Å; L200-T204 VanDerWaalsContact O-CG2 3.28Å; L200-T204 WeakPolarHBondContact O-CG2 3.45Å; L200-T204 PolarHBondContact O-N 2.75Å; L200-T204 PolarHBondContact O-OG1 3.04Å |
| 201 | V | 90.5 | Very high | 92.4 | Very high | 31 Ų | 31 | 70.4 Ų | 70.4 | 19% | 0.188 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 176.4 | 170.4 | 0 | 0 | 0 | 0 | 110.3 | N197 L198 T204 R205 T235 | N197-V201 WeakPolarHBondContact O-CG2 3.2Å; N197-V201 PolarHBondContact O-N 3.06Å; L198-V201 PolarHBondContact O-N 3.39Å; V201-T204 PolarHBondContact O-OG1 3.07Å; V201-T204 VanDerWaalsContact O-OG1 3.1Å; V201-R205 WeakPolarHBondContact O-CB 3.44Å; V201-R205 VanDerWaalsContact O-CG 3.24Å; V201-R205 WeakPolarHBondContact O-CG 3.2Å; V201-R205 PolarHBondContact O-N 3.16Å; V201-T235 HydrophobicContact CG2-CG2 4.25Å |
| 202 | I | 92.3 | Very high | 92.3 | Very high | 73 Ų | 73 | 71.8 Ų | 71.8 | 37% | 0.374 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64 | -47.9 | 176.6 | -66.6 | 167.4 | 0 | 0 | 0 | 110.5 | L198 T199 L200 R205 R206 | L198-I202 HydrophobicContact CD1-CD1 4.16Å; L198-I202 HydrophobicContact CG-CD1 4.01Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 2.94Å; T199-I202 PolarHBondContact O-N 3.45Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 3.43Å; I202-R205 PolarHBondContact O-N 2.87Å; I202-R206 HydrophobicContact CG2-CG 4.37Å; I202-R206 WeakPolarHBondContact O-CB 3.41Å; I202-R206 WeakPolarHBondContact O-CG 3.47Å; I202-R206 PolarHBondContact O-N 3.03Å |
| 203 | Y | 91.6 | Very high | 92.2 | Very high | 97 Ų | 97 | 79.3 Ų | 79.3 | 38% | 0.38 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -59.5 | -48.2 | 179.7 | 172.9 | -101 | 0 | 0 | 0 | 112.2 | A120 T199 L200 R205 R206 S207 | A120-Y203 HydrophobicContact CB-CE1 4.35Å; T199-Y203 VanDerWaalsContact O-CB 3.26Å; T199-Y203 WeakPolarHBondContact O-CB 3.05Å; T199-Y203 PolarHBondContact O-N 3.23Å; L200-Y203 PolarHBondContact O-N 3.39Å; Y203-R205 PolarHBondContact O-N 3.02Å; Y203-R206 PolarHBondContact O-N 3.36Å; Y203-S207 WeakPolarHBondContact O-CB 3.3Å; Y203-S207 PolarHBondContact O-N 3.29Å; Y203-S207 PolarHBondContact O-OG 3.21Å |
| 204 | T | 89 | Confident | 92.2 | Very high | 13 Ų | 13 | 87.7 Ų | 87.7 | 8% | 0.08 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.1 | -37.1 | 179.6 | 54.6 | 0 | 0 | 0 | 0 | 111.9 | L200 V201 A208 | L200-T204 HydrophobicContact CG-CG2 4.41Å; L200-T204 WeakPolarHBondContact O-CB 3.4Å; L200-T204 VanDerWaalsContact O-CG2 3.28Å; L200-T204 WeakPolarHBondContact O-CG2 3.45Å; L200-T204 PolarHBondContact O-N 2.75Å; L200-T204 PolarHBondContact O-OG1 3.04Å; V201-T204 PolarHBondContact O-OG1 3.07Å; V201-T204 VanDerWaalsContact O-OG1 3.1Å; T204-A208 WeakPolarHBondContact O-CB 3.49Å; T204-A208 PolarHBondContact O-N 3.26Å |
| 205 | R | 90.1 | Very high | 92.1 | Very high | 169 Ų | 169 | 90.9 Ų | 90.9 | 64% | 0.638 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -66 | -44.6 | 173.2 | -75.6 | 178.6 | 176.9 | -167.8 | 0.7 | 112.3 | V201 I202 Y203 A208 K209 | V201-R205 WeakPolarHBondContact O-CB 3.44Å; V201-R205 VanDerWaalsContact O-CG 3.24Å; V201-R205 WeakPolarHBondContact O-CG 3.2Å; V201-R205 PolarHBondContact O-N 3.16Å; I202-R205 PolarHBondContact O-N 2.87Å; Y203-R205 PolarHBondContact O-N 3.02Å; R205-A208 PolarHBondContact O-N 2.71Å; R205-K209 PolarHBondContact O-N 3.39Å |
| 206 | R | 92.4 | Very high | 92.1 | Very high | 178 Ų | 178 | 89 Ų | 89 | 67% | 0.672 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.7 | -43 | 176.1 | -76.5 | -177.3 | 177.2 | -179.7 | 0.1 | 111.5 | I202 Y203 K209 T210 | I202-R206 HydrophobicContact CG2-CG 4.37Å; I202-R206 WeakPolarHBondContact O-CB 3.41Å; I202-R206 WeakPolarHBondContact O-CG 3.47Å; I202-R206 PolarHBondContact O-N 3.03Å; Y203-R206 PolarHBondContact O-N 3.36Å; R206-K209 PolarHBondContact O-N 3.03Å; R206-T210 PolarHBondContact O-N 2.99Å; R206-T210 PolarHBondContact O-OG1 2.89Å |
| 207 | S | 90.2 | Very high | 92 | Very high | 15 Ų | 15 | 88.4 Ų | 88.4 | 11% | 0.105 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -59.1 | -51.9 | 174.2 | -65.6 | 0 | 0 | 0 | 0 | 110.5 | Y203 K209 T210 Y211 | Y203-S207 WeakPolarHBondContact O-CB 3.3Å; Y203-S207 PolarHBondContact O-N 3.29Å; Y203-S207 PolarHBondContact O-OG 3.21Å; S207-K209 VanDerWaalsContact C-N 3.34Å; S207-K209 PolarHBondContact O-N 3.42Å; S207-T210 WeakPolarHBondContact O-CA 3.37Å; S207-T210 WeakPolarHBondContact O-CB 3.46Å; S207-T210 PolarHBondContact O-N 3.46Å; S207-Y211 VanDerWaalsContact O-CD2 3.3Å; S207-Y211 WeakPolarHBondContact O-CD2 3.4Å; S207-Y211 PolarHBondContact O-N 3.18Å |
| 208 | A | 89.8 | Confident | 91.9 | Very high | 18 Ų | 18 | 95.5 Ų | 95.5 | 15% | 0.149 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -54.4 | -46.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | T204 R205 T210 Y211 Q212 F220 | T204-A208 WeakPolarHBondContact O-CB 3.49Å; T204-A208 PolarHBondContact O-N 3.26Å; R205-A208 PolarHBondContact O-N 2.71Å; A208-T210 VanDerWaalsContact C-N 3.3Å; A208-T210 PolarHBondContact O-N 3.33Å; A208-Y211 PolarHBondContact O-N 3.31Å; A208-Q212 WeakPolarHBondContact O-CB 3.44Å; A208-Q212 PolarHBondContact O-N 2.96Å; A208-F220 HydrophobicContact CB-CE1 4.16Å; A208-F220 HydrophobicContact CB-CE2 4.03Å; A208-F220 HydrophobicContact CB-CZ 3.8Å |
| 209 | K | 93.3 | Very high | 91.7 | Very high | 134 Ų | 134 | 95.7 Ų | 95.7 | 58% | 0.583 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -60.8 | -38 | 175.4 | -73.6 | -173.6 | 177.4 | -172.6 | 0 | 112.8 | R205 R206 S207 Q212 R213 | R205-K209 PolarHBondContact O-N 3.39Å; R206-K209 PolarHBondContact O-N 3.03Å; S207-K209 VanDerWaalsContact C-N 3.34Å; S207-K209 PolarHBondContact O-N 3.42Å; K209-Q212 PolarHBondContact O-N 2.68Å; K209-R213 WeakPolarHBondContact O-CG 3.48Å; K209-R213 PolarHBondContact O-N 2.77Å |
| 210 | T | 93.4 | Very high | 91.6 | Very high | 64 Ų | 64 | 92 Ų | 92 | 39% | 0.393 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -67.3 | -43 | 179 | -55.1 | 0 | 0 | 0 | 0 | 111.4 | R206 S207 A208 Q212 R213 R214 | R206-T210 PolarHBondContact O-N 2.99Å; R206-T210 PolarHBondContact O-OG1 2.89Å; S207-T210 WeakPolarHBondContact O-CA 3.37Å; S207-T210 WeakPolarHBondContact O-CB 3.46Å; S207-T210 PolarHBondContact O-N 3.46Å; A208-T210 VanDerWaalsContact C-N 3.3Å; A208-T210 PolarHBondContact O-N 3.33Å; T210-Q212 VanDerWaalsContact C-N 3.33Å; T210-R213 PolarHBondContact O-N 3.45Å; T210-R214 WeakPolarHBondContact O-CG 3.47Å; T210-R214 PolarHBondContact O-N 2.74Å |
| 211 | Y | 92.2 | Very high | 91.4 | Very high | 46 Ų | 46 | 95.1 Ų | 95.1 | 18% | 0.18 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -66.7 | -36.2 | 174.1 | -80.8 | -98.5 | 0 | 0 | 0 | 111.8 | S207 A208 R214 N215 L216 L219 F220 Y224 | S207-Y211 VanDerWaalsContact O-CD2 3.3Å; S207-Y211 WeakPolarHBondContact O-CD2 3.4Å; S207-Y211 PolarHBondContact O-N 3.18Å; A208-Y211 PolarHBondContact O-N 3.31Å; Y211-R214 CarbonylContact O-C 3.56Å; Y211-R214 PolarHBondContact O-N 3.36Å; Y211-N215 PolarHBondContact O-N 3.07Å; Y211-L216 HydrophobicContact CD1-CB 3.94Å; Y211-L216 WeakPolarHBondContact CD1-O 3.28Å; Y211-L216 PolarHBondContact O-N 3.38Å; Y211-L219 HydrophobicContact CE1-CB 4.48Å; Y211-L219 HydrophobicContact CE1-CD2 4.09Å; Y211-L219 HydrophobicContact CE1-CG 4.16Å; Y211-F220 HydrophobicContact CD1-CB 3.92Å; Y211-F220 HydrophobicContact CD2-CB 4.42Å; Y211-F220 AromaticContact CD2-CD2 3.91Å; Y211-F220 HydrophobicContact CD2-CD2 3.91Å; Y211-F220 HydrophobicContact CE2-CD2 4.39Å; Y211-F220 HydrophobicContact CG-CB 3.81Å; Y211-F220 HydrophobicContact CG-CD2 4.14Å; Y211-F220 HydrophobicContact CG-CG 4.42Å; Y211-Y224 HydrophobicContact CE2-CE2 4.45Å |
| 212 | Q | 93 | Very high | 91.2 | Very high | 118 Ų | 118 | 98.6 Ų | 98.6 | 55% | 0.551 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -62 | -47.3 | 174.8 | -171.7 | -179.6 | -8.1 | 0 | 0 | 111.9 | A208 K209 T210 R214 N215 M217 | A208-Q212 WeakPolarHBondContact O-CB 3.44Å; A208-Q212 PolarHBondContact O-N 2.96Å; K209-Q212 PolarHBondContact O-N 2.68Å; T210-Q212 VanDerWaalsContact C-N 3.33Å; Q212-R214 PolarHBondContact O-N 2.78Å; Q212-N215 PolarHBondContact O-N 3.13Å; Q212-M217 HydrophobicContact CB-CG 4.06Å; Q212-M217 HydrophobicContact CB-SD 3.68Å; Q212-M217 HydrophobicContact CG-CG 4.31Å; Q212-M217 HydrophobicContact CG-SD 4.4Å |
| 213 | R | 94.4 | Very high | 90.8 | Very high | 221 Ų | 221 | 99.5 Ų | 99.5 | 83% | 0.834 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -59.5 | -27 | 176.7 | -75 | 178.5 | 179.3 | -174.1 | -2.2 | 113.3 | K209 T210 | K209-R213 WeakPolarHBondContact O-CG 3.48Å; K209-R213 PolarHBondContact O-N 2.77Å; T210-R213 PolarHBondContact O-N 3.45Å |
| 214 | R | 94.3 | Very high | 90.4 | Very high | 180 Ų | 180 | 95.5 Ų | 95.5 | 68% | 0.679 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | 3.9 | 178 | -64.4 | -179.2 | -178.6 | -173 | -0.3 | 113.4 | T210 Y211 Q212 L216 | T210-R214 WeakPolarHBondContact O-CG 3.47Å; T210-R214 PolarHBondContact O-N 2.74Å; Y211-R214 CarbonylContact O-C 3.56Å; Y211-R214 PolarHBondContact O-N 3.36Å; Q212-R214 PolarHBondContact O-N 2.78Å; R214-L216 HydrophobicContact CB-CB 4.5Å; R214-L216 HydrophobicContact CB-CD1 4.08Å; R214-L216 HydrophobicContact CB-CG 4.13Å; R214-L216 WeakPolarHBondContact O-CG 3.22Å; R214-L216 PolarHBondContact O-N 2.91Å |
| 215 | N | 92.8 | Very high | 90.1 | Very high | 150 Ų | 150 | 101.8 Ų | 101.8 | 80% | 0.802 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.4 | 24 | -172.1 | -63.7 | -36.4 | 0 | 0 | 0 | 114.4 | Y211 Q212 | Y211-N215 PolarHBondContact O-N 3.07Å; Q212-N215 PolarHBondContact O-N 3.13Å |
| 216 | L | 93.8 | Very high | 89.5 | Confident | 79 Ų | 79 | 96.6 Ų | 96.6 | 41% | 0.414 | 44% | 0.439 | S | S | . | . | trans | -104 | 32.1 | -177.7 | -64.3 | 176 | 0 | 0 | 0 | 112.6 | Y211 R214 Q218 L219 F220 | Y211-L216 HydrophobicContact CD1-CB 3.94Å; Y211-L216 WeakPolarHBondContact CD1-O 3.28Å; Y211-L216 PolarHBondContact O-N 3.38Å; R214-L216 HydrophobicContact CB-CB 4.5Å; R214-L216 HydrophobicContact CB-CD1 4.08Å; R214-L216 HydrophobicContact CB-CG 4.13Å; R214-L216 WeakPolarHBondContact O-CG 3.22Å; R214-L216 PolarHBondContact O-N 2.91Å; L216-Q218 VanDerWaalsContact C-N 3.27Å; L216-Q218 PolarHBondContact O-N 2.98Å; L216-L219 HydrophobicContact CB-CB 4.31Å; L216-L219 WeakPolarHBondContact O-CB 3.4Å; L216-L219 PolarHBondContact O-N 3.03Å; L216-L219 VanDerWaalsContact O-N 3.11Å; L216-F220 PolarHBondContact O-N 3.46Å; L216-F220 VanDerWaalsContact O-N 3.09Å | ||
| 217 | M | 89.9 | Confident | 88.9 | Confident | 69 Ų | 69 | 89.3 Ų | 89.3 | 34% | 0.34 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.6 | -31.5 | -177.7 | -74.6 | -61.8 | -82.5 | 0 | 0 | 113.4 | Q212 L219 F220 N221 | Q212-M217 HydrophobicContact CB-CG 4.06Å; Q212-M217 HydrophobicContact CB-SD 3.68Å; Q212-M217 HydrophobicContact CG-CG 4.31Å; Q212-M217 HydrophobicContact CG-SD 4.4Å; M217-L219 VanDerWaalsContact C-N 3.33Å; M217-L219 PolarHBondContact O-N 3.23Å; M217-F220 WeakPolarHBondContact O-CB 3.24Å; M217-F220 PolarHBondContact O-N 2.93Å; M217-N221 PolarHBondContact O-N 2.98Å |
| 218 | Q | 90.3 | Very high | 88.5 | Confident | 162 Ų | 162 | 91.1 Ų | 91.1 | 76% | 0.757 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.7 | -43.6 | 173.4 | -68.2 | -175.7 | -11.2 | 0 | 0 | 111.3 | L216 F220 N221 I222 | L216-Q218 VanDerWaalsContact C-N 3.27Å; L216-Q218 PolarHBondContact O-N 2.98Å; Q218-F220 VanDerWaalsContact C-N 3.34Å; Q218-F220 PolarHBondContact O-N 2.8Å; Q218-N221 PolarHBondContact O-N 3.47Å; Q218-I222 VanDerWaalsContact O-CG1 3.31Å; Q218-I222 WeakPolarHBondContact O-CG1 3.15Å; Q218-I222 PolarHBondContact O-N 3.42Å |
| 219 | L | 89 | Confident | 88.1 | Confident | 86 Ų | 86 | 96.9 Ų | 96.9 | 45% | 0.45 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -63.8 | -39.3 | 176.5 | -176.3 | 60.9 | 0 | 0 | 0 | 111.7 | Y211 L216 M217 I222 K223 | Y211-L219 HydrophobicContact CE1-CB 4.48Å; Y211-L219 HydrophobicContact CE1-CD2 4.09Å; Y211-L219 HydrophobicContact CE1-CG 4.16Å; L216-L219 HydrophobicContact CB-CB 4.31Å; L216-L219 WeakPolarHBondContact O-CB 3.4Å; L216-L219 PolarHBondContact O-N 3.03Å; L216-L219 VanDerWaalsContact O-N 3.11Å; M217-L219 VanDerWaalsContact C-N 3.33Å; M217-L219 PolarHBondContact O-N 3.23Å; L219-I222 PolarHBondContact O-N 2.85Å; L219-K223 VanDerWaalsContact O-CB 3.28Å; L219-K223 WeakPolarHBondContact O-CB 3.11Å; L219-K223 PolarHBondContact O-N 3.41Å |
| 220 | F | 89.3 | Confident | 87.6 | Confident | 11 Ų | 11 | 91.4 Ų | 91.4 | 5% | 0.048 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -58.8 | -48.4 | 172.7 | 177.6 | -93.6 | 0 | 0 | 0 | 111.5 | A208 Y211 L216 M217 Q218 I222 K223 Y224 V228 | A208-F220 HydrophobicContact CB-CE1 4.16Å; A208-F220 HydrophobicContact CB-CE2 4.03Å; A208-F220 HydrophobicContact CB-CZ 3.8Å; Y211-F220 HydrophobicContact CD1-CB 3.92Å; Y211-F220 HydrophobicContact CD2-CB 4.42Å; Y211-F220 AromaticContact CD2-CD2 3.91Å; Y211-F220 HydrophobicContact CD2-CD2 3.91Å; Y211-F220 HydrophobicContact CE2-CD2 4.39Å; Y211-F220 HydrophobicContact CG-CB 3.81Å; Y211-F220 HydrophobicContact CG-CD2 4.14Å; Y211-F220 HydrophobicContact CG-CG 4.42Å; L216-F220 PolarHBondContact O-N 3.46Å; L216-F220 VanDerWaalsContact O-N 3.09Å; M217-F220 WeakPolarHBondContact O-CB 3.24Å; M217-F220 PolarHBondContact O-N 2.93Å; Q218-F220 VanDerWaalsContact C-N 3.34Å; Q218-F220 PolarHBondContact O-N 2.8Å; F220-I222 VanDerWaalsContact C-N 3.29Å; F220-I222 PolarHBondContact O-N 2.69Å; F220-K223 PolarHBondContact O-N 3.01Å; F220-Y224 AromaticContact CD2-CD2 3.36Å; F220-Y224 HydrophobicContact CD2-CD2 3.36Å; F220-Y224 AromaticContact CD2-CE2 3.76Å; F220-Y224 HydrophobicContact CD2-CE2 3.76Å; F220-Y224 HydrophobicContact CD2-CG 4.37Å; F220-Y224 AromaticContact CE2-CD2 3.37Å; F220-Y224 HydrophobicContact CE2-CD2 3.37Å; F220-Y224 AromaticContact CE2-CE2 3.81Å; F220-Y224 HydrophobicContact CE2-CE2 3.81Å; F220-Y224 HydrophobicContact CE2-CG 4.03Å; F220-Y224 HydrophobicContact CG-CD2 4.07Å; F220-Y224 HydrophobicContact CZ-CD2 4.09Å; F220-Y224 HydrophobicContact CZ-CG 4.38Å; F220-Y224 WeakPolarHBondContact O-CB 3.3Å; F220-Y224 PolarHBondContact O-N 3.26Å; F220-V228 HydrophobicContact CE1-CG2 3.88Å; F220-V228 HydrophobicContact CZ-CG2 4.4Å |
| 221 | N | 87.5 | Confident | 87.2 | Confident | 83 Ų | 83 | 93 Ų | 93 | 44% | 0.444 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -66 | -29.5 | 179.8 | -74.6 | -22.8 | 0 | 0 | 0 | 113.1 | M217 Q218 R225 | M217-N221 PolarHBondContact O-N 2.98Å; Q218-N221 PolarHBondContact O-N 3.47Å; N221-R225 WeakPolarHBondContact O-CA 3.39Å; N221-R225 WeakPolarHBondContact O-CB 3.14Å; N221-R225 PolarHBondContact O-N 2.98Å |
| 222 | I | 86.2 | Confident | 87 | Confident | 104 Ų | 104 | 96.8 Ų | 96.8 | 53% | 0.533 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -73.7 | -47.4 | 173.7 | -67.9 | 165.2 | 0 | 0 | 0 | 110.1 | Q218 L219 F220 | Q218-I222 VanDerWaalsContact O-CG1 3.31Å; Q218-I222 WeakPolarHBondContact O-CG1 3.15Å; Q218-I222 PolarHBondContact O-N 3.42Å; L219-I222 PolarHBondContact O-N 2.85Å; F220-I222 VanDerWaalsContact C-N 3.29Å; F220-I222 PolarHBondContact O-N 2.69Å |
| 223 | K | 84.1 | Confident | 86.7 | Confident | 92 Ų | 92 | 91.2 Ų | 91.2 | 40% | 0.4 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -68.6 | -38.7 | -176.5 | -173.1 | 171.9 | 180 | 173.3 | 0 | 113 | P123 L219 F220 | P123-K223 HydrophobicContact CB-CG 4.32Å; P123-K223 HydrophobicContact CG-CD 4.39Å; P123-K223 HydrophobicContact CG-CG 3.97Å; L219-K223 VanDerWaalsContact O-CB 3.28Å; L219-K223 WeakPolarHBondContact O-CB 3.11Å; L219-K223 PolarHBondContact O-N 3.41Å; F220-K223 PolarHBondContact O-N 3.01Å |
| 224 | Y | 83.9 | Confident | 86.5 | Confident | 13 Ų | 13 | 80.8 Ų | 80.8 | 5% | 0.051 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.7 | 21.2 | -175.3 | -60.8 | -75.2 | 0 | 0 | 0 | 113.2 | P123 Y211 F220 E226 Q227 V228 | P123-Y224 HydrophobicContact CG-CE1 4.38Å; Y211-Y224 HydrophobicContact CE2-CE2 4.45Å; F220-Y224 AromaticContact CD2-CD2 3.36Å; F220-Y224 HydrophobicContact CD2-CD2 3.36Å; F220-Y224 AromaticContact CD2-CE2 3.76Å; F220-Y224 HydrophobicContact CD2-CE2 3.76Å; F220-Y224 HydrophobicContact CD2-CG 4.37Å; F220-Y224 AromaticContact CE2-CD2 3.37Å; F220-Y224 HydrophobicContact CE2-CD2 3.37Å; F220-Y224 AromaticContact CE2-CE2 3.81Å; F220-Y224 HydrophobicContact CE2-CE2 3.81Å; F220-Y224 HydrophobicContact CE2-CG 4.03Å; F220-Y224 HydrophobicContact CG-CD2 4.07Å; F220-Y224 HydrophobicContact CZ-CD2 4.09Å; F220-Y224 HydrophobicContact CZ-CG 4.38Å; F220-Y224 WeakPolarHBondContact O-CB 3.3Å; F220-Y224 PolarHBondContact O-N 3.26Å; Y224-E226 VanDerWaalsContact C-N 3.35Å; Y224-E226 PolarHBondContact O-N 3.42Å; Y224-Q227 VanDerWaalsContact CD1-OE1 3.29Å; Y224-Q227 PolarHBondContact O-N 3.05Å; Y224-V228 WeakPolarHBondContact O-CG2 3.45Å; Y224-V228 PolarHBondContact O-N 3.39Å |
| 225 | R | 82.1 | Confident | 86.3 | Confident | 146 Ų | 146 | 73.9 Ų | 73.9 | 55% | 0.551 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -47.4 | -53.2 | -176 | -175.8 | 177.8 | -88.2 | -155.8 | -0.1 | 113.2 | N221 R229 | N221-R225 WeakPolarHBondContact O-CA 3.39Å; N221-R225 WeakPolarHBondContact O-CB 3.14Å; N221-R225 PolarHBondContact O-N 2.98Å; R225-R229 WeakPolarHBondContact O-CG 3.47Å; R225-R229 PolarHBondContact O-N 3.5Å |
| 226 | E | 76.9 | Confident | 86.2 | Confident | 60 Ų | 60 | 72.8 Ų | 72.8 | 28% | 0.28 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.6 | -45.5 | -176.2 | -170.6 | 168.7 | 178 | 0 | 0 | 110.8 | Y224 V228 R229 V230 | Y224-E226 VanDerWaalsContact C-N 3.35Å; Y224-E226 PolarHBondContact O-N 3.42Å; E226-V228 VanDerWaalsContact C-N 3.35Å; E226-V228 PolarHBondContact O-N 3.42Å; E226-R229 WeakPolarHBondContact O-CB 3.41Å; E226-R229 PolarHBondContact O-N 2.97Å; E226-R229 VanDerWaalsContact O-N 3.15Å; E226-V230 WeakPolarHBondContact O-CG2 2.97Å; E226-V230 PolarHBondContact O-N 2.78Å; E226-V230 VanDerWaalsContact O-N 3.09Å |
| 227 | Q | 80.8 | Confident | 86.1 | Confident | 25 Ų | 25 | 69.2 Ų | 69.2 | 12% | 0.117 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.6 | -46 | 176.8 | -62.9 | -151.2 | -49.9 | 0 | 0 | 112.3 | R116 A119 A120 Y224 R229 V230 R231 | R116-Q227 PolarHBondContact O-NE2 3.16Å; R116-Q227 VanDerWaalsContact O-NE2 3.12Å; A119-Q227 HydrophobicContact CB-CG 4.02Å; A119-Q227 PolarHBondContact O-NE2 3.41Å; A120-Q227 VanDerWaalsContact CA-NE2 3.28Å; Y224-Q227 VanDerWaalsContact CD1-OE1 3.29Å; Y224-Q227 PolarHBondContact O-N 3.05Å; Q227-R229 VanDerWaalsContact C-N 3.26Å; Q227-R229 PolarHBondContact O-N 3.19Å; Q227-V230 PolarHBondContact O-N 2.77Å; Q227-R231 WeakPolarHBondContact O-CA 3.47Å; Q227-R231 WeakPolarHBondContact O-CB 3.38Å; Q227-R231 PolarHBondContact O-N 3.18Å |
| 228 | V | 82.1 | Confident | 86.2 | Confident | 53 Ų | 53 | 66.1 Ų | 66.1 | 32% | 0.321 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.6 | -37.5 | -179.6 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | F220 Y224 E226 | F220-V228 HydrophobicContact CE1-CG2 3.88Å; F220-V228 HydrophobicContact CZ-CG2 4.4Å; Y224-V228 WeakPolarHBondContact O-CG2 3.45Å; Y224-V228 PolarHBondContact O-N 3.39Å; E226-V228 VanDerWaalsContact C-N 3.35Å; E226-V228 PolarHBondContact O-N 3.42Å |
| 229 | R | 80 | Confident | 86.4 | Confident | 138 Ų | 138 | 61.7 Ų | 61.7 | 52% | 0.521 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -67.7 | -46.1 | 178 | -67.9 | 177.1 | -164.2 | -178.8 | 1.1 | 112.6 | R225 E226 Q227 E292 | R225-R229 WeakPolarHBondContact O-CG 3.47Å; R225-R229 PolarHBondContact O-N 3.5Å; E226-R229 WeakPolarHBondContact O-CB 3.41Å; E226-R229 PolarHBondContact O-N 2.97Å; E226-R229 VanDerWaalsContact O-N 3.15Å; Q227-R229 VanDerWaalsContact C-N 3.26Å; Q227-R229 PolarHBondContact O-N 3.19Å; R229-E292 IonicContact NH1-OE1 3.74Å |
| 230 | V | 83.7 | Confident | 86.6 | Confident | 19 Ų | 19 | 58.8 Ų | 58.8 | 12% | 0.115 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -93.7 | -15.3 | -170.8 | -54 | 0 | 0 | 0 | 0 | 113.5 | Y52 E226 Q227 K232 T233 L234 | Y52-V230 HydrophobicContact CD1-CG1 3.67Å; Y52-V230 HydrophobicContact CD2-CB 3.79Å; Y52-V230 HydrophobicContact CD2-CG1 3.69Å; Y52-V230 HydrophobicContact CD2-CG2 4.25Å; Y52-V230 HydrophobicContact CE1-CB 4.45Å; Y52-V230 HydrophobicContact CE1-CG1 3.83Å; Y52-V230 HydrophobicContact CE2-CB 3.69Å; Y52-V230 HydrophobicContact CE2-CG1 3.86Å; Y52-V230 HydrophobicContact CE2-CG2 4.49Å; Y52-V230 HydrophobicContact CG-CB 4.21Å; Y52-V230 HydrophobicContact CG-CG1 3.57Å; E226-V230 WeakPolarHBondContact O-CG2 2.97Å; E226-V230 PolarHBondContact O-N 2.78Å; E226-V230 VanDerWaalsContact O-N 3.09Å; Q227-V230 PolarHBondContact O-N 2.77Å; V230-K232 VanDerWaalsContact C-N 3.32Å; V230-K232 PolarHBondContact O-N 3.23Å; V230-T233 PolarHBondContact O-N 2.85Å; V230-L234 HydrophobicContact CB-CD1 4.2Å; V230-L234 HydrophobicContact CB-CG 4.43Å; V230-L234 HydrophobicContact CG2-CD1 3.77Å; V230-L234 HydrophobicContact CG2-CG 4.48Å; V230-L234 PolarHBondContact O-N 2.93Å |
| 231 | R | 85.3 | Confident | 86.8 | Confident | 98 Ų | 98 | 58.5 Ų | 58.5 | 37% | 0.37 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -52.6 | -46.4 | -174.5 | 173.2 | -177.3 | 66.9 | -171.9 | -2 | 112.4 | Q227 T235 | Q227-R231 WeakPolarHBondContact O-CA 3.47Å; Q227-R231 WeakPolarHBondContact O-CB 3.38Å; Q227-R231 PolarHBondContact O-N 3.18Å; R231-T235 WeakPolarHBondContact O-CB 3.27Å; R231-T235 PolarHBondContact O-N 2.76Å; R231-T235 PolarHBondContact O-OG1 3.32Å |
| 232 | K | 87.1 | Confident | 87.1 | Confident | 126 Ų | 126 | 54.7 Ų | 54.7 | 55% | 0.548 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.7 | -51.8 | -177.4 | -174.6 | 176.1 | 179.4 | -178.3 | 0 | 110.1 | V230 T235 W236 T289 | V230-K232 VanDerWaalsContact C-N 3.32Å; V230-K232 PolarHBondContact O-N 3.23Å; K232-T235 PolarHBondContact O-N 3.48Å; K232-W236 PolarHBondContact O-N 2.87Å; K232-W236 VanDerWaalsContact O-N 3.15Å; K232-T289 HydrophobicContact CD-CG2 4.43Å; K232-T289 HydrophobicContact CG-CG2 4.19Å |
| 233 | T | 88.4 | Confident | 87.6 | Confident | 1 Ų | 1 | 53.2 Ų | 53.2 | 1% | 0.006 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.1 | -53.2 | -179.6 | -47.1 | 0 | 0 | 0 | 0 | 111.9 | Y52 V230 T235 W236 V237 V286 T289 | Y52-T233 WeakPolarHBondContact OH-CB 3.31Å; Y52-T233 WeakPolarHBondContact OH-CG2 3.34Å; V230-T233 PolarHBondContact O-N 2.85Å; T233-T235 PolarHBondContact O-N 2.86Å; T233-W236 PolarHBondContact O-N 2.96Å; T233-V237 HydrophobicContact CG2-CG2 4.41Å; T233-V237 WeakPolarHBondContact O-CG2 3.44Å; T233-V237 PolarHBondContact O-N 3.35Å; T233-V286 HydrophobicContact CG2-CB 4.49Å; T233-V286 HydrophobicContact CG2-CG2 3.98Å; T233-T289 WeakPolarHBondContact CA-OG1 3.38Å; T233-T289 VanDerWaalsContact CB-OG1 3.26Å; T233-T289 WeakPolarHBondContact CB-OG1 3.43Å; T233-T289 WeakPolarHBondContact CG2-OG1 3.44Å; T233-T289 PolarHBondContact OG1-OG1 3.39Å |
| 234 | L | 88.2 | Confident | 88.1 | Confident | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.3 | -38.1 | -177.1 | -68.6 | -179.2 | 0 | 0 | 0 | 113 | Y52 L112 R116 V230 W236 V237 T238 | Y52-L234 HydrophobicContact CD2-CD1 3.96Å; Y52-L234 HydrophobicContact CD2-CD2 4.16Å; Y52-L234 HydrophobicContact CD2-CG 4.19Å; Y52-L234 HydrophobicContact CE2-CD1 3.9Å; Y52-L234 HydrophobicContact CE2-CD2 3.52Å; Y52-L234 HydrophobicContact CE2-CG 3.61Å; L112-L234 HydrophobicContact CD1-CD2 4.13Å; L112-L234 HydrophobicContact CD2-CD2 3.64Å; L112-L234 HydrophobicContact CG-CD2 4.44Å; R116-L234 HydrophobicContact CG-CD1 3.82Å; R116-L234 PolarHBondContact NH1-O 3.36Å; V230-L234 HydrophobicContact CB-CD1 4.2Å; V230-L234 HydrophobicContact CB-CG 4.43Å; V230-L234 HydrophobicContact CG2-CD1 3.77Å; V230-L234 HydrophobicContact CG2-CG 4.48Å; V230-L234 PolarHBondContact O-N 2.93Å; L234-W236 VanDerWaalsContact C-N 3.33Å; L234-W236 PolarHBondContact O-N 3.3Å; L234-V237 PolarHBondContact O-N 3.49Å; L234-T238 WeakPolarHBondContact O-CG2 3.34Å; L234-T238 PolarHBondContact O-N 3.01Å; L234-T238 PolarHBondContact O-OG1 3.03Å |
| 235 | T | 90.4 | Very high | 88.6 | Confident | 35 Ų | 35 | 49.6 Ų | 49.6 | 22% | 0.215 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.9 | -46.5 | 176.8 | -56 | 0 | 0 | 0 | 0 | 110.4 | V201 R231 K232 T233 T238 L239 | V201-T235 HydrophobicContact CG2-CG2 4.25Å; R231-T235 WeakPolarHBondContact O-CB 3.27Å; R231-T235 PolarHBondContact O-N 2.76Å; R231-T235 PolarHBondContact O-OG1 3.32Å; K232-T235 PolarHBondContact O-N 3.48Å; T233-T235 PolarHBondContact O-N 2.86Å; T235-T238 PolarHBondContact O-OG1 3.44Å; T235-L239 WeakPolarHBondContact O-CB 3.35Å; T235-L239 PolarHBondContact O-N 2.94Å |
| 236 | W | 91.7 | Very high | 89.2 | Confident | 127 Ų | 127 | 44 Ų | 44 | 48% | 0.481 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -65.6 | -46.2 | 177.8 | -81.5 | 112.4 | 0 | 0 | 0 | 112.9 | K232 T233 L234 T238 L239 V240 I285 | K232-W236 PolarHBondContact O-N 2.87Å; K232-W236 VanDerWaalsContact O-N 3.15Å; T233-W236 PolarHBondContact O-N 2.96Å; L234-W236 VanDerWaalsContact C-N 3.33Å; L234-W236 PolarHBondContact O-N 3.3Å; W236-T238 PolarHBondContact O-N 3.4Å; W236-L239 HydrophobicContact CE3-CD2 4.3Å; W236-L239 HydrophobicContact CZ3-CD2 4.18Å; W236-L239 PolarHBondContact O-N 2.82Å; W236-V240 WeakPolarHBondContact O-CG2 3.35Å; W236-V240 PolarHBondContact O-N 2.87Å; W236-I285 HydrophobicContact CB-CG2 3.58Å |
| 237 | V | 92.2 | Very high | 90.1 | Very high | 5 Ų | 5 | 42.9 Ų | 42.9 | 3% | 0.03 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -55.2 | -52.7 | 176 | 169.3 | 0 | 0 | 0 | 0 | 109.9 | L112 T233 L234 L239 V240 V241 I285 V286 | L112-V237 HydrophobicContact CD1-CG1 3.89Å; T233-V237 HydrophobicContact CG2-CG2 4.41Å; T233-V237 WeakPolarHBondContact O-CG2 3.44Å; T233-V237 PolarHBondContact O-N 3.35Å; L234-V237 PolarHBondContact O-N 3.49Å; V237-L239 VanDerWaalsContact C-N 3.35Å; V237-L239 PolarHBondContact O-N 3.29Å; V237-V240 PolarHBondContact O-N 3.13Å; V237-V241 HydrophobicContact CG1-CG2 4.28Å; V237-V241 WeakPolarHBondContact O-CG2 3.25Å; V237-V241 PolarHBondContact O-N 2.98Å; V237-I285 HydrophobicContact CG2-CB 4.22Å; V237-I285 HydrophobicContact CG2-CG2 3.64Å; V237-V286 HydrophobicContact CG2-CG2 4.46Å |
| 238 | T | 91.9 | Very high | 90.8 | Very high | 3 Ų | 3 | 41.7 Ų | 41.7 | 2% | 0.018 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -69.2 | -32.5 | -177.6 | 56.6 | 0 | 0 | 0 | 0 | 113.8 | A109 L112 R116 L234 T235 W236 V242 | A109-T238 HydrophobicContact CB-CG2 4.44Å; L112-T238 HydrophobicContact CB-CG2 3.92Å; L112-T238 HydrophobicContact CD1-CG2 3.82Å; R116-T238 PolarHBondContact NH1-OG1 3.17Å; R116-T238 VanDerWaalsContact NH2-CB 3.34Å; R116-T238 PolarHBondContact NH2-OG1 3.42Å; L234-T238 WeakPolarHBondContact O-CG2 3.34Å; L234-T238 PolarHBondContact O-N 3.01Å; L234-T238 PolarHBondContact O-OG1 3.03Å; T235-T238 PolarHBondContact O-OG1 3.44Å; W236-T238 PolarHBondContact O-N 3.4Å; T238-V242 VanDerWaalsContact O-CB 3.26Å; T238-V242 WeakPolarHBondContact O-CB 3.49Å; T238-V242 WeakPolarHBondContact O-CG2 3.45Å; T238-V242 PolarHBondContact O-N 2.97Å |
| 239 | L | 92.8 | Very high | 91.3 | Very high | 69 Ų | 69 | 39.2 Ų | 39.2 | 36% | 0.361 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -66.3 | -43.4 | 176.8 | -177.5 | 143.1 | 0 | 0 | 0 | 110.9 | T235 W236 V237 T243 | T235-L239 WeakPolarHBondContact O-CB 3.35Å; T235-L239 PolarHBondContact O-N 2.94Å; W236-L239 HydrophobicContact CE3-CD2 4.3Å; W236-L239 HydrophobicContact CZ3-CD2 4.18Å; W236-L239 PolarHBondContact O-N 2.82Å; V237-L239 VanDerWaalsContact C-N 3.35Å; V237-L239 PolarHBondContact O-N 3.29Å; L239-T243 VanDerWaalsContact O-CB 3.25Å; L239-T243 WeakPolarHBondContact O-CB 3.46Å; L239-T243 PolarHBondContact O-N 2.98Å; L239-T243 PolarHBondContact O-OG1 3.11Å |
| 240 | V | 93.8 | Very high | 92 | Very high | 25 Ų | 25 | 35.2 Ų | 35.2 | 15% | 0.152 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -66.8 | -49.1 | 178.1 | 169.7 | 0 | 0 | 0 | 0 | 110.6 | W236 V237 V242 T243 L244 L281 I285 | W236-V240 WeakPolarHBondContact O-CG2 3.35Å; W236-V240 PolarHBondContact O-N 2.87Å; V237-V240 PolarHBondContact O-N 3.13Å; V240-V242 VanDerWaalsContact C-N 3.34Å; V240-V242 PolarHBondContact O-N 2.92Å; V240-T243 PolarHBondContact O-N 3.42Å; V240-L244 HydrophobicContact CG1-CD1 3.71Å; V240-L244 HydrophobicContact CG1-CG 4.34Å; V240-L244 WeakPolarHBondContact O-CB 3.31Å; V240-L244 WeakPolarHBondContact O-CG 3.48Å; V240-L244 PolarHBondContact O-N 3.39Å; V240-L281 HydrophobicContact CG1-CB 4.19Å; V240-L281 HydrophobicContact CG1-CD1 3.81Å; V240-I285 HydrophobicContact CB-CD1 3.85Å; V240-I285 HydrophobicContact CG1-CD1 4.15Å; V240-I285 HydrophobicContact CG2-CD1 3.71Å |
| 241 | V | 93.4 | Very high | 92.5 | Very high | 6 Ų | 6 | 37.4 Ų | 37.4 | 4% | 0.036 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -55.3 | -50.6 | 177.6 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | A109 V237 L244 Q245 N278 | A109-V241 HydrophobicContact CB-CB 4.34Å; A109-V241 HydrophobicContact CB-CG1 3.8Å; V237-V241 HydrophobicContact CG1-CG2 4.28Å; V237-V241 WeakPolarHBondContact O-CG2 3.25Å; V237-V241 PolarHBondContact O-N 2.98Å; V241-L244 PolarHBondContact O-N 2.9Å; V241-Q245 HydrophobicContact CG1-CG 4.2Å; V241-Q245 VanDerWaalsContact O-CB 3.24Å; V241-Q245 WeakPolarHBondContact O-CB 3.07Å; V241-Q245 WeakPolarHBondContact O-CG 3.27Å; V241-Q245 PolarHBondContact O-N 2.82Å; V241-N278 VanDerWaalsContact CA-OD1 3.28Å; V241-N278 WeakPolarHBondContact CA-OD1 3.48Å; V241-N278 WeakPolarHBondContact CG2-OD1 3.38Å |
| 242 | V | 94.8 | Very high | 92.8 | Very high | 2 Ų | 2 | 32.7 Ų | 32.7 | 1% | 0.012 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -66.7 | -43.4 | -177.3 | 169.4 | 0 | 0 | 0 | 0 | 111.8 | A190 I193 F194 T238 V240 L244 Q245 I246 | A190-V242 HydrophobicContact CB-CG1 4.23Å; A190-V242 VanDerWaalsContact O-CG1 3.24Å; A190-V242 WeakPolarHBondContact O-CG1 3.37Å; I193-V242 HydrophobicContact CB-CG2 3.86Å; I193-V242 HydrophobicContact CD1-CG2 4.35Å; I193-V242 HydrophobicContact CG2-CG2 3.47Å; I193-V242 VanDerWaalsContact CG2-CG2 3.47Å; F194-V242 HydrophobicContact CB-CG1 4.04Å; T238-V242 VanDerWaalsContact O-CB 3.26Å; T238-V242 WeakPolarHBondContact O-CB 3.49Å; T238-V242 WeakPolarHBondContact O-CG2 3.45Å; T238-V242 PolarHBondContact O-N 2.97Å; V240-V242 VanDerWaalsContact C-N 3.34Å; V240-V242 PolarHBondContact O-N 2.92Å; V242-L244 PolarHBondContact O-N 2.92Å; V242-Q245 PolarHBondContact O-N 3.36Å; V242-I246 HydrophobicContact CG1-CD1 3.55Å; V242-I246 HydrophobicContact CG1-CG1 4.23Å; V242-I246 WeakPolarHBondContact O-CB 3.36Å; V242-I246 VanDerWaalsContact O-CG1 3.27Å; V242-I246 WeakPolarHBondContact O-CG1 3.48Å; V242-I246 PolarHBondContact O-N 3.29Å |
| 243 | T | 95.3 | Very high | 93.1 | Very high | 73 Ų | 73 | 27.7 Ų | 27.7 | 45% | 0.448 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -60.9 | -47.1 | 178.7 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | L239 V240 I246 A247 | L239-T243 VanDerWaalsContact O-CB 3.25Å; L239-T243 WeakPolarHBondContact O-CB 3.46Å; L239-T243 PolarHBondContact O-N 2.98Å; L239-T243 PolarHBondContact O-OG1 3.11Å; V240-T243 PolarHBondContact O-N 3.42Å; T243-I246 PolarHBondContact O-N 2.91Å; T243-A247 VanDerWaalsContact O-CB 3.29Å; T243-A247 WeakPolarHBondContact O-CB 3.41Å; T243-A247 PolarHBondContact O-N 3.37Å |
| 244 | L | 95.8 | Very high | 93.4 | Very high | 25 Ų | 25 | 31.3 Ų | 31.3 | 13% | 0.131 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -67.4 | -36.7 | 178.9 | -70.4 | 177.8 | 0 | 0 | 0 | 112.3 | V240 V241 V242 G248 F274 L277 N278 L281 | V240-L244 HydrophobicContact CG1-CD1 3.71Å; V240-L244 HydrophobicContact CG1-CG 4.34Å; V240-L244 WeakPolarHBondContact O-CB 3.31Å; V240-L244 WeakPolarHBondContact O-CG 3.48Å; V240-L244 PolarHBondContact O-N 3.39Å; V241-L244 PolarHBondContact O-N 2.9Å; V242-L244 PolarHBondContact O-N 2.92Å; L244-G248 PolarHBondContact O-N 3.16Å; L244-F274 HydrophobicContact CB-CB 4.34Å; L244-F274 HydrophobicContact CD2-CB 4.25Å; L244-F274 HydrophobicContact CD2-CD1 3.75Å; L244-F274 HydrophobicContact CD2-CE1 4.44Å; L244-F274 HydrophobicContact CD2-CG 4.2Å; L244-L277 HydrophobicContact CD1-CG 4.5Å; L244-L277 HydrophobicContact CD2-CD2 4.29Å; L244-N278 HydrophobicContact CD1-CB 3.72Å; L244-L281 HydrophobicContact CD1-CD1 4.09Å |
| 245 | Q | 94.2 | Very high | 93.6 | Very high | 4 Ų | 4 | 31.2 Ų | 31.2 | 2% | 0.019 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -67.3 | -44.3 | 175.7 | -76.9 | -72.4 | -32.1 | 0 | 0 | 112.1 | N102 L106 V241 V242 R249 | N102-Q245 PolarHBondContact OD1-NE2 2.92Å; N102-Q245 PolarHBondContact OD1-OE1 2.79Å; L106-Q245 HydrophobicContact CB-CG 4.37Å; L106-Q245 HydrophobicContact CD1-CB 4.44Å; L106-Q245 HydrophobicContact CD1-CG 4.31Å; V241-Q245 HydrophobicContact CG1-CG 4.2Å; V241-Q245 VanDerWaalsContact O-CB 3.24Å; V241-Q245 WeakPolarHBondContact O-CB 3.07Å; V241-Q245 WeakPolarHBondContact O-CG 3.27Å; V241-Q245 PolarHBondContact O-N 2.82Å; V242-Q245 PolarHBondContact O-N 3.36Å; Q245-R249 VanDerWaalsContact O-CB 3.28Å; Q245-R249 WeakPolarHBondContact O-CB 3.35Å; Q245-R249 WeakPolarHBondContact O-CG 3.28Å; Q245-R249 PolarHBondContact O-N 3.25Å |
| 246 | I | 94.8 | Very high | 93.5 | Very high | 30 Ų | 30 | 31.9 Ų | 31.9 | 15% | 0.154 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -62.8 | -51.3 | 175.5 | -67.6 | 167.9 | 0 | 0 | 0 | 109.4 | A190 F191 V242 T243 G248 R249 T250 | A190-I246 HydrophobicContact CB-CD1 4.22Å; A190-I246 HydrophobicContact CB-CG1 3.68Å; F191-I246 HydrophobicContact CD1-CD1 3.98Å; F191-I246 HydrophobicContact CE1-CD1 3.87Å; F191-I246 HydrophobicContact CE2-CD1 4.41Å; F191-I246 HydrophobicContact CE2-CG2 4.33Å; F191-I246 HydrophobicContact CG-CD1 4.3Å; F191-I246 HydrophobicContact CZ-CD1 4.09Å; F191-I246 HydrophobicContact CZ-CG2 3.98Å; V242-I246 HydrophobicContact CG1-CD1 3.55Å; V242-I246 HydrophobicContact CG1-CG1 4.23Å; V242-I246 WeakPolarHBondContact O-CB 3.36Å; V242-I246 VanDerWaalsContact O-CG1 3.27Å; V242-I246 WeakPolarHBondContact O-CG1 3.48Å; V242-I246 PolarHBondContact O-N 3.29Å; T243-I246 PolarHBondContact O-N 2.91Å; I246-G248 PolarHBondContact O-N 3.02Å; I246-R249 PolarHBondContact O-N 3.24Å; I246-T250 WeakPolarHBondContact O-CB 3.02Å; I246-T250 PolarHBondContact O-N 2.92Å; I246-T250 PolarHBondContact O-OG1 3.18Å |
| 247 | A | 95.8 | Very high | 93.4 | Very high | 35 Ų | 35 | 32.3 Ų | 32.3 | 29% | 0.289 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -58.3 | -48.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | T243 R249 T250 M251 F274 | T243-A247 VanDerWaalsContact O-CB 3.29Å; T243-A247 WeakPolarHBondContact O-CB 3.41Å; T243-A247 PolarHBondContact O-N 3.37Å; A247-R249 PolarHBondContact O-N 3.27Å; A247-T250 PolarHBondContact O-N 3.35Å; A247-M251 WeakPolarHBondContact O-CG 3.43Å; A247-M251 PolarHBondContact O-N 3.44Å; A247-F274 HydrophobicContact CB-CD2 4.44Å; A247-F274 HydrophobicContact CB-CE2 4.1Å |
| 248 | G | 94.7 | Very high | 93.4 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.8 | -40.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | L244 I246 M251 R252 F274 | L244-G248 PolarHBondContact O-N 3.16Å; I246-G248 PolarHBondContact O-N 3.02Å; G248-M251 PolarHBondContact O-N 3.23Å; G248-R252 WeakPolarHBondContact O-CB 3.27Å; G248-R252 PolarHBondContact O-N 3.44Å; G248-F274 VanDerWaalsContact CA-CD2 3.46Å |
| 249 | R | 93.8 | Very high | 93.2 | Very high | 1 Ų | 1 | 40.4 Ų | 40.4 | 0% | 0.004 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -71 | -35.5 | 177.1 | -68.3 | 178.9 | -177.8 | -92 | 8.1 | 112.1 | N103 N186 Q245 I246 A247 R252 L253 I271 | N103-R249 PolarHBondContact OD1-NH2 3.34Å; N186-R249 PolarHBondContact ND2-NH1 2.05Å; Q245-R249 VanDerWaalsContact O-CB 3.28Å; Q245-R249 WeakPolarHBondContact O-CB 3.35Å; Q245-R249 WeakPolarHBondContact O-CG 3.28Å; Q245-R249 PolarHBondContact O-N 3.25Å; I246-R249 PolarHBondContact O-N 3.24Å; A247-R249 PolarHBondContact O-N 3.27Å; R249-R252 WeakPolarHBondContact O-CB 2.98Å; R249-R252 PolarHBondContact O-N 2.86Å; R249-L253 WeakPolarHBondContact O-CG 3.43Å; R249-L253 PolarHBondContact O-N 3.29Å; R249-I271 HydrophobicContact CG-CD1 3.97Å |
| 250 | T | 94.7 | Very high | 93 | Very high | 55 Ų | 55 | 40 Ų | 40 | 34% | 0.337 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.8 | -48.2 | 170.5 | -60.5 | 0 | 0 | 0 | 0 | 111.1 | I246 A247 R252 L253 L254 | I246-T250 WeakPolarHBondContact O-CB 3.02Å; I246-T250 PolarHBondContact O-N 2.92Å; I246-T250 PolarHBondContact O-OG1 3.18Å; A247-T250 PolarHBondContact O-N 3.35Å; T250-R252 VanDerWaalsContact C-N 3.27Å; T250-R252 PolarHBondContact O-N 3.35Å; T250-L253 PolarHBondContact O-N 2.98Å; T250-L253 VanDerWaalsContact O-N 3.15Å; T250-L254 HydrophobicContact CG2-CD1 4.18Å; T250-L254 WeakPolarHBondContact O-CG 3.27Å; T250-L254 PolarHBondContact O-N 2.89Å |
| 251 | M | 94.3 | Very high | 92.7 | Very high | 64 Ų | 64 | 42 Ų | 42 | 32% | 0.315 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -59.6 | -39.2 | 176.1 | -67.9 | -58 | -179.2 | 0 | 0 | 111.8 | A247 G248 L254 S255 L267 F274 | A247-M251 WeakPolarHBondContact O-CG 3.43Å; A247-M251 PolarHBondContact O-N 3.44Å; G248-M251 PolarHBondContact O-N 3.23Å; M251-L254 PolarHBondContact O-N 3.47Å; M251-L254 HydrophobicContact SD-CD1 4.35Å; M251-S255 PolarHBondContact O-N 2.91Å; M251-L267 HydrophobicContact SD-CD2 3.56Å; M251-L267 VanDerWaalsContact SD-CD2 3.56Å; M251-F274 HydrophobicContact CG-CE2 4.14Å |
| 252 | R | 91.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.4 | -44.5 | 174.2 | -178.8 | 71.6 | 95 | -161.6 | 4.1 | 112.3 | E170 G248 R249 T250 L254 S255 L256 Y268 I271 H272 | E170-R252 VanDerWaalsContact CD-CZ 3.41Å; E170-R252 VanDerWaalsContact CD-NH2 3.31Å; E170-R252 HydrophobicContact CG-CG 4.48Å; E170-R252 IonicContact OE1-CZ 3.2Å; E170-R252 VanDerWaalsContact OE1-CZ 3.27Å; E170-R252 IonicContact OE1-NE 3.36Å; E170-R252 PolarHBondContact OE1-NE 2.84Å; E170-R252 IonicContact OE1-NH2 3.59Å; E170-R252 PolarHBondContact OE1-NH2 3.08Å; E170-R252 VanDerWaalsContact OE1-NH2 3.07Å; E170-R252 IonicContact OE2-CZ 3.51Å; E170-R252 IonicContact OE2-NE 3.98Å; E170-R252 PolarHBondContact OE2-NE 3.32Å; E170-R252 IonicContact OE2-NH1 3.27Å; E170-R252 IonicContact OE2-NH2 2.75Å; E170-R252 PolarHBondContact OE2-NH2 2.8Å; G248-R252 WeakPolarHBondContact O-CB 3.27Å; G248-R252 PolarHBondContact O-N 3.44Å; R249-R252 WeakPolarHBondContact O-CB 2.98Å; R249-R252 PolarHBondContact O-N 2.86Å; T250-R252 VanDerWaalsContact C-N 3.27Å; T250-R252 PolarHBondContact O-N 3.35Å; R252-L254 VanDerWaalsContact C-N 3.33Å; R252-L254 PolarHBondContact O-N 3.49Å; R252-S255 WeakPolarHBondContact O-CB 3.29Å; R252-S255 PolarHBondContact O-N 2.97Å; R252-S255 PolarHBondContact O-OG 3.29Å; R252-L256 PolarHBondContact O-N 3.26Å; R252-Y268 PolarHBondContact NH1-O 3.22Å; R252-I271 HydrophobicContact CB-CD1 4.27Å; R252-I271 VanDerWaalsContact NH2-CG2 3.35Å; R252-H272 PolarHBondContact NH2-CE1 3.47Å; R252-H272 PolarHBondContact NH2-NE2 3.32Å; R252-H272 VanDerWaalsContact NH2-NE2 3.13Å |
| 253 | L | 93 | Very high | 92.3 | Very high | 21 Ų | 21 | 47.4 Ų | 47.4 | 11% | 0.11 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 177.4 | -73 | 174.1 | 0 | 0 | 0 | 111.7 | Y180 Q183 M187 R249 T250 S255 L256 | Y180-L253 HydrophobicContact CD1-CD2 3.48Å; Y180-L253 VanDerWaalsContact CD1-CD2 3.48Å; Y180-L253 HydrophobicContact CE1-CD2 3.71Å; Q183-L253 HydrophobicContact CB-CD2 3.82Å; Q183-L253 HydrophobicContact CB-CG 4.22Å; Q183-L253 HydrophobicContact CG-CD2 4.27Å; M187-L253 HydrophobicContact CE-CD1 4.34Å; R249-L253 WeakPolarHBondContact O-CG 3.43Å; R249-L253 PolarHBondContact O-N 3.29Å; T250-L253 PolarHBondContact O-N 2.98Å; T250-L253 VanDerWaalsContact O-N 3.15Å; L253-S255 VanDerWaalsContact C-N 3.29Å; L253-S255 PolarHBondContact O-N 3.42Å; L253-L256 PolarHBondContact O-N 2.93Å |
| 254 | L | 93.8 | Very high | 92.2 | Very high | 76 Ų | 76 | 45.8 Ų | 45.8 | 40% | 0.398 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -64.6 | -34.1 | 174.4 | -67.7 | 174.1 | 0 | 0 | 0 | 112 | T250 M251 R252 L256 Q257 A258 L267 | T250-L254 HydrophobicContact CG2-CD1 4.18Å; T250-L254 WeakPolarHBondContact O-CG 3.27Å; T250-L254 PolarHBondContact O-N 2.89Å; M251-L254 PolarHBondContact O-N 3.47Å; M251-L254 HydrophobicContact SD-CD1 4.35Å; R252-L254 VanDerWaalsContact C-N 3.33Å; R252-L254 PolarHBondContact O-N 3.49Å; L254-L256 VanDerWaalsContact C-N 3.28Å; L254-L256 PolarHBondContact O-N 2.92Å; L254-Q257 CarbonylContact O-C 3.13Å; L254-Q257 PolarHBondContact O-N 2.91Å; L254-A258 PolarHBondContact O-N 2.73Å; L254-L267 HydrophobicContact CB-CD1 4.12Å |
| 255 | S | 92.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.6 | -38.7 | 176.7 | 88.5 | 0 | 0 | 0 | 0 | 111.3 | M251 R252 L253 Q257 A258 Y264 L267 Y268 | M251-S255 PolarHBondContact O-N 2.91Å; R252-S255 WeakPolarHBondContact O-CB 3.29Å; R252-S255 PolarHBondContact O-N 2.97Å; R252-S255 PolarHBondContact O-OG 3.29Å; L253-S255 VanDerWaalsContact C-N 3.29Å; L253-S255 PolarHBondContact O-N 3.42Å; S255-Q257 PolarHBondContact O-N 3.43Å; S255-A258 VanDerWaalsContact O-CB 3.3Å; S255-A258 WeakPolarHBondContact O-CB 3.06Å; S255-A258 PolarHBondContact O-N 3.39Å; S255-A258 VanDerWaalsContact O-N 3.11Å; S255-Y264 WeakPolarHBondContact O-CD2 3.26Å; S255-L267 VanDerWaalsContact CB-CB 3.49Å; S255-Y268 VanDerWaalsContact CB-N 3.33Å |
| 256 | L | 89 | Confident | 91.8 | Very high | 48 Ų | 48 | 50 Ų | 50 | 25% | 0.251 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -16.3 | 177.4 | -61.9 | 176.2 | 0 | 0 | 0 | 113.2 | V179 Y180 R252 L253 L254 | V179-L256 HydrophobicContact CG1-CD1 3.96Å; Y180-L256 HydrophobicContact CE1-CD1 4.08Å; Y180-L256 HydrophobicContact CE2-CD1 4.45Å; Y180-L256 WeakPolarHBondContact OH-CB 3.48Å; R252-L256 PolarHBondContact O-N 3.26Å; L253-L256 PolarHBondContact O-N 2.93Å; L254-L256 VanDerWaalsContact C-N 3.28Å; L254-L256 PolarHBondContact O-N 2.92Å |
| 257 | Q | 90.1 | Very high | 91.7 | Very high | 136 Ų | 136 | 50 Ų | 50 | 64% | 0.636 | 27% | 0.268 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103 | 0.3 | 176.5 | -62.8 | 179.6 | -26.2 | 0 | 0 | 112.7 | L254 S255 | L254-Q257 CarbonylContact O-C 3.13Å; L254-Q257 PolarHBondContact O-N 2.91Å; S255-Q257 PolarHBondContact O-N 3.43Å |
| 258 | A | 90.6 | Very high | 91.5 | Very high | 31 Ų | 31 | 48.5 Ų | 48.5 | 26% | 0.256 | 26% | 0.255 | S | S | . | . | trans | -70.8 | 134.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L254 S255 N263 L267 | L254-A258 PolarHBondContact O-N 2.73Å; S255-A258 VanDerWaalsContact O-CB 3.3Å; S255-A258 WeakPolarHBondContact O-CB 3.06Å; S255-A258 PolarHBondContact O-N 3.39Å; S255-A258 VanDerWaalsContact O-N 3.11Å; A258-N263 HydrophobicContact CB-CB 4.16Å; A258-L267 HydrophobicContact CB-CD1 4.48Å | ||
| 259 | T | 89 | Confident | 91.4 | Very high | 148 Ų | 148 | 49.7 Ų | 49.7 | 91% | 0.908 | 26% | 0.261 | S | S | * | . | S | Bend | trans | -87.4 | -20.9 | -179.7 | 53.9 | 0 | 0 | 0 | 0 | 113.8 | ||
| 260 | N | 88.4 | Confident | 91.4 | Very high | 61 Ų | 61 | 50.1 Ų | 50.1 | 33% | 0.326 | 26% | 0.264 | S | S | . | . | S | Bend | trans | -116.4 | 138.5 | -178.9 | -177 | -11.8 | 0 | 0 | 0 | 109.9 | F9 I262 N263 Y264 | F9-N260 WeakPolarHBondContact CE2-OD1 3.18Å; F9-N260 WeakPolarHBondContact CZ-OD1 3.28Å; N260-I262 VanDerWaalsContact C-N 3.27Å; N260-I262 PolarHBondContact O-N 2.87Å; N260-I262 PolarHBondContact OD1-N 2.82Å; N260-I262 VanDerWaalsContact OD1-N 3.11Å; N260-N263 PolarHBondContact O-N 3.49Å; N260-N263 VanDerWaalsContact O-N 3.13Å; N260-Y264 PolarHBondContact O-N 3.5Å |
| 261 | E | 87.2 | Confident | 91.3 | Very high | 66 Ų | 66 | 47.6 Ų | 47.6 | 31% | 0.308 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -57.9 | -33.7 | 178.1 | -173.2 | 164.3 | -140.4 | 0 | 0 | 113.5 | F9 L13 K166 T265 | F9-E261 HydrophobicContact CZ-CB 4.15Å; L13-E261 HydrophobicContact CD1-CG 4.38Å; L13-E261 HydrophobicContact CD2-CG 3.96Å; K166-E261 WeakPolarHBondContact CE-OE1 3.21Å; K166-E261 IonicContact NZ-OE1 2.78Å; K166-E261 PolarHBondContact NZ-OE1 2.86Å; E261-T265 VanDerWaalsContact O-CB 3.24Å; E261-T265 WeakPolarHBondContact O-CB 3.37Å; E261-T265 PolarHBondContact O-N 2.96Å; E261-T265 PolarHBondContact O-OG1 3.23Å |
| 262 | I | 89.2 | Confident | 91.2 | Very high | 37 Ų | 37 | 45 Ų | 45 | 19% | 0.19 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.3 | -49 | 174.9 | -65.2 | 176 | 0 | 0 | 0 | 110.3 | F9 K12 L13 L16 N260 T265 F266 | F9-I262 HydrophobicContact CD2-CD1 3.8Å; F9-I262 HydrophobicContact CD2-CG1 4.44Å; F9-I262 HydrophobicContact CE2-CD1 3.46Å; F9-I262 VanDerWaalsContact CE2-CD1 3.46Å; F9-I262 HydrophobicContact CE2-CG1 3.71Å; F9-I262 HydrophobicContact CZ-CD1 4.14Å; F9-I262 HydrophobicContact CZ-CG1 3.89Å; K12-I262 HydrophobicContact CB-CD1 4.22Å; L13-I262 HydrophobicContact CD1-CG1 4.4Å; L16-I262 HydrophobicContact CD2-CG2 3.94Å; N260-I262 VanDerWaalsContact C-N 3.27Å; N260-I262 PolarHBondContact O-N 2.87Å; N260-I262 PolarHBondContact OD1-N 2.82Å; N260-I262 VanDerWaalsContact OD1-N 3.11Å; I262-T265 PolarHBondContact O-N 3.38Å; I262-F266 WeakPolarHBondContact O-CB 3.11Å; I262-F266 PolarHBondContact O-N 3.35Å |
| 263 | N | 91.2 | Very high | 91.4 | Very high | 84 Ų | 84 | 47 Ų | 47 | 45% | 0.449 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -66.9 | -42 | 179.6 | -71.8 | -5.8 | 0 | 0 | 0 | 111.1 | A258 N260 T265 L267 | A258-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 3.49Å; N260-N263 VanDerWaalsContact O-N 3.13Å; N263-T265 VanDerWaalsContact C-N 3.35Å; N263-T265 PolarHBondContact O-N 3.11Å; N263-L267 VanDerWaalsContact O-CB 3.26Å; N263-L267 WeakPolarHBondContact O-CB 3.2Å; N263-L267 WeakPolarHBondContact O-CG 3.42Å; N263-L267 PolarHBondContact O-N 3.27Å |
| 264 | Y | 91.4 | Very high | 91.5 | Very high | 39 Ų | 39 | 48.5 Ų | 48.5 | 15% | 0.153 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -53.8 | -54.4 | 172.6 | 175.5 | -88.5 | 0 | 0 | 0 | 109.9 | S255 N260 F266 L267 Y268 | S255-Y264 WeakPolarHBondContact O-CD2 3.26Å; N260-Y264 PolarHBondContact O-N 3.5Å; Y264-F266 PolarHBondContact O-N 3.25Å; Y264-L267 PolarHBondContact O-N 2.97Å; Y264-Y268 HydrophobicContact CE1-CD2 4.15Å; Y264-Y268 HydrophobicContact CE1-CG 4.11Å; Y264-Y268 HydrophobicContact CE2-CD2 4.3Å; Y264-Y268 AromaticContact CZ-CD2 3.7Å; Y264-Y268 WeakPolarHBondContact O-CA 3.34Å; Y264-Y268 WeakPolarHBondContact O-CB 3.49Å; Y264-Y268 PolarHBondContact O-N 3.32Å; Y264-Y268 WeakPolarHBondContact OH-CD2 3.28Å; Y264-Y268 WeakPolarHBondContact OH-CE2 3.39Å |
| 265 | T | 90.2 | Very high | 91.6 | Very high | 11 Ų | 11 | 45 Ų | 45 | 7% | 0.067 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.5 | -45 | -175.5 | -60 | 0 | 0 | 0 | 0 | 111.9 | L13 L16 L17 I20 E261 I262 N263 N269 | L13-T265 HydrophobicContact CD1-CG2 4.18Å; L16-T265 HydrophobicContact CD2-CG2 4.36Å; L17-T265 HydrophobicContact CD2-CG2 3.56Å; L17-T265 HydrophobicContact CG-CG2 4.16Å; I20-T265 HydrophobicContact CD1-CG2 4.37Å; E261-T265 VanDerWaalsContact O-CB 3.24Å; E261-T265 WeakPolarHBondContact O-CB 3.37Å; E261-T265 PolarHBondContact O-N 2.96Å; E261-T265 PolarHBondContact O-OG1 3.23Å; I262-T265 PolarHBondContact O-N 3.38Å; N263-T265 VanDerWaalsContact C-N 3.35Å; N263-T265 PolarHBondContact O-N 3.11Å; T265-N269 WeakPolarHBondContact O-CB 3.44Å; T265-N269 PolarHBondContact O-N 3.47Å; T265-N269 PolarHBondContact O-ND2 3Å |
| 266 | F | 92.2 | Very high | 91.7 | Very high | 106 Ų | 106 | 45 Ų | 45 | 47% | 0.465 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.1 | -52.2 | 177.4 | 175.2 | -106.2 | 0 | 0 | 0 | 112.1 | L16 I262 Y264 N269 S270 | L16-F266 HydrophobicContact CD1-CD2 4.17Å; L16-F266 HydrophobicContact CD2-CB 4.05Å; I262-F266 WeakPolarHBondContact O-CB 3.11Å; I262-F266 PolarHBondContact O-N 3.35Å; Y264-F266 PolarHBondContact O-N 3.25Å; F266-N269 PolarHBondContact O-N 3.33Å; F266-S270 PolarHBondContact O-N 3.05Å; F266-S270 PolarHBondContact O-OG 3.3Å |
| 267 | L | 93.9 | Very high | 92 | Very high | 31 Ų | 31 | 45.4 Ų | 45.4 | 16% | 0.162 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.5 | -40.7 | -178 | -68.4 | 172.1 | 0 | 0 | 0 | 111.5 | M251 L254 S255 A258 N263 Y264 S270 | M251-L267 HydrophobicContact SD-CD2 3.56Å; M251-L267 VanDerWaalsContact SD-CD2 3.56Å; L254-L267 HydrophobicContact CB-CD1 4.12Å; S255-L267 VanDerWaalsContact CB-CB 3.49Å; A258-L267 HydrophobicContact CB-CD1 4.48Å; N263-L267 VanDerWaalsContact O-CB 3.26Å; N263-L267 WeakPolarHBondContact O-CB 3.2Å; N263-L267 WeakPolarHBondContact O-CG 3.42Å; N263-L267 PolarHBondContact O-N 3.27Å; Y264-L267 PolarHBondContact O-N 2.97Å; L267-S270 WeakPolarHBondContact O-CB 3.24Å; L267-S270 PolarHBondContact O-N 3.4Å |
| 268 | Y | 91.7 | Very high | 92.3 | Very high | 4 Ų | 4 | 39 Ų | 39 | 2% | 0.016 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.6 | -46.8 | 177.3 | -172.2 | -92 | 0 | 0 | 0 | 110.1 | G168 R252 S255 Y264 S270 I271 | G168-Y268 WeakPolarHBondContact CA-OH 3.37Å; R252-Y268 PolarHBondContact NH1-O 3.22Å; S255-Y268 VanDerWaalsContact CB-N 3.33Å; Y264-Y268 HydrophobicContact CE1-CD2 4.15Å; Y264-Y268 HydrophobicContact CE1-CG 4.11Å; Y264-Y268 HydrophobicContact CE2-CD2 4.3Å; Y264-Y268 AromaticContact CZ-CD2 3.7Å; Y264-Y268 WeakPolarHBondContact O-CA 3.34Å; Y264-Y268 WeakPolarHBondContact O-CB 3.49Å; Y264-Y268 PolarHBondContact O-N 3.32Å; Y264-Y268 WeakPolarHBondContact OH-CD2 3.28Å; Y264-Y268 WeakPolarHBondContact OH-CE2 3.39Å; Y268-S270 VanDerWaalsContact C-N 3.33Å; Y268-S270 PolarHBondContact O-N 2.93Å; Y268-I271 WeakPolarHBondContact O-CG2 3.5Å |
| 269 | N | 91.6 | Very high | 92.5 | Very high | 24 Ų | 24 | 37.6 Ų | 37.6 | 13% | 0.128 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -77.9 | -14.9 | -178.7 | -74.2 | -69.7 | 0 | 0 | 0 | 114.6 | I20 T265 F266 I271 H272 I273 | I20-N269 HydrophobicContact CD1-CB 3.82Å; I20-N269 HydrophobicContact CG1-CB 4.36Å; I20-N269 HydrophobicContact CG2-CB 3.69Å; T265-N269 WeakPolarHBondContact O-CB 3.44Å; T265-N269 PolarHBondContact O-N 3.47Å; T265-N269 PolarHBondContact O-ND2 3Å; F266-N269 PolarHBondContact O-N 3.33Å; N269-I271 VanDerWaalsContact C-N 3.29Å; N269-I271 PolarHBondContact O-N 2.98Å; N269-H272 WeakPolarHBondContact O-CB 3.33Å; N269-H272 PolarHBondContact O-N 2.88Å; N269-I273 PolarHBondContact O-N 2.94Å |
| 270 | S | 93.4 | Very high | 92.8 | Very high | 10 Ų | 10 | 31 Ų | 31 | 7% | 0.07 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.7 | -35.9 | 179.1 | -68 | 0 | 0 | 0 | 0 | 113.1 | F266 L267 Y268 H272 I273 F274 | F266-S270 PolarHBondContact O-N 3.05Å; F266-S270 PolarHBondContact O-OG 3.3Å; L267-S270 WeakPolarHBondContact O-CB 3.24Å; L267-S270 PolarHBondContact O-N 3.4Å; Y268-S270 VanDerWaalsContact C-N 3.33Å; Y268-S270 PolarHBondContact O-N 2.93Å; S270-H272 VanDerWaalsContact C-N 3.29Å; S270-H272 PolarHBondContact O-N 3.15Å; S270-I273 PolarHBondContact O-N 3.34Å; S270-F274 WeakPolarHBondContact O-CD2 3.33Å; S270-F274 WeakPolarHBondContact O-CG 3.49Å; S270-F274 PolarHBondContact O-N 3.07Å |
| 271 | I | 92.4 | Very high | 93.1 | Very high | 2 Ų | 2 | 30.7 Ų | 30.7 | 1% | 0.01 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.4 | -34.4 | 175.6 | -167.9 | 171.5 | 0 | 0 | 0 | 112.3 | R249 R252 Y268 N269 F274 T275 | R249-I271 HydrophobicContact CG-CD1 3.97Å; R252-I271 HydrophobicContact CB-CD1 4.27Å; R252-I271 VanDerWaalsContact NH2-CG2 3.35Å; Y268-I271 WeakPolarHBondContact O-CG2 3.5Å; N269-I271 VanDerWaalsContact C-N 3.29Å; N269-I271 PolarHBondContact O-N 2.98Å; I271-F274 PolarHBondContact O-N 3.1Å; I271-T275 WeakPolarHBondContact O-CB 3.31Å; I271-T275 PolarHBondContact O-N 3.19Å; I271-T275 PolarHBondContact O-OG1 3.36Å |
| 272 | H | 93.1 | Very high | 93.4 | Very high | 10 Ų | 10 | 28 Ų | 28 | 5% | 0.046 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -67.2 | -43.8 | 177.3 | -65.5 | -53.5 | 0 | 0 | 0 | 110.4 | L24 Y70 R252 N269 S270 F274 T275 A276 | L24-H272 HydrophobicContact CD1-CB 4.26Å; L24-H272 HydrophobicContact CD2-CB 3.99Å; Y70-H272 HydrophobicContact CE1-CB 3.59Å; Y70-H272 AromaticContact CE1-CG 3.81Å; Y70-H272 AromaticContact CE1-ND1 3.55Å; Y70-H272 AromaticContact CZ-ND1 3.7Å; Y70-H272 WeakPolarHBondContact OH-CA 3.21Å; Y70-H272 PolarHBondContact OH-ND1 3.39Å; R252-H272 PolarHBondContact NH2-CE1 3.47Å; R252-H272 PolarHBondContact NH2-NE2 3.32Å; R252-H272 VanDerWaalsContact NH2-NE2 3.13Å; N269-H272 WeakPolarHBondContact O-CB 3.33Å; N269-H272 PolarHBondContact O-N 2.88Å; S270-H272 VanDerWaalsContact C-N 3.29Å; S270-H272 PolarHBondContact O-N 3.15Å; H272-F274 PolarHBondContact O-N 3.46Å; H272-T275 PolarHBondContact O-N 3.44Å; H272-A276 WeakPolarHBondContact O-CB 3.4Å; H272-A276 PolarHBondContact O-N 3.26Å |
| 273 | I | 95.3 | Very high | 93.5 | Very high | 43 Ų | 43 | 28.1 Ų | 28.1 | 22% | 0.221 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.6 | -48.1 | 174.3 | -64.3 | 171.7 | 0 | 0 | 0 | 110.3 | L24 L27 N269 S270 T275 A276 L277 | L24-I273 HydrophobicContact CD2-CG1 4.02Å; L24-I273 HydrophobicContact CG-CG1 4.4Å; L27-I273 HydrophobicContact CD1-CG2 4.1Å; N269-I273 PolarHBondContact O-N 2.94Å; S270-I273 PolarHBondContact O-N 3.34Å; I273-T275 VanDerWaalsContact C-N 3.33Å; I273-T275 PolarHBondContact O-N 3.32Å; I273-A276 PolarHBondContact O-N 3.07Å; I273-L277 WeakPolarHBondContact O-CB 3.31Å; I273-L277 PolarHBondContact O-N 3.32Å |
| 274 | F | 95.9 | Very high | 93.5 | Very high | 51 Ų | 51 | 28.8 Ų | 28.8 | 22% | 0.224 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.9 | -35.2 | 178.6 | -67 | -40.1 | 0 | 0 | 0 | 113.3 | L244 A247 G248 M251 S270 I271 H272 N278 | L244-F274 HydrophobicContact CB-CB 4.34Å; L244-F274 HydrophobicContact CD2-CB 4.25Å; L244-F274 HydrophobicContact CD2-CD1 3.75Å; L244-F274 HydrophobicContact CD2-CE1 4.44Å; L244-F274 HydrophobicContact CD2-CG 4.2Å; A247-F274 HydrophobicContact CB-CD2 4.44Å; A247-F274 HydrophobicContact CB-CE2 4.1Å; G248-F274 VanDerWaalsContact CA-CD2 3.46Å; M251-F274 HydrophobicContact CG-CE2 4.14Å; S270-F274 WeakPolarHBondContact O-CD2 3.33Å; S270-F274 WeakPolarHBondContact O-CG 3.49Å; S270-F274 PolarHBondContact O-N 3.07Å; I271-F274 PolarHBondContact O-N 3.1Å; H272-F274 PolarHBondContact O-N 3.46Å; F274-N278 VanDerWaalsContact O-CB 3.31Å; F274-N278 WeakPolarHBondContact O-CB 3.43Å; F274-N278 PolarHBondContact O-N 3.31Å |
| 275 | T | 94.4 | Very high | 93.6 | Very high | 3 Ų | 3 | 27.8 Ų | 27.8 | 2% | 0.018 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -67.7 | -45.5 | 176.3 | -55.7 | 0 | 0 | 0 | 0 | 111 | T66 Y70 N102 I271 H272 I273 N278 A279 | T66-T275 HydrophobicContact CG2-CG2 4.07Å; Y70-T275 HydrophobicContact CE2-CG2 4.04Å; N102-T275 HydrophobicContact CB-CG2 4.33Å; I271-T275 WeakPolarHBondContact O-CB 3.31Å; I271-T275 PolarHBondContact O-N 3.19Å; I271-T275 PolarHBondContact O-OG1 3.36Å; H272-T275 PolarHBondContact O-N 3.44Å; I273-T275 VanDerWaalsContact C-N 3.33Å; I273-T275 PolarHBondContact O-N 3.32Å; T275-N278 WeakPolarHBondContact O-CB 3.43Å; T275-N278 PolarHBondContact O-N 3.23Å; T275-A279 PolarHBondContact O-N 2.9Å |
| 276 | A | 95.3 | Very high | 93.5 | Very high | 1 Ų | 1 | 27.8 Ų | 27.8 | 1% | 0.008 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65.3 | -41.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L24 L27 Y70 H272 I273 N278 A279 V280 | L24-A276 HydrophobicContact CD2-CB 4.26Å; L27-A276 HydrophobicContact CB-CB 3.81Å; L27-A276 HydrophobicContact CD1-CB 4.12Å; Y70-A276 HydrophobicContact CD2-CB 3.88Å; Y70-A276 HydrophobicContact CE2-CB 4.16Å; Y70-A276 HydrophobicContact CG-CB 4.46Å; H272-A276 WeakPolarHBondContact O-CB 3.4Å; H272-A276 PolarHBondContact O-N 3.26Å; I273-A276 PolarHBondContact O-N 3.07Å; A276-N278 VanDerWaalsContact C-N 3.33Å; A276-N278 PolarHBondContact O-N 2.03Å; A276-A279 WeakPolarHBondContact O-CB 3.29Å; A276-A279 PolarHBondContact O-N 3.24Å; A276-V280 WeakPolarHBondContact O-CG2 3.37Å; A276-V280 PolarHBondContact O-N 3.15Å; A276-V280 VanDerWaalsContact O-N 3.17Å |
| 277 | L | 96.3 | Very high | 93.4 | Very high | 55 Ų | 55 | 23.4 Ų | 23.4 | 29% | 0.288 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -61.6 | -41.3 | 175.4 | -178.5 | 63.4 | 0 | 0 | 0 | 111.6 | L27 L244 I273 A279 V280 L281 | L27-L277 HydrophobicContact CD1-CB 4.42Å; L27-L277 HydrophobicContact CD2-CD1 4.17Å; L244-L277 HydrophobicContact CD1-CG 4.5Å; L244-L277 HydrophobicContact CD2-CD2 4.29Å; I273-L277 WeakPolarHBondContact O-CB 3.31Å; I273-L277 PolarHBondContact O-N 3.32Å; L277-A279 VanDerWaalsContact C-N 3.34Å; L277-A279 PolarHBondContact O-N 3.4Å; L277-V280 PolarHBondContact O-N 2.98Å; L277-L281 HydrophobicContact CD1-CD1 4.08Å; L277-L281 HydrophobicContact CD1-CG 4.08Å; L277-L281 HydrophobicContact CD2-CD1 4.3Å; L277-L281 HydrophobicContact CG-CD1 3.75Å; L277-L281 HydrophobicContact CG-CG 4.18Å; L277-L281 WeakPolarHBondContact O-CB 2.98Å; L277-L281 VanDerWaalsContact O-CG 3.28Å; L277-L281 WeakPolarHBondContact O-CG 3.45Å; L277-L281 PolarHBondContact O-N 2.91Å |
| 278 | N | 95.7 | Very high | 93.2 | Very high | 3 Ų | 3 | 28.2 Ų | 28.2 | 2% | 0.016 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -57.6 | -46.9 | 175.2 | 178.7 | 66.2 | 0 | 0 | 0 | 111.8 | V241 L244 F274 T275 A276 V280 L281 N282 | V241-N278 VanDerWaalsContact CA-OD1 3.28Å; V241-N278 WeakPolarHBondContact CA-OD1 3.48Å; V241-N278 WeakPolarHBondContact CG2-OD1 3.38Å; L244-N278 HydrophobicContact CD1-CB 3.72Å; F274-N278 VanDerWaalsContact O-CB 3.31Å; F274-N278 WeakPolarHBondContact O-CB 3.43Å; F274-N278 PolarHBondContact O-N 3.31Å; T275-N278 WeakPolarHBondContact O-CB 3.43Å; T275-N278 PolarHBondContact O-N 3.23Å; A276-N278 VanDerWaalsContact C-N 3.33Å; A276-N278 PolarHBondContact O-N 2.03Å; N278-V280 VanDerWaalsContact C-N 3.29Å; N278-V280 PolarHBondContact O-N 2.74Å; N278-L281 PolarHBondContact O-N 3.22Å; N278-N282 PolarHBondContact O-N 3.36Å; N278-N282 VanDerWaalsContact O-N 3.08Å |
| 279 | A | 94.8 | Very high | 93 | Very high | 1 Ų | 1 | 29.1 Ų | 29.1 | 1% | 0.008 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.6 | -40.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | S31 D63 T66 T275 A276 L277 | S31-A279 VanDerWaalsContact OG-CB 3.26Å; S31-A279 WeakPolarHBondContact OG-CB 3.01Å; D63-A279 HydrophobicContact CB-CB 3.78Å; T66-A279 HydrophobicContact CG2-CB 4.19Å; T275-A279 PolarHBondContact O-N 2.9Å; A276-A279 WeakPolarHBondContact O-CB 3.29Å; A276-A279 PolarHBondContact O-N 3.24Å; L277-A279 VanDerWaalsContact C-N 3.34Å; L277-A279 PolarHBondContact O-N 3.4Å |
| 280 | V | 95.6 | Very high | 92.9 | Very high | 8 Ų | 8 | 28.3 Ų | 28.3 | 5% | 0.048 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -67.6 | -47.4 | 174.8 | 175.4 | 0 | 0 | 0 | 0 | 112 | L27 L30 A276 L277 N278 N282 Y283 F284 | L27-V280 HydrophobicContact CD2-CG2 4.25Å; L27-V280 VanDerWaalsContact O-CG2 3.31Å; L27-V280 WeakPolarHBondContact O-CG2 3.3Å; L30-V280 HydrophobicContact CB-CG1 4.32Å; L30-V280 HydrophobicContact CB-CG2 3.87Å; A276-V280 WeakPolarHBondContact O-CG2 3.37Å; A276-V280 PolarHBondContact O-N 3.15Å; A276-V280 VanDerWaalsContact O-N 3.17Å; L277-V280 PolarHBondContact O-N 2.98Å; N278-V280 VanDerWaalsContact C-N 3.29Å; N278-V280 PolarHBondContact O-N 2.74Å; V280-N282 VanDerWaalsContact C-N 3.28Å; V280-N282 PolarHBondContact O-N 3.3Å; V280-Y283 PolarHBondContact O-N 3.44Å; V280-F284 HydrophobicContact CG1-CD2 4Å; V280-F284 HydrophobicContact CG1-CE2 3.62Å; V280-F284 WeakPolarHBondContact O-CD2 3.28Å |
| 281 | L | 95.2 | Very high | 92.6 | Very high | 56 Ų | 56 | 30.9 Ų | 30.9 | 29% | 0.293 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -65.5 | -30.2 | -174.7 | -72.8 | 173.6 | 0 | 0 | 0 | 112.7 | V240 L244 L277 N278 Y283 F284 I285 | V240-L281 HydrophobicContact CG1-CB 4.19Å; V240-L281 HydrophobicContact CG1-CD1 3.81Å; L244-L281 HydrophobicContact CD1-CD1 4.09Å; L277-L281 HydrophobicContact CD1-CD1 4.08Å; L277-L281 HydrophobicContact CD1-CG 4.08Å; L277-L281 HydrophobicContact CD2-CD1 4.3Å; L277-L281 HydrophobicContact CG-CD1 3.75Å; L277-L281 HydrophobicContact CG-CG 4.18Å; L277-L281 WeakPolarHBondContact O-CB 2.98Å; L277-L281 VanDerWaalsContact O-CG 3.28Å; L277-L281 WeakPolarHBondContact O-CG 3.45Å; L277-L281 PolarHBondContact O-N 2.91Å; N278-L281 PolarHBondContact O-N 3.22Å; L281-Y283 VanDerWaalsContact C-N 3.29Å; L281-Y283 PolarHBondContact O-N 2.97Å; L281-F284 PolarHBondContact O-N 3.03Å; L281-F284 VanDerWaalsContact O-N 3.12Å; L281-I285 HydrophobicContact CB-CD1 4.39Å; L281-I285 VanDerWaalsContact O-CG1 3.23Å; L281-I285 WeakPolarHBondContact O-CG1 3.5Å; L281-I285 PolarHBondContact O-N 2.87Å |
| 282 | N | 92.6 | Very high | 92.2 | Very high | 8 Ų | 8 | 34.1 Ų | 34.1 | 4% | 0.043 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -54 | -45.2 | 177 | -77.7 | -21.4 | 0 | 0 | 0 | 112.2 | I59 D63 N278 V280 I285 V286 | I59-N282 WeakPolarHBondContact CG2-ND2 3.44Å; D63-N282 PolarHBondContact OD1-ND2 2.89Å; D63-N282 WeakPolarHBondContact OD2-CB 3.24Å; D63-N282 PolarHBondContact OD2-ND2 3.41Å; N278-N282 PolarHBondContact O-N 3.36Å; N278-N282 VanDerWaalsContact O-N 3.08Å; V280-N282 VanDerWaalsContact C-N 3.28Å; V280-N282 PolarHBondContact O-N 3.3Å; N282-I285 PolarHBondContact O-N 3.17Å; N282-V286 VanDerWaalsContact O-CG2 3.29Å; N282-V286 WeakPolarHBondContact O-CG2 3.2Å; N282-V286 PolarHBondContact O-N 2.86Å |
| 283 | Y | 91.2 | Very high | 91.9 | Very high | 40 Ų | 40 | 33.7 Ų | 33.7 | 16% | 0.157 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -57.4 | -52.8 | 174.5 | 169.4 | -94.7 | 0 | 0 | 0 | 112 | S34 V38 V280 L281 I285 V286 A287 F293 Q297 | S34-Y283 WeakPolarHBondContact O-CD2 3.38Å; V38-Y283 HydrophobicContact CG2-CD2 3.46Å; V38-Y283 VanDerWaalsContact CG2-CD2 3.46Å; V38-Y283 HydrophobicContact CG2-CE2 4.1Å; V38-Y283 HydrophobicContact CG2-CG 4.48Å; V280-Y283 PolarHBondContact O-N 3.44Å; L281-Y283 VanDerWaalsContact C-N 3.29Å; L281-Y283 PolarHBondContact O-N 2.97Å; Y283-I285 VanDerWaalsContact C-N 3.32Å; Y283-I285 PolarHBondContact O-N 3.29Å; Y283-V286 PolarHBondContact O-N 2.98Å; Y283-A287 HydrophobicContact CE1-CB 4.48Å; Y283-A287 WeakPolarHBondContact O-CB 3.11Å; Y283-A287 PolarHBondContact O-N 3.37Å; Y283-F293 HydrophobicContact CE2-CE1 4.25Å; Y283-F293 HydrophobicContact CE2-CZ 4.21Å; Y283-Q297 PolarHBondContact OH-NE2 2.9Å |
| 284 | F | 92.3 | Very high | 91.5 | Very high | 99 Ų | 99 | 36 Ų | 36 | 43% | 0.434 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -63.9 | -39.9 | -175.8 | -71.8 | -72.5 | 0 | 0 | 0 | 111.7 | V280 L281 A287 L288 | V280-F284 HydrophobicContact CG1-CD2 4Å; V280-F284 HydrophobicContact CG1-CE2 3.62Å; V280-F284 WeakPolarHBondContact O-CD2 3.28Å; L281-F284 PolarHBondContact O-N 3.03Å; L281-F284 VanDerWaalsContact O-N 3.12Å; F284-A287 PolarHBondContact O-N 3.14Å; F284-L288 VanDerWaalsContact O-CB 3.3Å; F284-L288 WeakPolarHBondContact O-CB 3.2Å; F284-L288 WeakPolarHBondContact O-CG 3.23Å; F284-L288 PolarHBondContact O-N 2.99Å |
| 285 | I | 92.2 | Very high | 91.1 | Very high | 18 Ų | 18 | 35.3 Ų | 35.3 | 9% | 0.092 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.7 | -50.6 | 174.7 | -65.8 | 163.2 | 0 | 0 | 0 | 109.6 | W236 V237 V240 L281 N282 Y283 A287 L288 T289 | W236-I285 HydrophobicContact CB-CG2 3.58Å; V237-I285 HydrophobicContact CG2-CB 4.22Å; V237-I285 HydrophobicContact CG2-CG2 3.64Å; V240-I285 HydrophobicContact CB-CD1 3.85Å; V240-I285 HydrophobicContact CG1-CD1 4.15Å; V240-I285 HydrophobicContact CG2-CD1 3.71Å; L281-I285 HydrophobicContact CB-CD1 4.39Å; L281-I285 VanDerWaalsContact O-CG1 3.23Å; L281-I285 WeakPolarHBondContact O-CG1 3.5Å; L281-I285 PolarHBondContact O-N 2.87Å; N282-I285 PolarHBondContact O-N 3.17Å; Y283-I285 VanDerWaalsContact C-N 3.32Å; Y283-I285 PolarHBondContact O-N 3.29Å; I285-A287 PolarHBondContact O-N 3.06Å; I285-L288 PolarHBondContact O-N 3.45Å; I285-T289 HydrophobicContact CG2-CG2 4.36Å; I285-T289 WeakPolarHBondContact O-CB 3.29Å; I285-T289 WeakPolarHBondContact O-CG2 3.47Å; I285-T289 PolarHBondContact O-N 3.13Å; I285-T289 PolarHBondContact O-OG1 3.2Å |
| 286 | V | 89.1 | Confident | 90.8 | Very high | 11 Ų | 11 | 35.5 Ų | 35.5 | 7% | 0.067 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.3 | -45.2 | 179.6 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | M56 T233 V237 N282 Y283 L288 T289 S290 F293 | M56-V286 HydrophobicContact SD-CG1 4.39Å; M56-V286 HydrophobicContact SD-CG2 3.65Å; T233-V286 HydrophobicContact CG2-CB 4.49Å; T233-V286 HydrophobicContact CG2-CG2 3.98Å; V237-V286 HydrophobicContact CG2-CG2 4.46Å; N282-V286 VanDerWaalsContact O-CG2 3.29Å; N282-V286 WeakPolarHBondContact O-CG2 3.2Å; N282-V286 PolarHBondContact O-N 2.86Å; Y283-V286 PolarHBondContact O-N 2.98Å; V286-L288 PolarHBondContact O-N 2.95Å; V286-T289 PolarHBondContact O-N 3.31Å; V286-S290 WeakPolarHBondContact O-CB 3.43Å; V286-S290 PolarHBondContact O-N 3.25Å; V286-F293 HydrophobicContact CG1-CB 3.97Å; V286-F293 HydrophobicContact CG1-CD1 4.03Å; V286-F293 HydrophobicContact CG1-CD2 3.88Å; V286-F293 HydrophobicContact CG1-CE1 4.49Å; V286-F293 HydrophobicContact CG1-CE2 4.37Å; V286-F293 HydrophobicContact CG1-CG 3.68Å |
| 287 | A | 88.5 | Confident | 90.3 | Very high | 14 Ų | 14 | 37.8 Ų | 37.8 | 12% | 0.116 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61 | -43.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y283 F284 I285 F293 R294 | Y283-A287 HydrophobicContact CE1-CB 4.48Å; Y283-A287 WeakPolarHBondContact O-CB 3.11Å; Y283-A287 PolarHBondContact O-N 3.37Å; F284-A287 PolarHBondContact O-N 3.14Å; I285-A287 PolarHBondContact O-N 3.06Å; A287-F293 HydrophobicContact CB-CD1 4.32Å; A287-F293 HydrophobicContact CB-CE1 4.23Å; A287-R294 WeakPolarHBondContact O-CD 3.38Å; A287-R294 WeakPolarHBondContact O-CG 3.36Å; A287-R294 PolarHBondContact O-NH1 2.88Å |
| 288 | L | 90.2 | Very high | 89.9 | Confident | 131 Ų | 131 | 43.2 Ų | 43.2 | 69% | 0.686 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -77.3 | -29.7 | -177.3 | -68.6 | 172.6 | 0 | 0 | 0 | 113.2 | F284 I285 V286 R294 | F284-L288 VanDerWaalsContact O-CB 3.3Å; F284-L288 WeakPolarHBondContact O-CB 3.2Å; F284-L288 WeakPolarHBondContact O-CG 3.23Å; F284-L288 PolarHBondContact O-N 2.99Å; I285-L288 PolarHBondContact O-N 3.45Å; V286-L288 PolarHBondContact O-N 2.95Å; L288-R294 PolarHBondContact O-NH1 3.06Å |
| 289 | T | 89 | Confident | 89.4 | Confident | 23 Ų | 23 | 51.8 Ų | 51.8 | 14% | 0.141 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -105.7 | -28.8 | -171.5 | 60.8 | 0 | 0 | 0 | 0 | 114.1 | K232 T233 I285 V286 | K232-T289 HydrophobicContact CD-CG2 4.43Å; K232-T289 HydrophobicContact CG-CG2 4.19Å; T233-T289 WeakPolarHBondContact CA-OG1 3.38Å; T233-T289 VanDerWaalsContact CB-OG1 3.26Å; T233-T289 WeakPolarHBondContact CB-OG1 3.43Å; T233-T289 WeakPolarHBondContact CG2-OG1 3.44Å; T233-T289 PolarHBondContact OG1-OG1 3.39Å; I285-T289 HydrophobicContact CG2-CG2 4.36Å; I285-T289 WeakPolarHBondContact O-CB 3.29Å; I285-T289 WeakPolarHBondContact O-CG2 3.47Å; I285-T289 PolarHBondContact O-N 3.13Å; I285-T289 PolarHBondContact O-OG1 3.2Å; V286-T289 PolarHBondContact O-N 3.31Å |
| 290 | S | 87.6 | Confident | 88.8 | Confident | 7 Ų | 7 | 53.9 Ų | 53.9 | 5% | 0.049 | 26% | 0.263 | C | S | . | . | trans | -91.3 | 110.3 | -179.4 | -178.1 | 0 | 0 | 0 | 0 | 112.3 | V286 E292 F293 R294 | V286-S290 WeakPolarHBondContact O-CB 3.43Å; V286-S290 PolarHBondContact O-N 3.25Å; S290-E292 VanDerWaalsContact C-N 3.31Å; S290-E292 PolarHBondContact O-N 3.44Å; S290-F293 PolarHBondContact O-N 3.04Å; S290-F293 WeakPolarHBondContact OG-CB 3.48Å; S290-F293 PolarHBondContact OG-N 2.94Å; S290-R294 PolarHBondContact O-N 3.03Å; S290-R294 VanDerWaalsContact O-N 3.12Å | ||
| 291 | A | 87.1 | Confident | 88.1 | Confident | 64 Ų | 64 | 58.8 Ų | 58.8 | 53% | 0.529 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.1 | -36.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | R294 A295 | A291-R294 PolarHBondContact O-N 2.79Å; A291-A295 WeakPolarHBondContact O-CB 3.25Å; A291-A295 PolarHBondContact O-N 3.43Å |
| 292 | E | 85 | Confident | 87.1 | Confident | 71 Ų | 71 | 62 Ų | 62 | 33% | 0.332 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.8 | -42.4 | 178.3 | -65.1 | -179.5 | 179.7 | 0 | 0 | 111.1 | L48 R229 S290 A295 A296 | L48-E292 HydrophobicContact CD2-CB 4.29Å; R229-E292 IonicContact NH1-OE1 3.74Å; S290-E292 VanDerWaalsContact C-N 3.31Å; S290-E292 PolarHBondContact O-N 3.44Å; E292-A295 PolarHBondContact O-N 3.45Å; E292-A296 PolarHBondContact O-N 3.42Å |
| 293 | F | 86.3 | Confident | 85.6 | Confident | 1 Ų | 1 | 72 Ų | 72 | 0% | 0.004 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65.4 | -44.8 | 176.9 | -172.3 | -95.9 | 0 | 0 | 0 | 111.6 | V38 M41 L48 F53 Y283 V286 A287 S290 A295 A296 Q297 | V38-F293 HydrophobicContact CB-CE2 4.36Å; V38-F293 HydrophobicContact CB-CZ 4.43Å; V38-F293 HydrophobicContact CG1-CE2 4.2Å; V38-F293 HydrophobicContact CG2-CE2 3.97Å; V38-F293 HydrophobicContact CG2-CZ 3.7Å; M41-F293 HydrophobicContact CB-CE2 4.06Å; M41-F293 HydrophobicContact CB-CZ 4.47Å; M41-F293 HydrophobicContact CG-CZ 4.43Å; L48-F293 HydrophobicContact CD1-CD2 4.08Å; F53-F293 HydrophobicContact CE1-CD2 4.49Å; Y283-F293 HydrophobicContact CE2-CE1 4.25Å; Y283-F293 HydrophobicContact CE2-CZ 4.21Å; V286-F293 HydrophobicContact CG1-CB 3.97Å; V286-F293 HydrophobicContact CG1-CD1 4.03Å; V286-F293 HydrophobicContact CG1-CD2 3.88Å; V286-F293 HydrophobicContact CG1-CE1 4.49Å; V286-F293 HydrophobicContact CG1-CE2 4.37Å; V286-F293 HydrophobicContact CG1-CG 3.68Å; A287-F293 HydrophobicContact CB-CD1 4.32Å; A287-F293 HydrophobicContact CB-CE1 4.23Å; S290-F293 PolarHBondContact O-N 3.04Å; S290-F293 WeakPolarHBondContact OG-CB 3.48Å; S290-F293 PolarHBondContact OG-N 2.94Å; F293-A295 VanDerWaalsContact C-N 3.33Å; F293-A295 PolarHBondContact O-N 3.3Å; F293-A296 WeakPolarHBondContact O-CB 3.41Å; F293-A296 PolarHBondContact O-N 2.94Å; F293-Q297 WeakPolarHBondContact O-CB 3.28Å; F293-Q297 PolarHBondContact O-N 3.23Å |
| 294 | R | 88.2 | Confident | 83.6 | Confident | 90 Ų | 90 | 74.2 Ų | 74.2 | 34% | 0.34 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.1 | -41 | 175 | -71.6 | -165.7 | -61.4 | -86.2 | 6.5 | 112.9 | A287 L288 S290 A291 A296 Q297 R298 | A287-R294 WeakPolarHBondContact O-CD 3.38Å; A287-R294 WeakPolarHBondContact O-CG 3.36Å; A287-R294 PolarHBondContact O-NH1 2.88Å; L288-R294 PolarHBondContact O-NH1 3.06Å; S290-R294 PolarHBondContact O-N 3.03Å; S290-R294 VanDerWaalsContact O-N 3.12Å; A291-R294 PolarHBondContact O-N 2.79Å; R294-A296 VanDerWaalsContact C-N 3.32Å; R294-Q297 PolarHBondContact O-N 3.47Å; R294-R298 WeakPolarHBondContact O-CB 3.45Å; R294-R298 WeakPolarHBondContact O-CG 3.43Å; R294-R298 PolarHBondContact O-N 3.37Å |
| 295 | A | 87.2 | Confident | 81.4 | Confident | 38 Ų | 38 | 75.1 Ų | 75.1 | 31% | 0.314 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63 | -41.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111 | A291 E292 F293 R299 | A291-A295 WeakPolarHBondContact O-CB 3.25Å; A291-A295 PolarHBondContact O-N 3.43Å; E292-A295 PolarHBondContact O-N 3.45Å; F293-A295 VanDerWaalsContact C-N 3.33Å; F293-A295 PolarHBondContact O-N 3.3Å; A295-R299 VanDerWaalsContact O-CG 3.28Å; A295-R299 WeakPolarHBondContact O-CG 3.45Å; A295-R299 PolarHBondContact O-N 2.75Å |
| 296 | A | 86.6 | Confident | 79.2 | Confident | 7 Ų | 7 | 78.7 Ų | 78.7 | 6% | 0.058 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -63.6 | -47.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | A45 L48 E292 F293 R294 R298 R299 V300 | A45-A296 HydrophobicContact CB-CB 3.83Å; L48-A296 HydrophobicContact CD1-CB 3.63Å; L48-A296 HydrophobicContact CD2-CB 4.11Å; L48-A296 HydrophobicContact CG-CB 3.95Å; E292-A296 PolarHBondContact O-N 3.42Å; F293-A296 WeakPolarHBondContact O-CB 3.41Å; F293-A296 PolarHBondContact O-N 2.94Å; R294-A296 VanDerWaalsContact C-N 3.32Å; A296-R298 VanDerWaalsContact C-N 3.34Å; A296-R298 PolarHBondContact O-N 3.33Å; A296-R299 PolarHBondContact O-N 3.41Å; A296-R299 VanDerWaalsContact O-N 3.15Å; A296-V300 WeakPolarHBondContact O-CG2 3.38Å; A296-V300 PolarHBondContact O-N 3.25Å |
| 297 | Q | 86.3 | Confident | 77 | Confident | 48 Ų | 48 | 84.9 Ų | 84.9 | 22% | 0.224 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -58.1 | -45.5 | 177.6 | -174.6 | 177.6 | 1.2 | 0 | 0 | 111.7 | M41 Y283 F293 R294 V300 L301 | M41-Q297 HydrophobicContact SD-CB 4.46Å; Y283-Q297 PolarHBondContact OH-NE2 2.9Å; F293-Q297 WeakPolarHBondContact O-CB 3.28Å; F293-Q297 PolarHBondContact O-N 3.23Å; R294-Q297 PolarHBondContact O-N 3.47Å; Q297-V300 PolarHBondContact O-N 2.82Å; Q297-L301 HydrophobicContact CG-CD1 3.5Å; Q297-L301 HydrophobicContact CG-CG 4.14Å; Q297-L301 VanDerWaalsContact O-CB 3.28Å; Q297-L301 WeakPolarHBondContact O-CB 3.44Å; Q297-L301 WeakPolarHBondContact O-CG 3.34Å; Q297-L301 PolarHBondContact O-N 3.13Å |
| 298 | R | 86.7 | Confident | 74.9 | Confident | 170 Ų | 170 | 86.7 Ų | 86.7 | 64% | 0.642 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -60.8 | -46.5 | 174.3 | -73.4 | -177.9 | -176.7 | -168.3 | -0.4 | 111.7 | R294 A296 V300 L302 | R294-R298 WeakPolarHBondContact O-CB 3.45Å; R294-R298 WeakPolarHBondContact O-CG 3.43Å; R294-R298 PolarHBondContact O-N 3.37Å; A296-R298 VanDerWaalsContact C-N 3.34Å; A296-R298 PolarHBondContact O-N 3.33Å; R298-V300 VanDerWaalsContact C-N 3.3Å; R298-V300 PolarHBondContact O-N 3.13Å; R298-L302 HydrophobicContact CB-CD1 4.14Å; R298-L302 HydrophobicContact CG-CD1 3.99Å; R298-L302 CarbonylContact O-C 3.54Å; R298-L302 VanDerWaalsContact O-CA 3.23Å; R298-L302 WeakPolarHBondContact O-CA 3.45Å; R298-L302 WeakPolarHBondContact O-CB 3.5Å; R298-L302 PolarHBondContact O-N 3.4Å |
| 299 | R | 85 | Confident | 73.1 | Confident | 182 Ų | 182 | 85.6 Ų | 85.6 | 69% | 0.687 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.3 | -34.9 | 179.9 | -72.7 | 176.3 | -162.5 | 173.6 | 4.5 | 113.5 | A295 A296 | A295-R299 VanDerWaalsContact O-CG 3.28Å; A295-R299 WeakPolarHBondContact O-CG 3.45Å; A295-R299 PolarHBondContact O-N 2.75Å; A296-R299 PolarHBondContact O-N 3.41Å; A296-R299 VanDerWaalsContact O-N 3.15Å |
| 300 | V | 83.1 | Confident | 71.3 | Confident | 45 Ų | 45 | 92.7 Ų | 92.7 | 27% | 0.273 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -84.4 | -45 | -177.5 | 177.5 | 0 | 0 | 0 | 0 | 111.5 | F40 M41 K44 A296 Q297 R298 | F40-V300 HydrophobicContact CE1-CG1 3.81Å; M41-V300 HydrophobicContact CE-CB 3.74Å; M41-V300 HydrophobicContact CE-CG1 3.43Å; M41-V300 VanDerWaalsContact CE-CG1 3.43Å; M41-V300 HydrophobicContact CE-CG2 4.5Å; M41-V300 HydrophobicContact SD-CB 3.66Å; M41-V300 HydrophobicContact SD-CG1 3.93Å; M41-V300 HydrophobicContact SD-CG2 3.89Å; K44-V300 HydrophobicContact CB-CG2 4.27Å; A296-V300 WeakPolarHBondContact O-CG2 3.38Å; A296-V300 PolarHBondContact O-N 3.25Å; Q297-V300 PolarHBondContact O-N 2.82Å; R298-V300 VanDerWaalsContact C-N 3.3Å; R298-V300 PolarHBondContact O-N 3.13Å |
| 301 | L | 80.1 | Confident | 69 | Low | 111 Ų | 111 | 104.6 Ų | 104.6 | 58% | 0.581 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -82.6 | -43.9 | -177.7 | -62.2 | -178.6 | 0 | 0 | 0 | 112.7 | M41 Q297 R303 | M41-L301 HydrophobicContact CE-CD2 3.93Å; M41-L301 HydrophobicContact CE-CG 4.06Å; Q297-L301 HydrophobicContact CG-CD1 3.5Å; Q297-L301 HydrophobicContact CG-CG 4.14Å; Q297-L301 VanDerWaalsContact O-CB 3.28Å; Q297-L301 WeakPolarHBondContact O-CB 3.44Å; Q297-L301 WeakPolarHBondContact O-CG 3.34Å; Q297-L301 PolarHBondContact O-N 3.13Å; L301-R303 PolarHBondContact O-N 3.32Å |
| 302 | L | 75.1 | Confident | 66.7 | Low | 123 Ų | 123 | 104.8 Ų | 104.8 | 64% | 0.644 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | 45.1 | 174.6 | -51.1 | 170.1 | 0 | 0 | 0 | 109.3 | R298 S304 | R298-L302 HydrophobicContact CB-CD1 4.14Å; R298-L302 HydrophobicContact CG-CD1 3.99Å; R298-L302 CarbonylContact O-C 3.54Å; R298-L302 VanDerWaalsContact O-CA 3.23Å; R298-L302 WeakPolarHBondContact O-CA 3.45Å; R298-L302 WeakPolarHBondContact O-CB 3.5Å; R298-L302 PolarHBondContact O-N 3.4Å; L302-S304 PolarHBondContact O-N 3.5Å |
| 303 | R | 60 | Low | 64.3 | Low | 218 Ų | 218 | 106.7 Ų | 106.7 | 82% | 0.823 | 57% | 0.566 | S | S | * | * | trans | -64 | 82.5 | 166 | -163.1 | -179.2 | -170.5 | -174.5 | 0.9 | 106.2 | L301 S305 | L301-R303 PolarHBondContact O-N 3.32Å; R303-S305 PolarHBondContact O-N 3.49Å | ||
| 304 | S | 49.7 | Very low | 62 | Low | 87 Ų | 87 | 119.2 Ų | 119.2 | 61% | 0.608 | 62% | 0.624 | S | S | * | * | trans | -51.3 | 117.9 | 166.5 | 53.1 | 0 | 0 | 0 | 0 | 104.4 | L302 S306 | L302-S304 PolarHBondContact O-N 3.5Å; S304-S306 PolarHBondContact O-N 3.1Å | ||
| 305 | S | 45.6 | Very low | 60.7 | Low | 119 Ų | 119 | 120.7 Ų | 120.7 | 83% | 0.832 | 64% | 0.638 | S | S | * | * | trans | -55.2 | 69.3 | 156.3 | 49.2 | 0 | 0 | 0 | 0 | 108.9 | R303 | R303-S305 PolarHBondContact O-N 3.49Š| ||
| 306 | S | 46 | Very low | 59.3 | Low | 93 Ų | 93 | 125.1 Ų | 125.1 | 65% | 0.65 | 66% | 0.655 | S | S | * | * | trans | -107.3 | 66.6 | 156.6 | 70.2 | 0 | 0 | 0 | 0 | 106.1 | S304 G308 | S304-S306 PolarHBondContact O-N 3.1Å; S306-G308 PolarHBondContact O-N 2.91Å | ||
| 307 | V | 44.7 | Very low | 57.8 | Low | 141 Ų | 141 | 131.6 Ų | 131.6 | 86% | 0.855 | 69% | 0.689 | S | S | * | * | trans | -73.4 | 75.6 | 150.2 | -170.8 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 308 | G | 43.5 | Very low | 56.1 | Low | 52 Ų | 52 | 136.5 Ų | 136.5 | 54% | 0.536 | 72% | 0.716 | S | S | . | * | trans | -84.4 | 123.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 107.5 | S306 F310 | S306-G308 PolarHBondContact O-N 2.91Å; G308-F310 PolarHBondContact O-N 3.37Å | ||
| 309 | P | 52.2 | Low | 54.2 | Low | 108 Ų | 108 | 134.4 Ų | 134.4 | 70% | 0.701 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -74.6 | 18.5 | -170.2 | 30.4 | -34.3 | 0 | 0 | 0 | 114.7 | ||
| 310 | F | 50.6 | Low | 52.1 | Low | 171 Ų | 171 | 131.3 Ų | 131.3 | 75% | 0.75 | 72% | 0.723 | S | S | * | * | trans | -109.1 | 57.3 | -171.4 | -57.7 | -73.5 | 0 | 0 | 0 | 113.1 | G308 | G308-F310 PolarHBondContact O-N 3.37Š| ||
| 311 | R | 40.9 | Very low | 49.9 | Very low | 257 Ų | 257 | 137.4 Ų | 137.4 | 97% | 0.97 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -125.6 | 72.3 | 152.8 | -97.8 | -167.4 | -178.1 | -171.5 | -0.2 | 108.8 | ||
| 312 | G | 37.6 | Very low | 47.6 | Very low | 69 Ų | 69 | 139.5 Ų | 139.5 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | -174.2 | 46.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 313 | V | 35.8 | Very low | 45.3 | Very low | 111 Ų | 111 | 140.8 Ų | 140.8 | 67% | 0.673 | 78% | 0.779 | S | S | * | * | trans | -143 | 110.7 | 166.9 | -173.8 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 314 | E | 37.3 | Very low | 44 | Very low | 264 Ų | 264 | 133.8 Ų | 133.8 | 100% | 1.234 | 78% | 0.775 | S | S | * | * | trans | 74.7 | 0 | 167.7 | -63.8 | 170.9 | -165.4 | 0 | 0 | 118.5 |
Retrieved 314 of 314 residues in 278 ms
(Link to these results)