| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.7 | Very low | 40.7 | Very low | 219 Ų | 219 | 110.8 Ų | 110.8 | 100% | 1.079 | 61% | 0.609 | S | S | * | * | 0 | -30.7 | 0 | -62.6 | 178.1 | -162.7 | 0 | 0 | 113 | L3 | M1-L3 PolarHBondContact O-N 3.5Š| |||
| 2 | G | 39.6 | Very low | 40.9 | Very low | 49 Ų | 49 | 111.3 Ų | 111.3 | 51% | 0.505 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -73.7 | -18.8 | -179.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | C6 | G2-C6 PolarHBondContact O-N 3.48Å |
| 3 | L | 36.3 | Very low | 41.2 | Very low | 157 Ų | 157 | 104.4 Ų | 104.4 | 82% | 0.822 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -71.7 | -37.5 | 179 | -162.9 | 79.5 | 0 | 0 | 0 | 112 | M1 C7 | M1-L3 PolarHBondContact O-N 3.5Å; L3-C7 WeakPolarHBondContact O-CB 3.31Å; L3-C7 PolarHBondContact O-N 3.09Å |
| 4 | L | 35.4 | Very low | 42 | Very low | 145 Ų | 145 | 98.1 Ų | 98.1 | 76% | 0.759 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -71.6 | -33 | 177 | -150 | 88.8 | 0 | 0 | 0 | 111 | A8 | L4-A8 WeakPolarHBondContact O-CB 3.38Å; L4-A8 PolarHBondContact O-N 2.95Å |
| 5 | E | 41.8 | Very low | 43.5 | Very low | 122 Ų | 122 | 93.5 Ų | 93.5 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -77.1 | -38.8 | 176.2 | -70.1 | -168.1 | 112.3 | 0 | 0 | 113.5 | C7 A8 R9 | E5-C7 VanDerWaalsContact C-N 3.31Å; E5-A8 PolarHBondContact O-N 3.2Å; E5-R9 WeakPolarHBondContact O-CB 3.47Å; E5-R9 WeakPolarHBondContact O-CG 3.48Å; E5-R9 PolarHBondContact O-N 3.38Å |
| 6 | C | 40.4 | Very low | 45.1 | Very low | 45 Ų | 45 | 94.5 Ų | 94.5 | 30% | 0.304 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.7 | -32.7 | 172 | -145 | 0 | 0 | 0 | 0 | 109.6 | G2 C10 C109 | G2-C6 PolarHBondContact O-N 3.48Å; C6-C10 WeakPolarHBondContact O-CB 3.36Å; C6-C10 PolarHBondContact O-N 3.18Å; C6-C10 PolarHBondContact O-SG 3.16Å; C6-C10 VanDerWaalsContact O-SG 3.36Å; C6-C109 WeakPolarHBondContact CB-SG 3.48Å; C6-C109 WeakPolarHBondContact SG-CB 3.29Å; C6-C109 CovalentContact SG-SG 2.13Å; C6-C109 PolarHBondContact SG-SG 2.93Å |
| 7 | C | 40 | Very low | 46.5 | Very low | 71 Ų | 71 | 93.4 Ų | 93.4 | 48% | 0.48 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.4 | -44.1 | 170.5 | -168.2 | 0 | 0 | 0 | 0 | 112.8 | L3 E5 R9 C10 L11 | L3-C7 WeakPolarHBondContact O-CB 3.31Å; L3-C7 PolarHBondContact O-N 3.09Å; E5-C7 VanDerWaalsContact C-N 3.31Å; C7-R9 PolarHBondContact O-N 3.01Å; C7-C10 PolarHBondContact O-N 3.27Å; C7-L11 PolarHBondContact O-N 2.8Å |
| 8 | A | 44.7 | Very low | 47.9 | Very low | 49 Ų | 49 | 89.4 Ų | 89.4 | 41% | 0.405 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.1 | -37.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L4 E5 L11 V12 | L4-A8 WeakPolarHBondContact O-CB 3.38Å; L4-A8 PolarHBondContact O-N 2.95Å; E5-A8 PolarHBondContact O-N 3.2Å; A8-L11 PolarHBondContact O-N 2.77Å; A8-V12 WeakPolarHBondContact O-CB 3.01Å; A8-V12 VanDerWaalsContact O-CG2 3.22Å; A8-V12 WeakPolarHBondContact O-CG2 3.31Å; A8-V12 PolarHBondContact O-N 3.47Å |
| 9 | R | 42.6 | Very low | 49.4 | Very low | 175 Ų | 175 | 87.7 Ų | 87.7 | 66% | 0.66 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -75.1 | -25.6 | 175.1 | -71.3 | -169 | -179.1 | -171.9 | 2.9 | 113.5 | E5 C7 G13 | E5-R9 WeakPolarHBondContact O-CB 3.47Å; E5-R9 WeakPolarHBondContact O-CG 3.48Å; E5-R9 PolarHBondContact O-N 3.38Å; C7-R9 PolarHBondContact O-N 3.01Å; R9-G13 PolarHBondContact O-N 2.88Å |
| 10 | C | 44.7 | Very low | 51.1 | Low | 87 Ų | 87 | 88.5 Ų | 88.5 | 59% | 0.588 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -72.9 | -38.3 | 167.2 | -80.7 | 0 | 0 | 0 | 0 | 112 | C6 C7 G13 A14 | C6-C10 WeakPolarHBondContact O-CB 3.36Å; C6-C10 PolarHBondContact O-N 3.18Å; C6-C10 PolarHBondContact O-SG 3.16Å; C6-C10 VanDerWaalsContact O-SG 3.36Å; C7-C10 PolarHBondContact O-N 3.27Å; C10-G13 PolarHBondContact O-N 2.99Å; C10-A14 PolarHBondContact O-N 3.4Å |
| 11 | L | 43 | Very low | 52.6 | Low | 100 Ų | 100 | 84.6 Ų | 84.6 | 52% | 0.524 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.6 | -46.8 | 172.1 | -106.5 | 108.3 | 0 | 0 | 0 | 111 | C7 A8 G13 A14 F16 | C7-L11 PolarHBondContact O-N 2.8Å; A8-L11 PolarHBondContact O-N 2.77Å; L11-G13 PolarHBondContact O-N 3.36Å; L11-A14 WeakPolarHBondContact O-CB 3.43Å; L11-A14 PolarHBondContact O-N 3.47Å; L11-A14 VanDerWaalsContact O-N 3.16Å; L11-F16 WeakPolarHBondContact O-CE2 3.35Å; L11-F16 WeakPolarHBondContact O-CZ 3.35Å |
| 12 | V | 43.6 | Very low | 54.9 | Low | 116 Ų | 116 | 74.2 Ų | 74.2 | 70% | 0.703 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -63.3 | -24.7 | 178.7 | 170.3 | 0 | 0 | 0 | 0 | 112.9 | A8 | A8-V12 WeakPolarHBondContact O-CB 3.01Å; A8-V12 VanDerWaalsContact O-CG2 3.22Å; A8-V12 WeakPolarHBondContact O-CG2 3.31Å; A8-V12 PolarHBondContact O-N 3.47Å |
| 13 | G | 44.3 | Very low | 57.2 | Low | 22 Ų | 22 | 72.9 Ų | 72.9 | 23% | 0.227 | 42% | 0.421 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | 5.3 | 178 | 0 | 0 | 0 | 0 | 0 | 115.2 | R9 C10 L11 T94 | R9-G13 PolarHBondContact O-N 2.88Å; C10-G13 PolarHBondContact O-N 2.99Å; L11-G13 PolarHBondContact O-N 3.36Å; G13-T94 WeakPolarHBondContact O-CG2 3.47Å |
| 14 | A | 52.8 | Low | 59.8 | Low | 17 Ų | 17 | 68.8 Ų | 68.8 | 14% | 0.14 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -89.8 | 145.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | C10 L11 F16 L19 | C10-A14 PolarHBondContact O-N 3.4Å; L11-A14 WeakPolarHBondContact O-CB 3.43Å; L11-A14 PolarHBondContact O-N 3.47Å; L11-A14 VanDerWaalsContact O-N 3.16Å; A14-F16 VanDerWaalsContact O-CD2 3.29Å; A14-F16 WeakPolarHBondContact O-CD2 3.41Å; A14-F16 PolarHBondContact O-N 2.87Å; A14-L19 HydrophobicContact CB-CD1 3.63Å |
| 15 | P | 64.9 | Low | 62.5 | Low | 28 Ų | 28 | 62.1 Ų | 62.1 | 18% | 0.182 | 36% | 0.364 | C | S | . | . | trans | -71.8 | 82.6 | 175.1 | 31.5 | -35.6 | 0 | 0 | 0 | 109.2 | A17 S18 L19 G90 T94 | P15-A17 PolarHBondContact O-N 3.44Å; P15-A17 VanDerWaalsContact O-N 3.11Å; P15-S18 PolarHBondContact O-N 3.38Å; P15-L19 PolarHBondContact O-N 3.35Å; P15-G90 WeakPolarHBondContact CG-O 3.49Å; P15-T94 WeakPolarHBondContact CB-OG1 3.28Å; P15-T94 WeakPolarHBondContact CD-OG1 3.04Å; P15-T94 WeakPolarHBondContact CG-OG1 3.48Å | ||
| 16 | F | 68.4 | Low | 64.8 | Low | 110 Ų | 110 | 59.3 Ų | 59.3 | 48% | 0.482 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -52.1 | -37.3 | -178.8 | -72.3 | -78.3 | 0 | 0 | 0 | 112 | L11 A14 L19 V20 | L11-F16 WeakPolarHBondContact O-CE2 3.35Å; L11-F16 WeakPolarHBondContact O-CZ 3.35Å; A14-F16 VanDerWaalsContact O-CD2 3.29Å; A14-F16 WeakPolarHBondContact O-CD2 3.41Å; A14-F16 PolarHBondContact O-N 2.87Å; F16-L19 PolarHBondContact O-N 3.45Å; F16-V20 VanDerWaalsContact O-CB 3.3Å; F16-V20 WeakPolarHBondContact O-CB 3.25Å; F16-V20 WeakPolarHBondContact O-CG2 3.31Å; F16-V20 PolarHBondContact O-N 3.3Å |
| 17 | A | 69.1 | Low | 67.4 | Low | 76 Ų | 76 | 64.8 Ų | 64.8 | 63% | 0.628 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.8 | -45.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P15 A21 | P15-A17 PolarHBondContact O-N 3.44Å; P15-A17 VanDerWaalsContact O-N 3.11Å; A17-A21 VanDerWaalsContact O-CB 3.28Å; A17-A21 WeakPolarHBondContact O-CB 3.35Å; A17-A21 PolarHBondContact O-N 2.84Å |
| 18 | S | 71.8 | Confident | 70 | Confident | 21 Ų | 21 | 61.5 Ų | 61.5 | 15% | 0.147 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.5 | -35.9 | 178.9 | -163.1 | 0 | 0 | 0 | 0 | 111.9 | P15 T22 | P15-S18 PolarHBondContact O-N 3.38Å; S18-T22 VanDerWaalsContact O-CB 3.27Å; S18-T22 WeakPolarHBondContact O-CB 3.25Å; S18-T22 PolarHBondContact O-N 3.15Å; S18-T22 PolarHBondContact O-OG1 3.25Å |
| 19 | L | 76.6 | Confident | 72.5 | Confident | 58 Ų | 58 | 59.5 Ų | 59.5 | 30% | 0.304 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.9 | -46.9 | 175.6 | -75.9 | 174.6 | 0 | 0 | 0 | 111.7 | A14 P15 F16 T22 G23 L87 F91 | A14-L19 HydrophobicContact CB-CD1 3.63Å; P15-L19 PolarHBondContact O-N 3.35Å; F16-L19 PolarHBondContact O-N 3.45Å; L19-T22 PolarHBondContact O-N 2.93Å; L19-G23 PolarHBondContact O-N 3.26Å; L19-L87 HydrophobicContact CD2-CD2 3.52Å; L19-F91 HydrophobicContact CD2-CZ 4.34Å |
| 20 | V | 83.6 | Confident | 75 | Confident | 102 Ų | 102 | 54.1 Ų | 54.1 | 62% | 0.618 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -64.7 | -44.2 | 177.5 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | F16 T22 G23 L24 | F16-V20 VanDerWaalsContact O-CB 3.3Å; F16-V20 WeakPolarHBondContact O-CB 3.25Å; F16-V20 WeakPolarHBondContact O-CG2 3.31Å; F16-V20 PolarHBondContact O-N 3.3Å; V20-T22 PolarHBondContact O-N 3.36Å; V20-G23 PolarHBondContact O-N 3.43Å; V20-L24 WeakPolarHBondContact O-CB 3.32Å; V20-L24 PolarHBondContact O-N 3.05Å |
| 21 | A | 83.3 | Confident | 77.4 | Confident | 7 Ų | 7 | 53.3 Ų | 53.3 | 6% | 0.058 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.8 | -46.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | A17 G23 L24 C25 S253 T256 | A17-A21 VanDerWaalsContact O-CB 3.28Å; A17-A21 WeakPolarHBondContact O-CB 3.35Å; A17-A21 PolarHBondContact O-N 2.84Å; A21-G23 PolarHBondContact O-N 3.03Å; A21-L24 PolarHBondContact O-N 2.89Å; A21-C25 WeakPolarHBondContact O-CB 3.31Å; A21-C25 PolarHBondContact O-N 2.74Å; A21-S253 PolarHBondContact O-OG 2.85Å; A21-T256 HydrophobicContact CB-CG2 4.5Å |
| 22 | T | 85.4 | Confident | 80 | Confident | 1 Ų | 1 | 49.9 Ų | 49.9 | 1% | 0.006 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.9 | -45.3 | 178.8 | -55.1 | 0 | 0 | 0 | 0 | 111.2 | S18 L19 V20 L24 C25 F26 L86 L87 | S18-T22 VanDerWaalsContact O-CB 3.27Å; S18-T22 WeakPolarHBondContact O-CB 3.25Å; S18-T22 PolarHBondContact O-N 3.15Å; S18-T22 PolarHBondContact O-OG1 3.25Å; L19-T22 PolarHBondContact O-N 2.93Å; V20-T22 PolarHBondContact O-N 3.36Å; T22-L24 PolarHBondContact O-N 3.25Å; T22-C25 VanDerWaalsContact O-CB 3.27Å; T22-C25 WeakPolarHBondContact O-CB 3.34Å; T22-C25 PolarHBondContact O-N 2.99Å; T22-C25 VanDerWaalsContact O-N 3.15Å; T22-F26 HydrophobicContact CG2-CD2 3.63Å; T22-F26 HydrophobicContact CG2-CE2 3.46Å; T22-F26 VanDerWaalsContact CG2-CE2 3.46Å; T22-F26 WeakPolarHBondContact O-CD2 3.11Å; T22-F26 PolarHBondContact O-N 3.13Å; T22-L86 HydrophobicContact CG2-CB 4.37Å; T22-L87 HydrophobicContact CG2-CD1 4.38Å; T22-L87 HydrophobicContact CG2-CD2 3.74Å; T22-L87 HydrophobicContact CG2-CG 3.74Å |
| 23 | G | 88.5 | Confident | 82.5 | Confident | 22 Ų | 22 | 44.9 Ų | 44.9 | 23% | 0.227 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -56.9 | -48.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | L19 V20 A21 C25 F26 F27 | L19-G23 PolarHBondContact O-N 3.26Å; V20-G23 PolarHBondContact O-N 3.43Å; A21-G23 PolarHBondContact O-N 3.03Å; G23-C25 VanDerWaalsContact C-N 3.28Å; G23-C25 PolarHBondContact O-N 3.03Å; G23-F26 PolarHBondContact O-N 3.48Å; G23-F27 WeakPolarHBondContact O-CD2 3.46Å; G23-F27 PolarHBondContact O-N 3.38Å |
| 24 | L | 90.7 | Very high | 84.9 | Confident | 71 Ų | 71 | 45.7 Ų | 45.7 | 37% | 0.372 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.4 | -36 | 176.8 | -172.9 | 65.5 | 0 | 0 | 0 | 112.3 | V20 A21 T22 G28 A249 | V20-L24 WeakPolarHBondContact O-CB 3.32Å; V20-L24 PolarHBondContact O-N 3.05Å; A21-L24 PolarHBondContact O-N 2.89Å; T22-L24 PolarHBondContact O-N 3.25Å; L24-G28 PolarHBondContact O-N 3.45Å; L24-A249 HydrophobicContact CD1-CB 4.25Å |
| 25 | C | 91.9 | Very high | 87 | Confident | 4 Ų | 4 | 46 Ų | 46 | 3% | 0.027 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.4 | -50.3 | 173.7 | -163.6 | 0 | 0 | 0 | 0 | 110.7 | A21 T22 G23 F27 G28 V29 S253 | A21-C25 WeakPolarHBondContact O-CB 3.31Å; A21-C25 PolarHBondContact O-N 2.74Å; T22-C25 VanDerWaalsContact O-CB 3.27Å; T22-C25 WeakPolarHBondContact O-CB 3.34Å; T22-C25 PolarHBondContact O-N 2.99Å; T22-C25 VanDerWaalsContact O-N 3.15Å; G23-C25 VanDerWaalsContact C-N 3.28Å; G23-C25 PolarHBondContact O-N 3.03Å; C25-F27 PolarHBondContact O-N 3.39Å; C25-G28 PolarHBondContact O-N 2.96Å; C25-V29 WeakPolarHBondContact O-CB 3.35Å; C25-V29 VanDerWaalsContact O-CG2 3.29Å; C25-V29 WeakPolarHBondContact O-CG2 3.32Å; C25-V29 PolarHBondContact O-N 2.95Å; C25-S253 VanDerWaalsContact CB-OG 3.32Å; C25-S253 WeakPolarHBondContact CB-OG 3.01Å |
| 26 | F | 91.4 | Very high | 88.5 | Confident | 63 Ų | 63 | 44.9 Ų | 44.9 | 28% | 0.276 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -60.2 | -47.9 | 178.6 | -86.2 | -74.2 | 0 | 0 | 0 | 112.1 | T22 G23 A30 F80 | T22-F26 HydrophobicContact CG2-CD2 3.63Å; T22-F26 HydrophobicContact CG2-CE2 3.46Å; T22-F26 VanDerWaalsContact CG2-CE2 3.46Å; T22-F26 WeakPolarHBondContact O-CD2 3.11Å; T22-F26 PolarHBondContact O-N 3.13Å; G23-F26 PolarHBondContact O-N 3.48Å; F26-A30 WeakPolarHBondContact O-CB 3.24Å; F26-A30 PolarHBondContact O-N 3.22Å; F26-F80 HydrophobicContact CE1-CB 4.34Å; F26-F80 AromaticContact CE1-CD2 3.68Å; F26-F80 HydrophobicContact CE1-CD2 3.68Å; F26-F80 HydrophobicContact CE1-CE2 4.33Å; F26-F80 HydrophobicContact CE1-CG 4.27Å; F26-F80 HydrophobicContact CZ-CD2 4.5Å |
| 27 | F | 94.3 | Very high | 89.7 | Confident | 160 Ų | 160 | 41.5 Ų | 41.5 | 70% | 0.702 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -64.8 | -42.4 | 177.9 | -71.7 | -61.2 | 0 | 0 | 0 | 111.9 | G23 C25 A30 L31 | G23-F27 WeakPolarHBondContact O-CD2 3.46Å; G23-F27 PolarHBondContact O-N 3.38Å; C25-F27 PolarHBondContact O-N 3.39Å; F27-A30 PolarHBondContact O-N 3.31Å; F27-L31 VanDerWaalsContact O-CB 3.25Å; F27-L31 WeakPolarHBondContact O-CB 3.47Å; F27-L31 PolarHBondContact O-N 3.36Å |
| 28 | G | 95.4 | Very high | 91 | Very high | 2 Ų | 2 | 43.2 Ų | 43.2 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.2 | -45.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L24 C25 L31 F32 G246 T250 | L24-G28 PolarHBondContact O-N 3.45Å; C25-G28 PolarHBondContact O-N 2.96Å; G28-L31 PolarHBondContact O-N 2.93Å; G28-F32 WeakPolarHBondContact O-CB 3.36Å; G28-F32 PolarHBondContact O-N 3.37Å; G28-G246 CarbonylContact C-O 3.58Å; G28-G246 CarbonylContact O-C 3.56Å; G28-G246 WeakPolarHBondContact O-CA 3.41Å; G28-T250 VanDerWaalsContact CA-OG1 3.31Å; G28-T250 WeakPolarHBondContact CA-OG1 3.31Å |
| 29 | V | 95.4 | Very high | 92.1 | Very high | 7 Ų | 7 | 42.2 Ų | 42.2 | 4% | 0.042 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.9 | -44.2 | 177 | 175.2 | 0 | 0 | 0 | 0 | 110.7 | C25 L31 F32 C33 F79 W163 T250 | C25-V29 WeakPolarHBondContact O-CB 3.35Å; C25-V29 VanDerWaalsContact O-CG2 3.29Å; C25-V29 WeakPolarHBondContact O-CG2 3.32Å; C25-V29 PolarHBondContact O-N 2.95Å; V29-L31 VanDerWaalsContact C-N 3.3Å; V29-L31 PolarHBondContact O-N 3.01Å; V29-F32 PolarHBondContact O-N 3.22Å; V29-C33 VanDerWaalsContact O-CB 3.25Å; V29-C33 WeakPolarHBondContact O-CB 3.36Å; V29-C33 PolarHBondContact O-N 3.04Å; V29-C33 PolarHBondContact O-SG 3.46Å; V29-C33 VanDerWaalsContact O-SG 3.33Å; V29-F79 HydrophobicContact CB-CB 4.39Å; V29-F79 HydrophobicContact CG1-CB 3.91Å; V29-F79 HydrophobicContact CG1-CD2 4.43Å; V29-F79 HydrophobicContact CG1-CG 4.21Å; V29-F79 HydrophobicContact CG2-CB 4Å; V29-F79 HydrophobicContact CG2-CD1 3.65Å; V29-F79 HydrophobicContact CG2-CD2 4.2Å; V29-F79 HydrophobicContact CG2-CE1 4.11Å; V29-F79 HydrophobicContact CG2-CG 3.68Å; V29-W163 HydrophobicContact CG2-CZ2 4.25Å; V29-T250 HydrophobicContact CG2-CG2 3.57Å; V29-T250 PolarHBondContact N-OG1 2.02Å |
| 30 | A | 95.3 | Very high | 92.8 | Very high | 62 Ų | 62 | 40.6 Ų | 40.6 | 51% | 0.512 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.6 | -41.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F26 F27 G34 | F26-A30 WeakPolarHBondContact O-CB 3.24Å; F26-A30 PolarHBondContact O-N 3.22Å; F27-A30 PolarHBondContact O-N 3.31Å; A30-G34 WeakPolarHBondContact O-CA 3.5Å; A30-G34 PolarHBondContact O-N 3Å |
| 31 | L | 96.1 | Very high | 93.2 | Very high | 70 Ų | 70 | 38.2 Ų | 38.2 | 37% | 0.366 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -66.5 | -46.6 | 176.5 | -169.6 | 69.1 | 0 | 0 | 0 | 111.4 | F27 G28 V29 C35 A242 | F27-L31 VanDerWaalsContact O-CB 3.25Å; F27-L31 WeakPolarHBondContact O-CB 3.47Å; F27-L31 PolarHBondContact O-N 3.36Å; G28-L31 PolarHBondContact O-N 2.93Å; V29-L31 VanDerWaalsContact C-N 3.3Å; V29-L31 PolarHBondContact O-N 3.01Å; L31-C35 WeakPolarHBondContact O-CB 3.33Å; L31-C35 PolarHBondContact O-N 3.07Å; L31-C35 PolarHBondContact O-SG 3.48Å; L31-C35 VanDerWaalsContact O-SG 3.41Å; L31-A242 HydrophobicContact CD1-CB 4.47Å; L31-A242 WeakPolarHBondContact CD2-O 3.37Å |
| 32 | F | 96.8 | Very high | 93.6 | Very high | 29 Ų | 29 | 38.3 Ų | 38.3 | 13% | 0.127 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.5 | -50.2 | 176.5 | 174.4 | -101.2 | 0 | 0 | 0 | 111.9 | G28 V29 G36 W163 V166 A243 A247 | G28-F32 WeakPolarHBondContact O-CB 3.36Å; G28-F32 PolarHBondContact O-N 3.37Å; V29-F32 PolarHBondContact O-N 3.22Å; F32-G36 VanDerWaalsContact O-CA 3.3Å; F32-G36 WeakPolarHBondContact O-CA 3.04Å; F32-G36 PolarHBondContact O-N 2.83Å; F32-W163 HydrophobicContact CD1-CH2 4.04Å; F32-W163 HydrophobicContact CD1-CZ2 4Å; F32-W163 HydrophobicContact CE1-CH2 4.23Å; F32-W163 HydrophobicContact CE1-CZ2 4.45Å; F32-W163 HydrophobicContact CG-CZ2 4.36Å; F32-V166 HydrophobicContact CE1-CG1 3.98Å; F32-V166 HydrophobicContact CE2-CG1 3.76Å; F32-V166 HydrophobicContact CZ-CG1 3.4Å; F32-V166 VanDerWaalsContact CZ-CG1 3.4Å; F32-A243 HydrophobicContact CD2-CB 4.29Å; F32-A243 WeakPolarHBondContact CD2-O 3.14Å; F32-A247 HydrophobicContact CD2-CB 3.82Å; F32-A247 HydrophobicContact CE2-CB 4.23Å |
| 33 | C | 96.1 | Very high | 93.8 | Very high | 10 Ų | 10 | 39.2 Ų | 39.2 | 7% | 0.068 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -69.2 | -45.3 | -177.3 | -70.4 | 0 | 0 | 0 | 0 | 112.1 | V29 H37 I72 A76 | V29-C33 VanDerWaalsContact O-CB 3.25Å; V29-C33 WeakPolarHBondContact O-CB 3.36Å; V29-C33 PolarHBondContact O-N 3.04Å; V29-C33 PolarHBondContact O-SG 3.46Å; V29-C33 VanDerWaalsContact O-SG 3.33Å; C33-H37 WeakPolarHBondContact O-CB 3.4Å; C33-H37 PolarHBondContact O-N 3.2Å; C33-I72 HydrophobicContact CB-CG2 3.57Å; C33-I72 WeakPolarHBondContact O-CG2 3.42Å; C33-I72 PolarHBondContact SG-O 3.15Å; C33-I72 VanDerWaalsContact SG-O 3.42Å; C33-A76 HydrophobicContact CB-CB 4.32Å |
| 34 | G | 95.7 | Very high | 93.8 | Very high | 39 Ų | 39 | 40 Ų | 40 | 40% | 0.402 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -66.9 | -54.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112 | A30 G36 H37 E38 | A30-G34 WeakPolarHBondContact O-CA 3.5Å; A30-G34 PolarHBondContact O-N 3Å; G34-G36 VanDerWaalsContact C-N 3.31Å; G34-G36 PolarHBondContact O-N 3.07Å; G34-H37 PolarHBondContact O-N 3.45Å; G34-E38 PolarHBondContact O-N 3.43Å |
| 35 | C | 96.3 | Very high | 93.7 | Very high | 24 Ų | 24 | 41.3 Ų | 41.3 | 16% | 0.162 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.8 | -34.3 | 178.8 | -62.4 | 0 | 0 | 0 | 0 | 112 | L31 A39 L239 A242 A243 | L31-C35 WeakPolarHBondContact O-CB 3.33Å; L31-C35 PolarHBondContact O-N 3.07Å; L31-C35 PolarHBondContact O-SG 3.48Å; L31-C35 VanDerWaalsContact O-SG 3.41Å; C35-A39 WeakPolarHBondContact O-CB 3.43Å; C35-A39 PolarHBondContact O-N 3.23Å; C35-L239 HydrophobicContact CB-CB 4.41Å; C35-L239 HydrophobicContact CB-CG 4.48Å; C35-L239 WeakPolarHBondContact CB-O 3.42Å; C35-A242 HydrophobicContact CB-CB 4.12Å; C35-A243 HydrophobicContact CB-CB 4.1Å |
| 36 | G | 95.6 | Very high | 93.6 | Very high | 4 Ų | 4 | 41.6 Ų | 41.6 | 4% | 0.041 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.8 | -48.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F32 G34 E38 A39 L40 | F32-G36 VanDerWaalsContact O-CA 3.3Å; F32-G36 WeakPolarHBondContact O-CA 3.04Å; F32-G36 PolarHBondContact O-N 2.83Å; G34-G36 VanDerWaalsContact C-N 3.31Å; G34-G36 PolarHBondContact O-N 3.07Å; G36-E38 PolarHBondContact O-N 3.4Å; G36-A39 PolarHBondContact O-N 3.22Å; G36-L40 WeakPolarHBondContact O-CB 3.33Å; G36-L40 WeakPolarHBondContact O-CD1 3.46Å; G36-L40 PolarHBondContact O-N 2.79Å |
| 37 | H | 95.1 | Very high | 93.3 | Very high | 39 Ų | 39 | 39 Ų | 39 | 18% | 0.181 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57.7 | -52.5 | 179 | 178 | 68.6 | 0 | 0 | 0 | 112 | C33 G34 A39 L40 T41 Q69 Y73 | C33-H37 WeakPolarHBondContact O-CB 3.4Å; C33-H37 PolarHBondContact O-N 3.2Å; G34-H37 PolarHBondContact O-N 3.45Å; H37-A39 VanDerWaalsContact C-N 3.33Å; H37-A39 PolarHBondContact O-N 2.93Å; H37-L40 PolarHBondContact O-N 2.86Å; H37-T41 PolarHBondContact O-N 2.96Å; H37-T41 PolarHBondContact O-OG1 3.47Å; H37-Q69 PolarHBondContact CE1-NE2 3.1Å; H37-Y73 AromaticContact CE1-CZ 3.94Å; H37-Y73 PolarHBondContact CE1-OH 3.41Å; H37-Y73 AromaticContact ND1-CZ 3.77Å; H37-Y73 PolarHBondContact ND1-OH 2.95Å; H37-Y73 VanDerWaalsContact ND1-OH 3.11Å; H37-Y73 PolarHBondContact NE2-OH 2.95Å |
| 38 | E | 95.1 | Very high | 92.9 | Very high | 112 Ų | 112 | 35.1 Ų | 35.1 | 52% | 0.523 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65.2 | -36.4 | -179.4 | -64.7 | -61.1 | 151.8 | 0 | 0 | 111.9 | G34 G36 G42 L239 | G34-E38 PolarHBondContact O-N 3.43Å; G36-E38 PolarHBondContact O-N 3.4Å; E38-G42 PolarHBondContact O-N 3.17Å; E38-L239 HydrophobicContact CB-CD2 3.25Å; E38-L239 HydrophobicContact CG-CD2 4.41Å |
| 39 | A | 94.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.9 | -44.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | C35 G36 H37 G42 T43 T236 L239 F240 | C35-A39 WeakPolarHBondContact O-CB 3.43Å; C35-A39 PolarHBondContact O-N 3.23Å; G36-A39 PolarHBondContact O-N 3.22Å; H37-A39 VanDerWaalsContact C-N 3.33Å; H37-A39 PolarHBondContact O-N 2.93Å; A39-G42 PolarHBondContact O-N 2.98Å; A39-T43 PolarHBondContact O-N 3.38Å; A39-T43 PolarHBondContact O-OG1 3.16Å; A39-T43 VanDerWaalsContact O-OG1 3.09Å; A39-T236 HydrophobicContact CB-CG2 4.41Å; A39-T236 WeakPolarHBondContact O-CG2 3.3Å; A39-L239 HydrophobicContact CB-CB 3.9Å; A39-F240 HydrophobicContact CB-CD1 3.91Å; A39-F240 HydrophobicContact CB-CD2 3.97Å; A39-F240 HydrophobicContact CB-CE1 3.77Å; A39-F240 HydrophobicContact CB-CE2 3.83Å; A39-F240 HydrophobicContact CB-CG 4Å; A39-F240 HydrophobicContact CB-CZ 3.72Å |
| 40 | L | 92.6 | Very high | 91.8 | Very high | 24 Ų | 24 | 42.4 Ų | 42.4 | 13% | 0.126 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.2 | -43.8 | 178.8 | -93.3 | 85.4 | 0 | 0 | 0 | 111.5 | G36 H37 G42 T43 E44 I65 F68 Q69 I72 F240 | G36-L40 WeakPolarHBondContact O-CB 3.33Å; G36-L40 WeakPolarHBondContact O-CD1 3.46Å; G36-L40 PolarHBondContact O-N 2.79Å; H37-L40 PolarHBondContact O-N 2.86Å; L40-G42 VanDerWaalsContact C-N 3.32Å; L40-G42 PolarHBondContact O-N 3.37Å; L40-T43 PolarHBondContact O-N 3.32Å; L40-E44 PolarHBondContact O-N 2.95Å; L40-I65 HydrophobicContact CB-CG2 4.17Å; L40-I65 HydrophobicContact CD2-CG2 4.21Å; L40-F68 HydrophobicContact CD2-CB 3.38Å; L40-F68 HydrophobicContact CD2-CD2 4.34Å; L40-F68 HydrophobicContact CD2-CG 4.2Å; L40-Q69 HydrophobicContact CD2-CG 4.45Å; L40-I72 HydrophobicContact CD1-CD1 4.46Å; L40-F240 HydrophobicContact CD1-CE1 4.24Å |
| 41 | T | 92.2 | Very high | 91 | Very high | 53 Ų | 53 | 40.2 Ų | 40.2 | 33% | 0.325 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -63 | -38.7 | 174.7 | -54.6 | 0 | 0 | 0 | 0 | 111.5 | H37 E44 K45 Q69 | H37-T41 PolarHBondContact O-N 2.96Å; H37-T41 PolarHBondContact O-OG1 3.47Å; T41-E44 PolarHBondContact O-N 3.41Å; T41-K45 PolarHBondContact O-N 3.41Å; T41-Q69 PolarHBondContact OG1-NE2 3.28Å; T41-Q69 VanDerWaalsContact OG1-NE2 3.15Å |
| 42 | G | 91.1 | Very high | 90.2 | Very high | 9 Ų | 9 | 36.9 Ų | 36.9 | 9% | 0.093 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.8 | -40.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | E38 A39 L40 K45 L46 | E38-G42 PolarHBondContact O-N 3.17Å; A39-G42 PolarHBondContact O-N 2.98Å; L40-G42 VanDerWaalsContact C-N 3.32Å; L40-G42 PolarHBondContact O-N 3.37Å; G42-K45 PolarHBondContact O-N 3.09Å; G42-L46 WeakPolarHBondContact O-CB 3.49Å; G42-L46 PolarHBondContact O-N 3.06Å |
| 43 | T | 89.5 | Confident | 89.1 | Confident | 20 Ų | 20 | 44.3 Ų | 44.3 | 12% | 0.123 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.6 | -41.8 | 175.9 | -60.8 | 0 | 0 | 0 | 0 | 112 | A39 L40 L46 I47 Y177 F240 | A39-T43 PolarHBondContact O-N 3.38Å; A39-T43 PolarHBondContact O-OG1 3.16Å; A39-T43 VanDerWaalsContact O-OG1 3.09Å; L40-T43 PolarHBondContact O-N 3.32Å; T43-L46 PolarHBondContact O-N 3.46Å; T43-I47 HydrophobicContact CG2-CD1 3.68Å; T43-I47 HydrophobicContact CG2-CG1 4.44Å; T43-I47 VanDerWaalsContact O-CG1 3.3Å; T43-I47 WeakPolarHBondContact O-CG1 3.45Å; T43-I47 PolarHBondContact O-N 3.04Å; T43-Y177 PolarHBondContact OG1-OH 2.86Å; T43-F240 WeakPolarHBondContact OG1-CE2 3.3Å |
| 44 | E | 88.8 | Confident | 88.2 | Confident | 37 Ų | 37 | 48.2 Ų | 48.2 | 17% | 0.173 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56 | -56 | 174.8 | -178.2 | 179.1 | -173.2 | 0 | 0 | 110.9 | L40 T41 L46 I47 E48 I62 I65 | L40-E44 PolarHBondContact O-N 2.95Å; T41-E44 PolarHBondContact O-N 3.41Å; E44-L46 VanDerWaalsContact C-N 3.28Å; E44-L46 PolarHBondContact O-N 3.15Å; E44-I47 PolarHBondContact O-N 3.26Å; E44-E48 WeakPolarHBondContact O-CG 3.48Å; E44-E48 PolarHBondContact O-N 3.36Å; E44-I62 HydrophobicContact CG-CG1 4.28Å; E44-I65 HydrophobicContact CB-CD1 4.07Å |
| 45 | K | 88.9 | Confident | 87.3 | Confident | 100 Ų | 100 | 52.5 Ų | 52.5 | 44% | 0.435 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -58.3 | -39.3 | 179.8 | -171.1 | -179.6 | -178.1 | -171.7 | 0 | 112.7 | T41 G42 I47 T49 E232 | T41-K45 PolarHBondContact O-N 3.41Å; G42-K45 PolarHBondContact O-N 3.09Å; K45-I47 VanDerWaalsContact C-N 3.34Å; K45-T49 VanDerWaalsContact O-CB 3.31Å; K45-T49 WeakPolarHBondContact O-CB 3.29Å; K45-T49 PolarHBondContact O-N 2.92Å; K45-T49 VanDerWaalsContact O-N 3.1Å; K45-T49 PolarHBondContact O-OG1 2.82Å; K45-E232 IonicContact NZ-OE1 3.53Å; K45-E232 PolarHBondContact NZ-OE1 2.88Å; K45-E232 IonicContact NZ-OE2 2.93Å |
| 46 | L | 88.3 | Confident | 86.4 | Confident | 10 Ų | 10 | 58.3 Ų | 58.3 | 5% | 0.052 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.5 | -41.4 | 177.3 | -170.4 | 76.8 | 0 | 0 | 0 | 111.4 | G42 T43 E44 Y50 Y177 I227 F233 | G42-L46 WeakPolarHBondContact O-CB 3.49Å; G42-L46 PolarHBondContact O-N 3.06Å; T43-L46 PolarHBondContact O-N 3.46Å; E44-L46 VanDerWaalsContact C-N 3.28Å; E44-L46 PolarHBondContact O-N 3.15Å; L46-Y50 HydrophobicContact CD1-CD2 3.7Å; L46-Y50 HydrophobicContact CD1-CE2 3.97Å; L46-Y50 HydrophobicContact CG-CD2 4.27Å; L46-Y50 WeakPolarHBondContact O-CB 3.42Å; L46-Y50 WeakPolarHBondContact O-CD2 3.29Å; L46-Y50 PolarHBondContact O-N 3.24Å; L46-Y177 HydrophobicContact CD2-CE1 4.35Å; L46-I227 HydrophobicContact CD1-CG2 3.91Å; L46-F233 HydrophobicContact CD1-CB 4.36Å; L46-F233 HydrophobicContact CD2-CD2 3.88Å |
| 47 | I | 86.3 | Confident | 85.4 | Confident | 8 Ų | 8 | 59.5 Ų | 59.5 | 4% | 0.041 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -72.7 | -43.9 | -177.1 | -70.6 | 170.2 | 0 | 0 | 0 | 111 | T43 E44 K45 T49 F51 S52 L61 V209 L210 | T43-I47 HydrophobicContact CG2-CD1 3.68Å; T43-I47 HydrophobicContact CG2-CG1 4.44Å; T43-I47 VanDerWaalsContact O-CG1 3.3Å; T43-I47 WeakPolarHBondContact O-CG1 3.45Å; T43-I47 PolarHBondContact O-N 3.04Å; E44-I47 PolarHBondContact O-N 3.26Å; K45-I47 VanDerWaalsContact C-N 3.34Å; I47-T49 VanDerWaalsContact C-N 3.26Å; I47-T49 PolarHBondContact O-N 2.75Å; I47-F51 HydrophobicContact CG2-CB 4.3Å; I47-F51 PolarHBondContact O-N 2.13Å; I47-S52 PolarHBondContact O-N 3.28Å; I47-L61 HydrophobicContact CD1-CD2 3.33Å; I47-L61 HydrophobicContact CG2-CD2 4.16Å; I47-V209 HydrophobicContact CD1-CG1 3.58Å; I47-L210 HydrophobicContact CD1-CD1 4.41Å; I47-L210 HydrophobicContact CG2-CD1 4.15Å; I47-L210 HydrophobicContact CG2-CD2 4.29Å |
| 48 | E | 84.6 | Confident | 84.6 | Confident | 79 Ų | 79 | 59.1 Ų | 59.1 | 37% | 0.369 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.3 | -36.3 | 175.4 | -68.8 | -170.5 | 144.8 | 0 | 0 | 112.5 | E44 Y58 | E44-E48 WeakPolarHBondContact O-CG 3.48Å; E44-E48 PolarHBondContact O-N 3.36Å; E48-Y58 HydrophobicContact CG-CD2 4.33Å; E48-Y58 HydrophobicContact CG-CE2 3.82Å; E48-Y58 WeakPolarHBondContact OE1-CE2 3.29Å |
| 49 | T | 84.8 | Confident | 84 | Confident | 78 Ų | 78 | 57.3 Ų | 57.3 | 48% | 0.479 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -82.4 | -38 | -176.1 | -52.4 | 0 | 0 | 0 | 0 | 112.3 | K45 I47 | K45-T49 VanDerWaalsContact O-CB 3.31Å; K45-T49 WeakPolarHBondContact O-CB 3.29Å; K45-T49 PolarHBondContact O-N 2.92Å; K45-T49 VanDerWaalsContact O-N 3.1Å; K45-T49 PolarHBondContact O-OG1 2.82Å; I47-T49 VanDerWaalsContact C-N 3.26Å; I47-T49 PolarHBondContact O-N 2.75Å |
| 50 | Y | 83.4 | Confident | 83.3 | Confident | 83 Ų | 83 | 66.3 Ų | 66.3 | 33% | 0.325 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -120.9 | -26.3 | -165.5 | -61.2 | -74.5 | 0 | 0 | 0 | 116 | L46 I227 | L46-Y50 HydrophobicContact CD1-CD2 3.7Å; L46-Y50 HydrophobicContact CD1-CE2 3.97Å; L46-Y50 HydrophobicContact CG-CD2 4.27Å; L46-Y50 WeakPolarHBondContact O-CB 3.42Å; L46-Y50 WeakPolarHBondContact O-CD2 3.29Å; L46-Y50 PolarHBondContact O-N 3.24Å; Y50-I227 HydrophobicContact CD1-CD1 3.86Å; Y50-I227 HydrophobicContact CD1-CG1 3.57Å; Y50-I227 HydrophobicContact CD2-CG1 4.44Å; Y50-I227 HydrophobicContact CD2-CG2 4.47Å; Y50-I227 HydrophobicContact CE1-CG1 3.96Å; Y50-I227 HydrophobicContact CG-CD1 3.89Å; Y50-I227 HydrophobicContact CG-CG1 3.84Å |
| 51 | F | 80.1 | Confident | 82.8 | Confident | 16 Ų | 16 | 66.4 Ų | 66.4 | 7% | 0.07 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.9 | -30.4 | -169.6 | -76.8 | -86.7 | 0 | 0 | 0 | 114.5 | I47 A204 P216 G217 V219 | I47-F51 HydrophobicContact CG2-CB 4.3Å; I47-F51 PolarHBondContact O-N 2.13Å; F51-A204 HydrophobicContact CD1-CB 3.93Å; F51-A204 HydrophobicContact CE1-CB 4.14Å; F51-P216 WeakPolarHBondContact O-CD 3.36Å; F51-G217 PolarHBondContact O-N 2.95Å; F51-V219 HydrophobicContact CD1-CG2 3.99Å; F51-V219 HydrophobicContact CE1-CB 4.33Å; F51-V219 HydrophobicContact CE1-CG2 3.72Å; F51-V219 HydrophobicContact CZ-CG2 4.13Å |
| 52 | S | 79.1 | Confident | 82.5 | Confident | 1 Ų | 1 | 64.8 Ų | 64.8 | 1% | 0.007 | 30% | 0.298 | C | S | . | . | B | Isolated β-bridge | trans | -140.6 | 130.4 | 175.2 | -172.1 | 0 | 0 | 0 | 0 | 111.8 | I47 N54 | I47-S52 PolarHBondContact O-N 3.28Å; S52-N54 PolarHBondContact OG-N 3.45Å; S52-N54 PolarHBondContact OG-O 3.21Å |
| 53 | K | 72.4 | Confident | 82.3 | Confident | 184 Ų | 184 | 68.8 Ų | 68.8 | 80% | 0.8 | 32% | 0.317 | S | S | * | . | trans | -96.9 | -9.9 | 171.8 | -67 | -172.1 | 177 | -176 | 0 | 112.9 | ||||
| 54 | N | 78.3 | Confident | 82.1 | Confident | 92 Ų | 92 | 69.9 Ų | 69.9 | 49% | 0.492 | 32% | 0.324 | S | S | . | . | trans | -104.2 | 119.7 | -176 | -74.1 | -29.2 | 0 | 0 | 0 | 110.2 | S52 Q56 D57 Y58 | S52-N54 PolarHBondContact OG-N 3.45Å; S52-N54 PolarHBondContact OG-O 3.21Å; N54-Q56 VanDerWaalsContact C-N 3.25Å; N54-Q56 PolarHBondContact O-N 3.02Å; N54-D57 WeakPolarHBondContact CB-OD2 3.44Å; N54-D57 PolarHBondContact O-N 3.13Å; N54-Y58 VanDerWaalsContact C-CE1 3.44Å; N54-Y58 WeakPolarHBondContact O-CD1 3.42Å; N54-Y58 WeakPolarHBondContact O-CE1 3.49Å | ||
| 55 | Y | 77 | Confident | 82.2 | Confident | 129 Ų | 129 | 68.6 Ų | 68.6 | 51% | 0.506 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -53.3 | -40.2 | 179.1 | -176.7 | -100.9 | 0 | 0 | 0 | 113.6 | D57 Y58 E59 | Y55-D57 PolarHBondContact O-N 3.39Å; Y55-Y58 AromaticContact CD2-CE2 3.97Å; Y55-Y58 HydrophobicContact CD2-CE2 3.97Å; Y55-Y58 AromaticContact CD2-CZ 3.89Å; Y55-Y58 HydrophobicContact CE2-CE2 4.44Å; Y55-Y58 PolarHBondContact O-N 2.96Å; Y55-E59 HydrophobicContact CE1-CB 4.37Å; Y55-E59 HydrophobicContact CE1-CG 4.21Å; Y55-E59 PolarHBondContact O-N 2.68Å; Y55-E59 VanDerWaalsContact O-N 3.1Å |
| 56 | Q | 76.6 | Confident | 82.2 | Confident | 147 Ų | 147 | 67.3 Ų | 67.3 | 69% | 0.687 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -62.1 | -26.4 | -177.1 | -68.9 | -69.9 | -76.1 | 0 | 0 | 114 | N54 E59 | N54-Q56 VanDerWaalsContact C-N 3.25Å; N54-Q56 PolarHBondContact O-N 3.02Å; Q56-E59 PolarHBondContact NE2-OE2 3.45Å |
| 57 | D | 74.1 | Confident | 82.4 | Confident | 29 Ų | 29 | 69.4 Ų | 69.4 | 16% | 0.155 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -84.2 | -21.2 | -177 | -68.3 | -46 | 0 | 0 | 0 | 113 | N54 Y55 P211 A214 | N54-D57 WeakPolarHBondContact CB-OD2 3.44Å; N54-D57 PolarHBondContact O-N 3.13Å; Y55-D57 PolarHBondContact O-N 3.39Å; D57-P211 HydrophobicContact CB-CG 4.23Å; D57-P211 WeakPolarHBondContact O-CD 3.18Å; D57-P211 WeakPolarHBondContact O-CG 3.42Å; D57-A214 HydrophobicContact CB-CB 3.97Å |
| 58 | Y | 77.9 | Confident | 82.6 | Confident | 30 Ų | 30 | 74.7 Ų | 74.7 | 12% | 0.118 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -117.4 | 0.6 | -177.3 | 67 | -96.3 | 0 | 0 | 0 | 114.3 | E48 N54 Y55 Y60 L61 I62 | E48-Y58 HydrophobicContact CG-CD2 4.33Å; E48-Y58 HydrophobicContact CG-CE2 3.82Å; E48-Y58 WeakPolarHBondContact OE1-CE2 3.29Å; N54-Y58 VanDerWaalsContact C-CE1 3.44Å; N54-Y58 WeakPolarHBondContact O-CD1 3.42Å; N54-Y58 WeakPolarHBondContact O-CE1 3.49Å; Y55-Y58 AromaticContact CD2-CE2 3.97Å; Y55-Y58 HydrophobicContact CD2-CE2 3.97Å; Y55-Y58 AromaticContact CD2-CZ 3.89Å; Y55-Y58 HydrophobicContact CE2-CE2 4.44Å; Y55-Y58 PolarHBondContact O-N 2.96Å; Y58-Y60 VanDerWaalsContact C-N 3.33Å; Y58-Y60 PolarHBondContact O-N 3.38Å; Y58-L61 WeakPolarHBondContact O-CB 3.32Å; Y58-L61 PolarHBondContact O-N 3.33Å; Y58-I62 HydrophobicContact CD2-CD1 3.39Å; Y58-I62 HydrophobicContact CD2-CG1 3.94Å; Y58-I62 HydrophobicContact CE2-CD1 3.43Å; Y58-I62 VanDerWaalsContact CE2-CD1 3.43Å; Y58-I62 HydrophobicContact CE2-CG1 4.44Å; Y58-I62 PolarHBondContact O-N 3.38Å |
| 59 | E | 82.4 | Confident | 83 | Confident | 75 Ų | 75 | 71.7 Ų | 71.7 | 35% | 0.35 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -55.3 | -45.2 | 173.3 | -173.4 | -175.3 | 156.8 | 0 | 0 | 112.2 | Y55 Q56 L61 I62 N63 | Y55-E59 HydrophobicContact CE1-CB 4.37Å; Y55-E59 HydrophobicContact CE1-CG 4.21Å; Y55-E59 PolarHBondContact O-N 2.68Å; Y55-E59 VanDerWaalsContact O-N 3.1Å; Q56-E59 PolarHBondContact NE2-OE2 3.45Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 2.79Å; E59-I62 PolarHBondContact O-N 2.92Å; E59-N63 PolarHBondContact O-N 3.18Å; E59-N63 PolarHBondContact O-ND2 2.93Å; E59-N63 VanDerWaalsContact O-ND2 3.13Å |
| 60 | Y | 80.4 | Confident | 83.3 | Confident | 188 Ų | 188 | 76.4 Ų | 76.4 | 74% | 0.737 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -62.4 | -38.6 | 176.1 | -175 | -95.8 | 0 | 0 | 0 | 111.9 | Y58 N63 V64 | Y58-Y60 VanDerWaalsContact C-N 3.33Å; Y58-Y60 PolarHBondContact O-N 3.38Å; Y60-N63 PolarHBondContact O-N 2.9Å; Y60-V64 HydrophobicContact CD1-CG2 4.07Å; Y60-V64 HydrophobicContact CE1-CG2 3.72Å; Y60-V64 VanDerWaalsContact O-CG2 3.3Å; Y60-V64 WeakPolarHBondContact O-CG2 3.37Å; Y60-V64 PolarHBondContact O-N 3.43Å |
| 61 | L | 82.8 | Confident | 83.8 | Confident | 26 Ų | 26 | 76.8 Ų | 76.8 | 14% | 0.136 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -67.9 | -43.2 | 178.9 | -179.2 | 67.3 | 0 | 0 | 0 | 111.6 | I47 Y58 E59 N63 V64 I65 V209 | I47-L61 HydrophobicContact CD1-CD2 3.33Å; I47-L61 HydrophobicContact CG2-CD2 4.16Å; Y58-L61 WeakPolarHBondContact O-CB 3.32Å; Y58-L61 PolarHBondContact O-N 3.33Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 2.79Å; L61-N63 VanDerWaalsContact C-N 3.3Å; L61-N63 PolarHBondContact O-N 2.92Å; L61-V64 WeakPolarHBondContact O-CB 3.36Å; L61-V64 PolarHBondContact O-N 2.85Å; L61-V64 VanDerWaalsContact O-N 3.14Å; L61-I65 HydrophobicContact CD1-CD1 4.39Å; L61-I65 HydrophobicContact CD1-CG1 4.47Å; L61-I65 HydrophobicContact CD2-CD1 4.39Å; L61-I65 HydrophobicContact CG-CD1 3.94Å; L61-I65 HydrophobicContact CG-CG1 4.41Å; L61-I65 WeakPolarHBondContact O-CB 3.35Å; L61-I65 WeakPolarHBondContact O-CG1 3.49Å; L61-I65 PolarHBondContact O-N 2.81Å; L61-V209 HydrophobicContact CD1-CG1 3.93Å; L61-V209 HydrophobicContact CD2-CG1 3.72Å; L61-V209 HydrophobicContact CG-CG1 4.49Å |
| 62 | I | 84.9 | Confident | 84.5 | Confident | 20 Ų | 20 | 76.6 Ų | 76.6 | 10% | 0.103 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -58.2 | -44.4 | 174.8 | -75.8 | 178.4 | 0 | 0 | 0 | 110.5 | E44 Y58 E59 V64 I65 H66 | E44-I62 HydrophobicContact CG-CG1 4.28Å; Y58-I62 HydrophobicContact CD2-CD1 3.39Å; Y58-I62 HydrophobicContact CD2-CG1 3.94Å; Y58-I62 HydrophobicContact CE2-CD1 3.43Å; Y58-I62 VanDerWaalsContact CE2-CD1 3.43Å; Y58-I62 HydrophobicContact CE2-CG1 4.44Å; Y58-I62 PolarHBondContact O-N 3.38Å; E59-I62 PolarHBondContact O-N 2.92Å; I62-V64 VanDerWaalsContact C-N 3.31Å; I62-V64 PolarHBondContact O-N 3.39Å; I62-I65 PolarHBondContact O-N 3.39Å; I62-H66 VanDerWaalsContact CG2-CD2 3.47Å; I62-H66 WeakPolarHBondContact CG2-CD2 3.42Å; I62-H66 PolarHBondContact O-CD2 2.96Å; I62-H66 VanDerWaalsContact O-CD2 3.28Å; I62-H66 PolarHBondContact O-N 3.4Å |
| 63 | N | 87.3 | Confident | 85.1 | Confident | 92 Ų | 92 | 82 Ų | 82 | 49% | 0.492 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 176 | -74.4 | -39.9 | 0 | 0 | 0 | 112.2 | E59 Y60 L61 A67 | E59-N63 PolarHBondContact O-N 3.18Å; E59-N63 PolarHBondContact O-ND2 2.93Å; E59-N63 VanDerWaalsContact O-ND2 3.13Å; Y60-N63 PolarHBondContact O-N 2.9Å; L61-N63 VanDerWaalsContact C-N 3.3Å; L61-N63 PolarHBondContact O-N 2.92Å; N63-A67 WeakPolarHBondContact O-CB 3.39Å; N63-A67 PolarHBondContact O-N 2.97Å |
| 64 | V | 86.6 | Confident | 86.1 | Confident | 44 Ų | 44 | 75.3 Ų | 75.3 | 27% | 0.267 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -65.4 | -43.8 | 175.8 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | Y60 L61 I62 A67 F68 | Y60-V64 HydrophobicContact CD1-CG2 4.07Å; Y60-V64 HydrophobicContact CE1-CG2 3.72Å; Y60-V64 VanDerWaalsContact O-CG2 3.3Å; Y60-V64 WeakPolarHBondContact O-CG2 3.37Å; Y60-V64 PolarHBondContact O-N 3.43Å; L61-V64 WeakPolarHBondContact O-CB 3.36Å; L61-V64 PolarHBondContact O-N 2.85Å; L61-V64 VanDerWaalsContact O-N 3.14Å; I62-V64 VanDerWaalsContact C-N 3.31Å; I62-V64 PolarHBondContact O-N 3.39Å; V64-A67 WeakPolarHBondContact O-CB 3.33Å; V64-A67 PolarHBondContact O-N 2.99Å; V64-F68 HydrophobicContact CG1-CD2 3.66Å; V64-F68 HydrophobicContact CG1-CE2 3.29Å; V64-F68 HydrophobicContact CG1-CZ 4.36Å; V64-F68 WeakPolarHBondContact O-CD2 3.33Å; V64-F68 PolarHBondContact O-N 2.93Å |
| 65 | I | 89.1 | Confident | 86.8 | Confident | 9 Ų | 9 | 72.2 Ų | 72.2 | 5% | 0.046 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -59.7 | -48.7 | 176.9 | -74.7 | 171.8 | 0 | 0 | 0 | 110.6 | L40 E44 L61 I62 A67 F68 Q69 | L40-I65 HydrophobicContact CB-CG2 4.17Å; L40-I65 HydrophobicContact CD2-CG2 4.21Å; E44-I65 HydrophobicContact CB-CD1 4.07Å; L61-I65 HydrophobicContact CD1-CD1 4.39Å; L61-I65 HydrophobicContact CD1-CG1 4.47Å; L61-I65 HydrophobicContact CD2-CD1 4.39Å; L61-I65 HydrophobicContact CG-CD1 3.94Å; L61-I65 HydrophobicContact CG-CG1 4.41Å; L61-I65 WeakPolarHBondContact O-CB 3.35Å; L61-I65 WeakPolarHBondContact O-CG1 3.49Å; L61-I65 PolarHBondContact O-N 2.81Å; I62-I65 PolarHBondContact O-N 3.39Å; I65-A67 PolarHBondContact O-N 2.87Å; I65-F68 WeakPolarHBondContact O-CB 3.47Å; I65-F68 PolarHBondContact O-N 3.4Å; I65-Q69 WeakPolarHBondContact O-CG 3.37Å; I65-Q69 PolarHBondContact O-N 3.42Å |
| 66 | H | 90 | Very high | 87.5 | Confident | 73 Ų | 73 | 67.9 Ų | 67.9 | 34% | 0.338 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -62.4 | -41.6 | 175.9 | -78.3 | -57.2 | 0 | 0 | 0 | 112.2 | I62 F68 Q69 Y70 | I62-H66 VanDerWaalsContact CG2-CD2 3.47Å; I62-H66 WeakPolarHBondContact CG2-CD2 3.42Å; I62-H66 PolarHBondContact O-CD2 2.96Å; I62-H66 VanDerWaalsContact O-CD2 3.28Å; I62-H66 PolarHBondContact O-N 3.4Å; H66-F68 VanDerWaalsContact C-N 3.28Å; H66-F68 PolarHBondContact O-N 2.95Å; H66-Q69 PolarHBondContact ND1-OE1 3.35Å; H66-Q69 VanDerWaalsContact ND1-OE1 3.12Å; H66-Q69 WeakPolarHBondContact O-CB 3.15Å; H66-Q69 PolarHBondContact O-N 3.44Å; H66-Q69 VanDerWaalsContact O-N 3.13Å; H66-Y70 WeakPolarHBondContact O-CD2 3.38Å; H66-Y70 PolarHBondContact O-N 3.47Å |
| 67 | A | 91.4 | Very high | 88.3 | Confident | 54 Ų | 54 | 64.5 Ų | 64.5 | 45% | 0.446 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -57.6 | -43.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | N63 V64 I65 Y70 V71 | N63-A67 WeakPolarHBondContact O-CB 3.39Å; N63-A67 PolarHBondContact O-N 2.97Å; V64-A67 WeakPolarHBondContact O-CB 3.33Å; V64-A67 PolarHBondContact O-N 2.99Å; I65-A67 PolarHBondContact O-N 2.87Å; A67-Y70 PolarHBondContact O-N 2.94Å; A67-V71 WeakPolarHBondContact O-CG2 3.31Å; A67-V71 PolarHBondContact O-N 3.06Å |
| 68 | F | 90.8 | Very high | 89.1 | Confident | 120 Ų | 120 | 67.6 Ų | 67.6 | 53% | 0.526 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.4 | -41.1 | 174.2 | -76.3 | -60.9 | 0 | 0 | 0 | 112.9 | L40 V64 I65 H66 Y70 V71 I72 | L40-F68 HydrophobicContact CD2-CB 3.38Å; L40-F68 HydrophobicContact CD2-CD2 4.34Å; L40-F68 HydrophobicContact CD2-CG 4.2Å; V64-F68 HydrophobicContact CG1-CD2 3.66Å; V64-F68 HydrophobicContact CG1-CE2 3.29Å; V64-F68 HydrophobicContact CG1-CZ 4.36Å; V64-F68 WeakPolarHBondContact O-CD2 3.33Å; V64-F68 PolarHBondContact O-N 2.93Å; I65-F68 WeakPolarHBondContact O-CB 3.47Å; I65-F68 PolarHBondContact O-N 3.4Å; H66-F68 VanDerWaalsContact C-N 3.28Å; H66-F68 PolarHBondContact O-N 2.95Å; F68-Y70 PolarHBondContact O-N 3.27Å; F68-V71 PolarHBondContact O-N 2.92Å; F68-I72 WeakPolarHBondContact O-CB 3.42Å; F68-I72 VanDerWaalsContact O-CG1 3.3Å; F68-I72 WeakPolarHBondContact O-CG1 3.49Å; F68-I72 PolarHBondContact O-N 3.49Å |
| 69 | Q | 92.8 | Very high | 89.7 | Confident | 16 Ų | 16 | 66.6 Ų | 66.6 | 8% | 0.075 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.5 | -43.2 | 174.8 | -70.1 | 175.4 | -20.2 | 0 | 0 | 111.7 | H37 L40 T41 I65 H66 V71 I72 Y73 | H37-Q69 PolarHBondContact CE1-NE2 3.1Å; L40-Q69 HydrophobicContact CD2-CG 4.45Å; T41-Q69 PolarHBondContact OG1-NE2 3.28Å; T41-Q69 VanDerWaalsContact OG1-NE2 3.15Å; I65-Q69 WeakPolarHBondContact O-CG 3.37Å; I65-Q69 PolarHBondContact O-N 3.42Å; H66-Q69 PolarHBondContact ND1-OE1 3.35Å; H66-Q69 VanDerWaalsContact ND1-OE1 3.12Å; H66-Q69 WeakPolarHBondContact O-CB 3.15Å; H66-Q69 PolarHBondContact O-N 3.44Å; H66-Q69 VanDerWaalsContact O-N 3.13Å; Q69-V71 VanDerWaalsContact C-N 3.35Å; Q69-V71 PolarHBondContact O-N 2.86Å; Q69-I72 WeakPolarHBondContact O-CB 3.36Å; Q69-I72 PolarHBondContact O-N 3.4Å; Q69-Y73 HydrophobicContact CB-CE2 4.26Å; Q69-Y73 WeakPolarHBondContact O-CD2 3.41Å; Q69-Y73 PolarHBondContact O-N 2.99Å |
| 70 | Y | 92.8 | Very high | 90 | Very high | 177 Ų | 177 | 69.5 Ų | 69.5 | 69% | 0.694 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.9 | -42.9 | 174.4 | -81.6 | -67.9 | 0 | 0 | 0 | 112.3 | H66 A67 F68 I72 Y73 G74 | H66-Y70 WeakPolarHBondContact O-CD2 3.38Å; H66-Y70 PolarHBondContact O-N 3.47Å; A67-Y70 PolarHBondContact O-N 2.94Å; F68-Y70 PolarHBondContact O-N 3.27Å; Y70-I72 VanDerWaalsContact C-N 3.32Å; Y70-I72 PolarHBondContact O-N 3.39Å; Y70-Y73 PolarHBondContact O-N 3.35Å; Y70-G74 PolarHBondContact O-N 3.38Å |
| 71 | V | 93 | Very high | 90.4 | Very high | 91 Ų | 91 | 66 Ų | 66 | 55% | 0.552 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -61.5 | -41.7 | 174.7 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | A67 F68 Q69 Y73 G74 T75 | A67-V71 WeakPolarHBondContact O-CG2 3.31Å; A67-V71 PolarHBondContact O-N 3.06Å; F68-V71 PolarHBondContact O-N 2.92Å; Q69-V71 VanDerWaalsContact C-N 3.35Å; Q69-V71 PolarHBondContact O-N 2.86Å; V71-Y73 PolarHBondContact O-N 3.28Å; V71-G74 PolarHBondContact O-N 3.38Å; V71-T75 VanDerWaalsContact O-CB 3.24Å; V71-T75 WeakPolarHBondContact O-CB 3.48Å; V71-T75 PolarHBondContact O-N 3.07Å; V71-T75 PolarHBondContact O-OG1 2.79Å |
| 72 | I | 93.9 | Very high | 90.6 | Very high | 12 Ų | 12 | 65.2 Ų | 65.2 | 6% | 0.062 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.4 | -46.2 | 176.9 | -76.4 | 167.8 | 0 | 0 | 0 | 111.3 | C33 L40 F68 Q69 Y70 T75 A76 | C33-I72 HydrophobicContact CB-CG2 3.57Å; C33-I72 WeakPolarHBondContact O-CG2 3.42Å; C33-I72 PolarHBondContact SG-O 3.15Å; C33-I72 VanDerWaalsContact SG-O 3.42Å; L40-I72 HydrophobicContact CD1-CD1 4.46Å; F68-I72 WeakPolarHBondContact O-CB 3.42Å; F68-I72 VanDerWaalsContact O-CG1 3.3Å; F68-I72 WeakPolarHBondContact O-CG1 3.49Å; F68-I72 PolarHBondContact O-N 3.49Å; Q69-I72 WeakPolarHBondContact O-CB 3.36Å; Q69-I72 PolarHBondContact O-N 3.4Å; Y70-I72 VanDerWaalsContact C-N 3.32Å; Y70-I72 PolarHBondContact O-N 3.39Å; I72-T75 PolarHBondContact O-N 2.69Å; I72-A76 WeakPolarHBondContact O-CB 3.42Å; I72-A76 PolarHBondContact O-N 3Å |
| 73 | Y | 93.2 | Very high | 90.5 | Very high | 114 Ų | 114 | 64.3 Ų | 64.3 | 45% | 0.447 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -68.1 | -40.7 | 178.7 | -63.7 | -51.2 | 0 | 0 | 0 | 113.1 | H37 Q69 Y70 V71 T75 A76 S77 | H37-Y73 AromaticContact CE1-CZ 3.94Å; H37-Y73 PolarHBondContact CE1-OH 3.41Å; H37-Y73 AromaticContact ND1-CZ 3.77Å; H37-Y73 PolarHBondContact ND1-OH 2.95Å; H37-Y73 VanDerWaalsContact ND1-OH 3.11Å; H37-Y73 PolarHBondContact NE2-OH 2.95Å; Q69-Y73 HydrophobicContact CB-CE2 4.26Å; Q69-Y73 WeakPolarHBondContact O-CD2 3.41Å; Q69-Y73 PolarHBondContact O-N 2.99Å; Y70-Y73 PolarHBondContact O-N 3.35Å; V71-Y73 PolarHBondContact O-N 3.28Å; Y73-T75 VanDerWaalsContact C-N 3.3Å; Y73-T75 PolarHBondContact O-N 3.14Å; Y73-A76 PolarHBondContact O-N 3.29Å; Y73-S77 PolarHBondContact O-N 3.48Å; Y73-S77 VanDerWaalsContact O-N 3.1Å; Y73-S77 PolarHBondContact O-OG 2.85Å |
| 74 | G | 93.3 | Very high | 90.3 | Very high | 43 Ų | 43 | 62.3 Ų | 62.3 | 44% | 0.443 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y70 V71 S77 F78 | Y70-G74 PolarHBondContact O-N 3.38Å; V71-G74 PolarHBondContact O-N 3.38Å; G74-S77 PolarHBondContact O-N 2.71Å; G74-F78 WeakPolarHBondContact O-CB 3.34Å; G74-F78 PolarHBondContact O-N 2.95Å |
| 75 | T | 91.9 | Very high | 90.1 | Very high | 27 Ų | 27 | 63.6 Ų | 63.6 | 17% | 0.166 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 177.4 | -57.8 | 0 | 0 | 0 | 0 | 111.7 | V71 I72 Y73 S77 F78 F79 W163 | V71-T75 VanDerWaalsContact O-CB 3.24Å; V71-T75 WeakPolarHBondContact O-CB 3.48Å; V71-T75 PolarHBondContact O-N 3.07Å; V71-T75 PolarHBondContact O-OG1 2.79Å; I72-T75 PolarHBondContact O-N 2.69Å; Y73-T75 VanDerWaalsContact C-N 3.3Å; Y73-T75 PolarHBondContact O-N 3.14Å; T75-S77 VanDerWaalsContact C-N 3.3Å; T75-S77 PolarHBondContact O-N 2.96Å; T75-F78 PolarHBondContact O-N 3Å; T75-F79 HydrophobicContact CG2-CD2 3.59Å; T75-F79 HydrophobicContact CG2-CE2 3.75Å; T75-F79 WeakPolarHBondContact O-CB 3.17Å; T75-F79 WeakPolarHBondContact O-CD2 3.38Å; T75-F79 PolarHBondContact O-N 3.24Å; T75-W163 HydrophobicContact CG2-CH2 3.39Å; T75-W163 HydrophobicContact CG2-CZ3 3.38Å |
| 76 | A | 92.6 | Very high | 89.6 | Confident | 38 Ų | 38 | 63.3 Ų | 63.3 | 31% | 0.314 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -57 | -44.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | C33 I72 Y73 F80 | C33-A76 HydrophobicContact CB-CB 4.32Å; I72-A76 WeakPolarHBondContact O-CB 3.42Å; I72-A76 PolarHBondContact O-N 3Å; Y73-A76 PolarHBondContact O-N 3.29Å; A76-F80 WeakPolarHBondContact O-CB 3.02Å; A76-F80 PolarHBondContact O-N 3.09Å |
| 77 | S | 92.4 | Very high | 89 | Confident | 76 Ų | 76 | 62.5 Ų | 62.5 | 53% | 0.531 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -67 | -43.7 | 179 | -57.2 | 0 | 0 | 0 | 0 | 112.2 | Y73 G74 T75 F80 L81 | Y73-S77 PolarHBondContact O-N 3.48Å; Y73-S77 VanDerWaalsContact O-N 3.1Å; Y73-S77 PolarHBondContact O-OG 2.85Å; G74-S77 PolarHBondContact O-N 2.71Å; T75-S77 VanDerWaalsContact C-N 3.3Å; T75-S77 PolarHBondContact O-N 2.96Å; S77-F80 PolarHBondContact O-N 3.27Å; S77-L81 PolarHBondContact O-N 3.36Å |
| 78 | F | 92.1 | Very high | 88.3 | Confident | 94 Ų | 94 | 61.9 Ų | 61.9 | 41% | 0.412 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.4 | -47.5 | 178.2 | 175.4 | -92.5 | 0 | 0 | 0 | 112 | G74 T75 F80 L81 Y82 L159 | G74-F78 WeakPolarHBondContact O-CB 3.34Å; G74-F78 PolarHBondContact O-N 2.95Å; T75-F78 PolarHBondContact O-N 3Å; F78-F80 VanDerWaalsContact C-N 3.27Å; F78-F80 PolarHBondContact O-N 3.48Å; F78-L81 PolarHBondContact O-N 3.38Å; F78-Y82 WeakPolarHBondContact O-CB 3.45Å; F78-Y82 PolarHBondContact O-N 3.21Å; F78-L159 HydrophobicContact CD1-CD2 4.36Å; F78-L159 HydrophobicContact CE1-CD1 3.71Å; F78-L159 HydrophobicContact CE1-CD2 3.39Å; F78-L159 HydrophobicContact CE1-CG 4.17Å; F78-L159 HydrophobicContact CZ-CD1 4Å; F78-L159 HydrophobicContact CZ-CD2 3.84Å; F78-L159 HydrophobicContact CZ-CG 4.46Å |
| 79 | F | 90.6 | Very high | 87.4 | Confident | 10 Ų | 10 | 57 Ų | 57 | 4% | 0.044 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.7 | -27.8 | 179.1 | -89.3 | -88.6 | 0 | 0 | 0 | 112.7 | V29 T75 Y82 G83 W163 T250 L254 | V29-F79 HydrophobicContact CB-CB 4.39Å; V29-F79 HydrophobicContact CG1-CB 3.91Å; V29-F79 HydrophobicContact CG1-CD2 4.43Å; V29-F79 HydrophobicContact CG1-CG 4.21Å; V29-F79 HydrophobicContact CG2-CB 4Å; V29-F79 HydrophobicContact CG2-CD1 3.65Å; V29-F79 HydrophobicContact CG2-CD2 4.2Å; V29-F79 HydrophobicContact CG2-CE1 4.11Å; V29-F79 HydrophobicContact CG2-CG 3.68Å; T75-F79 HydrophobicContact CG2-CD2 3.59Å; T75-F79 HydrophobicContact CG2-CE2 3.75Å; T75-F79 WeakPolarHBondContact O-CB 3.17Å; T75-F79 WeakPolarHBondContact O-CD2 3.38Å; T75-F79 PolarHBondContact O-N 3.24Å; F79-Y82 HydrophobicContact CD1-CD1 4.42Å; F79-G83 PolarHBondContact O-N 3.19Å; F79-W163 HydrophobicContact CD2-CH2 4.46Å; F79-W163 HydrophobicContact CD2-CZ3 4.27Å; F79-W163 AromaticContact CE2-CE3 3.72Å; F79-W163 HydrophobicContact CE2-CE3 3.72Å; F79-W163 AromaticContact CE2-CH2 3.9Å; F79-W163 HydrophobicContact CE2-CH2 3.9Å; F79-W163 AromaticContact CE2-CZ3 3.37Å; F79-W163 HydrophobicContact CE2-CZ3 3.37Å; F79-W163 HydrophobicContact CZ-CD2 4.13Å; F79-W163 AromaticContact CZ-CE3 3.68Å; F79-W163 HydrophobicContact CZ-CE3 3.68Å; F79-W163 HydrophobicContact CZ-CH2 4.33Å; F79-W163 AromaticContact CZ-CZ3 3.81Å; F79-W163 HydrophobicContact CZ-CZ3 3.81Å; F79-T250 HydrophobicContact CE1-CG2 4.06Å; F79-T250 HydrophobicContact CZ-CG2 4.43Å; F79-L254 HydrophobicContact CE1-CD1 4.25Å; F79-L254 HydrophobicContact CE1-CD2 4.34Å; F79-L254 HydrophobicContact CZ-CD1 4.36Å |
| 80 | F | 88.1 | Confident | 86.4 | Confident | 136 Ų | 136 | 56.5 Ų | 56.5 | 60% | 0.596 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -63.8 | -48.1 | 172.9 | -177.8 | -92.7 | 0 | 0 | 0 | 112 | F26 A76 S77 F78 G83 A84 | F26-F80 HydrophobicContact CE1-CB 4.34Å; F26-F80 AromaticContact CE1-CD2 3.68Å; F26-F80 HydrophobicContact CE1-CD2 3.68Å; F26-F80 HydrophobicContact CE1-CE2 4.33Å; F26-F80 HydrophobicContact CE1-CG 4.27Å; F26-F80 HydrophobicContact CZ-CD2 4.5Å; A76-F80 WeakPolarHBondContact O-CB 3.02Å; A76-F80 PolarHBondContact O-N 3.09Å; S77-F80 PolarHBondContact O-N 3.27Å; F78-F80 VanDerWaalsContact C-N 3.27Å; F78-F80 PolarHBondContact O-N 3.48Å; F80-G83 PolarHBondContact O-N 2.92Å; F80-A84 PolarHBondContact O-N 3.13Å; F80-A84 VanDerWaalsContact O-N 3.15Å |
| 81 | L | 88.7 | Confident | 85.3 | Confident | 115 Ų | 115 | 53.6 Ų | 53.6 | 60% | 0.602 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -64.9 | -44.9 | 175.4 | -66.3 | 174 | 0 | 0 | 0 | 111.3 | S77 F78 G83 A84 L85 | S77-L81 PolarHBondContact O-N 3.36Å; F78-L81 PolarHBondContact O-N 3.38Å; L81-G83 VanDerWaalsContact C-N 3.34Å; L81-G83 PolarHBondContact O-N 3.31Å; L81-A84 WeakPolarHBondContact O-CB 3.45Å; L81-A84 PolarHBondContact O-N 3.4Å; L81-L85 WeakPolarHBondContact O-CG 3.29Å; L81-L85 PolarHBondContact O-N 2.97Å |
| 82 | Y | 86.4 | Confident | 84 | Confident | 8 Ų | 8 | 56.2 Ų | 56.2 | 3% | 0.031 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 178 | -176.7 | -109.5 | 0 | 0 | 0 | 111.8 | F78 F79 A84 L85 L86 F152 I155 T156 L159 L254 | F78-Y82 WeakPolarHBondContact O-CB 3.45Å; F78-Y82 PolarHBondContact O-N 3.21Å; F79-Y82 HydrophobicContact CD1-CD1 4.42Å; Y82-A84 VanDerWaalsContact C-N 3.33Å; Y82-A84 PolarHBondContact O-N 3.26Å; Y82-L85 CarbonylContact O-C 3.46Å; Y82-L85 WeakPolarHBondContact O-CA 3.35Å; Y82-L85 WeakPolarHBondContact O-CB 3.08Å; Y82-L85 PolarHBondContact O-N 3.14Å; Y82-L86 HydrophobicContact CD1-CD1 4.05Å; Y82-L86 HydrophobicContact CD1-CD2 4.41Å; Y82-L86 HydrophobicContact CD1-CG 4.06Å; Y82-L86 HydrophobicContact CE1-CD1 3.68Å; Y82-L86 HydrophobicContact CE1-CD2 3.74Å; Y82-L86 HydrophobicContact CE1-CG 3.79Å; Y82-L86 HydrophobicContact CE2-CD2 4.14Å; Y82-L86 WeakPolarHBondContact O-CG 3.46Å; Y82-L86 PolarHBondContact O-N 3.49Å; Y82-F152 HydrophobicContact CE2-CE2 4.32Å; Y82-I155 HydrophobicContact CE2-CG2 4.31Å; Y82-T156 WeakPolarHBondContact OH-CA 3.49Å; Y82-T156 WeakPolarHBondContact OH-CB 3.26Å; Y82-T156 WeakPolarHBondContact OH-CG2 3.49Å; Y82-T156 PolarHBondContact OH-OG1 3.07Å; Y82-L159 HydrophobicContact CD1-CD1 4.11Å; Y82-L159 HydrophobicContact CD2-CD1 3.97Å; Y82-L159 HydrophobicContact CE1-CD1 3.86Å; Y82-L159 HydrophobicContact CE2-CD1 3.72Å; Y82-L159 HydrophobicContact CG-CD1 4.16Å; Y82-L254 HydrophobicContact CE1-CD2 4.06Å |
| 83 | G | 84.3 | Confident | 82.5 | Confident | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.01 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.3 | -37.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | F79 F80 L81 L85 L86 L87 | F79-G83 PolarHBondContact O-N 3.19Å; F80-G83 PolarHBondContact O-N 2.92Å; L81-G83 VanDerWaalsContact C-N 3.34Å; L81-G83 PolarHBondContact O-N 3.31Å; G83-L85 VanDerWaalsContact C-N 3.32Å; G83-L85 PolarHBondContact O-N 3.04Å; G83-L86 PolarHBondContact O-N 3.32Å; G83-L87 WeakPolarHBondContact O-CG 3.47Å; G83-L87 PolarHBondContact O-N 3.35Å |
| 84 | A | 82.8 | Confident | 80.9 | Confident | 51 Ų | 51 | 54.2 Ų | 54.2 | 42% | 0.421 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.7 | -37.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F80 L81 Y82 L87 A88 | F80-A84 PolarHBondContact O-N 3.13Å; F80-A84 VanDerWaalsContact O-N 3.15Å; L81-A84 WeakPolarHBondContact O-CB 3.45Å; L81-A84 PolarHBondContact O-N 3.4Å; Y82-A84 VanDerWaalsContact C-N 3.33Å; Y82-A84 PolarHBondContact O-N 3.26Å; A84-L87 PolarHBondContact O-N 2.92Å; A84-A88 PolarHBondContact O-N 3.39Å |
| 85 | L | 82 | Confident | 79.3 | Confident | 71 Ų | 71 | 53.9 Ų | 53.9 | 37% | 0.372 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 173.2 | -63.5 | 173.1 | 0 | 0 | 0 | 111.7 | L81 Y82 G83 L87 A88 E89 L142 | L81-L85 WeakPolarHBondContact O-CG 3.29Å; L81-L85 PolarHBondContact O-N 2.97Å; Y82-L85 CarbonylContact O-C 3.46Å; Y82-L85 WeakPolarHBondContact O-CA 3.35Å; Y82-L85 WeakPolarHBondContact O-CB 3.08Å; Y82-L85 PolarHBondContact O-N 3.14Å; G83-L85 VanDerWaalsContact C-N 3.32Å; G83-L85 PolarHBondContact O-N 3.04Å; L85-L87 VanDerWaalsContact C-N 3.3Å; L85-L87 PolarHBondContact O-N 3.39Å; L85-A88 PolarHBondContact O-N 2.84Å; L85-E89 WeakPolarHBondContact O-CB 3.45Å; L85-E89 PolarHBondContact O-N 3.47Å; L85-L142 HydrophobicContact CD2-CD2 3.32Å |
| 86 | L | 78.6 | Confident | 77.5 | Confident | 3 Ų | 3 | 54.6 Ų | 54.6 | 2% | 0.016 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.2 | -41.1 | 175.3 | -65.6 | -170.2 | 0 | 0 | 0 | 111.8 | T22 Y82 G83 G90 F152 F257 | T22-L86 HydrophobicContact CG2-CB 4.37Å; Y82-L86 HydrophobicContact CD1-CD1 4.05Å; Y82-L86 HydrophobicContact CD1-CD2 4.41Å; Y82-L86 HydrophobicContact CD1-CG 4.06Å; Y82-L86 HydrophobicContact CE1-CD1 3.68Å; Y82-L86 HydrophobicContact CE1-CD2 3.74Å; Y82-L86 HydrophobicContact CE1-CG 3.79Å; Y82-L86 HydrophobicContact CE2-CD2 4.14Å; Y82-L86 WeakPolarHBondContact O-CG 3.46Å; Y82-L86 PolarHBondContact O-N 3.49Å; G83-L86 PolarHBondContact O-N 3.32Å; L86-G90 PolarHBondContact O-N 3.24Å; L86-F152 HydrophobicContact CD2-CE2 4.01Å; L86-F152 HydrophobicContact CD2-CZ 3.48Å; L86-F152 VanDerWaalsContact CD2-CZ 3.48Å; L86-F257 HydrophobicContact CD2-CD1 4.11Å; L86-F257 HydrophobicContact CD2-CD2 4.25Å; L86-F257 HydrophobicContact CD2-CE1 3.62Å; L86-F257 HydrophobicContact CD2-CE2 3.79Å; L86-F257 HydrophobicContact CD2-CG 4.4Å; L86-F257 HydrophobicContact CD2-CZ 3.46Å; L86-F257 VanDerWaalsContact CD2-CZ 3.46Å |
| 87 | L | 77.2 | Confident | 75.5 | Confident | 56 Ų | 56 | 55.7 Ų | 55.7 | 29% | 0.293 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.1 | -46.9 | 175.8 | -69.7 | 175.7 | 0 | 0 | 0 | 111.4 | L19 T22 G83 A84 L85 E89 G90 F91 | L19-L87 HydrophobicContact CD2-CD2 3.52Å; T22-L87 HydrophobicContact CG2-CD1 4.38Å; T22-L87 HydrophobicContact CG2-CD2 3.74Å; T22-L87 HydrophobicContact CG2-CG 3.74Å; G83-L87 WeakPolarHBondContact O-CG 3.47Å; G83-L87 PolarHBondContact O-N 3.35Å; A84-L87 PolarHBondContact O-N 2.92Å; L85-L87 VanDerWaalsContact C-N 3.3Å; L85-L87 PolarHBondContact O-N 3.39Å; L87-E89 VanDerWaalsContact C-N 3.33Å; L87-E89 PolarHBondContact O-N 3.42Å; L87-G90 PolarHBondContact O-N 3.07Å; L87-F91 HydrophobicContact CB-CE2 4.49Å; L87-F91 WeakPolarHBondContact O-CD2 3.3Å; L87-F91 PolarHBondContact O-N 2.93Å |
| 88 | A | 76.2 | Confident | 73.6 | Confident | 40 Ų | 40 | 56.3 Ų | 56.3 | 33% | 0.331 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -59.4 | -43.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A84 L85 F91 Y92 | A84-A88 PolarHBondContact O-N 3.39Å; L85-A88 PolarHBondContact O-N 2.84Å; A88-F91 PolarHBondContact O-N 3Å; A88-Y92 WeakPolarHBondContact O-CB 3.49Å; A88-Y92 PolarHBondContact O-N 3.46Å |
| 89 | E | 73.4 | Confident | 71.7 | Confident | 19 Ų | 19 | 60 Ų | 60 | 9% | 0.089 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.1 | -43.3 | 174.6 | -81.4 | -78.2 | -165 | 0 | 0 | 112.8 | L85 L87 F91 Y92 T93 L146 F152 | L85-E89 WeakPolarHBondContact O-CB 3.45Å; L85-E89 PolarHBondContact O-N 3.47Å; L87-E89 VanDerWaalsContact C-N 3.33Å; L87-E89 PolarHBondContact O-N 3.42Å; E89-F91 VanDerWaalsContact C-N 3.31Å; E89-F91 PolarHBondContact O-N 2.95Å; E89-Y92 PolarHBondContact O-N 2.9Å; E89-T93 WeakPolarHBondContact O-CB 3.24Å; E89-T93 WeakPolarHBondContact O-CG2 3.39Å; E89-T93 PolarHBondContact O-N 3.34Å; E89-T93 PolarHBondContact O-OG1 3.26Å; E89-L146 HydrophobicContact CG-CD2 3.69Å; E89-L146 HydrophobicContact CG-CG 4.17Å; E89-L146 WeakPolarHBondContact OE1-CD2 3.32Å; E89-L146 WeakPolarHBondContact OE1-CG 3.49Å; E89-L146 WeakPolarHBondContact OE2-CD2 3.43Å; E89-F152 HydrophobicContact CB-CZ 4.23Å; E89-F152 HydrophobicContact CG-CE1 4.07Å; E89-F152 HydrophobicContact CG-CE2 4.06Å; E89-F152 HydrophobicContact CG-CZ 3.76Å |
| 90 | G | 71.4 | Confident | 70 | Confident | 4 Ų | 4 | 64.1 Ų | 64.1 | 4% | 0.041 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -56 | -46.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | P15 L86 L87 T93 T94 | P15-G90 WeakPolarHBondContact CG-O 3.49Å; L86-G90 PolarHBondContact O-N 3.24Å; L87-G90 PolarHBondContact O-N 3.07Å; G90-T93 PolarHBondContact O-OG1 3.39Å; G90-T94 VanDerWaalsContact O-CB 3.31Å; G90-T94 WeakPolarHBondContact O-CB 3.33Å; G90-T94 PolarHBondContact O-N 3.36Å; G90-T94 VanDerWaalsContact O-N 3.16Å; G90-T94 PolarHBondContact O-OG1 3.43Å |
| 91 | F | 69.5 | Low | 68.1 | Low | 116 Ų | 116 | 65 Ų | 65 | 51% | 0.509 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -67.6 | -40.4 | 176.9 | -69.4 | -62.2 | 0 | 0 | 0 | 112.7 | L19 L87 A88 E89 G95 | L19-F91 HydrophobicContact CD2-CZ 4.34Å; L87-F91 HydrophobicContact CB-CE2 4.49Å; L87-F91 WeakPolarHBondContact O-CD2 3.3Å; L87-F91 PolarHBondContact O-N 2.93Å; A88-F91 PolarHBondContact O-N 3Å; E89-F91 VanDerWaalsContact C-N 3.31Å; E89-F91 PolarHBondContact O-N 2.95Å; F91-G95 PolarHBondContact O-N 3.24Å |
| 92 | Y | 65.5 | Low | 65.8 | Low | 147 Ų | 147 | 60.8 Ų | 60.8 | 58% | 0.576 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -65.6 | -49.4 | -179.8 | -172.5 | -98.1 | 0 | 0 | 0 | 112.5 | A88 E89 T94 G95 A96 L146 | A88-Y92 WeakPolarHBondContact O-CB 3.49Å; A88-Y92 PolarHBondContact O-N 3.46Å; E89-Y92 PolarHBondContact O-N 2.9Å; Y92-T94 PolarHBondContact O-N 2.87Å; Y92-G95 PolarHBondContact O-N 3.02Å; Y92-G95 VanDerWaalsContact O-N 3.17Å; Y92-A96 PolarHBondContact O-N 3.47Å; Y92-L146 HydrophobicContact CD1-CD2 4.45Å; Y92-L146 HydrophobicContact CG-CD2 4.42Å |
| 93 | T | 62 | Low | 63.9 | Low | 47 Ų | 47 | 68.6 Ų | 68.6 | 29% | 0.288 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 178.3 | 53 | 0 | 0 | 0 | 0 | 112.1 | E89 G90 G95 A96 V97 | E89-T93 WeakPolarHBondContact O-CB 3.24Å; E89-T93 WeakPolarHBondContact O-CG2 3.39Å; E89-T93 PolarHBondContact O-N 3.34Å; E89-T93 PolarHBondContact O-OG1 3.26Å; G90-T93 PolarHBondContact O-OG1 3.39Å; T93-G95 VanDerWaalsContact C-N 3.32Å; T93-G95 PolarHBondContact O-N 3.46Å; T93-A96 PolarHBondContact O-N 3.37Å; T93-V97 WeakPolarHBondContact O-CG2 3.4Å; T93-V97 PolarHBondContact O-N 3.13Å |
| 94 | T | 60.4 | Low | 61.8 | Low | 37 Ų | 37 | 74.8 Ų | 74.8 | 23% | 0.227 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.1 | -37.5 | 175.5 | -53.4 | 0 | 0 | 0 | 0 | 111.4 | G13 P15 G90 Y92 R98 | G13-T94 WeakPolarHBondContact O-CG2 3.47Å; P15-T94 WeakPolarHBondContact CB-OG1 3.28Å; P15-T94 WeakPolarHBondContact CD-OG1 3.04Å; P15-T94 WeakPolarHBondContact CG-OG1 3.48Å; G90-T94 VanDerWaalsContact O-CB 3.31Å; G90-T94 WeakPolarHBondContact O-CB 3.33Å; G90-T94 PolarHBondContact O-N 3.36Å; G90-T94 VanDerWaalsContact O-N 3.16Å; G90-T94 PolarHBondContact O-OG1 3.43Å; Y92-T94 PolarHBondContact O-N 2.87Å; T94-R98 VanDerWaalsContact O-CB 3.29Å; T94-R98 WeakPolarHBondContact O-CB 3.37Å; T94-R98 PolarHBondContact O-N 3.18Å; T94-R98 VanDerWaalsContact O-N 3.09Å |
| 95 | G | 58.8 | Low | 59.8 | Low | 36 Ų | 36 | 81.5 Ų | 81.5 | 37% | 0.371 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.4 | -44.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | F91 Y92 T93 R98 Q99 | F91-G95 PolarHBondContact O-N 3.24Å; Y92-G95 PolarHBondContact O-N 3.02Å; Y92-G95 VanDerWaalsContact O-N 3.17Å; T93-G95 VanDerWaalsContact C-N 3.32Å; T93-G95 PolarHBondContact O-N 3.46Å; G95-R98 PolarHBondContact O-N 3.49Å; G95-Q99 PolarHBondContact O-N 2.91Å |
| 96 | A | 55.3 | Low | 57.7 | Low | 42 Ų | 42 | 82.1 Ų | 82.1 | 35% | 0.347 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.9 | -44.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y92 T93 R98 Q99 I100 | Y92-A96 PolarHBondContact O-N 3.47Å; T93-A96 PolarHBondContact O-N 3.37Å; A96-R98 VanDerWaalsContact C-N 3.26Å; A96-R98 PolarHBondContact O-N 3.4Å; A96-Q99 WeakPolarHBondContact O-CB 3.4Å; A96-Q99 PolarHBondContact O-N 2.91Å; A96-Q99 VanDerWaalsContact O-N 3.15Å; A96-I100 WeakPolarHBondContact O-CG1 3.49Å; A96-I100 PolarHBondContact O-N 2.94Å |
| 97 | V | 49.9 | Very low | 55.9 | Low | 61 Ų | 61 | 87.8 Ų | 87.8 | 37% | 0.37 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.5 | -36.6 | 175.6 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | T93 Q99 I100 F101 | T93-V97 WeakPolarHBondContact O-CG2 3.4Å; T93-V97 PolarHBondContact O-N 3.13Å; V97-Q99 VanDerWaalsContact C-N 3.29Å; V97-Q99 PolarHBondContact O-N 3.12Å; V97-I100 PolarHBondContact O-N 2.87Å; V97-F101 HydrophobicContact CG1-CD2 4.05Å; V97-F101 PolarHBondContact O-N 3.21Å |
| 98 | R | 53.3 | Low | 54.3 | Low | 89 Ų | 89 | 92.6 Ų | 92.6 | 34% | 0.336 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.9 | -30.5 | 177.3 | -157.4 | 173.6 | -176.6 | 176.2 | -2.6 | 112.9 | T94 G95 A96 I100 Y104 | T94-R98 VanDerWaalsContact O-CB 3.29Å; T94-R98 WeakPolarHBondContact O-CB 3.37Å; T94-R98 PolarHBondContact O-N 3.18Å; T94-R98 VanDerWaalsContact O-N 3.09Å; G95-R98 PolarHBondContact O-N 3.49Å; A96-R98 VanDerWaalsContact C-N 3.26Å; A96-R98 PolarHBondContact O-N 3.4Å; R98-I100 VanDerWaalsContact C-N 3.34Å; R98-Y104 HydrophobicContact CG-CE1 3.91Å; R98-Y104 PolarHBondContact NE-OH 2.66Å; R98-Y104 VanDerWaalsContact NE-OH 3.09Å; R98-Y104 PolarHBondContact NH2-OH 3.42Å |
| 99 | Q | 52.1 | Low | 52.7 | Low | 171 Ų | 171 | 95.6 Ų | 95.6 | 80% | 0.799 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -72 | -28.6 | 171.5 | -66.9 | -73.6 | -72.7 | 0 | 0 | 112.4 | G95 A96 V97 | G95-Q99 PolarHBondContact O-N 2.91Å; A96-Q99 WeakPolarHBondContact O-CB 3.4Å; A96-Q99 PolarHBondContact O-N 2.91Å; A96-Q99 VanDerWaalsContact O-N 3.15Å; V97-Q99 VanDerWaalsContact C-N 3.29Å; V97-Q99 PolarHBondContact O-N 3.12Å |
| 100 | I | 53.3 | Low | 51 | Low | 96 Ų | 96 | 98.1 Ų | 98.1 | 49% | 0.492 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -88.8 | -38.9 | -175.4 | -61.5 | 165.6 | 0 | 0 | 0 | 112.4 | A96 V97 R98 L268 M271 | A96-I100 WeakPolarHBondContact O-CG1 3.49Å; A96-I100 PolarHBondContact O-N 2.94Å; V97-I100 PolarHBondContact O-N 2.87Å; R98-I100 VanDerWaalsContact C-N 3.34Å; I100-L268 HydrophobicContact CD1-CD2 4.17Å; I100-M271 HydrophobicContact CG2-CE 4.15Å; I100-M271 HydrophobicContact CG2-SD 4.42Å |
| 101 | F | 48.8 | Very low | 49.3 | Very low | 155 Ų | 155 | 108 Ų | 108 | 68% | 0.68 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -91.8 | -8 | -170.8 | -103.5 | -89.3 | 0 | 0 | 0 | 115.7 | V97 M271 | V97-F101 HydrophobicContact CG1-CD2 4.05Å; V97-F101 PolarHBondContact O-N 3.21Å; F101-M271 HydrophobicContact CE2-SD 4.02Å |
| 102 | G | 41.2 | Very low | 47.6 | Very low | 27 Ų | 27 | 106 Ų | 106 | 28% | 0.278 | 58% | 0.581 | S | S | . | * | trans | 171.1 | 118.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y104 | G102-Y104 PolarHBondContact O-N 3.01Š| ||
| 103 | D | 45.2 | Very low | 46.3 | Very low | 172 Ų | 172 | 107.4 Ų | 107.4 | 92% | 0.92 | 60% | 0.598 | S | S | * | * | trans | -56.8 | 53.4 | 142.7 | -143.8 | -1.1 | 0 | 0 | 0 | 110.3 | K105 | D103-K105 PolarHBondContact O-N 2.92Š| ||
| 104 | Y | 41.7 | Very low | 45.1 | Very low | 130 Ų | 130 | 110.5 Ų | 110.5 | 51% | 0.51 | 62% | 0.622 | S | S | . | * | trans | -81.8 | 69.8 | 175.3 | 87.6 | -84.2 | 0 | 0 | 0 | 107.2 | R98 G102 T106 | R98-Y104 HydrophobicContact CG-CE1 3.91Å; R98-Y104 PolarHBondContact NE-OH 2.66Å; R98-Y104 VanDerWaalsContact NE-OH 3.09Å; R98-Y104 PolarHBondContact NH2-OH 3.42Å; G102-Y104 PolarHBondContact O-N 3.01Å; Y104-T106 VanDerWaalsContact C-N 3.32Å; Y104-T106 HydrophobicContact CD2-CG2 4.41Å; Y104-T106 HydrophobicContact CE2-CG2 3.85Å; Y104-T106 PolarHBondContact O-N 3.33Å | ||
| 105 | K | 39.6 | Very low | 43.6 | Very low | 193 Ų | 193 | 113.4 Ų | 113.4 | 84% | 0.839 | 65% | 0.649 | S | S | * | * | S | Bend | trans | 33.4 | 57.5 | 156.1 | -144 | -175.6 | -168.4 | -177.8 | 0 | 115 | D103 | D103-K105 PolarHBondContact O-N 2.92Š|
| 106 | T | 38.8 | Very low | 42.2 | Very low | 84 Ų | 84 | 117.3 Ų | 117.3 | 52% | 0.515 | 67% | 0.666 | S | S | . | * | trans | -113 | 45.8 | 163.5 | 59.6 | 0 | 0 | 0 | 0 | 110.4 | Y104 | Y104-T106 VanDerWaalsContact C-N 3.32Å; Y104-T106 HydrophobicContact CD2-CG2 4.41Å; Y104-T106 HydrophobicContact CE2-CG2 3.85Å; Y104-T106 PolarHBondContact O-N 3.33Å | ||
| 107 | T | 40.7 | Very low | 41 | Very low | 122 Ų | 122 | 122.1 Ų | 122.1 | 75% | 0.748 | 69% | 0.691 | S | S | * | * | trans | -64.5 | 130.8 | 149.6 | -44.7 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 108 | I | 43.5 | Very low | 40.2 | Very low | 156 Ų | 156 | 125.7 Ų | 125.7 | 80% | 0.8 | 71% | 0.713 | S | S | * | * | S | Bend | trans | 93.2 | 65.5 | 173.2 | -42.5 | 166 | 0 | 0 | 0 | 115.8 | ||
| 109 | C | 41.6 | Very low | 39 | Very low | 103 Ų | 103 | 124.5 Ų | 124.5 | 70% | 0.696 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -140.2 | 22.9 | 135.8 | -142 | 0 | 0 | 0 | 0 | 109.5 | C6 | C6-C109 WeakPolarHBondContact CB-SG 3.48Å; C6-C109 WeakPolarHBondContact SG-CB 3.29Å; C6-C109 CovalentContact SG-SG 2.13Å; C6-C109 PolarHBondContact SG-SG 2.93Å |
| 110 | G | 39 | Very low | 37.9 | Very low | 72 Ų | 72 | 120 Ų | 120 | 74% | 0.742 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -130.5 | -10 | -174.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 111 | K | 35.2 | Very low | 36.5 | Very low | 213 Ų | 213 | 125.2 Ų | 125.2 | 93% | 0.926 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -112.8 | 52.2 | 173.5 | -68.1 | -171.9 | 84.2 | 158.2 | 0 | 111.7 | ||
| 112 | G | 34.8 | Very low | 35.6 | Very low | 72 Ų | 72 | 128.1 Ų | 128.1 | 74% | 0.742 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -131.9 | 12.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 113 | L | 36.5 | Very low | 35 | Very low | 178 Ų | 178 | 130.2 Ų | 130.2 | 93% | 0.932 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -128.8 | 18.7 | 176.9 | -99.8 | 143.3 | 0 | 0 | 0 | 113.5 | ||
| 114 | S | 38 | Very low | 34.1 | Very low | 112 Ų | 112 | 134.2 Ų | 134.2 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -143.7 | 126.8 | 166.2 | -98.7 | 0 | 0 | 0 | 0 | 110.6 | ||
| 115 | A | 29.1 | Very low | 33.4 | Very low | 98 Ų | 98 | 131.6 Ų | 131.6 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | S | Bend | trans | 74.3 | 114.2 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 116 | T | 29.4 | Very low | 33.2 | Very low | 118 Ų | 118 | 128.1 Ų | 128.1 | 72% | 0.724 | 80% | 0.799 | S | S | * | * | cis | -160.5 | 121.3 | 34.4 | 39 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 117 | V | 29 | Very low | 32.7 | Very low | 142 Ų | 142 | 136 Ų | 136 | 86% | 0.861 | 82% | 0.82 | S | S | * | * | trans | -114.5 | 93.8 | 148.2 | 171.3 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 118 | T | 33.8 | Very low | 32.2 | Very low | 137 Ų | 137 | 133.5 Ų | 133.5 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | trans | -83.5 | 109.7 | 160.3 | 44 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 119 | G | 28.2 | Very low | 31.6 | Very low | 63 Ų | 63 | 134.8 Ų | 134.8 | 65% | 0.649 | 82% | 0.821 | S | S | * | * | trans | 163.4 | 87.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 120 | G | 28.6 | Very low | 31 | Very low | 78 Ų | 78 | 138.5 Ų | 138.5 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -66.8 | 146.8 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 121 | Q | 23.9 | Very low | 30.8 | Very low | 205 Ų | 205 | 143.3 Ų | 143.3 | 96% | 0.958 | 83% | 0.831 | S | S | * | * | trans | -158.7 | 152.4 | 135.4 | -109.7 | -175.2 | -8.8 | 0 | 0 | 110.9 | ||||
| 122 | K | 30.3 | Very low | 30.7 | Very low | 215 Ų | 215 | 136.2 Ų | 136.2 | 94% | 0.935 | 81% | 0.812 | S | S | * | * | trans | -84.2 | 133.8 | -161.9 | -176.1 | 178.5 | -175.3 | 176.8 | 0 | 111.5 | ||||
| 123 | G | 27.4 | Very low | 30.7 | Very low | 71 Ų | 71 | 138.4 Ų | 138.4 | 73% | 0.732 | 80% | 0.802 | S | S | * | * | trans | 147.3 | 124.8 | 152.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 124 | R | 26.3 | Very low | 30.8 | Very low | 256 Ų | 256 | 133.5 Ų | 133.5 | 97% | 0.966 | 78% | 0.783 | S | S | * | * | trans | 73.1 | 100.5 | 149.3 | -85.6 | 175.5 | 166.6 | 157.4 | -3.9 | 121 | ||||
| 125 | G | 26.8 | Very low | 30.8 | Very low | 76 Ų | 76 | 134.3 Ų | 134.3 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | 71.4 | 95.9 | 104 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 126 | S | 36 | Very low | 31.3 | Very low | 120 Ų | 120 | 136.1 Ų | 136.1 | 84% | 0.839 | 77% | 0.769 | S | S | * | * | trans | 42.2 | 116.9 | 134.4 | -155.7 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 127 | R | 28.8 | Very low | 31.8 | Very low | 249 Ų | 249 | 138.4 Ų | 138.4 | 94% | 0.94 | 77% | 0.765 | S | S | * | * | trans | 172.1 | 108.6 | 130.4 | -95.9 | 165.9 | -176 | -179.5 | 2 | 109.7 | ||||
| 128 | G | 30 | Very low | 32.4 | Very low | 70 Ų | 70 | 135.3 Ų | 135.3 | 72% | 0.722 | 75% | 0.746 | S | S | * | * | trans | 169.5 | -7.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | H130 | G128-H130 PolarHBondContact O-N 3.18Š| ||
| 129 | Q | 29.8 | Very low | 33 | Very low | 182 Ų | 182 | 132.8 Ų | 132.8 | 85% | 0.85 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -2.7 | -170.6 | -153.8 | 164.1 | -11.8 | 0 | 0 | 114.8 | ||
| 130 | H | 30 | Very low | 33.6 | Very low | 182 Ų | 182 | 136.7 Ų | 136.7 | 84% | 0.843 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -17 | -173.5 | -130.8 | -86.1 | 0 | 0 | 0 | 114.8 | G128 | G128-H130 PolarHBondContact O-N 3.18Š|
| 131 | Q | 33.7 | Very low | 34.3 | Very low | 173 Ų | 173 | 137 Ų | 137 | 81% | 0.808 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -92.7 | -24.6 | -175 | -160.3 | 157.5 | -13.9 | 0 | 0 | 113.2 | ||
| 132 | A | 34.6 | Very low | 35.4 | Very low | 63 Ų | 63 | 129.5 Ų | 129.5 | 52% | 0.521 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -69.2 | -34.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | S134 L135 E136 | A132-S134 VanDerWaalsContact C-N 3.29Å; A132-S134 PolarHBondContact O-N 3.15Å; A132-L135 PolarHBondContact O-N 3.37Å; A132-E136 PolarHBondContact O-N 2.85Å; A132-E136 VanDerWaalsContact O-N 3.15Å |
| 133 | H | 35.3 | Very low | 36.2 | Very low | 119 Ų | 119 | 121 Ų | 121 | 55% | 0.551 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -74.1 | -16 | -173.7 | -137.7 | -53.7 | 0 | 0 | 0 | 114.6 | ||
| 134 | S | 38.1 | Very low | 37.1 | Very low | 75 Ų | 75 | 125.8 Ų | 125.8 | 52% | 0.524 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -85.4 | -42.9 | 174.8 | -165.6 | 0 | 0 | 0 | 0 | 110.9 | A132 E136 R137 V138 | A132-S134 VanDerWaalsContact C-N 3.29Å; A132-S134 PolarHBondContact O-N 3.15Å; S134-E136 VanDerWaalsContact C-N 3.34Å; S134-E136 PolarHBondContact O-N 3.45Å; S134-R137 PolarHBondContact O-N 3.49Å; S134-V138 VanDerWaalsContact O-CG2 3.31Å; S134-V138 WeakPolarHBondContact O-CG2 3.49Å; S134-V138 PolarHBondContact O-N 2.88Å |
| 135 | L | 37.1 | Very low | 37.9 | Very low | 128 Ų | 128 | 122 Ų | 122 | 67% | 0.67 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -64.5 | -38.1 | 177.8 | -155.8 | 93.1 | 0 | 0 | 0 | 111.9 | A132 V138 C139 | A132-L135 PolarHBondContact O-N 3.37Å; L135-V138 PolarHBondContact O-N 3.48Å; L135-C139 WeakPolarHBondContact O-CB 3.21Å; L135-C139 PolarHBondContact O-N 3.35Å |
| 136 | E | 40.5 | Very low | 38.9 | Very low | 136 Ų | 136 | 119.8 Ų | 119.8 | 64% | 0.636 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68.3 | -38 | 178.5 | -143.5 | -180 | 163.4 | 0 | 0 | 112.3 | A132 S134 C139 H140 | A132-E136 PolarHBondContact O-N 2.85Å; A132-E136 VanDerWaalsContact O-N 3.15Å; S134-E136 VanDerWaalsContact C-N 3.34Å; S134-E136 PolarHBondContact O-N 3.45Å; E136-C139 PolarHBondContact O-N 2.87Å; E136-H140 VanDerWaalsContact O-CB 3.31Å; E136-H140 WeakPolarHBondContact O-CB 3.27Å; E136-H140 PolarHBondContact O-N 3.45Å |
| 137 | R | 39 | Very low | 39.4 | Very low | 167 Ų | 167 | 116.6 Ų | 116.6 | 63% | 0.63 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.8 | -38.9 | 172.8 | -106.4 | -173.9 | -71.9 | -154.9 | -3.3 | 112.2 | S134 H140 C141 | S134-R137 PolarHBondContact O-N 3.49Å; R137-H140 PolarHBondContact O-N 2.66Å; R137-C141 WeakPolarHBondContact O-CB 3.29Å; R137-C141 PolarHBondContact O-N 2.96Å |
| 138 | V | 42.6 | Very low | 40.6 | Very low | 77 Ų | 77 | 109.2 Ų | 109.2 | 47% | 0.467 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.9 | -44.6 | 174 | 169.6 | 0 | 0 | 0 | 0 | 110.2 | S134 L135 H140 C141 L142 | S134-V138 VanDerWaalsContact O-CG2 3.31Å; S134-V138 WeakPolarHBondContact O-CG2 3.49Å; S134-V138 PolarHBondContact O-N 2.88Å; L135-V138 PolarHBondContact O-N 3.48Å; V138-H140 PolarHBondContact O-N 2.91Å; V138-C141 PolarHBondContact O-N 3.11Å; V138-L142 HydrophobicContact CG1-CD1 3.49Å; V138-L142 VanDerWaalsContact CG1-CD1 3.49Å; V138-L142 HydrophobicContact CG1-CG 4.33Å; V138-L142 WeakPolarHBondContact O-CB 3.49Å; V138-L142 WeakPolarHBondContact O-CD1 3.27Å; V138-L142 VanDerWaalsContact O-CG 3.25Å; V138-L142 WeakPolarHBondContact O-CG 3.48Å; V138-L142 PolarHBondContact O-N 3.39Å |
| 139 | C | 46 | Very low | 42 | Very low | 83 Ų | 83 | 108.8 Ų | 108.8 | 56% | 0.561 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -61.8 | -38.8 | 173 | -98.1 | 0 | 0 | 0 | 0 | 113.2 | L135 E136 G143 | L135-C139 WeakPolarHBondContact O-CB 3.21Å; L135-C139 PolarHBondContact O-N 3.35Å; E136-C139 PolarHBondContact O-N 2.87Å; C139-G143 PolarHBondContact O-N 2.89Å |
| 140 | H | 39.8 | Very low | 43.7 | Very low | 145 Ų | 145 | 104.5 Ų | 104.5 | 67% | 0.671 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -74.6 | -37.6 | 179.8 | -163 | -81.7 | 0 | 0 | 0 | 112.4 | E136 R137 V138 K144 | E136-H140 VanDerWaalsContact O-CB 3.31Å; E136-H140 WeakPolarHBondContact O-CB 3.27Å; E136-H140 PolarHBondContact O-N 3.45Å; R137-H140 PolarHBondContact O-N 2.66Å; V138-H140 PolarHBondContact O-N 2.91Å; H140-K144 WeakPolarHBondContact O-CB 3.19Å; H140-K144 PolarHBondContact O-N 2.78Å; H140-K144 VanDerWaalsContact O-N 3.16Å |
| 141 | C | 43.9 | Very low | 45.7 | Very low | 86 Ų | 86 | 101 Ų | 101 | 58% | 0.581 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -70.1 | -42 | 171.3 | -84.8 | 0 | 0 | 0 | 0 | 111.9 | R137 V138 K144 W145 | R137-C141 WeakPolarHBondContact O-CB 3.29Å; R137-C141 PolarHBondContact O-N 2.96Å; V138-C141 PolarHBondContact O-N 3.11Å; C141-K144 PolarHBondContact O-N 3.16Å; C141-W145 WeakPolarHBondContact O-CB 3.39Å; C141-W145 PolarHBondContact O-N 3.29Å |
| 142 | L | 46.9 | Very low | 47.7 | Very low | 47 Ų | 47 | 94.2 Ų | 94.2 | 25% | 0.246 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -58.6 | -51.4 | 172.4 | -84.8 | 161.6 | 0 | 0 | 0 | 110.1 | L85 V138 K144 W145 L146 | L85-L142 HydrophobicContact CD2-CD2 3.32Å; V138-L142 HydrophobicContact CG1-CD1 3.49Å; V138-L142 VanDerWaalsContact CG1-CD1 3.49Å; V138-L142 HydrophobicContact CG1-CG 4.33Å; V138-L142 WeakPolarHBondContact O-CB 3.49Å; V138-L142 WeakPolarHBondContact O-CD1 3.27Å; V138-L142 VanDerWaalsContact O-CG 3.25Å; V138-L142 WeakPolarHBondContact O-CG 3.48Å; V138-L142 PolarHBondContact O-N 3.39Å; L142-K144 PolarHBondContact O-N 3.47Å; L142-W145 CarbonylContact O-C 3.56Å; L142-W145 PolarHBondContact O-N 3.22Å; L142-L146 HydrophobicContact CB-CD1 3.87Å; L142-L146 HydrophobicContact CD2-CD1 3.73Å; L142-L146 HydrophobicContact CG-CD1 4.45Å; L142-L146 VanDerWaalsContact O-CB 3.25Å; L142-L146 WeakPolarHBondContact O-CB 3.2Å; L142-L146 WeakPolarHBondContact O-CD1 3.22Å; L142-L146 PolarHBondContact O-N 3.35Å |
| 143 | G | 48.3 | Very low | 49.8 | Very low | 35 Ų | 35 | 93 Ų | 93 | 36% | 0.361 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.2 | -34 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | C139 G147 | C139-G143 PolarHBondContact O-N 2.89Å; G143-G147 PolarHBondContact O-N 2.83Å |
| 144 | K | 45.5 | Very low | 52.1 | Low | 173 Ų | 173 | 89.1 Ų | 89.1 | 75% | 0.752 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -76.7 | -30.3 | 176.1 | -151.7 | 178.9 | -173.9 | -178.1 | 0 | 113.1 | H140 C141 L142 | H140-K144 WeakPolarHBondContact O-CB 3.19Å; H140-K144 PolarHBondContact O-N 2.78Å; H140-K144 VanDerWaalsContact O-N 3.16Å; C141-K144 PolarHBondContact O-N 3.16Å; L142-K144 PolarHBondContact O-N 3.47Å |
| 145 | W | 42.6 | Very low | 54.3 | Low | 176 Ų | 176 | 88.5 Ų | 88.5 | 67% | 0.667 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -79.7 | -38.7 | 175.2 | -127.8 | 88.1 | 0 | 0 | 0 | 112.1 | C141 L142 G147 I155 | C141-W145 WeakPolarHBondContact O-CB 3.39Å; C141-W145 PolarHBondContact O-N 3.29Å; L142-W145 CarbonylContact O-C 3.56Å; L142-W145 PolarHBondContact O-N 3.22Å; W145-G147 PolarHBondContact O-N 3.38Å; W145-I155 HydrophobicContact CH2-CD1 4.22Å; W145-I155 HydrophobicContact CZ3-CD1 4.01Å |
| 146 | L | 48 | Very low | 56.6 | Low | 30 Ų | 30 | 82.4 Ų | 82.4 | 16% | 0.157 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -66.9 | -17.6 | 172.3 | -89.9 | 89.3 | 0 | 0 | 0 | 113.2 | E89 Y92 L142 H148 | E89-L146 HydrophobicContact CG-CD2 3.69Å; E89-L146 HydrophobicContact CG-CG 4.17Å; E89-L146 WeakPolarHBondContact OE1-CD2 3.32Å; E89-L146 WeakPolarHBondContact OE1-CG 3.49Å; E89-L146 WeakPolarHBondContact OE2-CD2 3.43Å; Y92-L146 HydrophobicContact CD1-CD2 4.45Å; Y92-L146 HydrophobicContact CG-CD2 4.42Å; L142-L146 HydrophobicContact CB-CD1 3.87Å; L142-L146 HydrophobicContact CD2-CD1 3.73Å; L142-L146 HydrophobicContact CG-CD1 4.45Å; L142-L146 VanDerWaalsContact O-CB 3.25Å; L142-L146 WeakPolarHBondContact O-CB 3.2Å; L142-L146 WeakPolarHBondContact O-CD1 3.22Å; L142-L146 PolarHBondContact O-N 3.35Å; L146-H148 PolarHBondContact O-N 2.9Å; L146-H148 VanDerWaalsContact O-N 3.09Å |
| 147 | G | 47.1 | Very low | 58.9 | Low | 53 Ų | 53 | 82.8 Ų | 82.8 | 55% | 0.546 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -8.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | G143 W145 P149 | G143-G147 PolarHBondContact O-N 2.83Å; W145-G147 PolarHBondContact O-N 3.38Å; G147-P149 WeakPolarHBondContact O-CD 3.37Å |
| 148 | H | 54.4 | Low | 61.3 | Low | 93 Ų | 93 | 77.3 Ų | 77.3 | 43% | 0.431 | 42% | 0.422 | S | S | . | . | trans | -115.3 | 83.9 | 175.3 | -92.5 | -74.7 | 0 | 0 | 0 | 110.7 | L146 D150 K151 | L146-H148 PolarHBondContact O-N 2.9Å; L146-H148 VanDerWaalsContact O-N 3.09Å; H148-D150 VanDerWaalsContact C-OD1 3.27Å; H148-D150 WeakPolarHBondContact CA-OD1 3.4Å; H148-D150 WeakPolarHBondContact CB-OD1 3.42Å; H148-D150 IonicContact CG-OD1 2.73Å; H148-D150 IonicContact ND1-OD1 3.7Å; H148-D150 PolarHBondContact ND1-OD1 2.89Å; H148-D150 IonicContact ND1-OD2 3.49Å; H148-D150 PolarHBondContact O-N 3.47Å; H148-K151 HydrophobicContact CB-CB 4.5Å; H148-K151 HydrophobicContact CB-CD 3.91Å; H148-K151 HydrophobicContact CB-CG 4.06Å; H148-K151 PolarHBondContact O-N 3.41Å | ||
| 149 | P | 58.5 | Low | 63.6 | Low | 61 Ų | 61 | 74.8 Ų | 74.8 | 40% | 0.396 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -58.4 | -22.5 | -179.4 | 23.1 | -33.3 | 0 | 0 | 0 | 112.8 | G147 V153 F265 | G147-P149 WeakPolarHBondContact O-CD 3.37Å; P149-V153 WeakPolarHBondContact O-CB 3.3Å; P149-V153 VanDerWaalsContact O-CG2 3.24Å; P149-V153 WeakPolarHBondContact O-CG2 3.47Å; P149-V153 PolarHBondContact O-N 3.47Å; P149-F265 HydrophobicContact CB-CD2 4.49Å; P149-F265 HydrophobicContact CG-CE2 4.43Å |
| 150 | D | 66.1 | Low | 65.8 | Low | 93 Ų | 93 | 71.4 Ų | 71.4 | 50% | 0.497 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.1 | -39.2 | 173.8 | 50.1 | -65 | 0 | 0 | 0 | 113.6 | H148 G154 | H148-D150 VanDerWaalsContact C-OD1 3.27Å; H148-D150 WeakPolarHBondContact CA-OD1 3.4Å; H148-D150 WeakPolarHBondContact CB-OD1 3.42Å; H148-D150 IonicContact CG-OD1 2.73Å; H148-D150 IonicContact ND1-OD1 3.7Å; H148-D150 PolarHBondContact ND1-OD1 2.89Å; H148-D150 IonicContact ND1-OD2 3.49Å; H148-D150 PolarHBondContact O-N 3.47Å; D150-G154 PolarHBondContact O-N 2.83Å; D150-G154 VanDerWaalsContact O-N 3.13Å |
| 151 | K | 72.2 | Confident | 68.3 | Low | 107 Ų | 107 | 68.2 Ų | 68.2 | 47% | 0.465 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -76.7 | -40 | -176 | -63.2 | 178.6 | -172.7 | 174.7 | 0 | 112.1 | H148 G154 I155 | H148-K151 HydrophobicContact CB-CB 4.5Å; H148-K151 HydrophobicContact CB-CD 3.91Å; H148-K151 HydrophobicContact CB-CG 4.06Å; H148-K151 PolarHBondContact O-N 3.41Å; K151-G154 PolarHBondContact O-N 3.2Å; K151-I155 WeakPolarHBondContact O-CG1 3.34Å; K151-I155 PolarHBondContact O-N 3.23Å |
| 152 | F | 74.5 | Confident | 70.7 | Confident | 31 Ų | 31 | 68 Ų | 68 | 14% | 0.136 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -70.3 | -41.8 | -179.5 | 176.1 | -102.2 | 0 | 0 | 0 | 112.2 | Y82 L86 E89 G154 I155 T156 F257 | Y82-F152 HydrophobicContact CE2-CE2 4.32Å; L86-F152 HydrophobicContact CD2-CE2 4.01Å; L86-F152 HydrophobicContact CD2-CZ 3.48Å; L86-F152 VanDerWaalsContact CD2-CZ 3.48Å; E89-F152 HydrophobicContact CB-CZ 4.23Å; E89-F152 HydrophobicContact CG-CE1 4.07Å; E89-F152 HydrophobicContact CG-CE2 4.06Å; E89-F152 HydrophobicContact CG-CZ 3.76Å; F152-G154 VanDerWaalsContact C-N 3.32Å; F152-G154 PolarHBondContact O-N 3.39Å; F152-I155 PolarHBondContact O-N 3.38Å; F152-T156 PolarHBondContact O-N 2.81Å; F152-T156 PolarHBondContact O-OG1 3Å; F152-F257 HydrophobicContact CD1-CE1 4.49Å; F152-F257 AromaticContact CE1-CE1 3.42Å; F152-F257 HydrophobicContact CE1-CE1 3.42Å; F152-F257 VanDerWaalsContact CE1-CE1 3.42Å; F152-F257 AromaticContact CE1-CZ 3.42Å; F152-F257 HydrophobicContact CE1-CZ 3.42Å; F152-F257 VanDerWaalsContact CE1-CZ 3.42Å; F152-F257 AromaticContact CZ-CE1 3.64Å; F152-F257 HydrophobicContact CZ-CE1 3.64Å; F152-F257 AromaticContact CZ-CZ 3.53Å; F152-F257 HydrophobicContact CZ-CZ 3.53Å |
| 153 | V | 79.4 | Confident | 72.9 | Confident | 38 Ų | 38 | 66.1 Ų | 66.1 | 23% | 0.23 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -63.1 | -40 | 172.1 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | P149 T156 Y157 M258 A261 | P149-V153 WeakPolarHBondContact O-CB 3.3Å; P149-V153 VanDerWaalsContact O-CG2 3.24Å; P149-V153 WeakPolarHBondContact O-CG2 3.47Å; P149-V153 PolarHBondContact O-N 3.47Å; V153-T156 PolarHBondContact O-N 3.32Å; V153-Y157 WeakPolarHBondContact O-CB 3.38Å; V153-Y157 PolarHBondContact O-N 3.34Å; V153-M258 HydrophobicContact CG1-CE 4.13Å; V153-M258 HydrophobicContact CG1-SD 4.48Å; V153-A261 HydrophobicContact CG2-CB 4.37Å |
| 154 | G | 82.9 | Confident | 75.2 | Confident | 37 Ų | 37 | 69.2 Ų | 69.2 | 38% | 0.381 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | D150 K151 F152 Y157 A158 | D150-G154 PolarHBondContact O-N 2.83Å; D150-G154 VanDerWaalsContact O-N 3.13Å; K151-G154 PolarHBondContact O-N 3.2Å; F152-G154 VanDerWaalsContact C-N 3.32Å; F152-G154 PolarHBondContact O-N 3.39Å; G154-Y157 PolarHBondContact O-N 2.98Å; G154-A158 PolarHBondContact O-N 3.38Å |
| 155 | I | 85.6 | Confident | 77.5 | Confident | 63 Ų | 63 | 66.3 Ų | 66.3 | 32% | 0.323 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.2 | -47.3 | 176.3 | -68 | 164.6 | 0 | 0 | 0 | 110.6 | Y82 W145 K151 F152 Y157 A158 L159 | Y82-I155 HydrophobicContact CE2-CG2 4.31Å; W145-I155 HydrophobicContact CH2-CD1 4.22Å; W145-I155 HydrophobicContact CZ3-CD1 4.01Å; K151-I155 WeakPolarHBondContact O-CG1 3.34Å; K151-I155 PolarHBondContact O-N 3.23Å; F152-I155 PolarHBondContact O-N 3.38Å; I155-Y157 VanDerWaalsContact C-N 3.27Å; I155-Y157 PolarHBondContact O-N 3.41Å; I155-A158 PolarHBondContact O-N 2.82Å; I155-L159 HydrophobicContact CG2-CD1 3.91Å; I155-L159 HydrophobicContact CG2-CG 4.3Å; I155-L159 WeakPolarHBondContact O-CG 3.48Å; I155-L159 PolarHBondContact O-N 2.84Å |
| 156 | T | 85.3 | Confident | 79.9 | Confident | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -56.8 | -43.3 | 177.9 | -50.1 | 0 | 0 | 0 | 0 | 111.5 | Y82 F152 V153 L159 T160 F257 M258 | Y82-T156 WeakPolarHBondContact OH-CA 3.49Å; Y82-T156 WeakPolarHBondContact OH-CB 3.26Å; Y82-T156 WeakPolarHBondContact OH-CG2 3.49Å; Y82-T156 PolarHBondContact OH-OG1 3.07Å; F152-T156 PolarHBondContact O-N 2.81Å; F152-T156 PolarHBondContact O-OG1 3Å; V153-T156 PolarHBondContact O-N 3.32Å; T156-L159 PolarHBondContact O-N 3.12Å; T156-T160 PolarHBondContact O-N 3.1Å; T156-T160 PolarHBondContact O-OG1 3.4Å; T156-F257 HydrophobicContact CG2-CD1 3.64Å; T156-F257 HydrophobicContact CG2-CE1 4.24Å; T156-M258 HydrophobicContact CG2-CG 3.68Å; T156-M258 HydrophobicContact CG2-SD 3.42Å; T156-M258 WeakPolarHBondContact CG2-SD 3.44Å |
| 157 | Y | 87.7 | Confident | 82.2 | Confident | 143 Ų | 143 | 61 Ų | 61 | 56% | 0.561 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -62.9 | -48 | 177.8 | 179.6 | -98.7 | 0 | 0 | 0 | 111.6 | V153 G154 I155 L159 T160 V161 M258 | V153-Y157 WeakPolarHBondContact O-CB 3.38Å; V153-Y157 PolarHBondContact O-N 3.34Å; G154-Y157 PolarHBondContact O-N 2.98Å; I155-Y157 VanDerWaalsContact C-N 3.27Å; I155-Y157 PolarHBondContact O-N 3.41Å; Y157-L159 VanDerWaalsContact C-N 3.31Å; Y157-L159 PolarHBondContact O-N 3.38Å; Y157-T160 WeakPolarHBondContact O-CB 3.31Å; Y157-T160 PolarHBondContact O-N 3.07Å; Y157-T160 VanDerWaalsContact O-N 3.13Å; Y157-V161 HydrophobicContact CD1-CG2 4.45Å; Y157-V161 HydrophobicContact CE1-CG2 4.06Å; Y157-V161 WeakPolarHBondContact O-CG2 3.49Å; Y157-V161 PolarHBondContact O-N 2.92Å; Y157-M258 HydrophobicContact CD2-CE 4.04Å |
| 158 | A | 90.6 | Very high | 84.5 | Confident | 52 Ų | 52 | 61 Ų | 61 | 43% | 0.43 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.9 | -42.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G154 I155 T160 V161 V162 | G154-A158 PolarHBondContact O-N 3.38Å; I155-A158 PolarHBondContact O-N 2.82Å; A158-T160 VanDerWaalsContact C-N 3.33Å; A158-T160 PolarHBondContact O-N 3.43Å; A158-V161 PolarHBondContact O-N 2.86Å; A158-V162 WeakPolarHBondContact O-CG2 3.5Å; A158-V162 PolarHBondContact O-N 3.29Å |
| 159 | L | 90.8 | Very high | 86.4 | Confident | 24 Ų | 24 | 60 Ų | 60 | 13% | 0.126 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.2 | -40.3 | 175.6 | -70.2 | 173.4 | 0 | 0 | 0 | 112.2 | F78 Y82 I155 T156 Y157 V161 V162 W163 | F78-L159 HydrophobicContact CD1-CD2 4.36Å; F78-L159 HydrophobicContact CE1-CD1 3.71Å; F78-L159 HydrophobicContact CE1-CD2 3.39Å; F78-L159 HydrophobicContact CE1-CG 4.17Å; F78-L159 HydrophobicContact CZ-CD1 4Å; F78-L159 HydrophobicContact CZ-CD2 3.84Å; F78-L159 HydrophobicContact CZ-CG 4.46Å; Y82-L159 HydrophobicContact CD1-CD1 4.11Å; Y82-L159 HydrophobicContact CD2-CD1 3.97Å; Y82-L159 HydrophobicContact CE1-CD1 3.86Å; Y82-L159 HydrophobicContact CE2-CD1 3.72Å; Y82-L159 HydrophobicContact CG-CD1 4.16Å; I155-L159 HydrophobicContact CG2-CD1 3.91Å; I155-L159 HydrophobicContact CG2-CG 4.3Å; I155-L159 WeakPolarHBondContact O-CG 3.48Å; I155-L159 PolarHBondContact O-N 2.84Å; T156-L159 PolarHBondContact O-N 3.12Å; Y157-L159 VanDerWaalsContact C-N 3.31Å; Y157-L159 PolarHBondContact O-N 3.38Å; L159-V161 VanDerWaalsContact C-N 3.35Å; L159-V161 PolarHBondContact O-N 2.92Å; L159-V162 PolarHBondContact O-N 3.19Å; L159-W163 VanDerWaalsContact O-CB 3.29Å; L159-W163 WeakPolarHBondContact O-CB 2.98Å; L159-W163 PolarHBondContact O-N 3.28Å |
| 160 | T | 91.4 | Very high | 88.1 | Confident | 13 Ų | 13 | 57.9 Ų | 57.9 | 8% | 0.08 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.3 | -43 | 176.8 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | T156 Y157 A158 W163 L164 L251 L254 L255 | T156-T160 PolarHBondContact O-N 3.1Å; T156-T160 PolarHBondContact O-OG1 3.4Å; Y157-T160 WeakPolarHBondContact O-CB 3.31Å; Y157-T160 PolarHBondContact O-N 3.07Å; Y157-T160 VanDerWaalsContact O-N 3.13Å; A158-T160 VanDerWaalsContact C-N 3.33Å; A158-T160 PolarHBondContact O-N 3.43Å; T160-W163 PolarHBondContact O-N 3.5Å; T160-L164 WeakPolarHBondContact O-CB 3.39Å; T160-L164 PolarHBondContact O-N 3Å; T160-L251 HydrophobicContact CG2-CD1 4.06Å; T160-L254 HydrophobicContact CG2-CB 4.49Å; T160-L255 HydrophobicContact CG2-CD2 3.67Å; T160-L255 HydrophobicContact CG2-CG 4.09Å |
| 161 | V | 93.3 | Very high | 89.5 | Confident | 77 Ų | 77 | 55.3 Ų | 55.3 | 47% | 0.467 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65 | -45.6 | 176.9 | 174 | 0 | 0 | 0 | 0 | 111.3 | Y157 A158 L159 W163 L164 L165 | Y157-V161 HydrophobicContact CD1-CG2 4.45Å; Y157-V161 HydrophobicContact CE1-CG2 4.06Å; Y157-V161 WeakPolarHBondContact O-CG2 3.49Å; Y157-V161 PolarHBondContact O-N 2.92Å; A158-V161 PolarHBondContact O-N 2.86Å; L159-V161 VanDerWaalsContact C-N 3.35Å; L159-V161 PolarHBondContact O-N 2.92Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 3.42Å; V161-L164 WeakPolarHBondContact O-CB 3.47Å; V161-L164 PolarHBondContact O-N 3.43Å; V161-L165 PolarHBondContact O-N 3.29Å |
| 162 | V | 93.4 | Very high | 90.5 | Very high | 82 Ų | 82 | 54.2 Ų | 54.2 | 50% | 0.497 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.5 | -42.2 | 175.2 | 170.7 | 0 | 0 | 0 | 0 | 110.4 | A158 L159 L164 L165 V166 | A158-V162 WeakPolarHBondContact O-CG2 3.5Å; A158-V162 PolarHBondContact O-N 3.29Å; L159-V162 PolarHBondContact O-N 3.19Å; V162-L164 VanDerWaalsContact C-N 3.35Å; V162-L164 PolarHBondContact O-N 2.91Å; V162-L165 WeakPolarHBondContact O-CB 3.45Å; V162-L165 PolarHBondContact O-N 3.19Å; V162-V166 WeakPolarHBondContact O-CG2 3.44Å; V162-V166 PolarHBondContact O-N 2.72Å |
| 163 | W | 94.3 | Very high | 91.4 | Very high | 7 Ų | 7 | 54.3 Ų | 54.3 | 3% | 0.027 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -72.7 | -28.4 | -178 | -144.2 | -101.8 | 0 | 0 | 0 | 113.7 | V29 F32 T75 F79 L159 T160 V161 L165 V166 F167 A247 T250 L251 L254 | V29-W163 HydrophobicContact CG2-CZ2 4.25Å; F32-W163 HydrophobicContact CD1-CH2 4.04Å; F32-W163 HydrophobicContact CD1-CZ2 4Å; F32-W163 HydrophobicContact CE1-CH2 4.23Å; F32-W163 HydrophobicContact CE1-CZ2 4.45Å; F32-W163 HydrophobicContact CG-CZ2 4.36Å; T75-W163 HydrophobicContact CG2-CH2 3.39Å; T75-W163 HydrophobicContact CG2-CZ3 3.38Å; F79-W163 HydrophobicContact CD2-CH2 4.46Å; F79-W163 HydrophobicContact CD2-CZ3 4.27Å; F79-W163 AromaticContact CE2-CE3 3.72Å; F79-W163 HydrophobicContact CE2-CE3 3.72Å; F79-W163 AromaticContact CE2-CH2 3.9Å; F79-W163 HydrophobicContact CE2-CH2 3.9Å; F79-W163 AromaticContact CE2-CZ3 3.37Å; F79-W163 HydrophobicContact CE2-CZ3 3.37Å; F79-W163 HydrophobicContact CZ-CD2 4.13Å; F79-W163 AromaticContact CZ-CE3 3.68Å; F79-W163 HydrophobicContact CZ-CE3 3.68Å; F79-W163 HydrophobicContact CZ-CH2 4.33Å; F79-W163 AromaticContact CZ-CZ3 3.81Å; F79-W163 HydrophobicContact CZ-CZ3 3.81Å; L159-W163 VanDerWaalsContact O-CB 3.29Å; L159-W163 WeakPolarHBondContact O-CB 2.98Å; L159-W163 PolarHBondContact O-N 3.28Å; T160-W163 PolarHBondContact O-N 3.5Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 3.42Å; W163-L165 VanDerWaalsContact C-N 3.31Å; W163-V166 HydrophobicContact CD2-CB 4.42Å; W163-V166 HydrophobicContact CE3-CB 4.44Å; W163-V166 HydrophobicContact CE3-CG2 4.17Å; W163-V166 HydrophobicContact CZ3-CG2 4.38Å; W163-V166 PolarHBondContact O-N 3.04Å; W163-F167 WeakPolarHBondContact O-CB 3.38Å; W163-F167 PolarHBondContact O-N 2.96Å; W163-A247 PolarHBondContact NE1-O 2.64Å; W163-A247 VanDerWaalsContact NE1-O 3.12Å; W163-T250 HydrophobicContact CD2-CG2 4.1Å; W163-T250 HydrophobicContact CG-CG2 4.18Å; W163-T250 HydrophobicContact CZ2-CG2 4Å; W163-T250 VanDerWaalsContact NE1-CG2 3.33Å; W163-L251 HydrophobicContact CB-CD1 4.36Å; W163-L254 HydrophobicContact CB-CD1 3.87Å; W163-L254 HydrophobicContact CG-CD1 4.09Å |
| 164 | L | 94.9 | Very high | 92.1 | Very high | 101 Ų | 101 | 53.9 Ų | 53.9 | 53% | 0.529 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 169.5 | -169.9 | 161.6 | 0 | 0 | 0 | 110.4 | T160 V161 V162 F167 A168 L251 | T160-L164 WeakPolarHBondContact O-CB 3.39Å; T160-L164 PolarHBondContact O-N 3Å; V161-L164 WeakPolarHBondContact O-CB 3.47Å; V161-L164 PolarHBondContact O-N 3.43Å; V162-L164 VanDerWaalsContact C-N 3.35Å; V162-L164 PolarHBondContact O-N 2.91Å; L164-F167 PolarHBondContact O-N 3.22Å; L164-A168 PolarHBondContact O-N 3.09Å; L164-L251 HydrophobicContact CB-CD1 4.23Å |
| 165 | L | 93.9 | Very high | 92.6 | Very high | 111 Ų | 111 | 58.9 Ų | 58.9 | 58% | 0.581 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -62.9 | -45.8 | 174.1 | -178 | 65.8 | 0 | 0 | 0 | 111.3 | V161 V162 W163 F167 A168 C169 | V161-L165 PolarHBondContact O-N 3.29Å; V162-L165 WeakPolarHBondContact O-CB 3.45Å; V162-L165 PolarHBondContact O-N 3.19Å; W163-L165 VanDerWaalsContact C-N 3.31Å; L165-F167 VanDerWaalsContact C-N 3.31Å; L165-F167 PolarHBondContact O-N 3.03Å; L165-A168 PolarHBondContact O-N 3.43Å; L165-C169 WeakPolarHBondContact O-CB 3.32Å; L165-C169 PolarHBondContact O-N 3.31Å; L165-C169 PolarHBondContact O-SG 2.99Å |
| 166 | V | 94.4 | Very high | 92.9 | Very high | 35 Ų | 35 | 57.2 Ų | 57.2 | 21% | 0.212 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -57.3 | -45.3 | 176.3 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | F32 V162 W163 C169 S170 | F32-V166 HydrophobicContact CE1-CG1 3.98Å; F32-V166 HydrophobicContact CE2-CG1 3.76Å; F32-V166 HydrophobicContact CZ-CG1 3.4Å; F32-V166 VanDerWaalsContact CZ-CG1 3.4Å; V162-V166 WeakPolarHBondContact O-CG2 3.44Å; V162-V166 PolarHBondContact O-N 2.72Å; W163-V166 HydrophobicContact CD2-CB 4.42Å; W163-V166 HydrophobicContact CE3-CB 4.44Å; W163-V166 HydrophobicContact CE3-CG2 4.17Å; W163-V166 HydrophobicContact CZ3-CG2 4.38Å; W163-V166 PolarHBondContact O-N 3.04Å; V166-C169 PolarHBondContact O-N 3.04Å; V166-S170 VanDerWaalsContact O-CB 3.26Å; V166-S170 WeakPolarHBondContact O-CB 3.42Å; V166-S170 PolarHBondContact O-N 2.6Å; V166-S170 PolarHBondContact O-OG 3.25Å |
| 167 | F | 96.3 | Very high | 93.2 | Very high | 59 Ų | 59 | 58 Ų | 58 | 26% | 0.259 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -59.1 | -48.3 | 176.1 | 174.2 | -112.1 | 0 | 0 | 0 | 111.6 | W163 L164 L165 S170 A171 F244 A247 A248 L251 | W163-F167 WeakPolarHBondContact O-CB 3.38Å; W163-F167 PolarHBondContact O-N 2.96Å; L164-F167 PolarHBondContact O-N 3.22Å; L165-F167 VanDerWaalsContact C-N 3.31Å; L165-F167 PolarHBondContact O-N 3.03Å; F167-S170 PolarHBondContact O-N 3.36Å; F167-S170 PolarHBondContact O-OG 2.85Å; F167-A171 PolarHBondContact O-N 2.82Å; F167-F244 HydrophobicContact CD2-CD2 4.25Å; F167-F244 AromaticContact CD2-CE2 3.82Å; F167-F244 HydrophobicContact CD2-CE2 3.82Å; F167-F244 HydrophobicContact CD2-CZ 4.21Å; F167-F244 HydrophobicContact CE2-CD1 4.45Å; F167-F244 AromaticContact CE2-CD2 3.99Å; F167-F244 HydrophobicContact CE2-CD2 3.99Å; F167-F244 AromaticContact CE2-CE1 3.86Å; F167-F244 HydrophobicContact CE2-CE1 3.86Å; F167-F244 AromaticContact CE2-CE2 3.29Å; F167-F244 HydrophobicContact CE2-CE2 3.29Å; F167-F244 AromaticContact CE2-CZ 3.23Å; F167-F244 HydrophobicContact CE2-CZ 3.23Å; F167-F244 HydrophobicContact CZ-CE1 4.27Å; F167-F244 AromaticContact CZ-CE2 3.78Å; F167-F244 HydrophobicContact CZ-CE2 3.78Å; F167-F244 AromaticContact CZ-CZ 3.45Å; F167-F244 HydrophobicContact CZ-CZ 3.45Å; F167-F244 VanDerWaalsContact CZ-CZ 3.45Å; F167-A247 HydrophobicContact CB-CB 4.42Å; F167-A247 HydrophobicContact CD2-CB 4.27Å; F167-A248 HydrophobicContact CD2-CB 3.99Å; F167-A248 HydrophobicContact CE2-CB 3.62Å; F167-A248 HydrophobicContact CZ-CB 4.45Å; F167-L251 HydrophobicContact CB-CD2 4.3Å; F167-L251 HydrophobicContact CD1-CD2 4.14Å; F167-L251 HydrophobicContact CG-CD2 4.29Å |
| 168 | A | 95.8 | Very high | 93.5 | Very high | 54 Ų | 54 | 56.3 Ų | 56.3 | 45% | 0.446 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.4 | -45.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L164 L165 S170 A171 | L164-A168 PolarHBondContact O-N 3.09Å; L165-A168 PolarHBondContact O-N 3.43Å; A168-S170 VanDerWaalsContact C-N 3.32Å; A168-S170 PolarHBondContact O-N 3.15Å; A168-A171 WeakPolarHBondContact O-CB 3.31Å; A168-A171 PolarHBondContact O-N 3.45Å |
| 169 | C | 92.9 | Very high | 93.5 | Very high | 73 Ų | 73 | 55.7 Ų | 55.7 | 49% | 0.493 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.6 | -34.7 | 178.1 | -68.8 | 0 | 0 | 0 | 0 | 112.2 | L165 V166 A171 V172 P173 | L165-C169 WeakPolarHBondContact O-CB 3.32Å; L165-C169 PolarHBondContact O-N 3.31Å; L165-C169 PolarHBondContact O-SG 2.99Å; V166-C169 PolarHBondContact O-N 3.04Å; C169-A171 PolarHBondContact O-N 3.11Å; C169-V172 WeakPolarHBondContact O-CB 3.39Å; C169-V172 WeakPolarHBondContact O-CG2 3.25Å; C169-V172 PolarHBondContact O-N 2.89Å; C169-V172 VanDerWaalsContact O-N 3.11Å; C169-P173 WeakPolarHBondContact O-CD 3.47Å |
| 170 | S | 94.8 | Very high | 93.5 | Very high | 15 Ų | 15 | 55.2 Ų | 55.2 | 11% | 0.105 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.9 | -17.3 | 177.9 | 72.2 | 0 | 0 | 0 | 0 | 113.6 | V166 F167 A168 V172 P173 F244 | V166-S170 VanDerWaalsContact O-CB 3.26Å; V166-S170 WeakPolarHBondContact O-CB 3.42Å; V166-S170 PolarHBondContact O-N 2.6Å; V166-S170 PolarHBondContact O-OG 3.25Å; F167-S170 PolarHBondContact O-N 3.36Å; F167-S170 PolarHBondContact O-OG 2.85Å; A168-S170 VanDerWaalsContact C-N 3.32Å; A168-S170 PolarHBondContact O-N 3.15Å; S170-V172 VanDerWaalsContact C-N 3.3Å; S170-V172 PolarHBondContact O-N 3.4Å; S170-P173 WeakPolarHBondContact O-CD 3.49Å; S170-P173 WeakPolarHBondContact O-CG 3.3Å; S170-F244 WeakPolarHBondContact OG-CD2 3.48Å |
| 171 | A | 95.6 | Very high | 93.5 | Very high | 40 Ų | 40 | 58 Ų | 58 | 33% | 0.331 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -70 | -26 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F167 A168 C169 V174 Y175 F244 | F167-A171 PolarHBondContact O-N 2.82Å; A168-A171 WeakPolarHBondContact O-CB 3.31Å; A168-A171 PolarHBondContact O-N 3.45Å; C169-A171 PolarHBondContact O-N 3.11Å; A171-V174 PolarHBondContact O-N 2.86Å; A171-Y175 WeakPolarHBondContact O-CB 3.19Å; A171-Y175 PolarHBondContact O-N 3.31Å; A171-F244 HydrophobicContact CB-CD2 4.36Å; A171-F244 HydrophobicContact CB-CE2 3.9Å |
| 172 | V | 92.9 | Very high | 93.3 | Very high | 83 Ų | 83 | 56.5 Ų | 56.5 | 50% | 0.503 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.6 | -56.1 | -178.2 | 178.3 | 0 | 0 | 0 | 0 | 112.2 | C169 S170 V174 Y175 I176 | C169-V172 WeakPolarHBondContact O-CB 3.39Å; C169-V172 WeakPolarHBondContact O-CG2 3.25Å; C169-V172 PolarHBondContact O-N 2.89Å; C169-V172 VanDerWaalsContact O-N 3.11Å; S170-V172 VanDerWaalsContact C-N 3.3Å; S170-V172 PolarHBondContact O-N 3.4Å; V172-V174 VanDerWaalsContact C-N 3.31Å; V172-V174 PolarHBondContact O-N 3.42Å; V172-Y175 WeakPolarHBondContact O-CB 2.99Å; V172-Y175 PolarHBondContact O-N 2.89Å; V172-I176 HydrophobicContact CG1-CD1 3.93Å; V172-I176 VanDerWaalsContact O-CG1 3.32Å; V172-I176 WeakPolarHBondContact O-CG1 3.16Å; V172-I176 PolarHBondContact O-N 2.86Å |
| 173 | P | 92.4 | Very high | 93 | Very high | 34 Ų | 34 | 54.1 Ų | 54.1 | 22% | 0.221 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.3 | -38.1 | 178.1 | 23.7 | -34 | 0 | 0 | 0 | 112.3 | C169 S170 Y175 I176 Y177 F240 | C169-P173 WeakPolarHBondContact O-CD 3.47Å; S170-P173 WeakPolarHBondContact O-CD 3.49Å; S170-P173 WeakPolarHBondContact O-CG 3.3Å; P173-Y175 VanDerWaalsContact C-N 3.31Å; P173-Y175 PolarHBondContact O-N 3.46Å; P173-I176 PolarHBondContact O-N 3.5Å; P173-Y177 WeakPolarHBondContact O-CD2 3.09Å; P173-Y177 PolarHBondContact O-N 2.91Å; P173-F240 HydrophobicContact CB-CD1 3.65Å; P173-F240 HydrophobicContact CB-CD2 4.35Å; P173-F240 HydrophobicContact CB-CE1 3.58Å; P173-F240 HydrophobicContact CB-CE2 4.29Å; P173-F240 HydrophobicContact CB-CG 4.06Å; P173-F240 HydrophobicContact CB-CZ 3.92Å; P173-F240 HydrophobicContact CG-CD1 3.75Å; P173-F240 HydrophobicContact CG-CE1 3.83Å |
| 174 | V | 95.2 | Very high | 92.8 | Very high | 29 Ų | 29 | 53.9 Ų | 53.9 | 18% | 0.176 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -58.8 | -44.5 | 175.2 | 177.6 | 0 | 0 | 0 | 0 | 110.9 | A171 V172 F178 F240 I241 F244 | A171-V174 PolarHBondContact O-N 2.86Å; V172-V174 VanDerWaalsContact C-N 3.31Å; V172-V174 PolarHBondContact O-N 3.42Å; V174-F178 WeakPolarHBondContact O-CB 3.34Å; V174-F178 PolarHBondContact O-N 2.88Å; V174-F240 HydrophobicContact CG2-CB 4.07Å; V174-F240 WeakPolarHBondContact CG2-O 3.25Å; V174-I241 HydrophobicContact CG1-CG1 4.34Å; V174-F244 HydrophobicContact CG2-CB 3.93Å; V174-F244 HydrophobicContact CG2-CG 4.41Å |
| 175 | Y | 94.1 | Very high | 92.6 | Very high | 141 Ų | 141 | 52.5 Ų | 52.5 | 55% | 0.553 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -62.5 | -44.9 | 177.2 | 178.5 | -100.7 | 0 | 0 | 0 | 111.9 | A171 V172 P173 F178 N179 Y207 | A171-Y175 WeakPolarHBondContact O-CB 3.19Å; A171-Y175 PolarHBondContact O-N 3.31Å; V172-Y175 WeakPolarHBondContact O-CB 2.99Å; V172-Y175 PolarHBondContact O-N 2.89Å; P173-Y175 VanDerWaalsContact C-N 3.31Å; P173-Y175 PolarHBondContact O-N 3.46Å; Y175-F178 PolarHBondContact O-N 2.91Å; Y175-N179 WeakPolarHBondContact CD1-ND2 3.36Å; Y175-N179 VanDerWaalsContact CD2-ND2 3.33Å; Y175-N179 WeakPolarHBondContact CD2-ND2 3.27Å; Y175-N179 WeakPolarHBondContact CE1-ND2 3.3Å; Y175-N179 WeakPolarHBondContact CE2-ND2 3.49Å; Y175-N179 PolarHBondContact O-N 3.34Å; Y175-N179 PolarHBondContact O-ND2 3.31Å; Y175-Y207 HydrophobicContact CE1-CE1 4.38Å |
| 176 | I | 91.9 | Very high | 92.2 | Very high | 29 Ų | 29 | 49 Ų | 49 | 15% | 0.149 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60.5 | -49.9 | 179.4 | -64.7 | 167.2 | 0 | 0 | 0 | 111.1 | V172 P173 F178 N179 T180 Y207 | V172-I176 HydrophobicContact CG1-CD1 3.93Å; V172-I176 VanDerWaalsContact O-CG1 3.32Å; V172-I176 WeakPolarHBondContact O-CG1 3.16Å; V172-I176 PolarHBondContact O-N 2.86Å; P173-I176 PolarHBondContact O-N 3.5Å; I176-F178 VanDerWaalsContact C-N 3.34Å; I176-F178 PolarHBondContact O-N 2.88Å; I176-N179 PolarHBondContact O-N 3.03Å; I176-T180 PolarHBondContact O-N 3.35Å; I176-T180 PolarHBondContact O-OG1 3.49Å; I176-Y207 HydrophobicContact CD1-CD1 4.04Å; I176-Y207 HydrophobicContact CD1-CG 3.92Å; I176-Y207 HydrophobicContact CG1-CD1 3.53Å; I176-Y207 HydrophobicContact CG1-CD2 4.29Å; I176-Y207 HydrophobicContact CG1-CE1 3.9Å; I176-Y207 HydrophobicContact CG1-CG 3.72Å; I176-Y207 HydrophobicContact CG2-CD2 3.88Å; I176-Y207 HydrophobicContact CG2-CE2 4.05Å; I176-Y207 HydrophobicContact CG2-CG 4.14Å |
| 177 | Y | 91.6 | Very high | 91.8 | Very high | 16 Ų | 16 | 47.8 Ų | 47.8 | 6% | 0.063 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.3 | -37.4 | 179 | -84.9 | -95.4 | 0 | 0 | 0 | 111.7 | T43 L46 P173 T180 W181 F233 T236 F237 F240 | T43-Y177 PolarHBondContact OG1-OH 2.86Å; L46-Y177 HydrophobicContact CD2-CE1 4.35Å; P173-Y177 WeakPolarHBondContact O-CD2 3.09Å; P173-Y177 PolarHBondContact O-N 2.91Å; Y177-T180 PolarHBondContact O-N 2.85Å; Y177-W181 VanDerWaalsContact O-CB 3.31Å; Y177-W181 WeakPolarHBondContact O-CB 2.88Å; Y177-W181 PolarHBondContact O-N 3.26Å; Y177-F233 AromaticContact CD1-CD2 3.95Å; Y177-F233 HydrophobicContact CD1-CD2 3.95Å; Y177-F233 HydrophobicContact CD1-CE1 4.39Å; Y177-F233 AromaticContact CD1-CE2 3.4Å; Y177-F233 HydrophobicContact CD1-CE2 3.4Å; Y177-F233 AromaticContact CD1-CZ 3.65Å; Y177-F233 HydrophobicContact CD1-CZ 3.65Å; Y177-F233 AromaticContact CE1-CD2 3.73Å; Y177-F233 HydrophobicContact CE1-CD2 3.73Å; Y177-F233 AromaticContact CE1-CE2 3.58Å; Y177-F233 HydrophobicContact CE1-CE2 3.58Å; Y177-F233 HydrophobicContact CE1-CZ 4.28Å; Y177-F233 HydrophobicContact CG-CE2 4.46Å; Y177-T236 HydrophobicContact CE1-CG2 3.86Å; Y177-T236 HydrophobicContact CE2-CG2 4.3Å; Y177-T236 VanDerWaalsContact OH-CG2 3.25Å; Y177-T236 WeakPolarHBondContact OH-CG2 3.06Å; Y177-F237 VanDerWaalsContact CB-CD2 3.45Å; Y177-F237 HydrophobicContact CD1-CB 4.1Å; Y177-F237 HydrophobicContact CG-CD2 4.34Å; Y177-F240 AromaticContact CD2-CD2 3.78Å; Y177-F240 HydrophobicContact CD2-CD2 3.78Å; Y177-F240 AromaticContact CD2-CE2 3.95Å; Y177-F240 HydrophobicContact CD2-CE2 3.95Å; Y177-F240 AromaticContact CE2-CD2 3.65Å; Y177-F240 HydrophobicContact CE2-CD2 3.65Å; Y177-F240 AromaticContact CE2-CE2 3.35Å; Y177-F240 HydrophobicContact CE2-CE2 3.35Å; Y177-F240 HydrophobicContact CE2-CZ 4.41Å; Y177-F240 HydrophobicContact CG-CD2 4.47Å; Y177-F240 AromaticContact CZ-CE2 3.92Å |
| 178 | F | 92.9 | Very high | 91.3 | Very high | 108 Ų | 108 | 47 Ų | 47 | 47% | 0.474 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.4 | -48.1 | 175.6 | -177 | -97.9 | 0 | 0 | 0 | 111.7 | V174 Y175 I176 T180 W181 T182 F237 | V174-F178 WeakPolarHBondContact O-CB 3.34Å; V174-F178 PolarHBondContact O-N 2.88Å; Y175-F178 PolarHBondContact O-N 2.91Å; I176-F178 VanDerWaalsContact C-N 3.34Å; I176-F178 PolarHBondContact O-N 2.88Å; F178-T180 VanDerWaalsContact C-N 3.3Å; F178-T180 PolarHBondContact O-N 3.35Å; F178-W181 PolarHBondContact O-N 3.23Å; F178-T182 HydrophobicContact CD1-CG2 4.04Å; F178-T182 HydrophobicContact CE1-CG2 3.65Å; F178-T182 HydrophobicContact CE2-CG2 4.2Å; F178-T182 HydrophobicContact CG-CG2 4.48Å; F178-T182 HydrophobicContact CZ-CG2 3.74Å; F178-T182 WeakPolarHBondContact O-CG2 3.38Å; F178-T182 PolarHBondContact O-N 3.4Å; F178-T182 PolarHBondContact O-OG1 3.25Å; F178-F237 HydrophobicContact CB-CE2 4.32Å; F178-F237 HydrophobicContact CD2-CZ 4.29Å |
| 179 | N | 91.7 | Very high | 90.7 | Very high | 38 Ų | 38 | 49.9 Ų | 49.9 | 20% | 0.203 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.5 | -36.2 | 177.4 | -76 | -74.5 | 0 | 0 | 0 | 112.6 | Y175 I176 T182 T183 | Y175-N179 WeakPolarHBondContact CD1-ND2 3.36Å; Y175-N179 VanDerWaalsContact CD2-ND2 3.33Å; Y175-N179 WeakPolarHBondContact CD2-ND2 3.27Å; Y175-N179 WeakPolarHBondContact CE1-ND2 3.3Å; Y175-N179 WeakPolarHBondContact CE2-ND2 3.49Å; Y175-N179 PolarHBondContact O-N 3.34Å; Y175-N179 PolarHBondContact O-ND2 3.31Å; I176-N179 PolarHBondContact O-N 3.03Å; N179-T182 WeakPolarHBondContact CA-OG1 3.41Å; N179-T182 PolarHBondContact O-OG1 3.44Å; N179-T183 WeakPolarHBondContact O-CB 3.33Å; N179-T183 PolarHBondContact O-N 2.96Å; N179-T183 PolarHBondContact O-OG1 3.33Å |
| 180 | T | 89.4 | Confident | 89.7 | Confident | 15 Ų | 15 | 49.5 Ų | 49.5 | 9% | 0.092 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -66.7 | -44.4 | 175.6 | -56.4 | 0 | 0 | 0 | 0 | 110.7 | I176 Y177 F178 T183 C184 A202 L224 F233 | I176-T180 PolarHBondContact O-N 3.35Å; I176-T180 PolarHBondContact O-OG1 3.49Å; Y177-T180 PolarHBondContact O-N 2.85Å; F178-T180 VanDerWaalsContact C-N 3.3Å; F178-T180 PolarHBondContact O-N 3.35Å; T180-T183 WeakPolarHBondContact O-CB 3.48Å; T180-T183 PolarHBondContact O-N 3.19Å; T180-C184 PolarHBondContact O-N 3.11Å; T180-C184 PolarHBondContact O-SG 3.04Å; T180-C184 VanDerWaalsContact O-SG 3.38Å; T180-A202 HydrophobicContact CG2-CB 3.98Å; T180-L224 HydrophobicContact CG2-CD1 4.23Å; T180-F233 HydrophobicContact CG2-CE2 3.85Å; T180-F233 HydrophobicContact CG2-CZ 3.8Å |
| 181 | W | 90.8 | Very high | 88.5 | Confident | 70 Ų | 70 | 54.7 Ų | 54.7 | 27% | 0.265 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.8 | -46.4 | 176.4 | 176 | -107.7 | 0 | 0 | 0 | 112.6 | Y177 F178 T183 C184 Q185 C228 F233 Q234 | Y177-W181 VanDerWaalsContact O-CB 3.31Å; Y177-W181 WeakPolarHBondContact O-CB 2.88Å; Y177-W181 PolarHBondContact O-N 3.26Å; F178-W181 PolarHBondContact O-N 3.23Å; W181-T183 VanDerWaalsContact C-N 3.3Å; W181-T183 PolarHBondContact O-N 3.19Å; W181-C184 WeakPolarHBondContact O-CB 3.17Å; W181-C184 PolarHBondContact O-N 3.44Å; W181-C184 VanDerWaalsContact O-N 3.15Å; W181-Q185 HydrophobicContact CD2-CG 4.48Å; W181-Q185 WeakPolarHBondContact O-CG 3.35Å; W181-Q185 PolarHBondContact O-N 3.06Å; W181-C228 HydrophobicContact CE3-CB 4.47Å; W181-F233 HydrophobicContact CB-CE1 4.4Å; W181-F233 HydrophobicContact CE3-CE1 4.14Å; W181-Q234 VanDerWaalsContact CE3-NE2 3.34Å |
| 182 | T | 89.8 | Confident | 87 | Confident | 47 Ų | 47 | 61.2 Ų | 61.2 | 29% | 0.288 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 177.3 | 56.4 | 0 | 0 | 0 | 0 | 111.3 | F178 N179 C184 Q185 S186 | F178-T182 HydrophobicContact CD1-CG2 4.04Å; F178-T182 HydrophobicContact CE1-CG2 3.65Å; F178-T182 HydrophobicContact CE2-CG2 4.2Å; F178-T182 HydrophobicContact CG-CG2 4.48Å; F178-T182 HydrophobicContact CZ-CG2 3.74Å; F178-T182 WeakPolarHBondContact O-CG2 3.38Å; F178-T182 PolarHBondContact O-N 3.4Å; F178-T182 PolarHBondContact O-OG1 3.25Å; N179-T182 WeakPolarHBondContact CA-OG1 3.41Å; N179-T182 PolarHBondContact O-OG1 3.44Å; T182-C184 VanDerWaalsContact C-N 3.33Å; T182-C184 PolarHBondContact O-N 2.73Å; T182-Q185 PolarHBondContact O-N 3.43Å; T182-S186 PolarHBondContact O-N 3.23Å; T182-S186 PolarHBondContact O-OG 3.48Å |
| 183 | T | 88.3 | Confident | 85.7 | Confident | 32 Ų | 32 | 59.4 Ų | 59.4 | 20% | 0.196 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.5 | -43.6 | 173.3 | -58.3 | 0 | 0 | 0 | 0 | 111.4 | N179 T180 W181 Q185 S186 I187 L200 L224 | N179-T183 WeakPolarHBondContact O-CB 3.33Å; N179-T183 PolarHBondContact O-N 2.96Å; N179-T183 PolarHBondContact O-OG1 3.33Å; T180-T183 WeakPolarHBondContact O-CB 3.48Å; T180-T183 PolarHBondContact O-N 3.19Å; W181-T183 VanDerWaalsContact C-N 3.3Å; W181-T183 PolarHBondContact O-N 3.19Å; T183-Q185 VanDerWaalsContact C-N 3.34Å; T183-Q185 PolarHBondContact O-N 3.26Å; T183-S186 PolarHBondContact O-N 3.19Å; T183-I187 HydrophobicContact CG2-CD1 4.32Å; T183-I187 WeakPolarHBondContact O-CG1 3.49Å; T183-I187 PolarHBondContact O-N 3.36Å; T183-I187 VanDerWaalsContact O-N 3.11Å; T183-L200 HydrophobicContact CG2-CB 4.09Å; T183-L224 HydrophobicContact CG2-CD2 3.9Å |
| 184 | C | 90 | Very high | 84.2 | Confident | 2 Ų | 2 | 64.3 Ų | 64.3 | 1% | 0.014 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.4 | -38.8 | 175.3 | -74.5 | 0 | 0 | 0 | 0 | 113.2 | T180 W181 T182 I187 A188 C228 | T180-C184 PolarHBondContact O-N 3.11Å; T180-C184 PolarHBondContact O-SG 3.04Å; T180-C184 VanDerWaalsContact O-SG 3.38Å; W181-C184 WeakPolarHBondContact O-CB 3.17Å; W181-C184 PolarHBondContact O-N 3.44Å; W181-C184 VanDerWaalsContact O-N 3.15Å; T182-C184 VanDerWaalsContact C-N 3.33Å; T182-C184 PolarHBondContact O-N 2.73Å; C184-I187 PolarHBondContact O-N 3.44Å; C184-A188 WeakPolarHBondContact O-CB 3.36Å; C184-A188 PolarHBondContact O-N 2.99Å; C184-C228 HydrophobicContact CB-CB 3.49Å; C184-C228 VanDerWaalsContact CB-CB 3.49Å; C184-C228 WeakPolarHBondContact CB-SG 3.01Å; C184-C228 WeakPolarHBondContact SG-CB 3.4Å; C184-C228 CovalentContact SG-SG 2.01Å; C184-C228 PolarHBondContact SG-SG 3.26Å |
| 185 | Q | 89.1 | Confident | 83 | Confident | 72 Ų | 72 | 65.3 Ų | 65.3 | 34% | 0.336 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.9 | -38.6 | 176.1 | -68.9 | -63.6 | -27.6 | 0 | 0 | 111.9 | W181 T182 T183 I187 A188 F189 | W181-Q185 HydrophobicContact CD2-CG 4.48Å; W181-Q185 WeakPolarHBondContact O-CG 3.35Å; W181-Q185 PolarHBondContact O-N 3.06Å; T182-Q185 PolarHBondContact O-N 3.43Å; T183-Q185 VanDerWaalsContact C-N 3.34Å; T183-Q185 PolarHBondContact O-N 3.26Å; Q185-I187 VanDerWaalsContact C-N 3.29Å; Q185-I187 PolarHBondContact O-N 3.24Å; Q185-A188 PolarHBondContact O-N 3.43Å; Q185-F189 PolarHBondContact O-N 2.88Å |
| 186 | S | 87.3 | Confident | 81.8 | Confident | 37 Ų | 37 | 62.6 Ų | 62.6 | 26% | 0.259 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.1 | -34 | 174.2 | -58.1 | 0 | 0 | 0 | 0 | 112.6 | T182 T183 F189 | T182-S186 PolarHBondContact O-N 3.23Å; T182-S186 PolarHBondContact O-OG 3.48Å; T183-S186 PolarHBondContact O-N 3.19Å; S186-F189 CarbonylContact O-C 3.58Å |
| 187 | I | 85.7 | Confident | 80.8 | Confident | 10 Ų | 10 | 65 Ų | 65 | 5% | 0.051 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -71.3 | -40.5 | 173.9 | -66.6 | 165.1 | 0 | 0 | 0 | 111.4 | T183 C184 Q185 F189 I197 L200 L224 L225 | T183-I187 HydrophobicContact CG2-CD1 4.32Å; T183-I187 WeakPolarHBondContact O-CG1 3.49Å; T183-I187 PolarHBondContact O-N 3.36Å; T183-I187 VanDerWaalsContact O-N 3.11Å; C184-I187 PolarHBondContact O-N 3.44Å; Q185-I187 VanDerWaalsContact C-N 3.29Å; Q185-I187 PolarHBondContact O-N 3.24Å; I187-F189 VanDerWaalsContact C-N 3.31Å; I187-F189 PolarHBondContact O-N 2.94Å; I187-I197 HydrophobicContact CG2-CG2 3.86Å; I187-L200 HydrophobicContact CD1-CB 3.85Å; I187-L200 HydrophobicContact CG1-CB 3.76Å; I187-L200 HydrophobicContact CG1-CD1 3.64Å; I187-L200 HydrophobicContact CG1-CG 4.36Å; I187-L224 HydrophobicContact CD1-CB 4.45Å; I187-L224 HydrophobicContact CD1-CD2 3.95Å; I187-L225 HydrophobicContact CG2-CB 4.17Å; I187-L225 HydrophobicContact CG2-CD2 4.34Å |
| 188 | A | 85.3 | Confident | 79.7 | Confident | 41 Ų | 41 | 66.9 Ų | 66.9 | 34% | 0.339 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -67.6 | -30.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | C184 Q185 L225 | C184-A188 WeakPolarHBondContact O-CB 3.36Å; C184-A188 PolarHBondContact O-N 2.99Å; Q185-A188 PolarHBondContact O-N 3.43Å; A188-L225 HydrophobicContact CB-CD1 3.97Å |
| 189 | F | 83.3 | Confident | 79 | Confident | 115 Ų | 115 | 65.4 Ų | 65.4 | 50% | 0.504 | 40% | 0.398 | S | S | . | . | trans | -126.3 | 74.7 | -178.3 | -60.1 | -76.9 | 0 | 0 | 0 | 111.3 | Q185 S186 I187 S191 K192 | Q185-F189 PolarHBondContact O-N 2.88Å; S186-F189 CarbonylContact O-C 3.58Å; I187-F189 VanDerWaalsContact C-N 3.31Å; I187-F189 PolarHBondContact O-N 2.94Å; F189-S191 PolarHBondContact O-N 3.12Å; F189-K192 PolarHBondContact O-N 3.42Å; F189-K192 VanDerWaalsContact O-N 3.11Å | ||
| 190 | P | 72.6 | Confident | 78.6 | Confident | 66 Ų | 66 | 65.2 Ų | 65.2 | 43% | 0.429 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -62 | -17.9 | -173.8 | 24.6 | -34 | 0 | 0 | 0 | 113.6 | K192 T193 I197 | P190-K192 PolarHBondContact O-N 3.41Å; P190-T193 PolarHBondContact O-N 2.84Å; P190-T193 VanDerWaalsContact O-N 3.14Å; P190-I197 HydrophobicContact CB-CD1 4.24Å; P190-I197 HydrophobicContact CB-CG1 4.4Å; P190-I197 HydrophobicContact CG-CD1 4.48Å |
| 191 | S | 67.8 | Low | 78.5 | Confident | 124 Ų | 124 | 66.9 Ų | 66.9 | 87% | 0.867 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -59.6 | -15.6 | 174.3 | -44.6 | 0 | 0 | 0 | 0 | 114.2 | F189 | F189-S191 PolarHBondContact O-N 3.12Š|
| 192 | K | 65.1 | Low | 78.3 | Confident | 176 Ų | 176 | 64 Ų | 64 | 77% | 0.765 | 40% | 0.4 | S | S | * | . | G | 310 helix | trans | -99.7 | 2.4 | -179.7 | -63.7 | -175 | 178.7 | 177.3 | 0 | 113.6 | F189 P190 | F189-K192 PolarHBondContact O-N 3.42Å; F189-K192 VanDerWaalsContact O-N 3.11Å; P190-K192 PolarHBondContact O-N 3.41Å |
| 193 | T | 65.5 | Low | 78.1 | Confident | 46 Ų | 46 | 63.1 Ų | 63.1 | 28% | 0.282 | 39% | 0.394 | S | S | . | . | trans | -148 | 131.8 | -172.2 | -65.3 | 0 | 0 | 0 | 0 | 112 | P190 A195 L200 | P190-T193 PolarHBondContact O-N 2.84Å; P190-T193 VanDerWaalsContact O-N 3.14Å; T193-A195 VanDerWaalsContact C-N 3.32Å; T193-A195 HydrophobicContact CG2-CB 3.87Å; T193-L200 HydrophobicContact CG2-CD1 4.44Å | ||
| 194 | S | 61.1 | Low | 77.8 | Confident | 137 Ų | 137 | 62.3 Ų | 62.3 | 96% | 0.958 | 39% | 0.39 | S | S | * | . | S | Bend | trans | -81.7 | -7.6 | -178.3 | -33.9 | 0 | 0 | 0 | 0 | 114.1 | ||
| 195 | A | 68.9 | Low | 77.5 | Confident | 49 Ų | 49 | 64.4 Ų | 64.4 | 41% | 0.405 | 40% | 0.397 | S | S | . | . | S | Bend | trans | -84.5 | 149.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | T193 | T193-A195 VanDerWaalsContact C-N 3.32Å; T193-A195 HydrophobicContact CG2-CB 3.87Å |
| 196 | S | 69.4 | Low | 77.2 | Confident | 85 Ų | 85 | 67.9 Ų | 67.9 | 59% | 0.594 | 42% | 0.415 | S | S | * | . | trans | -63.8 | 138.9 | 174.7 | -178.2 | 0 | 0 | 0 | 0 | 110.7 | G198 S199 | S196-G198 PolarHBondContact O-N 3.3Å; S196-G198 VanDerWaalsContact O-N 3.09Å; S196-S199 PolarHBondContact N-OG 3.5Å; S196-S199 PolarHBondContact O-N 3.01Å; S196-S199 PolarHBondContact O-OG 2.87Å | ||
| 197 | I | 71.9 | Confident | 76.9 | Confident | 79 Ų | 79 | 70.4 Ų | 70.4 | 41% | 0.405 | 42% | 0.42 | S | S | . | . | G | 310 helix | trans | -54.9 | -32.5 | 178.8 | -66 | 164.7 | 0 | 0 | 0 | 111.4 | I187 P190 S199 G221 | I187-I197 HydrophobicContact CG2-CG2 3.86Å; P190-I197 HydrophobicContact CB-CD1 4.24Å; P190-I197 HydrophobicContact CB-CG1 4.4Å; P190-I197 HydrophobicContact CG-CD1 4.48Å; I197-S199 VanDerWaalsContact C-N 3.33Å; I197-S199 PolarHBondContact O-N 3.33Å; I197-G221 WeakPolarHBondContact O-CA 3.32Å |
| 198 | G | 68.9 | Low | 76.6 | Confident | 55 Ų | 55 | 73 Ų | 73 | 57% | 0.567 | 45% | 0.45 | S | S | * | . | G | 310 helix | trans | -73.5 | -17.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | S196 | S196-G198 PolarHBondContact O-N 3.3Å; S196-G198 VanDerWaalsContact O-N 3.09Å |
| 199 | S | 77.3 | Confident | 76.4 | Confident | 77 Ų | 77 | 72.8 Ų | 72.8 | 54% | 0.538 | 44% | 0.444 | S | S | . | . | G | 310 helix | trans | -92.1 | -9.3 | 179 | 54.6 | 0 | 0 | 0 | 0 | 114.1 | S196 I197 | S196-S199 PolarHBondContact N-OG 3.5Å; S196-S199 PolarHBondContact O-N 3.01Å; S196-S199 PolarHBondContact O-OG 2.87Å; I197-S199 VanDerWaalsContact C-N 3.33Å; I197-S199 PolarHBondContact O-N 3.33Å |
| 200 | L | 84.2 | Confident | 76.2 | Confident | 35 Ų | 35 | 67.6 Ų | 67.6 | 18% | 0.183 | 42% | 0.421 | C | S | . | . | trans | -85 | 114.4 | 176 | -66.5 | 170.1 | 0 | 0 | 0 | 109.2 | T183 I187 T193 C220 G221 | T183-L200 HydrophobicContact CG2-CB 4.09Å; I187-L200 HydrophobicContact CD1-CB 3.85Å; I187-L200 HydrophobicContact CG1-CB 3.76Å; I187-L200 HydrophobicContact CG1-CD1 3.64Å; I187-L200 HydrophobicContact CG1-CG 4.36Å; T193-L200 HydrophobicContact CG2-CD1 4.44Å; L200-C220 VanDerWaalsContact O-CA 3.32Å; L200-C220 WeakPolarHBondContact O-CA 3.44Å; L200-G221 PolarHBondContact O-N 2.88Å | ||
| 201 | C | 85.6 | Confident | 76.5 | Confident | 50 Ų | 50 | 67.2 Ų | 67.2 | 34% | 0.338 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136 | 144.7 | -173.9 | -53.9 | 0 | 0 | 0 | 0 | 111.1 | V219 C220 | C201-V219 CarbonylContact C-O 3.49Å; C201-V219 VanDerWaalsContact CA-O 3.27Å; C201-V219 WeakPolarHBondContact CA-O 3.44Å; C201-C220 HydrophobicContact CB-CB 3.96Å; C201-C220 WeakPolarHBondContact CB-SG 3.47Å; C201-C220 WeakPolarHBondContact SG-CB 3.48Å; C201-C220 CovalentContact SG-SG 2.02Å; C201-C220 PolarHBondContact SG-SG 3.03Å |
| 202 | A | 87 | Confident | 76.9 | Confident | 10 Ų | 10 | 69.9 Ų | 69.9 | 8% | 0.083 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 120.4 | 163 | 0 | 0 | 0 | 0 | 0 | 108.2 | T180 K218 V219 L224 | T180-A202 HydrophobicContact CG2-CB 3.98Å; A202-K218 WeakPolarHBondContact O-CA 3.41Å; A202-V219 PolarHBondContact N-O 3.48Å; A202-V219 PolarHBondContact O-N 3.22Å; A202-L224 HydrophobicContact CB-CD1 3.67Å; A202-L224 HydrophobicContact CB-CD2 3.94Å; A202-L224 HydrophobicContact CB-CG 4.48Å |
| 203 | D | 85.8 | Confident | 77.4 | Confident | 28 Ų | 28 | 68.3 Ų | 68.3 | 15% | 0.15 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 112.8 | 175.8 | -165.6 | -27.8 | 0 | 0 | 0 | 109.3 | R205 M206 Y207 K218 | D203-R205 VanDerWaalsContact C-N 3.25Å; D203-R205 PolarHBondContact O-N 2.93Å; D203-R205 VanDerWaalsContact OD1-CB 3.23Å; D203-R205 WeakPolarHBondContact OD1-CB 3.41Å; D203-R205 WeakPolarHBondContact OD1-CG 3.4Å; D203-R205 IonicContact OD1-CZ 2.92Å; D203-R205 PolarHBondContact OD1-N 3.05Å; D203-R205 IonicContact OD1-NE 3.5Å; D203-R205 PolarHBondContact OD1-NE 2.89Å; D203-R205 IonicContact OD1-NH2 2.73Å; D203-R205 IonicContact OD2-CZ 3.67Å; D203-R205 IonicContact OD2-NE 3.42Å; D203-R205 PolarHBondContact OD2-NE 3.24Å; D203-R205 IonicContact OD2-NH2 3.75Å; D203-R205 PolarHBondContact OD2-NH2 3.44Å; D203-M206 HydrophobicContact CB-CG 4.03Å; D203-M206 HydrophobicContact CB-SD 4.25Å; D203-Y207 WeakPolarHBondContact O-CD2 3.43Å; D203-K218 HydrophobicContact CB-CB 4.26Å |
| 204 | A | 82.2 | Confident | 77.9 | Confident | 14 Ų | 14 | 66.2 Ų | 66.2 | 12% | 0.116 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -74.5 | -18.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | F51 Y207 V209 L210 G217 | F51-A204 HydrophobicContact CD1-CB 3.93Å; F51-A204 HydrophobicContact CE1-CB 4.14Å; A204-Y207 PolarHBondContact O-N 3.31Å; A204-V209 PolarHBondContact O-N 2.9Å; A204-L210 HydrophobicContact CB-CD1 3.55Å; A204-G217 PolarHBondContact N-O 3.41Å |
| 205 | R | 82.8 | Confident | 78.6 | Confident | 47 Ų | 47 | 67.4 Ų | 67.4 | 18% | 0.177 | 39% | 0.386 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.9 | -31.1 | -178.7 | -56.1 | 167.7 | -65 | 170.7 | 5.8 | 111.9 | D203 Y207 G208 L210 | D203-R205 VanDerWaalsContact C-N 3.25Å; D203-R205 PolarHBondContact O-N 2.93Å; D203-R205 VanDerWaalsContact OD1-CB 3.23Å; D203-R205 WeakPolarHBondContact OD1-CB 3.41Å; D203-R205 WeakPolarHBondContact OD1-CG 3.4Å; D203-R205 IonicContact OD1-CZ 2.92Å; D203-R205 PolarHBondContact OD1-N 3.05Å; D203-R205 IonicContact OD1-NE 3.5Å; D203-R205 PolarHBondContact OD1-NE 2.89Å; D203-R205 IonicContact OD1-NH2 2.73Å; D203-R205 IonicContact OD2-CZ 3.67Å; D203-R205 IonicContact OD2-NE 3.42Å; D203-R205 PolarHBondContact OD2-NE 3.24Å; D203-R205 IonicContact OD2-NH2 3.75Å; D203-R205 PolarHBondContact OD2-NH2 3.44Å; R205-Y207 PolarHBondContact O-N 3.31Å; R205-G208 PolarHBondContact O-N 2.92Å; R205-L210 HydrophobicContact CG-CB 4.18Å |
| 206 | M | 83.6 | Confident | 78.8 | Confident | 145 Ų | 145 | 67.3 Ų | 67.3 | 71% | 0.714 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -27.6 | 176.5 | -69.4 | -170.2 | 129.2 | 0 | 0 | 112.8 | D203 | D203-M206 HydrophobicContact CB-CG 4.03Å; D203-M206 HydrophobicContact CB-SD 4.25Å |
| 207 | Y | 81.8 | Confident | 79.1 | Confident | 89 Ų | 89 | 63.2 Ų | 63.2 | 35% | 0.349 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.7 | 4.2 | 179.3 | -58.2 | -68.3 | 0 | 0 | 0 | 113.2 | Y175 I176 D203 A204 R205 V209 | Y175-Y207 HydrophobicContact CE1-CE1 4.38Å; I176-Y207 HydrophobicContact CD1-CD1 4.04Å; I176-Y207 HydrophobicContact CD1-CG 3.92Å; I176-Y207 HydrophobicContact CG1-CD1 3.53Å; I176-Y207 HydrophobicContact CG1-CD2 4.29Å; I176-Y207 HydrophobicContact CG1-CE1 3.9Å; I176-Y207 HydrophobicContact CG1-CG 3.72Å; I176-Y207 HydrophobicContact CG2-CD2 3.88Å; I176-Y207 HydrophobicContact CG2-CE2 4.05Å; I176-Y207 HydrophobicContact CG2-CG 4.14Å; D203-Y207 WeakPolarHBondContact O-CD2 3.43Å; A204-Y207 PolarHBondContact O-N 3.31Å; R205-Y207 PolarHBondContact O-N 3.31Å; Y207-V209 PolarHBondContact O-N 3.48Å |
| 208 | G | 78.6 | Confident | 79.7 | Confident | 66 Ų | 66 | 65 Ų | 65 | 68% | 0.68 | 36% | 0.357 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.7 | 13.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | R205 | R205-G208 PolarHBondContact O-N 2.92Š|
| 209 | V | 80.8 | Confident | 80.6 | Confident | 36 Ų | 36 | 63 Ų | 63 | 22% | 0.218 | 33% | 0.334 | C | S | . | . | S | Bend | trans | -76.3 | -34.2 | -179.9 | -177.6 | 0 | 0 | 0 | 0 | 110.9 | I47 L61 A204 Y207 | I47-V209 HydrophobicContact CD1-CG1 3.58Å; L61-V209 HydrophobicContact CD1-CG1 3.93Å; L61-V209 HydrophobicContact CD2-CG1 3.72Å; L61-V209 HydrophobicContact CG-CG1 4.49Å; A204-V209 PolarHBondContact O-N 2.9Å; Y207-V209 PolarHBondContact O-N 3.48Å |
| 210 | L | 79.7 | Confident | 81.1 | Confident | 6 Ų | 6 | 61.1 Ų | 61.1 | 3% | 0.031 | 32% | 0.321 | C | S | . | . | S | Bend | trans | -126.1 | 149 | 175.7 | -76 | 95.1 | 0 | 0 | 0 | 111.3 | I47 A204 R205 A214 | I47-L210 HydrophobicContact CD1-CD1 4.41Å; I47-L210 HydrophobicContact CG2-CD1 4.15Å; I47-L210 HydrophobicContact CG2-CD2 4.29Å; A204-L210 HydrophobicContact CB-CD1 3.55Å; R205-L210 HydrophobicContact CG-CB 4.18Å; L210-A214 HydrophobicContact CB-CB 3.91Å; L210-A214 HydrophobicContact CD2-CB 3.65Å; L210-A214 HydrophobicContact CG-CB 4.41Å |
| 211 | P | 77.8 | Confident | 81.2 | Confident | 58 Ų | 58 | 59.8 Ų | 59.8 | 38% | 0.377 | 32% | 0.315 | S | S | . | . | trans | -62.9 | 153 | 172.4 | 27.6 | -33.8 | 0 | 0 | 0 | 111 | D57 N213 A214 | D57-P211 HydrophobicContact CB-CG 4.23Å; D57-P211 WeakPolarHBondContact O-CD 3.18Å; D57-P211 WeakPolarHBondContact O-CG 3.42Å; P211-N213 PolarHBondContact O-N 3.42Å; P211-A214 HydrophobicContact CG-CB 4.34Å; P211-A214 VanDerWaalsContact O-CB 3.27Å; P211-A214 WeakPolarHBondContact O-CB 3.12Å; P211-A214 PolarHBondContact O-N 3.26Å | ||
| 212 | W | 76.3 | Confident | 81.2 | Confident | 180 Ų | 180 | 61.6 Ų | 61.6 | 68% | 0.682 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -21.9 | -179.8 | -71.6 | 89.9 | 0 | 0 | 0 | 113.8 | A214 | W212-A214 VanDerWaalsContact C-N 3.33Š|
| 213 | N | 75.9 | Confident | 81.2 | Confident | 143 Ų | 143 | 66.3 Ų | 66.3 | 77% | 0.765 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.1 | -9.8 | 178.5 | -60.3 | -23.9 | 0 | 0 | 0 | 113.7 | P211 F215 | P211-N213 PolarHBondContact O-N 3.42Å; N213-F215 PolarHBondContact O-N 2.95Å |
| 214 | A | 76.1 | Confident | 81.2 | Confident | 2 Ų | 2 | 65 Ų | 65 | 2% | 0.017 | 35% | 0.345 | C | S | . | . | trans | -67.4 | 129.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | D57 L210 P211 W212 | D57-A214 HydrophobicContact CB-CB 3.97Å; L210-A214 HydrophobicContact CB-CB 3.91Å; L210-A214 HydrophobicContact CD2-CB 3.65Å; L210-A214 HydrophobicContact CG-CB 4.41Å; P211-A214 HydrophobicContact CG-CB 4.34Å; P211-A214 VanDerWaalsContact O-CB 3.27Å; P211-A214 WeakPolarHBondContact O-CB 3.12Å; P211-A214 PolarHBondContact O-N 3.26Å; W212-A214 VanDerWaalsContact C-N 3.33Å | ||
| 215 | F | 76 | Confident | 81.6 | Confident | 161 Ų | 161 | 66.1 Ų | 66.1 | 71% | 0.706 | 35% | 0.349 | S | S | * | . | S | Bend | trans | -121.4 | 128 | 176.9 | -166.3 | -93.3 | 0 | 0 | 0 | 110.6 | N213 | N213-F215 PolarHBondContact O-N 2.95Š|
| 216 | P | 73.4 | Confident | 81.9 | Confident | 47 Ų | 47 | 66.9 Ų | 66.9 | 31% | 0.305 | 36% | 0.361 | S | S | . | . | B | Isolated β-bridge | cis | -78.1 | -23.9 | 8.2 | 28.4 | -35.1 | 0 | 0 | 0 | 116.1 | F51 K218 | F51-P216 WeakPolarHBondContact O-CD 3.36Å; P216-K218 PolarHBondContact O-N 3.21Å |
| 217 | G | 74.4 | Confident | 82.2 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 33% | 0.328 | C | S | . | . | trans | 65.4 | -24.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 117.2 | F51 A204 | F51-G217 PolarHBondContact O-N 2.95Å; A204-G217 PolarHBondContact N-O 3.41Å | ||
| 218 | K | 85.8 | Confident | 82.6 | Confident | 115 Ų | 115 | 56 Ų | 56 | 50% | 0.5 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 143 | 175 | 67.4 | 178.6 | -176.9 | 176.1 | 0 | 110 | A202 D203 P216 | A202-K218 WeakPolarHBondContact O-CA 3.41Å; D203-K218 HydrophobicContact CB-CB 4.26Å; P216-K218 PolarHBondContact O-N 3.21Å |
| 219 | V | 86.7 | Confident | 83.3 | Confident | 15 Ų | 15 | 60.4 Ų | 60.4 | 9% | 0.091 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 132.9 | 175.9 | -172.3 | 0 | 0 | 0 | 0 | 109.5 | F51 C201 A202 N223 L224 I227 | F51-V219 HydrophobicContact CD1-CG2 3.99Å; F51-V219 HydrophobicContact CE1-CB 4.33Å; F51-V219 HydrophobicContact CE1-CG2 3.72Å; F51-V219 HydrophobicContact CZ-CG2 4.13Å; C201-V219 CarbonylContact C-O 3.49Å; C201-V219 VanDerWaalsContact CA-O 3.27Å; C201-V219 WeakPolarHBondContact CA-O 3.44Å; A202-V219 PolarHBondContact N-O 3.48Å; A202-V219 PolarHBondContact O-N 3.22Å; V219-N223 HydrophobicContact CG1-CB 3.83Å; V219-L224 HydrophobicContact CB-CD1 4.44Å; V219-L224 HydrophobicContact CG1-CB 4.1Å; V219-I227 HydrophobicContact CB-CD1 4.3Å; V219-I227 HydrophobicContact CG1-CD1 3.81Å; V219-I227 HydrophobicContact CG2-CD1 4.24Å |
| 220 | C | 89.2 | Confident | 83.8 | Confident | 37 Ų | 37 | 60 Ų | 60 | 25% | 0.25 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 157.2 | -172.2 | -50.6 | 0 | 0 | 0 | 0 | 112.6 | L200 C201 | L200-C220 VanDerWaalsContact O-CA 3.32Å; L200-C220 WeakPolarHBondContact O-CA 3.44Å; C201-C220 HydrophobicContact CB-CB 3.96Å; C201-C220 WeakPolarHBondContact CB-SG 3.47Å; C201-C220 WeakPolarHBondContact SG-CB 3.48Å; C201-C220 CovalentContact SG-SG 2.02Å; C201-C220 PolarHBondContact SG-SG 3.03Å |
| 221 | G | 86.3 | Confident | 84.3 | Confident | 6 Ų | 6 | 63.1 Ų | 63.1 | 6% | 0.062 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | 60.7 | -136.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 115 | I197 L200 N223 L224 L225 | I197-G221 WeakPolarHBondContact O-CA 3.32Å; L200-G221 PolarHBondContact O-N 2.88Å; G221-N223 VanDerWaalsContact C-N 3.29Å; G221-N223 PolarHBondContact O-N 3.44Å; G221-L224 WeakPolarHBondContact O-CB 3.23Å; G221-L224 PolarHBondContact O-N 2.92Å; G221-L224 VanDerWaalsContact O-N 3.15Å; G221-L225 PolarHBondContact O-N 2.94Å; G221-L225 VanDerWaalsContact O-N 3.09Å |
| 222 | S | 84.9 | Confident | 84.8 | Confident | 88 Ų | 88 | 64 Ų | 64 | 62% | 0.615 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -63.4 | -31.1 | -175.6 | 50.3 | 0 | 0 | 0 | 0 | 113.8 | L225 S226 | S222-L225 PolarHBondContact O-N 3.01Å; S222-S226 PolarHBondContact O-N 3.38Å |
| 223 | N | 86.9 | Confident | 85.6 | Confident | 109 Ų | 109 | 55.7 Ų | 55.7 | 58% | 0.583 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -64.2 | -43.3 | 174.4 | -69.3 | -31.2 | 0 | 0 | 0 | 110.7 | V219 G221 L225 S226 I227 | V219-N223 HydrophobicContact CG1-CB 3.83Å; G221-N223 VanDerWaalsContact C-N 3.29Å; G221-N223 PolarHBondContact O-N 3.44Å; N223-L225 VanDerWaalsContact C-N 3.33Å; N223-L225 PolarHBondContact O-N 3.43Å; N223-S226 PolarHBondContact O-N 3.47Å; N223-S226 PolarHBondContact O-OG 2.88Å; N223-I227 WeakPolarHBondContact O-CG1 3.32Å; N223-I227 PolarHBondContact O-N 3.42Å |
| 224 | L | 87.2 | Confident | 86.4 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 175.5 | -177.3 | 62.3 | 0 | 0 | 0 | 111.4 | T180 T183 I187 A202 V219 G221 S226 I227 C228 | T180-L224 HydrophobicContact CG2-CD1 4.23Å; T183-L224 HydrophobicContact CG2-CD2 3.9Å; I187-L224 HydrophobicContact CD1-CB 4.45Å; I187-L224 HydrophobicContact CD1-CD2 3.95Å; A202-L224 HydrophobicContact CB-CD1 3.67Å; A202-L224 HydrophobicContact CB-CD2 3.94Å; A202-L224 HydrophobicContact CB-CG 4.48Å; V219-L224 HydrophobicContact CB-CD1 4.44Å; V219-L224 HydrophobicContact CG1-CB 4.1Å; G221-L224 WeakPolarHBondContact O-CB 3.23Å; G221-L224 PolarHBondContact O-N 2.92Å; G221-L224 VanDerWaalsContact O-N 3.15Å; L224-S226 VanDerWaalsContact C-N 3.3Å; L224-S226 PolarHBondContact O-N 3.24Å; L224-I227 PolarHBondContact O-N 3.19Å; L224-C228 PolarHBondContact O-N 3.01Å |
| 225 | L | 88.6 | Confident | 87.2 | Confident | 38 Ų | 38 | 56.6 Ų | 56.6 | 20% | 0.199 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.3 | -38.5 | 175.8 | -177.4 | 64.3 | 0 | 0 | 0 | 112.3 | I187 A188 G221 S222 N223 I227 C228 K229 | I187-L225 HydrophobicContact CG2-CB 4.17Å; I187-L225 HydrophobicContact CG2-CD2 4.34Å; A188-L225 HydrophobicContact CB-CD1 3.97Å; G221-L225 PolarHBondContact O-N 2.94Å; G221-L225 VanDerWaalsContact O-N 3.09Å; S222-L225 PolarHBondContact O-N 3.01Å; N223-L225 VanDerWaalsContact C-N 3.33Å; N223-L225 PolarHBondContact O-N 3.43Å; L225-I227 VanDerWaalsContact C-N 3.34Å; L225-C228 PolarHBondContact O-N 3.39Å; L225-K229 WeakPolarHBondContact O-CG 3.35Å; L225-K229 PolarHBondContact O-N 3.18Å |
| 226 | S | 90.1 | Very high | 88 | Confident | 63 Ų | 63 | 49.1 Ų | 49.1 | 44% | 0.441 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 176.9 | 75.7 | 0 | 0 | 0 | 0 | 111.9 | S222 N223 L224 K229 T230 | S222-S226 PolarHBondContact O-N 3.38Å; N223-S226 PolarHBondContact O-N 3.47Å; N223-S226 PolarHBondContact O-OG 2.88Å; L224-S226 VanDerWaalsContact C-N 3.3Å; L224-S226 PolarHBondContact O-N 3.24Å; S226-K229 PolarHBondContact O-N 2.98Å; S226-T230 WeakPolarHBondContact O-CG2 3.46Å; S226-T230 PolarHBondContact O-N 3.36Å |
| 227 | I | 90 | Very high | 89 | Confident | 5 Ų | 5 | 47.7 Ų | 47.7 | 3% | 0.026 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63 | -46.9 | 176.6 | -63.2 | 168.7 | 0 | 0 | 0 | 110.5 | L46 Y50 V219 N223 L224 L225 K229 T230 F233 | L46-I227 HydrophobicContact CD1-CG2 3.91Å; Y50-I227 HydrophobicContact CD1-CD1 3.86Å; Y50-I227 HydrophobicContact CD1-CG1 3.57Å; Y50-I227 HydrophobicContact CD2-CG1 4.44Å; Y50-I227 HydrophobicContact CD2-CG2 4.47Å; Y50-I227 HydrophobicContact CE1-CG1 3.96Å; Y50-I227 HydrophobicContact CG-CD1 3.89Å; Y50-I227 HydrophobicContact CG-CG1 3.84Å; V219-I227 HydrophobicContact CB-CD1 4.3Å; V219-I227 HydrophobicContact CG1-CD1 3.81Å; V219-I227 HydrophobicContact CG2-CD1 4.24Å; N223-I227 WeakPolarHBondContact O-CG1 3.32Å; N223-I227 PolarHBondContact O-N 3.42Å; L224-I227 PolarHBondContact O-N 3.19Å; L225-I227 VanDerWaalsContact C-N 3.34Å; I227-K229 PolarHBondContact O-N 2.96Å; I227-T230 WeakPolarHBondContact O-CB 3.4Å; I227-T230 WeakPolarHBondContact O-CG2 3.33Å; I227-T230 PolarHBondContact O-N 3.04Å; I227-T230 PolarHBondContact O-OG1 2.9Å; I227-F233 HydrophobicContact CG2-CD2 4.48Å; I227-F233 WeakPolarHBondContact O-CB 3.33Å |
| 228 | C | 90.9 | Very high | 90.1 | Very high | 2 Ų | 2 | 52.6 Ų | 52.6 | 1% | 0.014 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.2 | -24.7 | 179.7 | -81.3 | 0 | 0 | 0 | 0 | 114.2 | W181 C184 L224 L225 Q234 | W181-C228 HydrophobicContact CE3-CB 4.47Å; C184-C228 HydrophobicContact CB-CB 3.49Å; C184-C228 VanDerWaalsContact CB-CB 3.49Å; C184-C228 WeakPolarHBondContact CB-SG 3.01Å; C184-C228 WeakPolarHBondContact SG-CB 3.4Å; C184-C228 CovalentContact SG-SG 2.01Å; C184-C228 PolarHBondContact SG-SG 3.26Å; L224-C228 PolarHBondContact O-N 3.01Å; L225-C228 PolarHBondContact O-N 3.39Å; C228-Q234 PolarHBondContact O-NE2 2.99Å |
| 229 | K | 91.4 | Very high | 90.6 | Very high | 157 Ų | 157 | 49 Ų | 49 | 68% | 0.683 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -11.2 | 174.6 | -73 | -177.1 | 177.8 | -177.8 | 0 | 113.5 | L225 S226 I227 | L225-K229 WeakPolarHBondContact O-CG 3.35Å; L225-K229 PolarHBondContact O-N 3.18Å; S226-K229 PolarHBondContact O-N 2.98Å; I227-K229 PolarHBondContact O-N 2.96Å |
| 230 | T | 92.1 | Very high | 91 | Very high | 27 Ų | 27 | 49.1 Ų | 49.1 | 17% | 0.166 | 27% | 0.27 | C | S | . | . | S | Bend | trans | -66.9 | 143.5 | 177.6 | 65.3 | 0 | 0 | 0 | 0 | 110.9 | S226 I227 E232 F233 Q234 | S226-T230 WeakPolarHBondContact O-CG2 3.46Å; S226-T230 PolarHBondContact O-N 3.36Å; I227-T230 WeakPolarHBondContact O-CB 3.4Å; I227-T230 WeakPolarHBondContact O-CG2 3.33Å; I227-T230 PolarHBondContact O-N 3.04Å; I227-T230 PolarHBondContact O-OG1 2.9Å; T230-E232 PolarHBondContact O-N 3.02Å; T230-F233 PolarHBondContact O-N 3.37Å; T230-F233 WeakPolarHBondContact OG1-CB 3.35Å; T230-F233 PolarHBondContact OG1-N 3.09Å; T230-Q234 PolarHBondContact O-N 3.47Å |
| 231 | A | 89.8 | Confident | 91.4 | Very high | 72 Ų | 72 | 50.3 Ų | 50.3 | 60% | 0.595 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -60.6 | -35.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | F233 Q234 M235 | A231-F233 PolarHBondContact O-N 3.16Å; A231-Q234 PolarHBondContact O-N 3.33Å; A231-M235 VanDerWaalsContact O-CB 3.3Å; A231-M235 WeakPolarHBondContact O-CB 3.5Å; A231-M235 WeakPolarHBondContact O-CG 3.48Å; A231-M235 PolarHBondContact O-N 3.34Å |
| 232 | E | 89.8 | Confident | 91.9 | Very high | 77 Ų | 77 | 51.3 Ų | 51.3 | 36% | 0.36 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -57.1 | -49.4 | 178.1 | -58.2 | -70.4 | 168.5 | 0 | 0 | 111.8 | K45 T230 T236 | K45-E232 IonicContact NZ-OE1 3.53Å; K45-E232 PolarHBondContact NZ-OE1 2.88Å; K45-E232 IonicContact NZ-OE2 2.93Å; T230-E232 PolarHBondContact O-N 3.02Å; E232-T236 VanDerWaalsContact O-CB 3.3Å; E232-T236 WeakPolarHBondContact O-CB 3.46Å; E232-T236 PolarHBondContact O-N 3.28Å; E232-T236 PolarHBondContact O-OG1 3.37Å |
| 233 | F | 91.7 | Very high | 92.5 | Very high | 5 Ų | 5 | 47.3 Ų | 47.3 | 2% | 0.022 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66.3 | -45 | 178.8 | -177.6 | -90 | 0 | 0 | 0 | 112.1 | L46 Y177 T180 W181 I227 T230 A231 T236 F237 | L46-F233 HydrophobicContact CD1-CB 4.36Å; L46-F233 HydrophobicContact CD2-CD2 3.88Å; Y177-F233 AromaticContact CD1-CD2 3.95Å; Y177-F233 HydrophobicContact CD1-CD2 3.95Å; Y177-F233 HydrophobicContact CD1-CE1 4.39Å; Y177-F233 AromaticContact CD1-CE2 3.4Å; Y177-F233 HydrophobicContact CD1-CE2 3.4Å; Y177-F233 AromaticContact CD1-CZ 3.65Å; Y177-F233 HydrophobicContact CD1-CZ 3.65Å; Y177-F233 AromaticContact CE1-CD2 3.73Å; Y177-F233 HydrophobicContact CE1-CD2 3.73Å; Y177-F233 AromaticContact CE1-CE2 3.58Å; Y177-F233 HydrophobicContact CE1-CE2 3.58Å; Y177-F233 HydrophobicContact CE1-CZ 4.28Å; Y177-F233 HydrophobicContact CG-CE2 4.46Å; T180-F233 HydrophobicContact CG2-CE2 3.85Å; T180-F233 HydrophobicContact CG2-CZ 3.8Å; W181-F233 HydrophobicContact CB-CE1 4.4Å; W181-F233 HydrophobicContact CE3-CE1 4.14Å; I227-F233 HydrophobicContact CG2-CD2 4.48Å; I227-F233 WeakPolarHBondContact O-CB 3.33Å; T230-F233 PolarHBondContact O-N 3.37Å; T230-F233 WeakPolarHBondContact OG1-CB 3.35Å; T230-F233 PolarHBondContact OG1-N 3.09Å; A231-F233 PolarHBondContact O-N 3.16Å; F233-T236 PolarHBondContact O-N 2.92Å; F233-F237 WeakPolarHBondContact O-CB 3.44Å; F233-F237 PolarHBondContact O-N 3.1Å |
| 234 | Q | 92.4 | Very high | 93 | Very high | 46 Ų | 46 | 44.9 Ų | 44.9 | 22% | 0.215 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.6 | -48.8 | 179.1 | -72 | -58 | -65.1 | 0 | 0 | 112 | W181 C228 T230 A231 F237 H238 | W181-Q234 VanDerWaalsContact CE3-NE2 3.34Å; C228-Q234 PolarHBondContact O-NE2 2.99Å; T230-Q234 PolarHBondContact O-N 3.47Å; A231-Q234 PolarHBondContact O-N 3.33Å; Q234-F237 PolarHBondContact O-N 2.73Å; Q234-H238 PolarHBondContact O-CD2 3.02Å; Q234-H238 PolarHBondContact O-N 3.46Å; Q234-H238 VanDerWaalsContact O-N 3.1Å |
| 235 | M | 93.6 | Very high | 93.5 | Very high | 118 Ų | 118 | 48.7 Ų | 48.7 | 58% | 0.581 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -62.1 | -49.6 | 179.7 | -67.8 | -64.7 | -79.4 | 0 | 0 | 109.9 | A231 F237 H238 L239 | A231-M235 VanDerWaalsContact O-CB 3.3Å; A231-M235 WeakPolarHBondContact O-CB 3.5Å; A231-M235 WeakPolarHBondContact O-CG 3.48Å; A231-M235 PolarHBondContact O-N 3.34Å; M235-F237 VanDerWaalsContact C-N 3.28Å; M235-F237 PolarHBondContact O-N 3Å; M235-H238 PolarHBondContact O-N 3.35Å; M235-H238 VanDerWaalsContact O-N 3.13Å; M235-L239 HydrophobicContact CB-CD1 4.49Å; M235-L239 WeakPolarHBondContact O-CD1 3.37Å; M235-L239 PolarHBondContact O-N 2.88Å |
| 236 | T | 93.8 | Very high | 93.9 | Very high | 4 Ų | 4 | 46.9 Ų | 46.9 | 3% | 0.025 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.5 | -41.5 | 179.4 | -55 | 0 | 0 | 0 | 0 | 112.2 | A39 Y177 E232 F233 L239 F240 | A39-T236 HydrophobicContact CB-CG2 4.41Å; A39-T236 WeakPolarHBondContact O-CG2 3.3Å; Y177-T236 HydrophobicContact CE1-CG2 3.86Å; Y177-T236 HydrophobicContact CE2-CG2 4.3Å; Y177-T236 VanDerWaalsContact OH-CG2 3.25Å; Y177-T236 WeakPolarHBondContact OH-CG2 3.06Å; E232-T236 VanDerWaalsContact O-CB 3.3Å; E232-T236 WeakPolarHBondContact O-CB 3.46Å; E232-T236 PolarHBondContact O-N 3.28Å; E232-T236 PolarHBondContact O-OG1 3.37Å; F233-T236 PolarHBondContact O-N 2.92Å; T236-L239 PolarHBondContact O-N 2.96Å; T236-F240 HydrophobicContact CG2-CD2 3.81Å; T236-F240 HydrophobicContact CG2-CE2 3.56Å; T236-F240 VanDerWaalsContact O-CD2 3.3Å; T236-F240 WeakPolarHBondContact O-CD2 3.38Å; T236-F240 PolarHBondContact O-N 3.13Å |
| 237 | F | 94.1 | Very high | 94.2 | Very high | 18 Ų | 18 | 43.9 Ų | 43.9 | 8% | 0.079 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.4 | -47.9 | 176.3 | 177.2 | -131.2 | 0 | 0 | 0 | 112.5 | Y177 F178 F233 Q234 M235 L239 F240 I241 | Y177-F237 VanDerWaalsContact CB-CD2 3.45Å; Y177-F237 HydrophobicContact CD1-CB 4.1Å; Y177-F237 HydrophobicContact CG-CD2 4.34Å; F178-F237 HydrophobicContact CB-CE2 4.32Å; F178-F237 HydrophobicContact CD2-CZ 4.29Å; F233-F237 WeakPolarHBondContact O-CB 3.44Å; F233-F237 PolarHBondContact O-N 3.1Å; Q234-F237 PolarHBondContact O-N 2.73Å; M235-F237 VanDerWaalsContact C-N 3.28Å; M235-F237 PolarHBondContact O-N 3Å; F237-L239 VanDerWaalsContact C-N 3.32Å; F237-L239 PolarHBondContact O-N 2.69Å; F237-F240 PolarHBondContact O-N 2.73Å; F237-I241 HydrophobicContact CD1-CD1 4.27Å; F237-I241 HydrophobicContact CD2-CD1 4.18Å; F237-I241 HydrophobicContact CD2-CG1 4.48Å; F237-I241 HydrophobicContact CE1-CD1 3.9Å; F237-I241 HydrophobicContact CE2-CD1 3.83Å; F237-I241 HydrophobicContact CE2-CG1 4.24Å; F237-I241 HydrophobicContact CG-CD1 4.43Å; F237-I241 HydrophobicContact CZ-CD1 3.69Å; F237-I241 WeakPolarHBondContact O-CG1 3.36Å; F237-I241 PolarHBondContact O-N 2.73Å; F237-I241 VanDerWaalsContact O-N 3.16Å |
| 238 | H | 96.1 | Very high | 94.5 | Very high | 103 Ų | 103 | 44.7 Ų | 44.7 | 48% | 0.477 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -64.4 | -36.7 | 177.4 | -72.7 | -58 | 0 | 0 | 0 | 112.6 | Q234 M235 I241 A242 | Q234-H238 PolarHBondContact O-CD2 3.02Å; Q234-H238 PolarHBondContact O-N 3.46Å; Q234-H238 VanDerWaalsContact O-N 3.1Å; M235-H238 PolarHBondContact O-N 3.35Å; M235-H238 VanDerWaalsContact O-N 3.13Å; H238-I241 PolarHBondContact O-N 3.42Å; H238-A242 WeakPolarHBondContact O-CB 3.25Å; H238-A242 PolarHBondContact O-N 2.99Å |
| 239 | L | 96.4 | Very high | 94.7 | Very high | 39 Ų | 39 | 45.6 Ų | 45.6 | 20% | 0.204 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.2 | -39.7 | 176.5 | -88.9 | 67.9 | 0 | 0 | 0 | 112 | C35 E38 A39 M235 T236 F237 I241 A242 A243 | C35-L239 HydrophobicContact CB-CB 4.41Å; C35-L239 HydrophobicContact CB-CG 4.48Å; C35-L239 WeakPolarHBondContact CB-O 3.42Å; E38-L239 HydrophobicContact CB-CD2 3.25Å; E38-L239 HydrophobicContact CG-CD2 4.41Å; A39-L239 HydrophobicContact CB-CB 3.9Å; M235-L239 HydrophobicContact CB-CD1 4.49Å; M235-L239 WeakPolarHBondContact O-CD1 3.37Å; M235-L239 PolarHBondContact O-N 2.88Å; T236-L239 PolarHBondContact O-N 2.96Å; F237-L239 VanDerWaalsContact C-N 3.32Å; F237-L239 PolarHBondContact O-N 2.69Å; L239-I241 VanDerWaalsContact C-N 3.34Å; L239-I241 PolarHBondContact O-N 2.72Å; L239-A242 PolarHBondContact O-N 2.75Å; L239-A243 WeakPolarHBondContact O-CB 3.31Å; L239-A243 PolarHBondContact O-N 3.32Å |
| 240 | F | 96.1 | Very high | 94.9 | Very high | 17 Ų | 17 | 38.1 Ų | 38.1 | 8% | 0.075 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.9 | -38.1 | 173.6 | -84.1 | -59.1 | 0 | 0 | 0 | 112.7 | A39 L40 T43 P173 V174 Y177 T236 F237 A243 F244 | A39-F240 HydrophobicContact CB-CD1 3.91Å; A39-F240 HydrophobicContact CB-CD2 3.97Å; A39-F240 HydrophobicContact CB-CE1 3.77Å; A39-F240 HydrophobicContact CB-CE2 3.83Å; A39-F240 HydrophobicContact CB-CG 4Å; A39-F240 HydrophobicContact CB-CZ 3.72Å; L40-F240 HydrophobicContact CD1-CE1 4.24Å; T43-F240 WeakPolarHBondContact OG1-CE2 3.3Å; P173-F240 HydrophobicContact CB-CD1 3.65Å; P173-F240 HydrophobicContact CB-CD2 4.35Å; P173-F240 HydrophobicContact CB-CE1 3.58Å; P173-F240 HydrophobicContact CB-CE2 4.29Å; P173-F240 HydrophobicContact CB-CG 4.06Å; P173-F240 HydrophobicContact CB-CZ 3.92Å; P173-F240 HydrophobicContact CG-CD1 3.75Å; P173-F240 HydrophobicContact CG-CE1 3.83Å; V174-F240 HydrophobicContact CG2-CB 4.07Å; V174-F240 WeakPolarHBondContact CG2-O 3.25Å; Y177-F240 AromaticContact CD2-CD2 3.78Å; Y177-F240 HydrophobicContact CD2-CD2 3.78Å; Y177-F240 AromaticContact CD2-CE2 3.95Å; Y177-F240 HydrophobicContact CD2-CE2 3.95Å; Y177-F240 AromaticContact CE2-CD2 3.65Å; Y177-F240 HydrophobicContact CE2-CD2 3.65Å; Y177-F240 AromaticContact CE2-CE2 3.35Å; Y177-F240 HydrophobicContact CE2-CE2 3.35Å; Y177-F240 HydrophobicContact CE2-CZ 4.41Å; Y177-F240 HydrophobicContact CG-CD2 4.47Å; Y177-F240 AromaticContact CZ-CE2 3.92Å; T236-F240 HydrophobicContact CG2-CD2 3.81Å; T236-F240 HydrophobicContact CG2-CE2 3.56Å; T236-F240 VanDerWaalsContact O-CD2 3.3Å; T236-F240 WeakPolarHBondContact O-CD2 3.38Å; T236-F240 PolarHBondContact O-N 3.13Å; F237-F240 PolarHBondContact O-N 2.73Å; F240-A243 PolarHBondContact O-N 2.94Å; F240-F244 WeakPolarHBondContact O-CB 3.04Å; F240-F244 PolarHBondContact O-N 3.04Å |
| 241 | I | 96.9 | Very high | 95 | Very high | 62 Ų | 62 | 37.9 Ų | 37.9 | 32% | 0.318 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -63.6 | -46.4 | 173.6 | -64.3 | 166.4 | 0 | 0 | 0 | 110.3 | V174 F237 H238 L239 A243 F244 V245 | V174-I241 HydrophobicContact CG1-CG1 4.34Å; F237-I241 HydrophobicContact CD1-CD1 4.27Å; F237-I241 HydrophobicContact CD2-CD1 4.18Å; F237-I241 HydrophobicContact CD2-CG1 4.48Å; F237-I241 HydrophobicContact CE1-CD1 3.9Å; F237-I241 HydrophobicContact CE2-CD1 3.83Å; F237-I241 HydrophobicContact CE2-CG1 4.24Å; F237-I241 HydrophobicContact CG-CD1 4.43Å; F237-I241 HydrophobicContact CZ-CD1 3.69Å; F237-I241 WeakPolarHBondContact O-CG1 3.36Å; F237-I241 PolarHBondContact O-N 2.73Å; F237-I241 VanDerWaalsContact O-N 3.16Å; H238-I241 PolarHBondContact O-N 3.42Å; L239-I241 VanDerWaalsContact C-N 3.34Å; L239-I241 PolarHBondContact O-N 2.72Å; I241-A243 VanDerWaalsContact C-N 3.31Å; I241-A243 PolarHBondContact O-N 2.89Å; I241-F244 WeakPolarHBondContact O-CB 3.48Å; I241-F244 PolarHBondContact O-N 3.49Å; I241-V245 WeakPolarHBondContact O-CG2 3.44Å; I241-V245 PolarHBondContact O-N 3.22Å |
| 242 | A | 97.3 | Very high | 95.2 | Very high | 27 Ų | 27 | 39 Ų | 39 | 22% | 0.223 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61 | -40.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L31 C35 H238 L239 V245 G246 | L31-A242 HydrophobicContact CD1-CB 4.47Å; L31-A242 WeakPolarHBondContact CD2-O 3.37Å; C35-A242 HydrophobicContact CB-CB 4.12Å; H238-A242 WeakPolarHBondContact O-CB 3.25Å; H238-A242 PolarHBondContact O-N 2.99Å; L239-A242 PolarHBondContact O-N 2.75Å; A242-V245 PolarHBondContact O-N 2.88Å; A242-G246 PolarHBondContact O-N 3.37Å |
| 243 | A | 96.9 | Very high | 95.3 | Very high | 4 Ų | 4 | 35.5 Ų | 35.5 | 3% | 0.033 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.8 | -45.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | F32 C35 L239 F240 I241 V245 G246 A247 | F32-A243 HydrophobicContact CD2-CB 4.29Å; F32-A243 WeakPolarHBondContact CD2-O 3.14Å; C35-A243 HydrophobicContact CB-CB 4.1Å; L239-A243 WeakPolarHBondContact O-CB 3.31Å; L239-A243 PolarHBondContact O-N 3.32Å; F240-A243 PolarHBondContact O-N 2.94Å; I241-A243 VanDerWaalsContact C-N 3.31Å; I241-A243 PolarHBondContact O-N 2.89Å; A243-V245 VanDerWaalsContact C-N 3.34Å; A243-V245 PolarHBondContact O-N 3.42Å; A243-G246 WeakPolarHBondContact O-CA 3.3Å; A243-G246 PolarHBondContact O-N 2.84Å; A243-G246 VanDerWaalsContact O-N 3.12Å; A243-A247 PolarHBondContact O-N 3.33Å |
| 244 | F | 97.3 | Very high | 95.2 | Very high | 59 Ų | 59 | 35.3 Ų | 35.3 | 26% | 0.259 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -58.5 | -44.1 | 175.5 | 177.4 | -99.3 | 0 | 0 | 0 | 112.4 | F167 S170 A171 V174 F240 I241 G246 A247 A248 | F167-F244 HydrophobicContact CD2-CD2 4.25Å; F167-F244 AromaticContact CD2-CE2 3.82Å; F167-F244 HydrophobicContact CD2-CE2 3.82Å; F167-F244 HydrophobicContact CD2-CZ 4.21Å; F167-F244 HydrophobicContact CE2-CD1 4.45Å; F167-F244 AromaticContact CE2-CD2 3.99Å; F167-F244 HydrophobicContact CE2-CD2 3.99Å; F167-F244 AromaticContact CE2-CE1 3.86Å; F167-F244 HydrophobicContact CE2-CE1 3.86Å; F167-F244 AromaticContact CE2-CE2 3.29Å; F167-F244 HydrophobicContact CE2-CE2 3.29Å; F167-F244 AromaticContact CE2-CZ 3.23Å; F167-F244 HydrophobicContact CE2-CZ 3.23Å; F167-F244 HydrophobicContact CZ-CE1 4.27Å; F167-F244 AromaticContact CZ-CE2 3.78Å; F167-F244 HydrophobicContact CZ-CE2 3.78Å; F167-F244 AromaticContact CZ-CZ 3.45Å; F167-F244 HydrophobicContact CZ-CZ 3.45Å; F167-F244 VanDerWaalsContact CZ-CZ 3.45Å; S170-F244 WeakPolarHBondContact OG-CD2 3.48Å; A171-F244 HydrophobicContact CB-CD2 4.36Å; A171-F244 HydrophobicContact CB-CE2 3.9Å; V174-F244 HydrophobicContact CG2-CB 3.93Å; V174-F244 HydrophobicContact CG2-CG 4.41Å; F240-F244 WeakPolarHBondContact O-CB 3.04Å; F240-F244 PolarHBondContact O-N 3.04Å; I241-F244 WeakPolarHBondContact O-CB 3.48Å; I241-F244 PolarHBondContact O-N 3.49Å; F244-G246 VanDerWaalsContact C-N 3.34Å; F244-G246 PolarHBondContact O-N 3.27Å; F244-A247 PolarHBondContact O-N 3.46Å; F244-A248 PolarHBondContact O-N 3.25Å |
| 245 | V | 97.6 | Very high | 95.1 | Very high | 79 Ų | 79 | 37 Ų | 37 | 48% | 0.479 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64 | -39.5 | 174.8 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | I241 A242 A243 A248 A249 | I241-V245 WeakPolarHBondContact O-CG2 3.44Å; I241-V245 PolarHBondContact O-N 3.22Å; A242-V245 PolarHBondContact O-N 2.88Å; A243-V245 VanDerWaalsContact C-N 3.34Å; A243-V245 PolarHBondContact O-N 3.42Å; V245-A248 WeakPolarHBondContact O-CB 3.33Å; V245-A248 PolarHBondContact O-N 3.08Å; V245-A249 WeakPolarHBondContact O-CB 3.19Å; V245-A249 PolarHBondContact O-N 2.97Å |
| 246 | G | 96.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.3 | -45.6 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | G28 A242 A243 F244 A248 A249 T250 | G28-G246 CarbonylContact C-O 3.58Å; G28-G246 CarbonylContact O-C 3.56Å; G28-G246 WeakPolarHBondContact O-CA 3.41Å; A242-G246 PolarHBondContact O-N 3.37Å; A243-G246 WeakPolarHBondContact O-CA 3.3Å; A243-G246 PolarHBondContact O-N 2.84Å; A243-G246 VanDerWaalsContact O-N 3.12Å; F244-G246 VanDerWaalsContact C-N 3.34Å; F244-G246 PolarHBondContact O-N 3.27Å; G246-A248 VanDerWaalsContact C-N 3.33Å; G246-A248 PolarHBondContact O-N 3.45Å; G246-A249 PolarHBondContact O-N 3.32Å; G246-T250 PolarHBondContact O-N 3.38Å; G246-T250 PolarHBondContact O-OG1 2.9Å; G246-T250 VanDerWaalsContact O-OG1 3.09Å |
| 247 | A | 96.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60 | -43.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | F32 W163 F167 A243 F244 T250 L251 | F32-A247 HydrophobicContact CD2-CB 3.82Å; F32-A247 HydrophobicContact CE2-CB 4.23Å; W163-A247 PolarHBondContact NE1-O 2.64Å; W163-A247 VanDerWaalsContact NE1-O 3.12Å; F167-A247 HydrophobicContact CB-CB 4.42Å; F167-A247 HydrophobicContact CD2-CB 4.27Å; A243-A247 PolarHBondContact O-N 3.33Å; F244-A247 PolarHBondContact O-N 3.46Å; A247-T250 PolarHBondContact O-N 2.88Å; A247-L251 WeakPolarHBondContact O-CB 3.12Å; A247-L251 PolarHBondContact O-N 3.36Å |
| 248 | A | 96.6 | Very high | 93.8 | Very high | 23 Ų | 23 | 35.7 Ų | 35.7 | 19% | 0.19 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.7 | -45.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | F167 F244 V245 G246 T250 L251 I252 | F167-A248 HydrophobicContact CD2-CB 3.99Å; F167-A248 HydrophobicContact CE2-CB 3.62Å; F167-A248 HydrophobicContact CZ-CB 4.45Å; F244-A248 PolarHBondContact O-N 3.25Å; V245-A248 WeakPolarHBondContact O-CB 3.33Å; V245-A248 PolarHBondContact O-N 3.08Å; G246-A248 VanDerWaalsContact C-N 3.33Å; G246-A248 PolarHBondContact O-N 3.45Å; A248-T250 VanDerWaalsContact C-N 3.34Å; A248-T250 PolarHBondContact O-N 3.1Å; A248-L251 WeakPolarHBondContact O-CB 3.18Å; A248-L251 PolarHBondContact O-N 2.72Å; A248-I252 VanDerWaalsContact O-CG1 3.32Å; A248-I252 WeakPolarHBondContact O-CG1 3.44Å; A248-I252 PolarHBondContact O-N 3.04Å |
| 249 | A | 95.8 | Very high | 93.2 | Very high | 21 Ų | 21 | 36.7 Ų | 36.7 | 17% | 0.174 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.6 | -43.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L24 V245 G246 I252 S253 | L24-A249 HydrophobicContact CD1-CB 4.25Å; V245-A249 WeakPolarHBondContact O-CB 3.19Å; V245-A249 PolarHBondContact O-N 2.97Å; G246-A249 PolarHBondContact O-N 3.32Å; A249-I252 PolarHBondContact O-N 2.01Å; A249-S253 WeakPolarHBondContact O-CB 3.14Å; A249-S253 PolarHBondContact O-N 3.36Å |
| 250 | T | 94.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.5 | -41 | 174.9 | -56.8 | 0 | 0 | 0 | 0 | 111.8 | G28 V29 F79 W163 G246 A247 A248 S253 L254 | G28-T250 VanDerWaalsContact CA-OG1 3.31Å; G28-T250 WeakPolarHBondContact CA-OG1 3.31Å; V29-T250 HydrophobicContact CG2-CG2 3.57Å; V29-T250 PolarHBondContact N-OG1 2.02Å; F79-T250 HydrophobicContact CE1-CG2 4.06Å; F79-T250 HydrophobicContact CZ-CG2 4.43Å; W163-T250 HydrophobicContact CD2-CG2 4.1Å; W163-T250 HydrophobicContact CG-CG2 4.18Å; W163-T250 HydrophobicContact CZ2-CG2 4Å; W163-T250 VanDerWaalsContact NE1-CG2 3.33Å; G246-T250 PolarHBondContact O-N 3.38Å; G246-T250 PolarHBondContact O-OG1 2.9Å; G246-T250 VanDerWaalsContact O-OG1 3.09Å; A247-T250 PolarHBondContact O-N 2.88Å; A248-T250 VanDerWaalsContact C-N 3.34Å; A248-T250 PolarHBondContact O-N 3.1Å; T250-S253 WeakPolarHBondContact O-CB 3.3Å; T250-S253 PolarHBondContact O-N 3.43Å; T250-L254 HydrophobicContact CG2-CD1 4.2Å; T250-L254 HydrophobicContact CG2-CG 4.45Å; T250-L254 WeakPolarHBondContact O-CG 3.27Å; T250-L254 PolarHBondContact O-N 3.24Å |
| 251 | L | 95.1 | Very high | 91.1 | Very high | 21 Ų | 21 | 36.9 Ų | 36.9 | 11% | 0.11 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.1 | -46.4 | 176.6 | -175.9 | 61 | 0 | 0 | 0 | 111.4 | T160 W163 L164 F167 A247 A248 S253 L254 L255 | T160-L251 HydrophobicContact CG2-CD1 4.06Å; W163-L251 HydrophobicContact CB-CD1 4.36Å; L164-L251 HydrophobicContact CB-CD1 4.23Å; F167-L251 HydrophobicContact CB-CD2 4.3Å; F167-L251 HydrophobicContact CD1-CD2 4.14Å; F167-L251 HydrophobicContact CG-CD2 4.29Å; A247-L251 WeakPolarHBondContact O-CB 3.12Å; A247-L251 PolarHBondContact O-N 3.36Å; A248-L251 WeakPolarHBondContact O-CB 3.18Å; A248-L251 PolarHBondContact O-N 2.72Å; L251-S253 VanDerWaalsContact C-N 3.3Å; L251-S253 PolarHBondContact O-N 2.99Å; L251-L254 PolarHBondContact O-N 3.22Å; L251-L255 HydrophobicContact CG-CD1 4.17Å; L251-L255 WeakPolarHBondContact O-CB 3.42Å; L251-L255 VanDerWaalsContact O-CG 3.31Å; L251-L255 WeakPolarHBondContact O-CG 3.42Å; L251-L255 PolarHBondContact O-N 3.39Å |
| 252 | I | 93.8 | Very high | 90.2 | Very high | 97 Ų | 97 | 37.5 Ų | 37.5 | 50% | 0.497 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.8 | -41.8 | 176.8 | -67.9 | 166 | 0 | 0 | 0 | 110.5 | A248 A249 L255 T256 | A248-I252 VanDerWaalsContact O-CG1 3.32Å; A248-I252 WeakPolarHBondContact O-CG1 3.44Å; A248-I252 PolarHBondContact O-N 3.04Å; A249-I252 PolarHBondContact O-N 2.01Å; I252-L255 PolarHBondContact O-N 3.23Å; I252-T256 WeakPolarHBondContact O-CB 3.48Å; I252-T256 PolarHBondContact O-N 3.47Å; I252-T256 PolarHBondContact O-OG1 3.38Å |
| 253 | S | 91.8 | Very high | 89.1 | Confident | 2 Ų | 2 | 43.9 Ų | 43.9 | 1% | 0.014 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.5 | -48.6 | 175.8 | 173 | 0 | 0 | 0 | 0 | 112.3 | A21 C25 A249 T250 L251 L255 T256 F257 | A21-S253 PolarHBondContact O-OG 2.85Å; C25-S253 VanDerWaalsContact CB-OG 3.32Å; C25-S253 WeakPolarHBondContact CB-OG 3.01Å; A249-S253 WeakPolarHBondContact O-CB 3.14Å; A249-S253 PolarHBondContact O-N 3.36Å; T250-S253 WeakPolarHBondContact O-CB 3.3Å; T250-S253 PolarHBondContact O-N 3.43Å; L251-S253 VanDerWaalsContact C-N 3.3Å; L251-S253 PolarHBondContact O-N 2.99Å; S253-L255 VanDerWaalsContact C-N 3.34Å; S253-L255 PolarHBondContact O-N 3.22Å; S253-T256 WeakPolarHBondContact O-CB 3.02Å; S253-T256 PolarHBondContact O-N 3.06Å; S253-F257 PolarHBondContact O-N 3.42Å |
| 254 | L | 90.4 | Very high | 87.8 | Confident | 1 Ų | 1 | 46.9 Ų | 46.9 | 1% | 0.005 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.3 | -41.1 | 178.5 | -71.3 | 173.7 | 0 | 0 | 0 | 112.1 | F79 Y82 T160 W163 T250 L251 F257 M258 | F79-L254 HydrophobicContact CE1-CD1 4.25Å; F79-L254 HydrophobicContact CE1-CD2 4.34Å; F79-L254 HydrophobicContact CZ-CD1 4.36Å; Y82-L254 HydrophobicContact CE1-CD2 4.06Å; T160-L254 HydrophobicContact CG2-CB 4.49Å; W163-L254 HydrophobicContact CB-CD1 3.87Å; W163-L254 HydrophobicContact CG-CD1 4.09Å; T250-L254 HydrophobicContact CG2-CD1 4.2Å; T250-L254 HydrophobicContact CG2-CG 4.45Å; T250-L254 WeakPolarHBondContact O-CG 3.27Å; T250-L254 PolarHBondContact O-N 3.24Å; L251-L254 PolarHBondContact O-N 3.22Å; L254-F257 PolarHBondContact O-N 2.99Å; L254-M258 WeakPolarHBondContact O-CG 3.41Å; L254-M258 PolarHBondContact O-N 3.4Å |
| 255 | L | 90.3 | Very high | 86.5 | Confident | 82 Ų | 82 | 48.6 Ų | 48.6 | 43% | 0.429 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64 | -43.5 | 174.6 | -71.9 | 170.7 | 0 | 0 | 0 | 112 | T160 L251 I252 S253 F257 M258 I259 | T160-L255 HydrophobicContact CG2-CD2 3.67Å; T160-L255 HydrophobicContact CG2-CG 4.09Å; L251-L255 HydrophobicContact CG-CD1 4.17Å; L251-L255 WeakPolarHBondContact O-CB 3.42Å; L251-L255 VanDerWaalsContact O-CG 3.31Å; L251-L255 WeakPolarHBondContact O-CG 3.42Å; L251-L255 PolarHBondContact O-N 3.39Å; I252-L255 PolarHBondContact O-N 3.23Å; S253-L255 VanDerWaalsContact C-N 3.34Å; S253-L255 PolarHBondContact O-N 3.22Å; L255-F257 VanDerWaalsContact C-N 3.26Å; L255-F257 PolarHBondContact O-N 2.66Å; L255-M258 WeakPolarHBondContact O-CB 3.36Å; L255-M258 PolarHBondContact O-N 3.37Å; L255-I259 WeakPolarHBondContact O-CG1 3.48Å; L255-I259 PolarHBondContact O-N 3.23Å |
| 256 | T | 87.7 | Confident | 85.4 | Confident | 67 Ų | 67 | 46.8 Ų | 46.8 | 41% | 0.411 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.3 | -41.6 | 176.8 | -56.5 | 0 | 0 | 0 | 0 | 110.6 | A21 I252 S253 I259 A260 | A21-T256 HydrophobicContact CB-CG2 4.5Å; I252-T256 WeakPolarHBondContact O-CB 3.48Å; I252-T256 PolarHBondContact O-N 3.47Å; I252-T256 PolarHBondContact O-OG1 3.38Å; S253-T256 WeakPolarHBondContact O-CB 3.02Å; S253-T256 PolarHBondContact O-N 3.06Å; T256-I259 PolarHBondContact O-N 2.99Å; T256-A260 PolarHBondContact O-N 3.2Å; T256-A260 VanDerWaalsContact O-N 3.07Å |
| 257 | F | 82 | Confident | 84.1 | Confident | 17 Ų | 17 | 48.7 Ų | 48.7 | 8% | 0.075 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 176.3 | -170.6 | -95.3 | 0 | 0 | 0 | 112.2 | L86 F152 T156 S253 L254 L255 I259 A260 A261 | L86-F257 HydrophobicContact CD2-CD1 4.11Å; L86-F257 HydrophobicContact CD2-CD2 4.25Å; L86-F257 HydrophobicContact CD2-CE1 3.62Å; L86-F257 HydrophobicContact CD2-CE2 3.79Å; L86-F257 HydrophobicContact CD2-CG 4.4Å; L86-F257 HydrophobicContact CD2-CZ 3.46Å; L86-F257 VanDerWaalsContact CD2-CZ 3.46Å; F152-F257 HydrophobicContact CD1-CE1 4.49Å; F152-F257 AromaticContact CE1-CE1 3.42Å; F152-F257 HydrophobicContact CE1-CE1 3.42Å; F152-F257 VanDerWaalsContact CE1-CE1 3.42Å; F152-F257 AromaticContact CE1-CZ 3.42Å; F152-F257 HydrophobicContact CE1-CZ 3.42Å; F152-F257 VanDerWaalsContact CE1-CZ 3.42Å; F152-F257 AromaticContact CZ-CE1 3.64Å; F152-F257 HydrophobicContact CZ-CE1 3.64Å; F152-F257 AromaticContact CZ-CZ 3.53Å; F152-F257 HydrophobicContact CZ-CZ 3.53Å; T156-F257 HydrophobicContact CG2-CD1 3.64Å; T156-F257 HydrophobicContact CG2-CE1 4.24Å; S253-F257 PolarHBondContact O-N 3.42Å; L254-F257 PolarHBondContact O-N 2.99Å; L255-F257 VanDerWaalsContact C-N 3.26Å; L255-F257 PolarHBondContact O-N 2.66Å; F257-I259 VanDerWaalsContact C-N 3.32Å; F257-I259 PolarHBondContact O-N 3.39Å; F257-A260 PolarHBondContact O-N 3.28Å; F257-A261 HydrophobicContact CE1-CB 4.33Å; F257-A261 WeakPolarHBondContact O-CB 3.36Å; F257-A261 PolarHBondContact O-N 3.04Å |
| 258 | M | 83.2 | Confident | 82.6 | Confident | 28 Ų | 28 | 52.8 Ų | 52.8 | 14% | 0.138 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -57.3 | -43.6 | 175.5 | -81.3 | -63.4 | -58.6 | 0 | 0 | 112.3 | V153 T156 Y157 L254 L255 T262 | V153-M258 HydrophobicContact CG1-CE 4.13Å; V153-M258 HydrophobicContact CG1-SD 4.48Å; T156-M258 HydrophobicContact CG2-CG 3.68Å; T156-M258 HydrophobicContact CG2-SD 3.42Å; T156-M258 WeakPolarHBondContact CG2-SD 3.44Å; Y157-M258 HydrophobicContact CD2-CE 4.04Å; L254-M258 WeakPolarHBondContact O-CG 3.41Å; L254-M258 PolarHBondContact O-N 3.4Å; L255-M258 WeakPolarHBondContact O-CB 3.36Å; L255-M258 PolarHBondContact O-N 3.37Å; M258-T262 VanDerWaalsContact O-CB 3.29Å; M258-T262 WeakPolarHBondContact O-CB 3.44Å; M258-T262 PolarHBondContact O-N 3.19Å; M258-T262 PolarHBondContact O-OG1 3.15Å |
| 259 | I | 83.6 | Confident | 81.3 | Confident | 124 Ų | 124 | 57.3 Ų | 57.3 | 64% | 0.636 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -64.1 | -47.3 | 178.2 | -65.3 | 164.2 | 0 | 0 | 0 | 110.3 | L255 T256 F257 T262 Y263 | L255-I259 WeakPolarHBondContact O-CG1 3.48Å; L255-I259 PolarHBondContact O-N 3.23Å; T256-I259 PolarHBondContact O-N 2.99Å; F257-I259 VanDerWaalsContact C-N 3.32Å; F257-I259 PolarHBondContact O-N 3.39Å; I259-T262 PolarHBondContact O-N 3.09Å; I259-Y263 WeakPolarHBondContact O-CB 3Å; I259-Y263 PolarHBondContact O-N 2.95Å |
| 260 | A | 76.5 | Confident | 79.9 | Confident | 44 Ų | 44 | 62.4 Ų | 62.4 | 36% | 0.364 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T256 F257 Y263 N264 | T256-A260 PolarHBondContact O-N 3.2Å; T256-A260 VanDerWaalsContact O-N 3.07Å; F257-A260 PolarHBondContact O-N 3.28Å; A260-Y263 PolarHBondContact O-N 3.28Å; A260-N264 WeakPolarHBondContact O-CB 3.44Å; A260-N264 VanDerWaalsContact O-CG 3.29Å; A260-N264 PolarHBondContact O-N 3.28Å; A260-N264 PolarHBondContact O-ND2 2.99Å |
| 261 | A | 73.3 | Confident | 78.3 | Confident | 17 Ų | 17 | 65.3 Ų | 65.3 | 14% | 0.14 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V153 F257 N264 F265 | V153-A261 HydrophobicContact CG2-CB 4.37Å; F257-A261 HydrophobicContact CE1-CB 4.33Å; F257-A261 WeakPolarHBondContact O-CB 3.36Å; F257-A261 PolarHBondContact O-N 3.04Å; A261-N264 PolarHBondContact O-N 3.47Å; A261-F265 WeakPolarHBondContact O-CB 3.41Å; A261-F265 PolarHBondContact O-N 2.94Å |
| 262 | T | 76.1 | Confident | 76.6 | Confident | 75 Ų | 75 | 66.4 Ų | 66.4 | 46% | 0.46 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.4 | -42.2 | 177.7 | -55.7 | 0 | 0 | 0 | 0 | 111.4 | M258 I259 F265 A266 | M258-T262 VanDerWaalsContact O-CB 3.29Å; M258-T262 WeakPolarHBondContact O-CB 3.44Å; M258-T262 PolarHBondContact O-N 3.19Å; M258-T262 PolarHBondContact O-OG1 3.15Å; I259-T262 PolarHBondContact O-N 3.09Å; T262-F265 PolarHBondContact O-N 3.34Å; T262-A266 WeakPolarHBondContact O-CB 3.49Å; T262-A266 PolarHBondContact O-N 3.15Å |
| 263 | Y | 74.1 | Confident | 74.7 | Confident | 160 Ų | 160 | 70.2 Ų | 70.2 | 63% | 0.627 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -61.6 | -49.9 | 176 | -178.3 | -94.6 | 0 | 0 | 0 | 111.6 | I259 A260 F265 A266 V267 | I259-Y263 WeakPolarHBondContact O-CB 3Å; I259-Y263 PolarHBondContact O-N 2.95Å; A260-Y263 PolarHBondContact O-N 3.28Å; Y263-F265 VanDerWaalsContact C-N 3.32Å; Y263-F265 PolarHBondContact O-N 3.19Å; Y263-A266 PolarHBondContact O-N 2.98Å; Y263-V267 HydrophobicContact CD1-CG2 4.12Å; Y263-V267 HydrophobicContact CE1-CG2 3.72Å; Y263-V267 HydrophobicContact CE2-CG2 4.33Å; Y263-V267 WeakPolarHBondContact O-CG2 3.46Å; Y263-V267 PolarHBondContact O-N 3.11Å |
| 264 | N | 70.8 | Confident | 72.6 | Confident | 67 Ų | 67 | 72.7 Ų | 72.7 | 36% | 0.358 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61 | -41.2 | 179.1 | -71.8 | -17.3 | 0 | 0 | 0 | 111.8 | A260 A261 V267 L268 | A260-N264 WeakPolarHBondContact O-CB 3.44Å; A260-N264 VanDerWaalsContact O-CG 3.29Å; A260-N264 PolarHBondContact O-N 3.28Å; A260-N264 PolarHBondContact O-ND2 2.99Å; A261-N264 PolarHBondContact O-N 3.47Å; N264-V267 PolarHBondContact O-N 3.45Å; N264-L268 WeakPolarHBondContact O-CB 3.35Å; N264-L268 WeakPolarHBondContact O-CG 3.32Å; N264-L268 PolarHBondContact O-N 3.01Å |
| 265 | F | 70.4 | Confident | 70.5 | Confident | 95 Ų | 95 | 78.3 Ų | 78.3 | 42% | 0.417 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.3 | -43.8 | 174.9 | 178.8 | -102.1 | 0 | 0 | 0 | 112.3 | P149 A261 T262 Y263 L268 K269 | P149-F265 HydrophobicContact CB-CD2 4.49Å; P149-F265 HydrophobicContact CG-CE2 4.43Å; A261-F265 WeakPolarHBondContact O-CB 3.41Å; A261-F265 PolarHBondContact O-N 2.94Å; T262-F265 PolarHBondContact O-N 3.34Å; Y263-F265 VanDerWaalsContact C-N 3.32Å; Y263-F265 PolarHBondContact O-N 3.19Å; F265-L268 PolarHBondContact O-N 2.96Å; F265-K269 HydrophobicContact CE1-CD 4.17Å; F265-K269 HydrophobicContact CZ-CD 4.4Å; F265-K269 WeakPolarHBondContact O-CB 3.41Å; F265-K269 PolarHBondContact O-N 3.44Å |
| 266 | A | 72.9 | Confident | 68.1 | Low | 42 Ų | 42 | 83 Ų | 83 | 35% | 0.347 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.3 | -44.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T262 Y263 K269 L270 | T262-A266 WeakPolarHBondContact O-CB 3.49Å; T262-A266 PolarHBondContact O-N 3.15Å; Y263-A266 PolarHBondContact O-N 2.98Å; A266-K269 PolarHBondContact O-N 3.31Å; A266-L270 VanDerWaalsContact O-CG 3.31Å; A266-L270 WeakPolarHBondContact O-CG 3.38Å; A266-L270 PolarHBondContact O-N 3.5Å |
| 267 | V | 69.9 | Low | 65.6 | Low | 40 Ų | 40 | 92 Ų | 92 | 24% | 0.242 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -62.1 | -48.2 | 177.1 | 171.1 | 0 | 0 | 0 | 0 | 111.3 | Y263 N264 K269 L270 M271 | Y263-V267 HydrophobicContact CD1-CG2 4.12Å; Y263-V267 HydrophobicContact CE1-CG2 3.72Å; Y263-V267 HydrophobicContact CE2-CG2 4.33Å; Y263-V267 WeakPolarHBondContact O-CG2 3.46Å; Y263-V267 PolarHBondContact O-N 3.11Å; N264-V267 PolarHBondContact O-N 3.45Å; V267-K269 VanDerWaalsContact C-N 3.29Å; V267-K269 PolarHBondContact O-N 3.22Å; V267-L270 PolarHBondContact O-N 2.75Å; V267-M271 HydrophobicContact CG1-CE 3.79Å; V267-M271 HydrophobicContact CG1-CG 4.4Å; V267-M271 HydrophobicContact CG1-SD 4.01Å; V267-M271 WeakPolarHBondContact O-CG 3.03Å; V267-M271 PolarHBondContact O-N 3.09Å |
| 268 | L | 65.3 | Low | 64.8 | Low | 86 Ų | 86 | 95.8 Ų | 95.8 | 45% | 0.45 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.1 | -39.6 | 176.7 | -72.5 | 171.2 | 0 | 0 | 0 | 112.2 | I100 N264 F265 M271 G272 | I100-L268 HydrophobicContact CD1-CD2 4.17Å; N264-L268 WeakPolarHBondContact O-CB 3.35Å; N264-L268 WeakPolarHBondContact O-CG 3.32Å; N264-L268 PolarHBondContact O-N 3.01Å; F265-L268 PolarHBondContact O-N 2.96Å; L268-M271 HydrophobicContact CD2-CE 4.01Å; L268-G272 PolarHBondContact O-N 3.27Å |
| 269 | K | 69.7 | Low | 63.8 | Low | 117 Ų | 117 | 99.4 Ų | 99.4 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.3 | -35.5 | 177.8 | -169.4 | 173.8 | -175.6 | 175.8 | 0 | 112.7 | F265 A266 V267 R273 | F265-K269 HydrophobicContact CE1-CD 4.17Å; F265-K269 HydrophobicContact CZ-CD 4.4Å; F265-K269 WeakPolarHBondContact O-CB 3.41Å; F265-K269 PolarHBondContact O-N 3.44Å; A266-K269 PolarHBondContact O-N 3.31Å; V267-K269 VanDerWaalsContact C-N 3.29Å; V267-K269 PolarHBondContact O-N 3.22Å; K269-R273 WeakPolarHBondContact O-CD 3.5Å; K269-R273 VanDerWaalsContact O-CG 3.31Å; K269-R273 WeakPolarHBondContact O-CG 3.42Å; K269-R273 PolarHBondContact O-N 3.47Å |
| 270 | L | 66.1 | Low | 62.7 | Low | 128 Ų | 128 | 98 Ų | 98 | 67% | 0.67 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -71.2 | -44.8 | 175.4 | -71.5 | 169.7 | 0 | 0 | 0 | 111.3 | A266 V267 R273 G274 | A266-L270 VanDerWaalsContact O-CG 3.31Å; A266-L270 WeakPolarHBondContact O-CG 3.38Å; A266-L270 PolarHBondContact O-N 3.5Å; V267-L270 PolarHBondContact O-N 2.75Å; L270-R273 PolarHBondContact O-N 3.44Å; L270-G274 PolarHBondContact O-N 3.14Å |
| 271 | M | 61.7 | Low | 61.9 | Low | 61 Ų | 61 | 101.2 Ų | 101.2 | 30% | 0.3 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.9 | -38.8 | 178.4 | -65.4 | -173 | -49.5 | 0 | 0 | 112.6 | I100 F101 V267 L268 R273 G274 T275 | I100-M271 HydrophobicContact CG2-CE 4.15Å; I100-M271 HydrophobicContact CG2-SD 4.42Å; F101-M271 HydrophobicContact CE2-SD 4.02Å; V267-M271 HydrophobicContact CG1-CE 3.79Å; V267-M271 HydrophobicContact CG1-CG 4.4Å; V267-M271 HydrophobicContact CG1-SD 4.01Å; V267-M271 WeakPolarHBondContact O-CG 3.03Å; V267-M271 PolarHBondContact O-N 3.09Å; L268-M271 HydrophobicContact CD2-CE 4.01Å; M271-R273 PolarHBondContact O-N 3.04Å; M271-G274 PolarHBondContact O-N 3.05Å; M271-T275 PolarHBondContact O-N 3.11Å |
| 272 | G | 57.9 | Low | 61.2 | Low | 45 Ų | 45 | 106.4 Ų | 106.4 | 46% | 0.464 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.4 | -16.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | L268 | L268-G272 PolarHBondContact O-N 3.27Å |
| 273 | R | 54.4 | Low | 60.2 | Low | 176 Ų | 176 | 108.5 Ų | 108.5 | 66% | 0.664 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -86.9 | -21.9 | 169.1 | -70.4 | 171.2 | 88.1 | 132.9 | 2.7 | 112.4 | K269 L270 M271 | K269-R273 WeakPolarHBondContact O-CD 3.5Å; K269-R273 VanDerWaalsContact O-CG 3.31Å; K269-R273 WeakPolarHBondContact O-CG 3.42Å; K269-R273 PolarHBondContact O-N 3.47Å; L270-R273 PolarHBondContact O-N 3.44Å; M271-R273 PolarHBondContact O-N 3.04Å |
| 274 | G | 47.7 | Very low | 59.2 | Low | 55 Ų | 55 | 104.9 Ų | 104.9 | 57% | 0.567 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -79.5 | -22.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | L270 M271 K276 | L270-G274 PolarHBondContact O-N 3.14Å; M271-G274 PolarHBondContact O-N 3.05Å; G274-K276 VanDerWaalsContact C-N 3.31Å; G274-K276 PolarHBondContact O-N 3.01Å |
| 275 | T | 45.8 | Very low | 58.3 | Low | 119 Ų | 119 | 107.8 Ų | 107.8 | 73% | 0.73 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | 9.7 | 177.5 | 44 | 0 | 0 | 0 | 0 | 114.3 | M271 | M271-T275 PolarHBondContact O-N 3.11Š|
| 276 | K | 40.8 | Very low | 57.3 | Low | 181 Ų | 181 | 108.8 Ų | 108.8 | 79% | 0.787 | 57% | 0.571 | S | S | * | * | trans | -103.8 | 23.2 | 179.4 | -105.2 | -166.7 | -177.3 | -173.2 | 0 | 114.2 | G274 | G274-K276 VanDerWaalsContact C-N 3.31Å; G274-K276 PolarHBondContact O-N 3.01Å | ||
| 277 | F | 35.5 | Very low | 55.9 | Low | 256 Ų | 256 | 114.9 Ų | 114.9 | 100% | 1.123 | 59% | 0.592 | S | S | * | * | trans | -124.8 | 0 | 172.1 | -74.5 | -78.7 | 0 | 0 | 0 | 110.5 |
Retrieved 277 of 277 residues in 471.9 ms
(Link to these results)