A0A061AE39_CAEEL Loading...

Acyltransferase 3 domain-containing protein

AlphaFold DB , UniProt , Accession A0A061AE39, Species CAEEL (Caenorhabditis elegans), Gene oac-58, Length 298 aa.

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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
1M36.8Very low49.8Very low241 Ų241114.3 Ų114.3100%1.18762%0.622SS**  098.70-159.5103.4138.100106.1
2S31.1Very low51.6Low94 Ų94106.5 Ų106.566%0.65758%0.579SS**PPolyproline II helixtrans-67138.217433.90000108.9Q4S2-Q4 PolarHBondContact O-N 3.3Å
3P32.9Very low53.4Low123 Ų123102.8 Ų102.880%0.79956%0.555SS**PPolyproline II helixtrans-61.6126.1173.324.6-30.1000108.6
4Q40.5Very low55.1Low168 Ų16898.9 Ų98.979%0.78555%0.552SS**PPolyproline II helixtrans-72.6130.4174-74.5-71-11.300108.4S2 S6S2-Q4 PolarHBondContact O-N 3.3Å; Q4-S6 PolarHBondContact O-N 3.32Å
5P36.8Very low56.7Low114 Ų11494.3 Ų94.374%0.7453%0.525SS*.PPolyproline II helixtrans-64.4128-177.725-31.9000110.1S7P5-S7 PolarHBondContact O-N 3.25Å
6S45.7Very low58.1Low34 Ų3491.3 Ų91.324%0.23850%0.503CS..PPolyproline II helixtrans-63.7123175.761.10000109.6Q4 K8 D243Q4-S6 PolarHBondContact O-N 3.32Å; S6-K8 PolarHBondContact O-N 3.47Å; S6-D243 VanDerWaalsContact CB-O 3.23Å; S6-D243 WeakPolarHBondContact CB-O 3.5Å; S6-D243 PolarHBondContact OG-O 3.37Å
7S50.1Low59.6Low110 Ų11087.6 Ų87.677%0.76949%0.491SS*.  trans-71.7100-177.2-175.90000109.7P5 R9P5-S7 PolarHBondContact O-N 3.25Å; S7-R9 PolarHBondContact O-N 2.85Å
8K57.5Low60.9Low70 Ų7088.8 Ų88.830%0.30450%0.496SS..  trans-56.6133.2176.8-160.9-178.4-154.9173.60110.7S6 Q10 Q13 D244S6-K8 PolarHBondContact O-N 3.47Å; K8-Q10 PolarHBondContact O-N 3.15Å; K8-Q13 VanDerWaalsContact CE-NE2 3.29Å; K8-Q13 VanDerWaalsContact CE-OE1 3.25Å; K8-D244 HydrophobicContact CB-CB 4.11Å; K8-D244 WeakPolarHBondContact CB-OD2 3.43Å; K8-D244 WeakPolarHBondContact CD-OD2 3.38Å; K8-D244 WeakPolarHBondContact CE-OD2 3.2Å; K8-D244 HydrophobicContact CG-CB 3.96Å; K8-D244 WeakPolarHBondContact CG-OD2 3.33Å; K8-D244 IonicContact NZ-OD2 3.91Å
9R67.1Low62.3Low100 Ų10084.2 Ų84.238%0.37747%0.47SS..  trans-69.480.1174.4-72.4-100.3-78.5-85.4-0.7110.2S7 D11 L12 Q13 M53S7-R9 PolarHBondContact O-N 2.85Å; R9-D11 VanDerWaalsContact C-N 3.25Å; R9-D11 WeakPolarHBondContact CA-OD1 3.34Å; R9-D11 VanDerWaalsContact CB-OD1 3.31Å; R9-D11 WeakPolarHBondContact CB-OD1 3.31Å; R9-D11 IonicContact NE-OD1 3.21Å; R9-D11 PolarHBondContact O-N 3.42Å; R9-L12 HydrophobicContact CB-CD1 4.31Å; R9-L12 HydrophobicContact CB-CG 4.49Å; R9-Q13 PolarHBondContact O-NE2 3.11Å; R9-M53 PolarHBondContact NH2-SD 3.43Å; R9-M53 VanDerWaalsContact NH2-SD 3.36Å
10Q74.6Confident63.5Low155 Ų15583.9 Ų83.972%0.72447%0.466SS*.Hα-helixtrans-66.6-28.9-179.2-70.7-177.4-13.900112K8 Q13 G14K8-Q10 PolarHBondContact O-N 3.15Å; Q10-Q13 PolarHBondContact O-N 3Å; Q10-G14 PolarHBondContact O-N 3.44Å
11D74.7Confident64.7Low48 Ų4885.4 Ų85.426%0.25747%0.473SS..Hα-helixtrans-54.2-52.8173.557.3-19000112R9 Q13 G14 I15R9-D11 VanDerWaalsContact C-N 3.25Å; R9-D11 WeakPolarHBondContact CA-OD1 3.34Å; R9-D11 VanDerWaalsContact CB-OD1 3.31Å; R9-D11 WeakPolarHBondContact CB-OD1 3.31Å; R9-D11 IonicContact NE-OD1 3.21Å; R9-D11 PolarHBondContact O-N 3.42Å; D11-Q13 VanDerWaalsContact C-N 3.29Å; D11-Q13 PolarHBondContact O-N 3.46Å; D11-G14 PolarHBondContact O-N 3.46Å; D11-I15 WeakPolarHBondContact O-CG1 3.5Å; D11-I15 PolarHBondContact O-N 3.43Å; D11-I15 VanDerWaalsContact O-N 3.16Å
12L72Confident67Low21 Ų2175.7 Ų75.711%0.1143%0.429CS..Hα-helixtrans-66.9-32.2179.6-65.4179.8000112.3R9 R16 L46 F49R9-L12 HydrophobicContact CB-CD1 4.31Å; R9-L12 HydrophobicContact CB-CG 4.49Å; L12-R16 VanDerWaalsContact O-CG 3.3Å; L12-R16 WeakPolarHBondContact O-CG 3.32Å; L12-R16 PolarHBondContact O-N 3.22Å; L12-R16 VanDerWaalsContact O-N 3.11Å; L12-L46 HydrophobicContact CD2-CD2 3.98Å; L12-F49 HydrophobicContact CD1-CE1 4.29Å; L12-F49 HydrophobicContact CD2-CE1 4.37Å
13Q73.8Confident69.7Low58 Ų5872.6 Ų72.627%0.27141%0.406SS..Hα-helixtrans-70.5-40.9175.5-83.8162.98400112.4K8 R9 Q10 D11 I15 R16 G17 F245K8-Q13 VanDerWaalsContact CE-NE2 3.29Å; K8-Q13 VanDerWaalsContact CE-OE1 3.25Å; R9-Q13 PolarHBondContact O-NE2 3.11Å; Q10-Q13 PolarHBondContact O-N 3Å; D11-Q13 VanDerWaalsContact C-N 3.29Å; D11-Q13 PolarHBondContact O-N 3.46Å; Q13-I15 VanDerWaalsContact C-N 3.32Å; Q13-I15 PolarHBondContact O-N 2.93Å; Q13-R16 PolarHBondContact O-N 3.34Å; Q13-G17 PolarHBondContact O-N 2.83Å; Q13-F245 HydrophobicContact CG-CE1 4.19Å; Q13-F245 HydrophobicContact CG-CZ 3.6Å; Q13-F245 VanDerWaalsContact NE2-CZ 3.28Å
14G78.3Confident72.3Confident49 Ų4970.5 Ų70.551%0.50539%0.387SS..Hα-helixtrans-59.8-43.8175.800000111.6Q10 D11 G17 L18Q10-G14 PolarHBondContact O-N 3.44Å; D11-G14 PolarHBondContact O-N 3.46Å; G14-G17 PolarHBondContact O-N 3.28Å; G14-L18 PolarHBondContact O-N 3.36Å
15I78.3Confident74.5Confident29 Ų2963 Ų6315%0.14936%0.355CS..Hα-helixtrans-66.4-40.8177.9-59.8173.9000111.3D11 Q13 G17 L18 A19 Q42 L46 L279D11-I15 WeakPolarHBondContact O-CG1 3.5Å; D11-I15 PolarHBondContact O-N 3.43Å; D11-I15 VanDerWaalsContact O-N 3.16Å; Q13-I15 VanDerWaalsContact C-N 3.32Å; Q13-I15 PolarHBondContact O-N 2.93Å; I15-G17 VanDerWaalsContact C-N 3.34Å; I15-L18 PolarHBondContact O-N 3.36Å; I15-A19 PolarHBondContact O-N 2.87Å; I15-Q42 HydrophobicContact CG2-CG 4.23Å; I15-L46 HydrophobicContact CB-CD1 4.33Å; I15-L46 HydrophobicContact CG2-CD1 3.75Å; I15-L46 HydrophobicContact CG2-CD2 4.15Å; I15-L46 HydrophobicContact CG2-CG 4.38Å; I15-L279 HydrophobicContact CD1-CB 4.44Å; I15-L279 HydrophobicContact CD1-CD1 3.98Å; I15-L279 HydrophobicContact CD1-CD2 3.6Å; I15-L279 HydrophobicContact CD1-CG 4.2Å
16R79.8Confident76.8Confident46 Ų4658.8 Ų58.817%0.17433%0.325CS..Hα-helixtrans-61.5-43.6172.4-73.3175.8177.6-161.3-11.8111.7L12 Q13 L18 A19 I20 F43 L46L12-R16 VanDerWaalsContact O-CG 3.3Å; L12-R16 WeakPolarHBondContact O-CG 3.32Å; L12-R16 PolarHBondContact O-N 3.22Å; L12-R16 VanDerWaalsContact O-N 3.11Å; Q13-R16 PolarHBondContact O-N 3.34Å; R16-L18 VanDerWaalsContact C-N 3.31Å; R16-L18 PolarHBondContact O-N 3.35Å; R16-A19 WeakPolarHBondContact O-CB 3.44Å; R16-A19 PolarHBondContact O-N 2.95Å; R16-I20 VanDerWaalsContact O-CG1 3.3Å; R16-I20 WeakPolarHBondContact O-CG1 3.46Å; R16-I20 PolarHBondContact O-N 3.33Å; R16-F43 HydrophobicContact CB-CE1 4.14Å; R16-F43 HydrophobicContact CB-CZ 4.47Å; R16-F43 HydrophobicContact CG-CD1 4.5Å; R16-F43 HydrophobicContact CG-CE1 4.03Å; R16-L46 HydrophobicContact CG-CD1 3.72Å
17G82.9Confident78.6Confident29 Ų2959.5 Ų59.530%0.29933%0.325SS..Hα-helixtrans-57-45.7175.500000111.6Q13 G14 I15 A19 I20 L21Q13-G17 PolarHBondContact O-N 2.83Å; G14-G17 PolarHBondContact O-N 3.28Å; I15-G17 VanDerWaalsContact C-N 3.34Å; G17-A19 PolarHBondContact O-N 3.22Å; G17-I20 PolarHBondContact O-N 2.87Å; G17-L21 WeakPolarHBondContact O-CG 3.33Å; G17-L21 PolarHBondContact O-N 3.29Å
18L84.2Confident80.4Confident110 Ų11061.2 Ų61.258%0.57632%0.318SS*.Hα-helixtrans-61.8-42.3175.8-173.765.1000112.3G14 I15 R16 I20 L21 S22G14-L18 PolarHBondContact O-N 3.36Å; I15-L18 PolarHBondContact O-N 3.36Å; R16-L18 VanDerWaalsContact C-N 3.31Å; R16-L18 PolarHBondContact O-N 3.35Å; L18-I20 PolarHBondContact O-N 3.42Å; L18-L21 PolarHBondContact O-N 3.11Å; L18-S22 WeakPolarHBondContact O-CB 3.42Å; L18-S22 PolarHBondContact O-N 3.33Å
19A85.9Confident81.8Confident0 Ų064.6 Ų64.60%033%0.33CS..Hα-helixtrans-60.9-42.6175.800000112I15 R16 G17 S22 V23 Q42 F43I15-A19 PolarHBondContact O-N 2.87Å; R16-A19 WeakPolarHBondContact O-CB 3.44Å; R16-A19 PolarHBondContact O-N 2.95Å; G17-A19 PolarHBondContact O-N 3.22Å; A19-S22 WeakPolarHBondContact O-CB 3.13Å; A19-S22 PolarHBondContact O-N 2.94Å; A19-V23 WeakPolarHBondContact O-CG2 3.3Å; A19-V23 PolarHBondContact O-N 3.4Å; A19-V23 VanDerWaalsContact O-N 3.12Å; A19-Q42 HydrophobicContact CB-CB 4.2Å; A19-Q42 HydrophobicContact CB-CG 4.25Å; A19-F43 HydrophobicContact CB-CD2 3.77Å; A19-F43 HydrophobicContact CB-CE2 3.72Å; A19-F43 HydrophobicContact CB-CG 4.47Å; A19-F43 HydrophobicContact CB-CZ 4.39Å
20I86.8Confident82.5Confident79 Ų7962.3 Ų62.341%0.40533%0.329SS..Hα-helixtrans-61.2-50.1174.9-64167.3000110.3R16 G17 L18 S22 V23 L24 F43R16-I20 VanDerWaalsContact O-CG1 3.3Å; R16-I20 WeakPolarHBondContact O-CG1 3.46Å; R16-I20 PolarHBondContact O-N 3.33Å; G17-I20 PolarHBondContact O-N 2.87Å; L18-I20 PolarHBondContact O-N 3.42Å; I20-S22 PolarHBondContact O-N 2.9Å; I20-V23 PolarHBondContact O-N 2.86Å; I20-V23 VanDerWaalsContact O-N 3.11Å; I20-L24 HydrophobicContact CG2-CD1 3.79Å; I20-L24 HydrophobicContact CG2-CG 4.07Å; I20-L24 WeakPolarHBondContact O-CG 3.16Å; I20-L24 PolarHBondContact O-N 3.01Å; I20-F43 HydrophobicContact CD1-CZ 3.94Å; I20-F43 HydrophobicContact CG1-CE2 3.63Å; I20-F43 HydrophobicContact CG1-CZ 3.33Å
21L88.4Confident83Confident116 Ų11660.5 Ų60.561%0.60733%0.328SS*.Hα-helixtrans-59.5-37.7-179.4-70.3175.4000111.6G17 L18 L24 G25G17-L21 WeakPolarHBondContact O-CG 3.33Å; G17-L21 PolarHBondContact O-N 3.29Å; L18-L21 PolarHBondContact O-N 3.11Å; L21-L24 PolarHBondContact O-N 3.32Å; L21-G25 PolarHBondContact O-N 3.39Å
22S86.8Confident83.6Confident37 Ų3767.1 Ų67.126%0.25935%0.351SS..Hα-helixtrans-60.5-48.3174.1-163.30000111.7L18 A19 I20 G25 F26 G36L18-S22 WeakPolarHBondContact O-CB 3.42Å; L18-S22 PolarHBondContact O-N 3.33Å; A19-S22 WeakPolarHBondContact O-CB 3.13Å; A19-S22 PolarHBondContact O-N 2.94Å; I20-S22 PolarHBondContact O-N 2.9Å; S22-G25 PolarHBondContact O-N 3.13Å; S22-F26 PolarHBondContact O-N 3.04Å; S22-G36 CarbonylContact C-O 3.47Å; S22-G36 CarbonylContact O-C 3.56Å; S22-G36 VanDerWaalsContact O-CA 3.25Å; S22-G36 WeakPolarHBondContact O-CA 3.3Å; S22-G36 VanDerWaalsContact OG-CA 3.3Å; S22-G36 WeakPolarHBondContact OG-CA 3.35Å; S22-G36 PolarHBondContact OG-O 3.08Å
23V86.4Confident84.2Confident29 Ų2971.2 Ų71.218%0.17637%0.368CS..Hα-helixtrans-65.9-41.4178.9175.70000111.8A19 I20 F26 H27 G36 V40A19-V23 WeakPolarHBondContact O-CG2 3.3Å; A19-V23 PolarHBondContact O-N 3.4Å; A19-V23 VanDerWaalsContact O-N 3.12Å; I20-V23 PolarHBondContact O-N 2.86Å; I20-V23 VanDerWaalsContact O-N 3.11Å; V23-F26 PolarHBondContact O-N 3.06Å; V23-H27 PolarHBondContact O-N 3.43Å; V23-H27 PolarHBondContact O-ND1 3.45Å; V23-G36 PolarHBondContact N-O 3.26Å; V23-V40 HydrophobicContact CG2-CG2 3.83Å
24L87.7Confident84.5Confident78 Ų7871.9 Ų71.941%0.40838%0.377SS..Hα-helixtrans-64.5-41.9175.6-67.4179.3000111I20 L21 F26 H27 F28I20-L24 HydrophobicContact CG2-CD1 3.79Å; I20-L24 HydrophobicContact CG2-CG 4.07Å; I20-L24 WeakPolarHBondContact O-CG 3.16Å; I20-L24 PolarHBondContact O-N 3.01Å; L21-L24 PolarHBondContact O-N 3.32Å; L24-F26 VanDerWaalsContact C-N 3.31Å; L24-F26 PolarHBondContact O-N 3.21Å; L24-H27 PolarHBondContact O-N 3.37Å; L24-H27 VanDerWaalsContact O-N 3.11Å; L24-F28 HydrophobicContact CB-CD2 4.28Å; L24-F28 HydrophobicContact CB-CE2 4.38Å; L24-F28 HydrophobicContact CD2-CE2 4.16Å; L24-F28 VanDerWaalsContact O-CD2 3.22Å; L24-F28 WeakPolarHBondContact O-CD2 3.43Å; L24-F28 PolarHBondContact O-N 2.93Å
25G87.1Confident84.8Confident10 Ų1074.1 Ų74.110%0.10338%0.378CS..Hα-helixtrans-57.4-43.517500000112.1L21 S22 H27 Y29L21-G25 PolarHBondContact O-N 3.39Å; S22-G25 PolarHBondContact O-N 3.13Å; G25-H27 VanDerWaalsContact C-N 3.32Å; G25-H27 PolarHBondContact O-N 3.26Å; G25-Y29 CarbonylContact O-C 3.24Å; G25-Y29 VanDerWaalsContact O-C 3.24Å; G25-Y29 WeakPolarHBondContact O-CA 3.1Å; G25-Y29 PolarHBondContact O-N 2.84Å
26F85.1Confident85Confident27 Ų2772.9 Ų72.912%0.11837%0.372CS..Hα-helixtrans-60.5-38.4174.8174.3-102.6000112.9S22 V23 L24 P30 F33 P34 Y37 L131S22-F26 PolarHBondContact O-N 3.04Å; V23-F26 PolarHBondContact O-N 3.06Å; L24-F26 VanDerWaalsContact C-N 3.31Å; L24-F26 PolarHBondContact O-N 3.21Å; F26-P30 VanDerWaalsContact O-CA 3.31Å; F26-P30 WeakPolarHBondContact O-CA 3.35Å; F26-P30 WeakPolarHBondContact O-CB 3.48Å; F26-F33 WeakPolarHBondContact CD2-O 3.46Å; F26-P34 WeakPolarHBondContact CD2-O 3.27Å; F26-P34 WeakPolarHBondContact CE2-O 3.41Å; F26-Y37 HydrophobicContact CD2-CD1 4.2Å; F26-Y37 AromaticContact CE2-CD1 3.93Å; F26-Y37 HydrophobicContact CE2-CD1 3.93Å; F26-Y37 HydrophobicContact CZ-CD1 4.36Å; F26-L131 HydrophobicContact CE1-CD2 4.33Å
27H83.8Confident85.1Confident49 Ų4973.5 Ų73.523%0.22738%0.375CS..Hα-helixtrans-75.4-45.1-179.7-76.575.1000113.1V23 L24 G25 L131 H140V23-H27 PolarHBondContact O-N 3.43Å; V23-H27 PolarHBondContact O-ND1 3.45Å; L24-H27 PolarHBondContact O-N 3.37Å; L24-H27 VanDerWaalsContact O-N 3.11Å; G25-H27 VanDerWaalsContact C-N 3.32Å; G25-H27 PolarHBondContact O-N 3.26Å; H27-L131 WeakPolarHBondContact NE2-CD1 3.5Å; H27-L131 WeakPolarHBondContact NE2-CD2 3.5Å; H27-L131 WeakPolarHBondContact NE2-CG 3.47Å; H27-H140 AromaticContact CD2-CE1 3.78Å; H27-H140 AromaticContact NE2-CE1 3.4Å; H27-H140 PolarHBondContact NE2-CE1 2.9Å; H27-H140 AromaticContact NE2-ND1 3.88Å
28F86.7Confident85.3Confident145 Ų14573.1 Ų73.164%0.63637%0.366SS*.Hα-helixtrans-83-30.1-176-69.3-66.3000113.1L24L24-F28 HydrophobicContact CB-CD2 4.28Å; L24-F28 HydrophobicContact CB-CE2 4.38Å; L24-F28 HydrophobicContact CD2-CE2 4.16Å; L24-F28 VanDerWaalsContact O-CD2 3.22Å; L24-F28 WeakPolarHBondContact O-CD2 3.43Å; L24-F28 PolarHBondContact O-N 2.93Å
29Y87.1Confident85.4Confident141 Ų14168 Ų6855%0.55334%0.339SS*.  trans-139.660.1-172.2-59.5-74.4000111.3G25 T31 Y32 F33G25-Y29 CarbonylContact O-C 3.24Å; G25-Y29 VanDerWaalsContact O-C 3.24Å; G25-Y29 WeakPolarHBondContact O-CA 3.1Å; G25-Y29 PolarHBondContact O-N 2.84Å; Y29-T31 PolarHBondContact O-N 3.45Å; Y29-T31 VanDerWaalsContact O-N 3.12Å; Y29-Y32 HydrophobicContact CD1-CD2 4.35Å; Y29-Y32 PolarHBondContact O-N 3.46Å; Y29-F33 PolarHBondContact O-N 3.41Å
30P82.3Confident85.5Confident53 Ų5368.7 Ų68.734%0.34434%0.343SS..THydrogen-bonded Turntrans-59.9-28.5-172.821.9-33.3000113.7F26 F33 P34F26-P30 VanDerWaalsContact O-CA 3.31Å; F26-P30 WeakPolarHBondContact O-CA 3.35Å; F26-P30 WeakPolarHBondContact O-CB 3.48Å; P30-F33 CarbonylContact O-C 3.56Å; P30-P34 VanDerWaalsContact O-CA 3.25Å; P30-P34 WeakPolarHBondContact O-CA 3.16Å
31T86Confident85.7Confident117 Ų11765 Ų6572%0.71832%0.324SS*.THydrogen-bonded Turntrans-70.2-32.5175.750.80000113.2Y29Y29-T31 PolarHBondContact O-N 3.45Å; Y29-T31 VanDerWaalsContact O-N 3.12Å
32Y86.3Confident85.7Confident187 Ų18761 Ų6173%0.73330%0.303SS*.THydrogen-bonded Turntrans-90.6-28.5179.8-64.1-80.6000112.4Y29 P34Y29-Y32 HydrophobicContact CD1-CD2 4.35Å; Y29-Y32 PolarHBondContact O-N 3.46Å; Y32-P34 WeakPolarHBondContact O-CD 3.37Å
33F84.9Confident85.8Confident106 Ų10661.8 Ų61.847%0.46530%0.302SS..  trans-12557.2179.9-63-87.8000112.3F26 Y29 P30 N35 G36F26-F33 WeakPolarHBondContact CD2-O 3.46Å; Y29-F33 PolarHBondContact O-N 3.41Å; P30-F33 CarbonylContact O-C 3.56Å; F33-N35 PolarHBondContact O-N 2.94Å; F33-N35 VanDerWaalsContact O-N 3.09Å; F33-G36 PolarHBondContact O-N 3.32Å
34P79.7Confident86.2Confident72 Ų7260.6 Ų60.647%0.46829%0.294SS..THydrogen-bonded Turntrans-62-25.2-174.625.7-35.5000113.3F26 P30 Y32 Y37F26-P34 WeakPolarHBondContact CD2-O 3.27Å; F26-P34 WeakPolarHBondContact CE2-O 3.41Å; P30-P34 VanDerWaalsContact O-CA 3.25Å; P30-P34 WeakPolarHBondContact O-CA 3.16Å; Y32-P34 WeakPolarHBondContact O-CD 3.37Å; P34-Y37 WeakPolarHBondContact O-CD1 3.47Å; P34-Y37 VanDerWaalsContact O-CE1 3.29Å; P34-Y37 WeakPolarHBondContact O-CE1 3.27Å
35N84.4Confident86.5Confident97 Ų9756.9 Ų56.952%0.51928%0.275SS..THydrogen-bonded Turntrans-101.412.6179.7-64.6-40.7000113.5F33 Y37 L38F33-N35 PolarHBondContact O-N 2.94Å; F33-N35 VanDerWaalsContact O-N 3.09Å; N35-Y37 PolarHBondContact O-N 3.47Å; N35-L38 HydrophobicContact CB-CD1 3.92Å; N35-L38 HydrophobicContact CB-CG 4.45Å; N35-L38 VanDerWaalsContact O-CB 3.3Å; N35-L38 WeakPolarHBondContact O-CB 3.11Å; N35-L38 VanDerWaalsContact O-CG 3.29Å; N35-L38 WeakPolarHBondContact O-CG 3.47Å; N35-L38 PolarHBondContact O-N 2.95Å; N35-L38 VanDerWaalsContact O-N 3.09Å
36G83.3Confident86.6Confident2 Ų256.6 Ų56.62%0.02127%0.271CS..THydrogen-bonded Turntrans-67.6-18.6-175.800000114.1S22 V23 F33 L38 G39S22-G36 CarbonylContact C-O 3.47Å; S22-G36 CarbonylContact O-C 3.56Å; S22-G36 VanDerWaalsContact O-CA 3.25Å; S22-G36 WeakPolarHBondContact O-CA 3.3Å; S22-G36 VanDerWaalsContact OG-CA 3.3Å; S22-G36 WeakPolarHBondContact OG-CA 3.35Å; S22-G36 PolarHBondContact OG-O 3.08Å; V23-G36 PolarHBondContact N-O 3.26Å; F33-G36 PolarHBondContact O-N 3.32Å; G36-L38 PolarHBondContact O-N 2.8Å; G36-L38 VanDerWaalsContact O-N 3.16Å; G36-G39 PolarHBondContact O-N 3.46Å
37Y82.1Confident86.8Confident59 Ų5955.3 Ų55.323%0.23127%0.265CS..THydrogen-bonded Turntrans-58.8-23170.668.5-95.2000113.3F26 P34 N35 G39 V40 F193F26-Y37 HydrophobicContact CD2-CD1 4.2Å; F26-Y37 AromaticContact CE2-CD1 3.93Å; F26-Y37 HydrophobicContact CE2-CD1 3.93Å; F26-Y37 HydrophobicContact CZ-CD1 4.36Å; P34-Y37 WeakPolarHBondContact O-CD1 3.47Å; P34-Y37 VanDerWaalsContact O-CE1 3.29Å; P34-Y37 WeakPolarHBondContact O-CE1 3.27Å; N35-Y37 PolarHBondContact O-N 3.47Å; Y37-G39 PolarHBondContact O-N 3.28Å; Y37-G39 VanDerWaalsContact O-N 3.14Å; Y37-V40 WeakPolarHBondContact O-CB 3.21Å; Y37-V40 PolarHBondContact O-N 2.91Å; Y37-F193 HydrophobicContact CD2-CE2 4.05Å
38L85.9Confident87.3Confident22 Ų2253 Ų5312%0.11525%0.254CS..Hα-helixtrans-63.6-15.4174.3-61.8176.6000112.7N35 G36 V40 D41 Q42 T287 I290N35-L38 HydrophobicContact CB-CD1 3.92Å; N35-L38 HydrophobicContact CB-CG 4.45Å; N35-L38 VanDerWaalsContact O-CB 3.3Å; N35-L38 WeakPolarHBondContact O-CB 3.11Å; N35-L38 VanDerWaalsContact O-CG 3.29Å; N35-L38 WeakPolarHBondContact O-CG 3.47Å; N35-L38 PolarHBondContact O-N 2.95Å; N35-L38 VanDerWaalsContact O-N 3.09Å; G36-L38 PolarHBondContact O-N 2.8Å; G36-L38 VanDerWaalsContact O-N 3.16Å; L38-V40 PolarHBondContact O-N 3.48Å; L38-D41 WeakPolarHBondContact O-CB 3.31Å; L38-D41 PolarHBondContact O-N 2.89Å; L38-D41 VanDerWaalsContact O-N 3.1Å; L38-Q42 PolarHBondContact O-N 3.35Å; L38-Q42 VanDerWaalsContact O-N 3.14Å; L38-T287 HydrophobicContact CD1-CG2 3.94Å; L38-I290 HydrophobicContact CD2-CD1 4.24Å
39G86.7Confident87.5Confident1 Ų147.2 Ų47.21%0.0123%0.229CC..Hα-helixtrans-59.1-31169.400000112.5G36 Y37 D41 Q42 F43G36-G39 PolarHBondContact O-N 3.46Å; Y37-G39 PolarHBondContact O-N 3.28Å; Y37-G39 VanDerWaalsContact O-N 3.14Å; G39-D41 VanDerWaalsContact C-N 3.34Å; G39-Q42 WeakPolarHBondContact O-CB 3.27Å; G39-Q42 PolarHBondContact O-N 3.16Å; G39-F43 VanDerWaalsContact O-CD2 3.29Å; G39-F43 WeakPolarHBondContact O-CD2 3.25Å; G39-F43 PolarHBondContact O-N 3.43Å
40V88.9Confident87.6Confident15 Ų1541.1 Ų41.19%0.09121%0.206CC..Hα-helixtrans-66.3-39.1174.4-175.90000111.3V23 Y37 L38 Q42 F43 F44 W142V23-V40 HydrophobicContact CG2-CG2 3.83Å; Y37-V40 WeakPolarHBondContact O-CB 3.21Å; Y37-V40 PolarHBondContact O-N 2.91Å; L38-V40 PolarHBondContact O-N 3.48Å; V40-Q42 VanDerWaalsContact C-N 3.32Å; V40-Q42 PolarHBondContact O-N 3.47Å; V40-F43 VanDerWaalsContact O-CB 3.27Å; V40-F43 WeakPolarHBondContact O-CB 3.44Å; V40-F43 PolarHBondContact O-N 3.05Å; V40-F43 VanDerWaalsContact O-N 3.16Å; V40-F44 HydrophobicContact CG1-CD2 4.42Å; V40-F44 HydrophobicContact CG1-CE1 4.25Å; V40-F44 HydrophobicContact CG1-CE2 3.91Å; V40-F44 HydrophobicContact CG1-CZ 3.81Å; V40-F44 PolarHBondContact O-N 3.41Å; V40-W142 HydrophobicContact CG1-CH2 3.61Å; V40-W142 HydrophobicContact CG1-CZ2 3.84Å; V40-W142 HydrophobicContact CG2-CZ2 4.23Å
41D91.1Very high88.1Confident1 Ų138.6 Ų38.61%0.00519%0.189CC..Hα-helixtrans-63.4-43.7177.9-61.6-3.3000110.2L38 G39 F43 F44 V45 R199 Q202 V286L38-D41 WeakPolarHBondContact O-CB 3.31Å; L38-D41 PolarHBondContact O-N 2.89Å; L38-D41 VanDerWaalsContact O-N 3.1Å; G39-D41 VanDerWaalsContact C-N 3.34Å; D41-F43 VanDerWaalsContact C-N 3.28Å; D41-F43 PolarHBondContact O-N 3.43Å; D41-F44 PolarHBondContact O-N 3.35Å; D41-F44 VanDerWaalsContact O-N 3.15Å; D41-V45 VanDerWaalsContact O-CG2 3.3Å; D41-V45 WeakPolarHBondContact O-CG2 3.33Å; D41-V45 PolarHBondContact O-N 2.89Å; D41-R199 IonicContact OD1-CZ 2.72Å; D41-R199 IonicContact OD1-NH1 2.8Å; D41-R199 PolarHBondContact OD1-NH1 3.29Å; D41-R199 IonicContact OD1-NH2 2.86Å; D41-R199 PolarHBondContact OD1-NH2 3.43Å; D41-R199 IonicContact OD2-NH1 3.62Å; D41-Q202 VanDerWaalsContact CB-NE2 3.27Å; D41-Q202 PolarHBondContact OD1-NE2 3.31Å; D41-Q202 PolarHBondContact OD2-NE2 3.39Å; D41-V286 HydrophobicContact CB-CG1 3.27Å
42Q87.9Confident88.4Confident34 Ų3433 Ų3316%0.15916%0.155CC..Hα-helixtrans-59.4-38.4174.7-170.617316.400112.3I15 A19 L38 G39 V40 V45 L46I15-Q42 HydrophobicContact CG2-CG 4.23Å; A19-Q42 HydrophobicContact CB-CB 4.2Å; A19-Q42 HydrophobicContact CB-CG 4.25Å; L38-Q42 PolarHBondContact O-N 3.35Å; L38-Q42 VanDerWaalsContact O-N 3.14Å; G39-Q42 WeakPolarHBondContact O-CB 3.27Å; G39-Q42 PolarHBondContact O-N 3.16Å; V40-Q42 VanDerWaalsContact C-N 3.32Å; V40-Q42 PolarHBondContact O-N 3.47Å; Q42-V45 PolarHBondContact O-N 3.14Å; Q42-L46 HydrophobicContact CG-CD1 4.22Å; Q42-L46 WeakPolarHBondContact O-CB 3.42Å; Q42-L46 WeakPolarHBondContact O-CD1 3.39Å; Q42-L46 VanDerWaalsContact O-CG 3.3Å; Q42-L46 WeakPolarHBondContact O-CG 3.26Å; Q42-L46 PolarHBondContact O-N 3.4Å
43F88.8Confident88.5Confident53 Ų5324.9 Ų24.923%0.23212%0.124CC..Hα-helixtrans-58.9-49.3172.6-94.6-68.3000112.2R16 A19 I20 G39 V40 D41 V45 L46 S47R16-F43 HydrophobicContact CB-CE1 4.14Å; R16-F43 HydrophobicContact CB-CZ 4.47Å; R16-F43 HydrophobicContact CG-CD1 4.5Å; R16-F43 HydrophobicContact CG-CE1 4.03Å; A19-F43 HydrophobicContact CB-CD2 3.77Å; A19-F43 HydrophobicContact CB-CE2 3.72Å; A19-F43 HydrophobicContact CB-CG 4.47Å; A19-F43 HydrophobicContact CB-CZ 4.39Å; I20-F43 HydrophobicContact CD1-CZ 3.94Å; I20-F43 HydrophobicContact CG1-CE2 3.63Å; I20-F43 HydrophobicContact CG1-CZ 3.33Å; G39-F43 VanDerWaalsContact O-CD2 3.29Å; G39-F43 WeakPolarHBondContact O-CD2 3.25Å; G39-F43 PolarHBondContact O-N 3.43Å; V40-F43 VanDerWaalsContact O-CB 3.27Å; V40-F43 WeakPolarHBondContact O-CB 3.44Å; V40-F43 PolarHBondContact O-N 3.05Å; V40-F43 VanDerWaalsContact O-N 3.16Å; D41-F43 VanDerWaalsContact C-N 3.28Å; D41-F43 PolarHBondContact O-N 3.43Å; F43-V45 VanDerWaalsContact C-N 3.35Å; F43-V45 PolarHBondContact O-N 2.9Å; F43-L46 PolarHBondContact O-N 2.85Å; F43-S47 WeakPolarHBondContact O-CB 3.48Å; F43-S47 PolarHBondContact O-N 3.05Å; F43-S47 PolarHBondContact O-OG 3.26Å
44F93.8Very high88.6Confident3 Ų321.5 Ų21.51%0.01311%0.111CC..Hα-helixtrans-62.7-40.2179.3-65.9-19.2000112.4V40 D41 S47 G48 W142 V146 R199 Q202 F203V40-F44 HydrophobicContact CG1-CD2 4.42Å; V40-F44 HydrophobicContact CG1-CE1 4.25Å; V40-F44 HydrophobicContact CG1-CE2 3.91Å; V40-F44 HydrophobicContact CG1-CZ 3.81Å; V40-F44 PolarHBondContact O-N 3.41Å; D41-F44 PolarHBondContact O-N 3.35Å; D41-F44 VanDerWaalsContact O-N 3.15Å; F44-S47 PolarHBondContact O-N 2.79Å; F44-G48 PolarHBondContact O-N 3.15Å; F44-W142 HydrophobicContact CE2-CH2 4.47Å; F44-W142 HydrophobicContact CE2-CZ3 4.35Å; F44-W142 HydrophobicContact CZ-CH2 4.32Å; F44-W142 HydrophobicContact CZ-CZ3 4.05Å; F44-V146 HydrophobicContact CE1-CB 4.34Å; F44-V146 HydrophobicContact CE1-CG1 4.11Å; F44-V146 HydrophobicContact CE2-CG1 4.08Å; F44-V146 HydrophobicContact CZ-CB 3.91Å; F44-V146 HydrophobicContact CZ-CG1 3.66Å; F44-R199 HydrophobicContact CD2-CB 4.31Å; F44-R199 HydrophobicContact CE2-CB 4.26Å; F44-R199 HydrophobicContact CE2-CG 4.38Å; F44-Q202 HydrophobicContact CB-CB 3.95Å; F44-F203 HydrophobicContact CB-CD1 4.21Å; F44-F203 HydrophobicContact CB-CD2 4.08Å; F44-F203 HydrophobicContact CB-CE1 3.91Å; F44-F203 HydrophobicContact CB-CE2 3.76Å; F44-F203 HydrophobicContact CB-CG 4.3Å; F44-F203 HydrophobicContact CB-CZ 3.68Å; F44-F203 AromaticContact CD1-CE1 3.87Å; F44-F203 HydrophobicContact CD1-CE1 3.87Å; F44-F203 AromaticContact CD1-CE2 3.96Å; F44-F203 HydrophobicContact CD1-CE2 3.96Å; F44-F203 AromaticContact CD1-CZ 3.29Å; F44-F203 HydrophobicContact CD1-CZ 3.29Å; F44-F203 AromaticContact CD2-CE2 4Å; F44-F203 HydrophobicContact CD2-CE2 4Å; F44-F203 HydrophobicContact CD2-CZ 4.18Å; F44-F203 AromaticContact CE1-CZ 3.89Å; F44-F203 HydrophobicContact CE1-CZ 3.89Å; F44-F203 HydrophobicContact CG-CD2 4.44Å; F44-F203 HydrophobicContact CG-CE1 4.1Å; F44-F203 AromaticContact CG-CE2 3.65Å; F44-F203 HydrophobicContact CG-CE2 3.65Å; F44-F203 AromaticContact CG-CZ 3.45Å; F44-F203 HydrophobicContact CG-CZ 3.45Å; F44-F203 VanDerWaalsContact CG-CZ 3.45Å; F44-F203 WeakPolarHBondContact O-CD1 3.3Å
45V94.4Very high89.1Confident1 Ų118.3 Ų18.31%0.0069%0.09CC..Hα-helixtrans-63-45.2174.4-167.90000111.3D41 Q42 F43 S47 G48 F49 Q202 I205 G206 I209 M282 V286D41-V45 VanDerWaalsContact O-CG2 3.3Å; D41-V45 WeakPolarHBondContact O-CG2 3.33Å; D41-V45 PolarHBondContact O-N 2.89Å; Q42-V45 PolarHBondContact O-N 3.14Å; F43-V45 VanDerWaalsContact C-N 3.35Å; F43-V45 PolarHBondContact O-N 2.9Å; V45-S47 VanDerWaalsContact C-N 3.3Å; V45-S47 PolarHBondContact O-N 3.25Å; V45-G48 PolarHBondContact O-N 2.96Å; V45-F49 PolarHBondContact O-N 3.42Å; V45-Q202 WeakPolarHBondContact CA-O 3.45Å; V45-Q202 HydrophobicContact CG2-CB 4.15Å; V45-Q202 WeakPolarHBondContact CG2-O 3.44Å; V45-I205 HydrophobicContact CG1-CB 4.24Å; V45-I205 HydrophobicContact CG1-CG2 3.86Å; V45-G206 VanDerWaalsContact O-CA 3.28Å; V45-G206 WeakPolarHBondContact O-CA 3.41Å; V45-I209 HydrophobicContact CG1-CD1 4.44Å; V45-M282 HydrophobicContact CB-CE 3.73Å; V45-M282 HydrophobicContact CG1-CE 3.27Å; V45-M282 HydrophobicContact CG1-CG 3.96Å; V45-M282 HydrophobicContact CG1-SD 4.49Å; V45-V286 HydrophobicContact CG2-CG2 3.52Å
46L88.4Confident89.4Confident3 Ų315 Ų152%0.0167%0.073CC..Hα-helixtrans-62.6-37.1176.9-75165.5000112.6L12 I15 R16 Q42 F43 L50 M282L12-L46 HydrophobicContact CD2-CD2 3.98Å; I15-L46 HydrophobicContact CB-CD1 4.33Å; I15-L46 HydrophobicContact CG2-CD1 3.75Å; I15-L46 HydrophobicContact CG2-CD2 4.15Å; I15-L46 HydrophobicContact CG2-CG 4.38Å; R16-L46 HydrophobicContact CG-CD1 3.72Å; Q42-L46 HydrophobicContact CG-CD1 4.22Å; Q42-L46 WeakPolarHBondContact O-CB 3.42Å; Q42-L46 WeakPolarHBondContact O-CD1 3.39Å; Q42-L46 VanDerWaalsContact O-CG 3.3Å; Q42-L46 WeakPolarHBondContact O-CG 3.26Å; Q42-L46 PolarHBondContact O-N 3.4Å; F43-L46 PolarHBondContact O-N 2.85Å; L46-L50 VanDerWaalsContact O-CB 3.32Å; L46-L50 WeakPolarHBondContact O-CB 3.47Å; L46-L50 PolarHBondContact O-N 3.41Å; L46-M282 HydrophobicContact CB-CE 4.41Å; L46-M282 HydrophobicContact CD2-CE 3.71Å; L46-M282 HydrophobicContact CD2-SD 4.28Å; L46-M282 HydrophobicContact CG-CE 3.82Å
47S91.3Very high89.4Confident1 Ų119.3 Ų19.31%0.0079%0.091CC..Hα-helixtrans-68.3-43177.6-65.80000111.1F43 F44 V45 F49 L50 M51 E147F43-S47 WeakPolarHBondContact O-CB 3.48Å; F43-S47 PolarHBondContact O-N 3.05Å; F43-S47 PolarHBondContact O-OG 3.26Å; F44-S47 PolarHBondContact O-N 2.79Å; V45-S47 VanDerWaalsContact C-N 3.3Å; V45-S47 PolarHBondContact O-N 3.25Å; S47-F49 PolarHBondContact O-N 3.14Å; S47-L50 PolarHBondContact O-N 3.16Å; S47-M51 WeakPolarHBondContact O-CB 3.33Å; S47-M51 VanDerWaalsContact O-CG 3.28Å; S47-M51 WeakPolarHBondContact O-CG 3.4Å; S47-M51 PolarHBondContact O-N 3.2Å; S47-E147 VanDerWaalsContact CB-OE1 3.23Å; S47-E147 WeakPolarHBondContact CB-OE1 3.33Å; S47-E147 PolarHBondContact OG-OE1 3.38Å
48G93.7Very high89.5Confident0 Ų017 Ų170%08%0.084CC..Hα-helixtrans-58.4-46.4172.200000113.1F44 V45 L50 M51 C52 F203 M207F44-G48 PolarHBondContact O-N 3.15Å; V45-G48 PolarHBondContact O-N 2.96Å; G48-L50 VanDerWaalsContact C-N 3.35Å; G48-L50 PolarHBondContact O-N 3.25Å; G48-M51 PolarHBondContact O-N 3.49Å; G48-C52 WeakPolarHBondContact O-CB 3.46Å; G48-C52 PolarHBondContact O-N 3.04Å; G48-F203 WeakPolarHBondContact CA-O 3.47Å; G48-M207 WeakPolarHBondContact O-CG 3.18Å
49F91.3Very high89.3Confident23 Ų2320.9 Ų20.910%0.10110%0.101CC..Hα-helixtrans-56.7-48.3174.4177.5-81.9000111.7L12 V45 S47 C52 M53 G206 I209 Y210L12-F49 HydrophobicContact CD1-CE1 4.29Å; L12-F49 HydrophobicContact CD2-CE1 4.37Å; V45-F49 PolarHBondContact O-N 3.42Å; S47-F49 PolarHBondContact O-N 3.14Å; F49-C52 PolarHBondContact O-N 3.32Å; F49-M53 WeakPolarHBondContact O-CB 3.32Å; F49-M53 PolarHBondContact O-N 3.12Å; F49-G206 VanDerWaalsContact CA-O 3.29Å; F49-G206 WeakPolarHBondContact CA-O 3.22Å; F49-G206 WeakPolarHBondContact CB-O 3.08Å; F49-I209 HydrophobicContact CD2-CB 4.44Å; F49-I209 HydrophobicContact CD2-CG2 4.02Å; F49-I209 HydrophobicContact CE2-CG2 4.17Å; F49-Y210 HydrophobicContact CD2-CD2 4.47Å; F49-Y210 HydrophobicContact CE1-CD2 4.24Å; F49-Y210 AromaticContact CE2-CD2 3.94Å; F49-Y210 HydrophobicContact CE2-CD2 3.94Å; F49-Y210 HydrophobicContact CE2-CG 4.35Å; F49-Y210 AromaticContact CZ-CD2 3.81Å; F49-Y210 HydrophobicContact CZ-CD2 3.81Å
50L89.1Confident89.2Confident13 Ų1327 Ų277%0.06814%0.139CC..Hα-helixtrans-70.1-38-176.6-172.873.1000112.4L46 S47 G48 M53 L54 R74L46-L50 VanDerWaalsContact O-CB 3.32Å; L46-L50 WeakPolarHBondContact O-CB 3.47Å; L46-L50 PolarHBondContact O-N 3.41Å; S47-L50 PolarHBondContact O-N 3.16Å; G48-L50 VanDerWaalsContact C-N 3.35Å; G48-L50 PolarHBondContact O-N 3.25Å; L50-M53 HydrophobicContact CD1-CE 3.47Å; L50-M53 VanDerWaalsContact CD1-CE 3.47Å; L50-M53 PolarHBondContact O-N 2.98Å; L50-L54 PolarHBondContact O-N 3.1Å; L50-L54 VanDerWaalsContact O-N 3.07Å; L50-R74 VanDerWaalsContact CD2-NH1 3.35Å
51M91.3Very high89.2Confident0 Ų029.9 Ų29.90%015%0.152CC..Hα-helixtrans-65.6-46.1175.8-68.1-39.8112.200110.9S47 G48 M53 L54 L55 F70 R74 F150 Y151 V154S47-M51 WeakPolarHBondContact O-CB 3.33Å; S47-M51 VanDerWaalsContact O-CG 3.28Å; S47-M51 WeakPolarHBondContact O-CG 3.4Å; S47-M51 PolarHBondContact O-N 3.2Å; G48-M51 PolarHBondContact O-N 3.49Å; M51-M53 VanDerWaalsContact C-N 3.27Å; M51-M53 PolarHBondContact O-N 3.5Å; M51-L54 PolarHBondContact O-N 3.43Å; M51-L54 VanDerWaalsContact O-N 3.15Å; M51-L55 WeakPolarHBondContact O-CG 3.31Å; M51-L55 PolarHBondContact O-N 3.16Å; M51-F70 HydrophobicContact CB-CE2 4.17Å; M51-F70 HydrophobicContact CB-CZ 4.26Å; M51-F70 HydrophobicContact CG-CE2 4.27Å; M51-F70 HydrophobicContact CG-CZ 4.06Å; M51-F70 HydrophobicContact SD-CE2 3.51Å; M51-F70 VanDerWaalsContact SD-CE2 3.51Å; M51-F70 HydrophobicContact SD-CZ 3.44Å; M51-F70 WeakPolarHBondContact SD-CZ 3.41Å; M51-R74 HydrophobicContact SD-CG 4.34Å; M51-R74 PolarHBondContact SD-NE 2.88Å; M51-R74 VanDerWaalsContact SD-NE 3.37Å; M51-F150 HydrophobicContact CG-CE1 4.29Å; M51-Y151 HydrophobicContact CE-CD1 4.2Å; M51-Y151 HydrophobicContact CE-CE1 3.37Å; M51-Y151 HydrophobicContact CE-CE2 4.11Å; M51-Y151 WeakPolarHBondContact CE-OH 3.48Å; M51-Y151 HydrophobicContact CG-CD1 3.62Å; M51-Y151 HydrophobicContact CG-CE1 3.5Å; M51-Y151 VanDerWaalsContact CG-CE1 3.5Å; M51-Y151 HydrophobicContact SD-CD1 3.68Å; M51-Y151 HydrophobicContact SD-CE1 3.47Å; M51-Y151 WeakPolarHBondContact SD-CE1 3.48Å; M51-Y151 HydrophobicContact SD-CE2 4.29Å; M51-Y151 HydrophobicContact SD-CG 4.21Å; M51-V154 HydrophobicContact CB-CG1 4.05Å; M51-V154 HydrophobicContact CB-CG2 4.15Å; M51-V154 HydrophobicContact CG-CG1 4.13Å
52C92.8Very high89.2Confident0 Ų034.3 Ų34.30%018%0.181CC..Hα-helixtrans-57.8-43.2176.1-160.90000111.3G48 F49 L54 L55 T56 M207 Y210G48-C52 WeakPolarHBondContact O-CB 3.46Å; G48-C52 PolarHBondContact O-N 3.04Å; F49-C52 PolarHBondContact O-N 3.32Å; C52-L54 PolarHBondContact O-N 3.48Å; C52-L55 PolarHBondContact O-N 2.97Å; C52-T56 WeakPolarHBondContact O-CB 3.48Å; C52-T56 PolarHBondContact O-N 3.21Å; C52-T56 PolarHBondContact O-OG1 3.11Å; C52-M207 HydrophobicContact CB-CB 3.98Å; C52-M207 HydrophobicContact CB-CE 4.32Å; C52-M207 HydrophobicContact CB-CG 3.92Å; C52-Y210 HydrophobicContact CB-CD1 3.84Å; C52-Y210 HydrophobicContact CB-CG 4.27Å; C52-Y210 VanDerWaalsContact SG-CD1 3.6Å
53M87.7Confident89.3Confident16 Ų1637 Ų378%0.07920%0.2CC..Hα-helixtrans-59.9-43.3176.2-177.8-170.277.300113.3R9 F49 L50 M51 K57 Y210R9-M53 PolarHBondContact NH2-SD 3.43Å; R9-M53 VanDerWaalsContact NH2-SD 3.36Å; F49-M53 WeakPolarHBondContact O-CB 3.32Å; F49-M53 PolarHBondContact O-N 3.12Å; L50-M53 HydrophobicContact CD1-CE 3.47Å; L50-M53 VanDerWaalsContact CD1-CE 3.47Å; L50-M53 PolarHBondContact O-N 2.98Å; M51-M53 VanDerWaalsContact C-N 3.27Å; M51-M53 PolarHBondContact O-N 3.5Å; M53-K57 WeakPolarHBondContact O-CG 3.3Å; M53-K57 PolarHBondContact O-N 2.96Å; M53-K57 VanDerWaalsContact O-N 3.16Å; M53-Y210 HydrophobicContact CB-CD2 3.76Å; M53-Y210 HydrophobicContact CB-CE1 4.25Å; M53-Y210 HydrophobicContact CB-CE2 3.46Å; M53-Y210 VanDerWaalsContact CB-CE2 3.46Å; M53-Y210 HydrophobicContact CB-CG 4.27Å; M53-Y210 HydrophobicContact CG-CD2 4.2Å; M53-Y210 HydrophobicContact CG-CE2 3.48Å; M53-Y210 VanDerWaalsContact CG-CE2 3.48Å; M53-Y210 HydrophobicContact SD-CE2 4.48Å
54L87.8Confident89.3Confident35 Ų3540.7 Ų40.718%0.18322%0.22CC..Hα-helixtrans-67.7-41.5177.6-74.4-159.1000112.4L50 M51 C52 K57 S58 F70 R74L50-L54 PolarHBondContact O-N 3.1Å; L50-L54 VanDerWaalsContact O-N 3.07Å; M51-L54 PolarHBondContact O-N 3.43Å; M51-L54 VanDerWaalsContact O-N 3.15Å; C52-L54 PolarHBondContact O-N 3.48Å; L54-K57 WeakPolarHBondContact O-CB 3.37Å; L54-K57 PolarHBondContact O-N 3.43Å; L54-S58 PolarHBondContact O-N 3.36Å; L54-S58 VanDerWaalsContact O-N 3.1Å; L54-S58 PolarHBondContact O-OG 3.22Å; L54-F70 HydrophobicContact CB-CD2 3.94Å; L54-F70 HydrophobicContact CB-CE2 4.22Å; L54-F70 HydrophobicContact CD1-CD2 4.25Å; L54-F70 HydrophobicContact CD1-CE2 4.46Å; L54-R74 VanDerWaalsContact CD1-CZ 3.42Å; L54-R74 VanDerWaalsContact CG-NH2 3.26Å
55L90.6Very high89.1Confident6 Ų643.4 Ų43.43%0.03124%0.24CC..Hα-helixtrans-66.1-40.3-179.9-71.7165.5000111.5M51 C52 K57 S58 E59 F70 V154 P155 F158M51-L55 WeakPolarHBondContact O-CG 3.31Å; M51-L55 PolarHBondContact O-N 3.16Å; C52-L55 PolarHBondContact O-N 2.97Å; L55-K57 VanDerWaalsContact C-N 3.29Å; L55-K57 PolarHBondContact O-N 3.24Å; L55-S58 PolarHBondContact O-N 3.44Å; L55-S58 VanDerWaalsContact O-N 3.14Å; L55-S58 PolarHBondContact O-OG 2.82Å; L55-E59 PolarHBondContact O-N 3.18Å; L55-F70 HydrophobicContact CD1-CE2 4.35Å; L55-F70 HydrophobicContact CD2-CB 4.17Å; L55-F70 HydrophobicContact CD2-CD1 4.37Å; L55-F70 HydrophobicContact CD2-CD2 3.8Å; L55-F70 HydrophobicContact CD2-CE2 4.27Å; L55-F70 HydrophobicContact CD2-CG 3.86Å; L55-F70 HydrophobicContact CG-CD2 3.86Å; L55-F70 HydrophobicContact CG-CE2 3.97Å; L55-F70 HydrophobicContact CG-CG 4.42Å; L55-V154 HydrophobicContact CD1-CG1 4.17Å; L55-V154 HydrophobicContact CD1-CG2 4.03Å; L55-P155 HydrophobicContact CD2-CB 4.03Å; L55-P155 HydrophobicContact CD2-CG 4.2Å; L55-F158 HydrophobicContact CB-CD1 3.77Å; L55-F158 HydrophobicContact CB-CD2 3.95Å; L55-F158 HydrophobicContact CB-CE1 3.8Å; L55-F158 HydrophobicContact CB-CE2 3.97Å; L55-F158 HydrophobicContact CB-CG 3.84Å; L55-F158 HydrophobicContact CB-CZ 3.88Å; L55-F158 HydrophobicContact CD1-CB 3.73Å; L55-F158 HydrophobicContact CD1-CD1 4.39Å; L55-F158 HydrophobicContact CD1-CD2 4.24Å; L55-F158 HydrophobicContact CD1-CG 3.88Å; L55-F158 HydrophobicContact CG-CG 4.42Å
56T89.8Confident88.8Confident28 Ų2843.5 Ų43.517%0.17224%0.241CC..Hα-helixtrans-62.6-36.3172.4-64.60000112.1C52 S58 E59 F158 Y210C52-T56 WeakPolarHBondContact O-CB 3.48Å; C52-T56 PolarHBondContact O-N 3.21Å; C52-T56 PolarHBondContact O-OG1 3.11Å; T56-S58 VanDerWaalsContact C-N 3.29Å; T56-S58 PolarHBondContact O-N 3.39Å; T56-E59 WeakPolarHBondContact O-CB 3.45Å; T56-E59 PolarHBondContact O-N 3Å; T56-F158 WeakPolarHBondContact OG1-CE2 3.35Å; T56-F158 WeakPolarHBondContact OG1-CZ 3.35Å; T56-Y210 HydrophobicContact CG2-CE1 4.12Å; T56-Y210 WeakPolarHBondContact OG1-CE1 3.47Å
57K83.4Confident88.8Confident91 Ų9144.9 Ų44.940%0.39625%0.249SC..Hα-helixtrans-67.9-27.8174.9-75.5-179.4176-164.10113.3M53 L54 L55M53-K57 WeakPolarHBondContact O-CG 3.3Å; M53-K57 PolarHBondContact O-N 2.96Å; M53-K57 VanDerWaalsContact O-N 3.16Å; L54-K57 WeakPolarHBondContact O-CB 3.37Å; L54-K57 PolarHBondContact O-N 3.43Å; L55-K57 VanDerWaalsContact C-N 3.29Å; L55-K57 PolarHBondContact O-N 3.24Å
58S84.3Confident88.7Confident11 Ų1150 Ų508%0.07728%0.276CS..THydrogen-bonded Turntrans-90.33177.960.80000114.1L54 L55 T56 T60 M61L54-S58 PolarHBondContact O-N 3.36Å; L54-S58 VanDerWaalsContact O-N 3.1Å; L54-S58 PolarHBondContact O-OG 3.22Å; L55-S58 PolarHBondContact O-N 3.44Å; L55-S58 VanDerWaalsContact O-N 3.14Å; L55-S58 PolarHBondContact O-OG 2.82Å; T56-S58 VanDerWaalsContact C-N 3.29Å; T56-S58 PolarHBondContact O-N 3.39Å; S58-T60 PolarHBondContact O-N 3.33Å; S58-M61 WeakPolarHBondContact O-CB 3.35Å; S58-M61 PolarHBondContact O-N 3.03Å
59E82.2Confident88.4Confident103 Ų10353.1 Ų53.148%0.48129%0.291SS..THydrogen-bonded Turntrans-61.7-23.4176.9-78179.9179.900113.6L55 T56 M61 F158L55-E59 PolarHBondContact O-N 3.18Å; T56-E59 WeakPolarHBondContact O-CB 3.45Å; T56-E59 PolarHBondContact O-N 3Å; E59-M61 PolarHBondContact O-N 3.26Å; E59-F158 HydrophobicContact CG-CE1 4.05Å; E59-F158 HydrophobicContact CG-CZ 4.24Å; E59-F158 WeakPolarHBondContact OE1-CE1 3.14Å; E59-F158 WeakPolarHBondContact OE1-CZ 3.41Å
60T84.9Confident88.3Confident131 Ų13152.1 Ų52.180%0.80429%0.286SS*.THydrogen-bonded Turntrans-75.6-13176.957.20000113.2S58S58-T60 PolarHBondContact O-N 3.33Å
61M87.9Confident88.4Confident75 Ų7553.5 Ų53.537%0.36929%0.291SS..SBendtrans-91.7156.9178.4-59.7178.4178.100110.6S58 E59 V63 H69S58-M61 WeakPolarHBondContact O-CB 3.35Å; S58-M61 PolarHBondContact O-N 3.03Å; E59-M61 PolarHBondContact O-N 3.26Å; M61-V63 PolarHBondContact O-N 3.38Å; M61-H69 HydrophobicContact SD-CB 4.21Å
62P91.9Very high88.2Confident93 Ų9356.1 Ų56.160%0.60431%0.309SS*.  trans-52.4140.9164.9-23.633.6000110.6I64 S65 G66P62-I64 VanDerWaalsContact C-N 3.3Å; P62-I64 PolarHBondContact O-N 3.29Å; P62-I64 VanDerWaalsContact O-N 3.15Å; P62-S65 PolarHBondContact O-N 2.7Å; P62-G66 PolarHBondContact O-N 3.44Å
63V89Confident87.9Confident92 Ų9261.8 Ų61.856%0.55833%0.33SS*.Hα-helixtrans-48.7-49.2-171.8175.20000112.6M61 G66 V67 L159M61-V63 PolarHBondContact O-N 3.38Å; V63-G66 PolarHBondContact O-N 3.39Å; V63-V67 VanDerWaalsContact O-CG2 3.27Å; V63-V67 WeakPolarHBondContact O-CG2 3.38Å; V63-V67 PolarHBondContact O-N 2.85Å; V63-L159 HydrophobicContact CG1-CD1 3.73Å; V63-L159 HydrophobicContact CG1-CD2 3.91Å; V63-L159 HydrophobicContact CG2-CD2 4.5Å
64I90.5Very high87.8Confident129 Ų12961.7 Ų61.766%0.66233%0.329SS*.Hα-helixtrans-62.7-48.4-179.1-62.6170.8000110.7P62 G66 V67 L68P62-I64 VanDerWaalsContact C-N 3.3Å; P62-I64 PolarHBondContact O-N 3.29Å; P62-I64 VanDerWaalsContact O-N 3.15Å; I64-G66 VanDerWaalsContact C-N 3.34Å; I64-G66 PolarHBondContact O-N 3.46Å; I64-V67 PolarHBondContact O-N 3.21Å; I64-L68 HydrophobicContact CG2-CD1 3.92Å; I64-L68 HydrophobicContact CG2-CG 4.42Å; I64-L68 WeakPolarHBondContact O-CB 3.11Å; I64-L68 WeakPolarHBondContact O-CG 3.45Å; I64-L68 PolarHBondContact O-N 3.02Å
65S89Confident87.8Confident61 Ų6164.3 Ų64.343%0.42734%0.339SS..Hα-helixtrans-63.1-40.7179.2-530000111.9P62 L68 H69P62-S65 PolarHBondContact O-N 2.7Å; S65-L68 PolarHBondContact O-N 2.92Å; S65-H69 WeakPolarHBondContact O-CB 3.45Å; S65-H69 PolarHBondContact O-N 3.45Å
66G87.6Confident87.7Confident3 Ų370.7 Ų70.73%0.03137%0.367CS..Hα-helixtrans-64.2-39.9177.200000112.8P62 V63 I64 F70P62-G66 PolarHBondContact O-N 3.44Å; V63-G66 PolarHBondContact O-N 3.39Å; I64-G66 VanDerWaalsContact C-N 3.34Å; I64-G66 PolarHBondContact O-N 3.46Å; G66-F70 WeakPolarHBondContact O-CB 3.47Å; G66-F70 PolarHBondContact O-N 3.02Å
67V89.4Confident87.5Confident31 Ų3173 Ų7319%0.18837%0.372CS..Hα-helixtrans-69.4-44.5176172.30000111.4V63 I64 H69 F70 Y71 P155 L159V63-V67 VanDerWaalsContact O-CG2 3.27Å; V63-V67 WeakPolarHBondContact O-CG2 3.38Å; V63-V67 PolarHBondContact O-N 2.85Å; I64-V67 PolarHBondContact O-N 3.21Å; V67-H69 VanDerWaalsContact C-N 3.34Å; V67-H69 PolarHBondContact O-N 3.03Å; V67-F70 WeakPolarHBondContact O-CB 3.38Å; V67-F70 PolarHBondContact O-N 3.4Å; V67-Y71 HydrophobicContact CG1-CD2 3.7Å; V67-Y71 HydrophobicContact CG1-CE2 3.34Å; V67-Y71 WeakPolarHBondContact O-CD2 3.4Å; V67-Y71 PolarHBondContact O-N 3.26Å; V67-P155 HydrophobicContact CG1-CB 4.25Å; V67-P155 HydrophobicContact CG2-CB 4.04Å; V67-L159 HydrophobicContact CG2-CD1 4.15Å
68L89.5Confident87.6Confident108 Ų10870 Ų7057%0.56536%0.361SS*.Hα-helixtrans-63.1-41.7176-71.9174.2000111.7I64 S65 F70 Y71 S72I64-L68 HydrophobicContact CG2-CD1 3.92Å; I64-L68 HydrophobicContact CG2-CG 4.42Å; I64-L68 WeakPolarHBondContact O-CB 3.11Å; I64-L68 WeakPolarHBondContact O-CG 3.45Å; I64-L68 PolarHBondContact O-N 3.02Å; S65-L68 PolarHBondContact O-N 2.92Å; L68-F70 VanDerWaalsContact C-N 3.33Å; L68-F70 PolarHBondContact O-N 3.1Å; L68-Y71 PolarHBondContact O-N 3.09Å; L68-S72 VanDerWaalsContact O-CB 3.32Å; L68-S72 WeakPolarHBondContact O-CB 3.47Å; L68-S72 PolarHBondContact O-N 2.89Å
69H86.5Confident87.9Confident66 Ų6672.3 Ų72.331%0.30637%0.372SS..Hα-helixtrans-61.9-41.6175.1179-98.1000111.6M61 S65 V67 R73M61-H69 HydrophobicContact SD-CB 4.21Å; S65-H69 WeakPolarHBondContact O-CB 3.45Å; S65-H69 PolarHBondContact O-N 3.45Å; V67-H69 VanDerWaalsContact C-N 3.34Å; V67-H69 PolarHBondContact O-N 3.03Å; H69-R73 PolarHBondContact CE1-NE 2.98Å; H69-R73 PolarHBondContact NE2-NE 3.42Å; H69-R73 PolarHBondContact O-N 3.37Å
70F89.1Confident88.4Confident2 Ų271.2 Ų71.21%0.00937%0.373CS..Hα-helixtrans-58.9-51173.4169-93000111.9M51 L54 L55 G66 V67 L68 R74 V154 P155M51-F70 HydrophobicContact CB-CE2 4.17Å; M51-F70 HydrophobicContact CB-CZ 4.26Å; M51-F70 HydrophobicContact CG-CE2 4.27Å; M51-F70 HydrophobicContact CG-CZ 4.06Å; M51-F70 HydrophobicContact SD-CE2 3.51Å; M51-F70 VanDerWaalsContact SD-CE2 3.51Å; M51-F70 HydrophobicContact SD-CZ 3.44Å; M51-F70 WeakPolarHBondContact SD-CZ 3.41Å; L54-F70 HydrophobicContact CB-CD2 3.94Å; L54-F70 HydrophobicContact CB-CE2 4.22Å; L54-F70 HydrophobicContact CD1-CD2 4.25Å; L54-F70 HydrophobicContact CD1-CE2 4.46Å; L55-F70 HydrophobicContact CD1-CE2 4.35Å; L55-F70 HydrophobicContact CD2-CB 4.17Å; L55-F70 HydrophobicContact CD2-CD1 4.37Å; L55-F70 HydrophobicContact CD2-CD2 3.8Å; L55-F70 HydrophobicContact CD2-CE2 4.27Å; L55-F70 HydrophobicContact CD2-CG 3.86Å; L55-F70 HydrophobicContact CG-CD2 3.86Å; L55-F70 HydrophobicContact CG-CE2 3.97Å; L55-F70 HydrophobicContact CG-CG 4.42Å; G66-F70 WeakPolarHBondContact O-CB 3.47Å; G66-F70 PolarHBondContact O-N 3.02Å; V67-F70 WeakPolarHBondContact O-CB 3.38Å; V67-F70 PolarHBondContact O-N 3.4Å; L68-F70 VanDerWaalsContact C-N 3.33Å; L68-F70 PolarHBondContact O-N 3.1Å; F70-R74 HydrophobicContact CE2-CG 4.34Å; F70-R74 HydrophobicContact CZ-CG 4.29Å; F70-R74 VanDerWaalsContact O-CG 3.27Å; F70-R74 WeakPolarHBondContact O-CG 3.41Å; F70-R74 PolarHBondContact O-N 3.29Å; F70-V154 HydrophobicContact CE1-CG1 4.12Å; F70-V154 HydrophobicContact CZ-CG1 3.72Å; F70-P155 HydrophobicContact CD1-CG 3.84Å; F70-P155 HydrophobicContact CE1-CG 3.77Å
71Y90.5Very high88.7Confident42 Ų4271 Ų7117%0.16537%0.367CS..Hα-helixtrans-64-47.6-179.3-74.6-46.8000112.4V67 L68 R73 R74 F75 Y151 F152 P155V67-Y71 HydrophobicContact CG1-CD2 3.7Å; V67-Y71 HydrophobicContact CG1-CE2 3.34Å; V67-Y71 WeakPolarHBondContact O-CD2 3.4Å; V67-Y71 PolarHBondContact O-N 3.26Å; L68-Y71 PolarHBondContact O-N 3.09Å; Y71-R73 PolarHBondContact O-N 3.12Å; Y71-R74 PolarHBondContact O-N 3.33Å; Y71-F75 HydrophobicContact CD1-CE2 4.02Å; Y71-F75 HydrophobicContact CG-CE2 4.28Å; Y71-F75 WeakPolarHBondContact O-CD2 3.37Å; Y71-F75 PolarHBondContact O-N 3.37Å; Y71-Y151 VanDerWaalsContact CE1-O 3.27Å; Y71-Y151 WeakPolarHBondContact CE1-O 3.45Å; Y71-F152 PolarHBondContact OH-O 2.86Å; Y71-P155 HydrophobicContact CE1-CG 4.17Å; Y71-P155 HydrophobicContact CE2-CG 4.49Å; Y71-P155 WeakPolarHBondContact OH-CG 3.44Å
72S87.9Confident88.8Confident55 Ų5568.1 Ų68.139%0.38535%0.352SS..Hα-helixtrans-55.6-49.8-178.9179.50000111.8L68 R74 F75 K76L68-S72 VanDerWaalsContact O-CB 3.32Å; L68-S72 WeakPolarHBondContact O-CB 3.47Å; L68-S72 PolarHBondContact O-N 2.89Å; S72-R74 VanDerWaalsContact C-N 3.26Å; S72-R74 PolarHBondContact O-N 3.45Å; S72-F75 PolarHBondContact O-N 3.16Å; S72-K76 WeakPolarHBondContact O-CB 3.17Å; S72-K76 WeakPolarHBondContact O-CG 3.49Å; S72-K76 PolarHBondContact O-N 3.42Å
73R85.4Confident88.9Confident119 Ų11967 Ų6745%0.44934%0.341SS..Hα-helixtrans-61.1-34.8177.6-74.9-166.8173.9-142.2-0.9112.8H69 Y71 R77 D243H69-R73 PolarHBondContact CE1-NE 2.98Å; H69-R73 PolarHBondContact NE2-NE 3.42Å; H69-R73 PolarHBondContact O-N 3.37Å; Y71-R73 PolarHBondContact O-N 3.12Å; R73-R77 WeakPolarHBondContact O-CB 3.44Å; R73-D243 IonicContact NH1-OD1 3.77Å
74R86.9Confident89.1Confident15 Ų1566.8 Ų66.86%0.05734%0.336CS..Hα-helixtrans-75.4-46.3-179-70.6-72161.7-1652.7112.3L50 M51 L54 F70 Y71 S72 R77 I78L50-R74 VanDerWaalsContact CD2-NH1 3.35Å; M51-R74 HydrophobicContact SD-CG 4.34Å; M51-R74 PolarHBondContact SD-NE 2.88Å; M51-R74 VanDerWaalsContact SD-NE 3.37Å; L54-R74 VanDerWaalsContact CD1-CZ 3.42Å; L54-R74 VanDerWaalsContact CG-NH2 3.26Å; F70-R74 HydrophobicContact CE2-CG 4.34Å; F70-R74 HydrophobicContact CZ-CG 4.29Å; F70-R74 VanDerWaalsContact O-CG 3.27Å; F70-R74 WeakPolarHBondContact O-CG 3.41Å; F70-R74 PolarHBondContact O-N 3.29Å; Y71-R74 PolarHBondContact O-N 3.33Å; S72-R74 VanDerWaalsContact C-N 3.26Å; S72-R74 PolarHBondContact O-N 3.45Å; R74-R77 PolarHBondContact O-N 3.26Å; R74-I78 PolarHBondContact O-N 2.9Å; R74-I78 VanDerWaalsContact O-N 3.13Å
75F88.1Confident89.3Confident90 Ų9064.7 Ų64.740%0.39532%0.322SS..Hα-helixtrans-64.7-44.9179-76.6-66000111.9Y71 S72 R77 I78 L79Y71-F75 HydrophobicContact CD1-CE2 4.02Å; Y71-F75 HydrophobicContact CG-CE2 4.28Å; Y71-F75 WeakPolarHBondContact O-CD2 3.37Å; Y71-F75 PolarHBondContact O-N 3.37Å; S72-F75 PolarHBondContact O-N 3.16Å; F75-R77 PolarHBondContact O-N 2.94Å; F75-I78 PolarHBondContact O-N 3.44Å; F75-L79 WeakPolarHBondContact O-CB 3.43Å; F75-L79 PolarHBondContact O-N 2.76Å
76K87.8Confident89.5Confident140 Ų14062.4 Ų62.461%0.60931%0.305SS*.Hα-helixtrans-57.6-31.7176.7-74.1-174178.3-167.50113.1S72 P80S72-K76 WeakPolarHBondContact O-CB 3.17Å; S72-K76 WeakPolarHBondContact O-CG 3.49Å; S72-K76 PolarHBondContact O-N 3.42Å; K76-P80 VanDerWaalsContact O-CD 3.25Å; K76-P80 WeakPolarHBondContact O-CD 3.46Å; K76-P80 VanDerWaalsContact O-CG 3.28Å; K76-P80 WeakPolarHBondContact O-CG 3.44Å
77R85.2Confident89.8Confident75 Ų7568.2 Ų68.228%0.28333%0.329SS..Hα-helixtrans-81.4-38.2-179.6-179.4177170.8169.86.1113.8R73 R74 F75 F245R73-R77 WeakPolarHBondContact O-CB 3.44Å; R74-R77 PolarHBondContact O-N 3.26Å; F75-R77 PolarHBondContact O-N 2.94Å; R77-F245 VanDerWaalsContact CZ-CD2 3.43Å; R77-F245 VanDerWaalsContact NH2-CD1 3.33Å
78I87Confident90.1Very high30 Ų3071 Ų7115%0.15434%0.343CS..Hα-helixtrans-99.5-40.5-167.4-64.8170.5000111.7R74 F75 Y82 L144 I148 Y151R74-I78 PolarHBondContact O-N 2.9Å; R74-I78 VanDerWaalsContact O-N 3.13Å; F75-I78 PolarHBondContact O-N 3.44Å; I78-Y82 WeakPolarHBondContact O-CB 3.39Å; I78-Y82 PolarHBondContact O-N 2.81Å; I78-L144 HydrophobicContact CG2-CD1 4.14Å; I78-L144 HydrophobicContact CG2-CD2 4.42Å; I78-I148 HydrophobicContact CG2-CD1 4.01Å; I78-Y151 HydrophobicContact CD1-CD2 4.27Å; I78-Y151 HydrophobicContact CD1-CE2 3.46Å; I78-Y151 VanDerWaalsContact CD1-CE2 3.46Å
79L89.5Confident90.2Very high59 Ų5966.7 Ų66.731%0.30932%0.321SS..Hα-helixtrans-63.4-41.9-171.5-166.364.6000113.3F75 L81 Y82 L83 F115F75-L79 WeakPolarHBondContact O-CB 3.43Å; F75-L79 PolarHBondContact O-N 2.76Å; L79-L81 PolarHBondContact O-N 3.19Å; L79-Y82 PolarHBondContact O-N 3.48Å; L79-L83 HydrophobicContact CD1-CD1 3.89Å; L79-L83 HydrophobicContact CD1-CD2 4.24Å; L79-L83 HydrophobicContact CD1-CG 3.84Å; L79-L83 HydrophobicContact CD2-CD1 4.26Å; L79-L83 HydrophobicContact CG-CD1 3.68Å; L79-L83 HydrophobicContact CG-CG 4.02Å; L79-L83 WeakPolarHBondContact O-CB 3.41Å; L79-L83 VanDerWaalsContact O-CG 3.3Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 3.41Å; L79-F115 HydrophobicContact CD1-CE2 4.23Å; L79-F115 HydrophobicContact CD1-CZ 3.94Å
80P91.8Very high90.5Very high79 Ų7965.7 Ų65.751%0.51332%0.319SS..Hα-helixtrans-61.3-50.2-176.9-24.234.7000113K76 Y82 L84K76-P80 VanDerWaalsContact O-CD 3.25Å; K76-P80 WeakPolarHBondContact O-CD 3.46Å; K76-P80 VanDerWaalsContact O-CG 3.28Å; K76-P80 WeakPolarHBondContact O-CG 3.44Å; P80-Y82 VanDerWaalsContact C-N 3.34Å; P80-Y82 PolarHBondContact O-N 2.86Å; P80-L84 VanDerWaalsContact O-CB 3.3Å; P80-L84 WeakPolarHBondContact O-CB 3.39Å; P80-L84 PolarHBondContact O-N 3.27Å
81L91.8Very high90.7Very high127 Ų12768.9 Ų68.967%0.66534%0.336SS*.Hα-helixtrans-69.6-35-177.9-171.161.9000111.6L79 L84 F85L79-L81 PolarHBondContact O-N 3.19Å; L81-L84 HydrophobicContact CD1-CD2 4.45Å; L81-F85 WeakPolarHBondContact O-CB 3.43Å; L81-F85 PolarHBondContact O-N 2.99Å
82Y91.4Very high90.8Very high14 Ų1468.7 Ų68.76%0.05534%0.341CS..Hα-helixtrans-68.8-45.2177.7-176.2-114.4000112.7I78 L79 P80 L84 F85 I86 A112 F115 T141 L144I78-Y82 WeakPolarHBondContact O-CB 3.39Å; I78-Y82 PolarHBondContact O-N 2.81Å; L79-Y82 PolarHBondContact O-N 3.48Å; P80-Y82 VanDerWaalsContact C-N 3.34Å; P80-Y82 PolarHBondContact O-N 2.86Å; Y82-L84 VanDerWaalsContact C-N 3.32Å; Y82-L84 PolarHBondContact O-N 3.46Å; Y82-F85 WeakPolarHBondContact O-CB 3.09Å; Y82-F85 PolarHBondContact O-N 3.44Å; Y82-I86 HydrophobicContact CD1-CD1 3.83Å; Y82-I86 HydrophobicContact CE1-CD1 3.31Å; Y82-I86 HydrophobicContact CE1-CG1 4.3Å; Y82-I86 HydrophobicContact CE2-CD1 4.26Å; Y82-I86 HydrophobicContact CE2-CG1 4.47Å; Y82-I86 WeakPolarHBondContact O-CG1 3.44Å; Y82-I86 PolarHBondContact O-N 2.99Å; Y82-A112 VanDerWaalsContact OH-C 3.31Å; Y82-A112 WeakPolarHBondContact OH-CA 3.45Å; Y82-A112 PolarHBondContact OH-O 3.41Å; Y82-F115 HydrophobicContact CD1-CD1 4.4Å; Y82-F115 AromaticContact CD1-CE1 3.3Å; Y82-F115 HydrophobicContact CD1-CE1 3.3Å; Y82-F115 AromaticContact CD1-CZ 3.53Å; Y82-F115 HydrophobicContact CD1-CZ 3.53Å; Y82-F115 AromaticContact CE1-CD1 3.75Å; Y82-F115 HydrophobicContact CE1-CD1 3.75Å; Y82-F115 AromaticContact CE1-CE1 3.05Å; Y82-F115 HydrophobicContact CE1-CE1 3.05Å; Y82-F115 AromaticContact CE1-CZ 3.59Å; Y82-F115 HydrophobicContact CE1-CZ 3.59Å; Y82-F115 HydrophobicContact CG-CE1 4.21Å; Y82-F115 AromaticContact CZ-CE1 3.82Å; Y82-T141 HydrophobicContact CE2-CG2 3.89Å; Y82-T141 WeakPolarHBondContact OH-CB 3.5Å; Y82-L144 HydrophobicContact CD1-CD2 4.48Å; Y82-L144 HydrophobicContact CD2-CD2 3.18Å; Y82-L144 HydrophobicContact CE2-CD2 3.47Å; Y82-L144 VanDerWaalsContact CE2-CD2 3.47Å; Y82-L144 HydrophobicContact CG-CD2 3.72Å
83L92.8Very high90.9Very high71 Ų7166.3 Ų66.337%0.37232%0.324SS..Hα-helixtrans-66.1-36.8175.9-68.5-179000111.5L79 I86 F87 L113L79-L83 HydrophobicContact CD1-CD1 3.89Å; L79-L83 HydrophobicContact CD1-CD2 4.24Å; L79-L83 HydrophobicContact CD1-CG 3.84Å; L79-L83 HydrophobicContact CD2-CD1 4.26Å; L79-L83 HydrophobicContact CG-CD1 3.68Å; L79-L83 HydrophobicContact CG-CG 4.02Å; L79-L83 WeakPolarHBondContact O-CB 3.41Å; L79-L83 VanDerWaalsContact O-CG 3.3Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 3.41Å; L83-I86 PolarHBondContact O-N 3.43Å; L83-F87 WeakPolarHBondContact O-CB 3.47Å; L83-F87 PolarHBondContact O-N 3.17Å; L83-L113 HydrophobicContact CD2-CD1 3.75Å
84L94.5Very high91.2Very high86 Ų8667.6 Ų67.645%0.4533%0.329SS..Hα-helixtrans-61.1-45.8172.8-179.763.7000111.3P80 L81 Y82 F87 L88P80-L84 VanDerWaalsContact O-CB 3.3Å; P80-L84 WeakPolarHBondContact O-CB 3.39Å; P80-L84 PolarHBondContact O-N 3.27Å; L81-L84 HydrophobicContact CD1-CD2 4.45Å; Y82-L84 VanDerWaalsContact C-N 3.32Å; Y82-L84 PolarHBondContact O-N 3.46Å; L84-F87 PolarHBondContact O-N 3.02Å; L84-L88 HydrophobicContact CD1-CD1 4.08Å; L84-L88 HydrophobicContact CD1-CG 4.1Å; L84-L88 HydrophobicContact CG-CD1 4.06Å; L84-L88 HydrophobicContact CG-CG 4.43Å; L84-L88 WeakPolarHBondContact O-CB 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.32Å; L84-L88 WeakPolarHBondContact O-CG 3.46Å; L84-L88 PolarHBondContact O-N 3.26Å
85F93.8Very high91.4Very high86 Ų8671.7 Ų71.738%0.37736%0.356SS..Hα-helixtrans-56.8-52.8174.7168-100.1000111.1L81 Y82 F87 L88 T89 T141L81-F85 WeakPolarHBondContact O-CB 3.43Å; L81-F85 PolarHBondContact O-N 2.99Å; Y82-F85 WeakPolarHBondContact O-CB 3.09Å; Y82-F85 PolarHBondContact O-N 3.44Å; F85-F87 VanDerWaalsContact C-N 3.3Å; F85-F87 PolarHBondContact O-N 3.27Å; F85-L88 PolarHBondContact O-N 3.38Å; F85-T89 WeakPolarHBondContact O-CB 2.88Å; F85-T89 PolarHBondContact O-N 3.26Å; F85-T89 PolarHBondContact O-OG1 3.41Å; F85-T141 HydrophobicContact CD1-CG2 4.49Å; F85-T141 HydrophobicContact CE1-CG2 3.8Å
86I93.3Very high91.6Very high13 Ų1373.5 Ų73.57%0.06737%0.369CS..Hα-helixtrans-56.2-47.6178.3-69.5173.6000110.8Y82 L83 L88 T89 V90 A112 L113 F138Y82-I86 HydrophobicContact CD1-CD1 3.83Å; Y82-I86 HydrophobicContact CE1-CD1 3.31Å; Y82-I86 HydrophobicContact CE1-CG1 4.3Å; Y82-I86 HydrophobicContact CE2-CD1 4.26Å; Y82-I86 HydrophobicContact CE2-CG1 4.47Å; Y82-I86 WeakPolarHBondContact O-CG1 3.44Å; Y82-I86 PolarHBondContact O-N 2.99Å; L83-I86 PolarHBondContact O-N 3.43Å; I86-L88 PolarHBondContact O-N 2.94Å; I86-T89 PolarHBondContact O-N 2.67Å; I86-V90 HydrophobicContact CG2-CG2 4.26Å; I86-V90 WeakPolarHBondContact O-CB 3.27Å; I86-V90 VanDerWaalsContact O-CG2 3.29Å; I86-V90 WeakPolarHBondContact O-CG2 3.35Å; I86-V90 PolarHBondContact O-N 3.07Å; I86-A112 HydrophobicContact CD1-CB 4.24Å; I86-L113 HydrophobicContact CD1-CB 4.42Å; I86-L113 HydrophobicContact CD1-CD1 4.33Å; I86-F138 HydrophobicContact CB-CE1 4.48Å; I86-F138 HydrophobicContact CG1-CE1 4.29Å; I86-F138 HydrophobicContact CG2-CE1 4.26Å
87F94.4Very high91.6Very high125 Ų12571 Ų7155%0.54836%0.358SS..Hα-helixtrans-59.3-48.6-178.5176.7-107.4000112.2L83 L84 F85 V90 I91L83-F87 WeakPolarHBondContact O-CB 3.47Å; L83-F87 PolarHBondContact O-N 3.17Å; L84-F87 PolarHBondContact O-N 3.02Å; F85-F87 VanDerWaalsContact C-N 3.3Å; F85-F87 PolarHBondContact O-N 3.27Å; F87-V90 PolarHBondContact O-N 2.77Å; F87-I91 HydrophobicContact CD1-CD1 3.81Å; F87-I91 HydrophobicContact CD2-CD1 4.25Å; F87-I91 HydrophobicContact CE1-CD1 3.31Å; F87-I91 HydrophobicContact CE2-CD1 3.8Å; F87-I91 HydrophobicContact CE2-CG1 4.47Å; F87-I91 HydrophobicContact CG-CD1 4.27Å; F87-I91 HydrophobicContact CZ-CD1 3.32Å; F87-I91 HydrophobicContact CZ-CG1 4.41Å; F87-I91 WeakPolarHBondContact O-CG1 3.28Å; F87-I91 PolarHBondContact O-N 3.36Å
88L94.9Very high91.7Very high89 Ų8971.3 Ų71.347%0.46637%0.37SS..Hα-helixtrans-64.5-43178.3-68177.3000111.6L84 F85 I86 V90 I91 S92L84-L88 HydrophobicContact CD1-CD1 4.08Å; L84-L88 HydrophobicContact CD1-CG 4.1Å; L84-L88 HydrophobicContact CG-CD1 4.06Å; L84-L88 HydrophobicContact CG-CG 4.43Å; L84-L88 WeakPolarHBondContact O-CB 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.32Å; L84-L88 WeakPolarHBondContact O-CG 3.46Å; L84-L88 PolarHBondContact O-N 3.26Å; F85-L88 PolarHBondContact O-N 3.38Å; I86-L88 PolarHBondContact O-N 2.94Å; L88-V90 PolarHBondContact O-N 3.19Å; L88-I91 PolarHBondContact O-N 2.85Å; L88-S92 PolarHBondContact O-N 2.96Å; L88-S92 PolarHBondContact O-OG 3.41Å; L88-S92 VanDerWaalsContact O-OG 3.11Å
89T92.2Very high91.7Very high18 Ų1876 Ų7611%0.1140%0.395CS..Hα-helixtrans-62.8-41.5177.6-57.40000111.7F85 I86 S92 L93 L137 F138F85-T89 WeakPolarHBondContact O-CB 2.88Å; F85-T89 PolarHBondContact O-N 3.26Å; F85-T89 PolarHBondContact O-OG1 3.41Å; I86-T89 PolarHBondContact O-N 2.67Å; T89-S92 PolarHBondContact O-N 3.01Å; T89-L93 WeakPolarHBondContact O-CG 3.49Å; T89-L93 PolarHBondContact O-N 3.35Å; T89-L137 HydrophobicContact CG2-CB 3.75Å; T89-L137 HydrophobicContact CG2-CD1 3.85Å; T89-L137 HydrophobicContact CG2-CG 4.47Å; T89-F138 HydrophobicContact CG2-CE1 3.9Å; T89-F138 HydrophobicContact CG2-CE2 3.86Å; T89-F138 HydrophobicContact CG2-CZ 3.48Å; T89-F138 VanDerWaalsContact CG2-CZ 3.48Å
90V92.5Very high91.4Very high45 Ų4577.7 Ų77.727%0.27341%0.408SS..Hα-helixtrans-63.4-45.8174.8171.50000110.8I86 F87 L88 S92 L93 Y94 A109 F138I86-V90 HydrophobicContact CG2-CG2 4.26Å; I86-V90 WeakPolarHBondContact O-CB 3.27Å; I86-V90 VanDerWaalsContact O-CG2 3.29Å; I86-V90 WeakPolarHBondContact O-CG2 3.35Å; I86-V90 PolarHBondContact O-N 3.07Å; F87-V90 PolarHBondContact O-N 2.77Å; L88-V90 PolarHBondContact O-N 3.19Å; V90-S92 VanDerWaalsContact C-N 3.32Å; V90-S92 PolarHBondContact O-N 3.17Å; V90-L93 WeakPolarHBondContact O-CB 3.49Å; V90-L93 PolarHBondContact O-N 3.45Å; V90-Y94 HydrophobicContact CG1-CD2 3.87Å; V90-Y94 HydrophobicContact CG1-CE2 3.82Å; V90-Y94 VanDerWaalsContact O-CD2 3.3Å; V90-Y94 WeakPolarHBondContact O-CD2 3.4Å; V90-Y94 PolarHBondContact O-N 3.45Å; V90-Y94 VanDerWaalsContact O-N 3.15Å; V90-A109 HydrophobicContact CG2-CB 4.36Å; V90-F138 HydrophobicContact CG2-CZ 3.93Å
91I93.9Very high91Very high68 Ų6874.6 Ų74.635%0.34939%0.389SS..Hα-helixtrans-58.3-46175.4-72.5170.2000110.9F87 L88 L93 Y94 T95F87-I91 HydrophobicContact CD1-CD1 3.81Å; F87-I91 HydrophobicContact CD2-CD1 4.25Å; F87-I91 HydrophobicContact CE1-CD1 3.31Å; F87-I91 HydrophobicContact CE2-CD1 3.8Å; F87-I91 HydrophobicContact CE2-CG1 4.47Å; F87-I91 HydrophobicContact CG-CD1 4.27Å; F87-I91 HydrophobicContact CZ-CD1 3.32Å; F87-I91 HydrophobicContact CZ-CG1 4.41Å; F87-I91 WeakPolarHBondContact O-CG1 3.28Å; F87-I91 PolarHBondContact O-N 3.36Å; L88-I91 PolarHBondContact O-N 2.85Å; I91-L93 VanDerWaalsContact C-N 3.3Å; I91-L93 PolarHBondContact O-N 3.01Å; I91-Y94 PolarHBondContact O-N 3.32Å; I91-T95 HydrophobicContact CG2-CG2 4.27Å; I91-T95 WeakPolarHBondContact O-CB 3.16Å; I91-T95 WeakPolarHBondContact O-CG2 3.37Å; I91-T95 PolarHBondContact O-N 2.96Å; I91-T95 PolarHBondContact O-OG1 3.22Å
92S91.7Very high90.6Very high39 Ų3970 Ų7027%0.27337%0.365SS..Hα-helixtrans-60.2-40.9177.7-63.80000111.7L88 T89 V90 Y94 T95 I96 F97L88-S92 PolarHBondContact O-N 2.96Å; L88-S92 PolarHBondContact O-OG 3.41Å; L88-S92 VanDerWaalsContact O-OG 3.11Å; T89-S92 PolarHBondContact O-N 3.01Å; V90-S92 VanDerWaalsContact C-N 3.32Å; V90-S92 PolarHBondContact O-N 3.17Å; S92-Y94 VanDerWaalsContact C-N 3.3Å; S92-Y94 PolarHBondContact O-N 3.35Å; S92-T95 PolarHBondContact O-N 2.89Å; S92-I96 WeakPolarHBondContact O-CB 3.44Å; S92-I96 PolarHBondContact O-N 3.37Å; S92-F97 WeakPolarHBondContact O-CD2 3.36Å; S92-F97 PolarHBondContact O-N 2.9Å
93L90.8Very high90.1Very high5 Ų575.6 Ų75.63%0.02640%0.395CS..Hα-helixtrans-58.8-39.9176-81.3169.5000112.9T89 V90 I91 F97 A101 L102 N105 L137 F138T89-L93 WeakPolarHBondContact O-CG 3.49Å; T89-L93 PolarHBondContact O-N 3.35Å; V90-L93 WeakPolarHBondContact O-CB 3.49Å; V90-L93 PolarHBondContact O-N 3.45Å; I91-L93 VanDerWaalsContact C-N 3.3Å; I91-L93 PolarHBondContact O-N 3.01Å; L93-F97 HydrophobicContact CD2-CB 4.24Å; L93-F97 HydrophobicContact CD2-CD2 4.39Å; L93-F97 HydrophobicContact CD2-CG 4.33Å; L93-A101 HydrophobicContact CD2-CB 4.34Å; L93-L102 HydrophobicContact CB-CD1 4.35Å; L93-N105 HydrophobicContact CD1-CB 3.66Å; L93-N105 HydrophobicContact CD2-CB 4.13Å; L93-L137 HydrophobicContact CD1-CD1 4.26Å; L93-L137 HydrophobicContact CD2-CD1 3.58Å; L93-L137 HydrophobicContact CG-CD1 3.76Å; L93-F138 HydrophobicContact CD1-CE2 3.7Å; L93-F138 HydrophobicContact CD1-CZ 4.33Å
94Y90.2Very high89.4Confident145 Ų14577.4 Ų77.457%0.56940%0.402SS*.Hα-helixtrans-81.1-17.8179.3-80.2-77.6000114.5V90 I91 S92 L102V90-Y94 HydrophobicContact CG1-CD2 3.87Å; V90-Y94 HydrophobicContact CG1-CE2 3.82Å; V90-Y94 VanDerWaalsContact O-CD2 3.3Å; V90-Y94 WeakPolarHBondContact O-CD2 3.4Å; V90-Y94 PolarHBondContact O-N 3.45Å; V90-Y94 VanDerWaalsContact O-N 3.15Å; I91-Y94 PolarHBondContact O-N 3.32Å; S92-Y94 VanDerWaalsContact C-N 3.3Å; S92-Y94 PolarHBondContact O-N 3.35Å; Y94-L102 HydrophobicContact CD1-CD1 4.34Å; Y94-L102 HydrophobicContact CD1-CD2 3.93Å; Y94-L102 HydrophobicContact CD2-CD1 4.27Å; Y94-L102 HydrophobicContact CE1-CD1 3.92Å; Y94-L102 HydrophobicContact CE1-CD2 3.48Å; Y94-L102 VanDerWaalsContact CE1-CD2 3.48Å; Y94-L102 HydrophobicContact CE1-CG 4.36Å; Y94-L102 HydrophobicContact CE2-CD1 3.83Å
95T92.3Very high89.1Confident101 Ų10173.4 Ų73.462%0.6238%0.381SS*.Hα-helixtrans-115.8-27.2-170.855.30000114.7I91 S92I91-T95 HydrophobicContact CG2-CG2 4.27Å; I91-T95 WeakPolarHBondContact O-CB 3.16Å; I91-T95 WeakPolarHBondContact O-CG2 3.37Å; I91-T95 PolarHBondContact O-N 2.96Å; I91-T95 PolarHBondContact O-OG1 3.22Å; S92-T95 PolarHBondContact O-N 2.89Å
96I91.8Very high88.6Confident128 Ų12874.3 Ų74.366%0.65639%0.386SS*.THydrogen-bonded Turntrans-117.5-38.4-171.2-57173.2000111.6S92S92-I96 WeakPolarHBondContact O-CB 3.44Å; S92-I96 PolarHBondContact O-N 3.37Å
97F88.1Confident88.3Confident89 Ų8976.9 Ų76.939%0.3941%0.405SS..SBendtrans-90.9155.8-172.9-72.7-90.5000112.7S92 L93 A101 L137S92-F97 WeakPolarHBondContact O-CD2 3.36Å; S92-F97 PolarHBondContact O-N 2.9Å; L93-F97 HydrophobicContact CD2-CB 4.24Å; L93-F97 HydrophobicContact CD2-CD2 4.39Å; L93-F97 HydrophobicContact CD2-CG 4.33Å; F97-A101 HydrophobicContact CB-CB 4.05Å; F97-A101 HydrophobicContact CD1-CB 4.48Å; F97-L137 HydrophobicContact CD2-CD1 4.45Å; F97-L137 HydrophobicContact CE2-CD1 4.09Å; F97-L137 HydrophobicContact CZ-CD1 4.21Å; F97-L137 HydrophobicContact CZ-CD2 4.36Å
98P87.8Confident87.9Confident80 Ų8071.2 Ų71.252%0.51938%0.381SS..  trans-68.8155.6175.529.2-35.6000112.1T100 A101 L102P98-T100 PolarHBondContact O-N 2.84Å; P98-A101 HydrophobicContact CG-CB 4.27Å; P98-A101 WeakPolarHBondContact O-CB 3.3Å; P98-A101 PolarHBondContact O-N 3.07Å; P98-L102 PolarHBondContact O-N 3.03Å
99D85.9Confident87.7Confident130 Ų13067.7 Ų67.770%0.69537%0.365SS*.Hα-helixtrans-55.2-29.8-179.6-66-28.3000113.6A101 L102 L103D99-A101 VanDerWaalsContact C-N 3.32Å; D99-A101 PolarHBondContact O-N 3.5Å; D99-L102 WeakPolarHBondContact O-CB 3.36Å; D99-L102 PolarHBondContact O-N 3.15Å; D99-L103 PolarHBondContact O-N 2.95Å; D99-L103 VanDerWaalsContact O-N 3.16Å
100T84.8Confident87.6Confident94 Ų9470.5 Ų70.558%0.57738%0.382SS*.Hα-helixtrans-61.8-39.2175.351.10000112.1P98 Q104P98-T100 PolarHBondContact O-N 2.84Å; T100-Q104 WeakPolarHBondContact O-CG 3.29Å; T100-Q104 PolarHBondContact O-N 3.28Å
101A83.6Confident87.5Confident14 Ų1470.8 Ų70.812%0.11638%0.38CS..Hα-helixtrans-69.3-36.5177.100000111.3L93 F97 P98 D99 Q104 N105L93-A101 HydrophobicContact CD2-CB 4.34Å; F97-A101 HydrophobicContact CB-CB 4.05Å; F97-A101 HydrophobicContact CD1-CB 4.48Å; P98-A101 HydrophobicContact CG-CB 4.27Å; P98-A101 WeakPolarHBondContact O-CB 3.3Å; P98-A101 PolarHBondContact O-N 3.07Å; D99-A101 VanDerWaalsContact C-N 3.32Å; D99-A101 PolarHBondContact O-N 3.5Å; A101-Q104 PolarHBondContact O-N 3.05Å; A101-N105 WeakPolarHBondContact O-CB 3.32Å; A101-N105 PolarHBondContact O-N 3.25Å; A101-N105 PolarHBondContact O-ND2 3.08Å
102L82.6Confident87.4Confident30 Ų3067.6 Ų67.616%0.15736%0.363CS..Hα-helixtrans-59.8-49.5176.1176.465000111.5L93 Y94 P98 D99 Q104 N105 Q106L93-L102 HydrophobicContact CB-CD1 4.35Å; Y94-L102 HydrophobicContact CD1-CD1 4.34Å; Y94-L102 HydrophobicContact CD1-CD2 3.93Å; Y94-L102 HydrophobicContact CD2-CD1 4.27Å; Y94-L102 HydrophobicContact CE1-CD1 3.92Å; Y94-L102 HydrophobicContact CE1-CD2 3.48Å; Y94-L102 VanDerWaalsContact CE1-CD2 3.48Å; Y94-L102 HydrophobicContact CE1-CG 4.36Å; Y94-L102 HydrophobicContact CE2-CD1 3.83Å; P98-L102 PolarHBondContact O-N 3.03Å; D99-L102 WeakPolarHBondContact O-CB 3.36Å; D99-L102 PolarHBondContact O-N 3.15Å; L102-Q104 VanDerWaalsContact C-N 3.29Å; L102-Q104 PolarHBondContact O-N 3.45Å; L102-N105 PolarHBondContact O-N 2.88Å; L102-Q106 PolarHBondContact O-N 3.12Å
103L80.6Confident87.4Confident132 Ų13270 Ų7069%0.69137%0.373SS*.Hα-helixtrans-61.1-38.2180-68.1175.7000112.2D99D99-L103 PolarHBondContact O-N 2.95Å; D99-L103 VanDerWaalsContact O-N 3.16Å
104Q79.1Confident87.5Confident109 Ų10975.2 Ų75.251%0.50940%0.4SS..Hα-helixtrans-70.2-33.5177.7-71.4173.5-12.700112.7T100 A101 L102T100-Q104 WeakPolarHBondContact O-CG 3.29Å; T100-Q104 PolarHBondContact O-N 3.28Å; A101-Q104 PolarHBondContact O-N 3.05Å; L102-Q104 VanDerWaalsContact C-N 3.29Å; L102-Q104 PolarHBondContact O-N 3.45Å
105N86.3Confident87.6Confident1 Ų169.9 Ų69.91%0.00538%0.38CS..Hα-helixtrans-96.9-13.4-171.6-77.9-99.7000114.1L93 A101 L102 S107 S108 A109 I135 D136 L137 F138L93-N105 HydrophobicContact CD1-CB 3.66Å; L93-N105 HydrophobicContact CD2-CB 4.13Å; A101-N105 WeakPolarHBondContact O-CB 3.32Å; A101-N105 PolarHBondContact O-N 3.25Å; A101-N105 PolarHBondContact O-ND2 3.08Å; L102-N105 PolarHBondContact O-N 2.88Å; N105-S107 PolarHBondContact O-N 2.87Å; N105-S108 PolarHBondContact O-N 3.44Å; N105-A109 WeakPolarHBondContact O-CB 3.48Å; N105-A109 PolarHBondContact O-N 3.31Å; N105-I135 PolarHBondContact ND2-O 2.83Å; N105-I135 VanDerWaalsContact ND2-O 3.15Å; N105-D136 WeakPolarHBondContact OD1-CA 3.3Å; N105-D136 PolarHBondContact OD1-OD1 3.44Å; N105-L137 PolarHBondContact OD1-N 3.38Å; N105-F138 HydrophobicContact CB-CD2 4.4Å; N105-F138 HydrophobicContact CB-CE2 4.4Å
106Q84.8Confident87.5Confident106 Ų10667.1 Ų67.150%0.49536%0.363SS..Hα-helixtrans-62.1-41.8-175.1-169.1179.419.800113.1L102 T110L102-Q106 PolarHBondContact O-N 3.12Å; Q106-T110 PolarHBondContact O-N 2.94Å; Q106-T110 PolarHBondContact O-OG1 3.4Å
107S85.6Confident87.4Confident67 Ų6761.8 Ų61.847%0.46934%0.337SS..Hα-helixtrans-64.6-44175.2-1690000110.9N105 T110 K111N105-S107 PolarHBondContact O-N 2.87Å; S107-T110 WeakPolarHBondContact O-CB 3.44Å; S107-T110 PolarHBondContact O-N 3.37Å; S107-K111 WeakPolarHBondContact O-CG 3.4Å; S107-K111 PolarHBondContact O-N 2.93Å; S107-K111 WeakPolarHBondContact OG-CE 3.25Å
108S87.2Confident87.4Confident5 Ų558.1 Ų58.14%0.03532%0.321CS..Hα-helixtrans-66.1-38.1180-56.40000112.7N105 T110 K111 A112 D136N105-S108 PolarHBondContact O-N 3.44Å; S108-T110 VanDerWaalsContact C-N 3.33Å; S108-T110 PolarHBondContact O-N 2.99Å; S108-K111 PolarHBondContact O-N 3.04Å; S108-A112 WeakPolarHBondContact O-CB 3.35Å; S108-A112 PolarHBondContact O-N 3.43Å; S108-D136 VanDerWaalsContact CB-OD1 3.32Å; S108-D136 WeakPolarHBondContact CB-OD1 3.25Å; S108-D136 WeakPolarHBondContact CB-OD2 3.15Å; S108-D136 PolarHBondContact OG-OD2 3.38Å
109A89.8Confident86.8Confident15 Ų1562.7 Ų62.712%0.12433%0.328CS..Hα-helixtrans-59.2-44172.200000111.6V90 N105 A112 L113 F138V90-A109 HydrophobicContact CG2-CB 4.36Å; N105-A109 WeakPolarHBondContact O-CB 3.48Å; N105-A109 PolarHBondContact O-N 3.31Å; A109-A112 PolarHBondContact O-N 3.12Å; A109-L113 WeakPolarHBondContact O-CB 3.24Å; A109-L113 PolarHBondContact O-N 2.97Å; A109-F138 HydrophobicContact CB-CD2 3.96Å; A109-F138 HydrophobicContact CB-CE1 4.17Å; A109-F138 HydrophobicContact CB-CE2 3.47Å; A109-F138 VanDerWaalsContact CB-CE2 3.47Å; A109-F138 HydrophobicContact CB-CG 4.48Å; A109-F138 HydrophobicContact CB-CZ 3.59Å
110T90.4Very high85.5Confident78 Ų7859.7 Ų59.748%0.47932%0.315SS..Hα-helixtrans-65.8-43.1177.9-55.80000111.1Q106 S107 S108 A112 L113 L114Q106-T110 PolarHBondContact O-N 2.94Å; Q106-T110 PolarHBondContact O-OG1 3.4Å; S107-T110 WeakPolarHBondContact O-CB 3.44Å; S107-T110 PolarHBondContact O-N 3.37Å; S108-T110 VanDerWaalsContact C-N 3.33Å; S108-T110 PolarHBondContact O-N 2.99Å; T110-A112 VanDerWaalsContact C-N 3.35Å; T110-A112 PolarHBondContact O-N 3.4Å; T110-L113 PolarHBondContact O-N 3.42Å; T110-L114 HydrophobicContact CG2-CD1 4.2Å; T110-L114 WeakPolarHBondContact O-CG 3.49Å; T110-L114 PolarHBondContact O-N 3.43Å; T110-L114 VanDerWaalsContact O-N 3.12Å
111K90.9Very high84.1Confident51 Ų5157.4 Ų57.422%0.22230%0.298CS..Hα-helixtrans-64-39.5176.3-68.5172-171.1173.60112S107 S108 L114 F115 V116 S117 H121S107-K111 WeakPolarHBondContact O-CG 3.4Å; S107-K111 PolarHBondContact O-N 2.93Å; S107-K111 WeakPolarHBondContact OG-CE 3.25Å; S108-K111 PolarHBondContact O-N 3.04Å; K111-L114 PolarHBondContact O-N 2.85Å; K111-F115 PolarHBondContact O-N 3.31Å; K111-V116 HydrophobicContact CB-CG2 4.12Å; K111-V116 HydrophobicContact CG-CG2 4.34Å; K111-V116 PolarHBondContact O-N 3.32Å; K111-S117 PolarHBondContact O-N 2.81Å; K111-H121 PolarHBondContact NZ-CD2 3.4Å; K111-H121 PolarHBondContact NZ-NE2 3.49Å
112A91.7Very high82.6Confident0 Ų063.2 Ų63.20%033%0.332CS..Hα-helixtrans-62-49.7174.800000110.8Y82 I86 S108 A109 T110 L114 F115 F138 T141Y82-A112 VanDerWaalsContact OH-C 3.31Å; Y82-A112 WeakPolarHBondContact OH-CA 3.45Å; Y82-A112 PolarHBondContact OH-O 3.41Å; I86-A112 HydrophobicContact CD1-CB 4.24Å; S108-A112 WeakPolarHBondContact O-CB 3.35Å; S108-A112 PolarHBondContact O-N 3.43Å; A109-A112 PolarHBondContact O-N 3.12Å; T110-A112 VanDerWaalsContact C-N 3.35Å; T110-A112 PolarHBondContact O-N 3.4Å; A112-L114 PolarHBondContact O-N 3.06Å; A112-F115 PolarHBondContact O-N 3.05Å; A112-F138 HydrophobicContact CB-CB 4.24Å; A112-F138 HydrophobicContact CB-CD1 3.8Å; A112-F138 HydrophobicContact CB-CG 4.31Å; A112-T141 HydrophobicContact CB-CG2 4.09Å
113L92.3Very high81.1Confident91 Ų9165.7 Ų65.748%0.47637%0.366SS..Hα-helixtrans-57-36.1179-174.664.2000113.1L83 I86 A109 T110 F115L83-L113 HydrophobicContact CD2-CD1 3.75Å; I86-L113 HydrophobicContact CD1-CB 4.42Å; I86-L113 HydrophobicContact CD1-CD1 4.33Å; A109-L113 WeakPolarHBondContact O-CB 3.24Å; A109-L113 PolarHBondContact O-N 2.97Å; T110-L113 PolarHBondContact O-N 3.42Å; L113-F115 VanDerWaalsContact C-N 3.34Å
114L92.4Very high79.6Confident113 Ų11368.4 Ų68.459%0.59238%0.375SS*.THydrogen-bonded Turntrans-88.34.5179.5-65177.5000113.9T110 K111 A112 V116T110-L114 HydrophobicContact CG2-CD1 4.2Å; T110-L114 WeakPolarHBondContact O-CG 3.49Å; T110-L114 PolarHBondContact O-N 3.43Å; T110-L114 VanDerWaalsContact O-N 3.12Å; K111-L114 PolarHBondContact O-N 2.85Å; A112-L114 PolarHBondContact O-N 3.06Å; L114-V116 VanDerWaalsContact C-N 3.28Å; L114-V116 HydrophobicContact CB-CG2 3.89Å; L114-V116 PolarHBondContact O-N 3.07Å
115F91.4Very high78.4Confident33 Ų3366.9 Ų66.915%0.14537%0.368CS..THydrogen-bonded Turntrans54.939.1-174.8-59.2-71.5000113.8L79 Y82 K111 A112 L113 S145 I148 Q149L79-F115 HydrophobicContact CD1-CE2 4.23Å; L79-F115 HydrophobicContact CD1-CZ 3.94Å; Y82-F115 HydrophobicContact CD1-CD1 4.4Å; Y82-F115 AromaticContact CD1-CE1 3.3Å; Y82-F115 HydrophobicContact CD1-CE1 3.3Å; Y82-F115 AromaticContact CD1-CZ 3.53Å; Y82-F115 HydrophobicContact CD1-CZ 3.53Å; Y82-F115 AromaticContact CE1-CD1 3.75Å; Y82-F115 HydrophobicContact CE1-CD1 3.75Å; Y82-F115 AromaticContact CE1-CE1 3.05Å; Y82-F115 HydrophobicContact CE1-CE1 3.05Å; Y82-F115 AromaticContact CE1-CZ 3.59Å; Y82-F115 HydrophobicContact CE1-CZ 3.59Å; Y82-F115 HydrophobicContact CG-CE1 4.21Å; Y82-F115 AromaticContact CZ-CE1 3.82Å; K111-F115 PolarHBondContact O-N 3.31Å; A112-F115 PolarHBondContact O-N 3.05Å; L113-F115 VanDerWaalsContact C-N 3.34Å; F115-S145 WeakPolarHBondContact CA-OG 3.5Å; F115-S145 WeakPolarHBondContact O-CB 3.37Å; F115-I148 HydrophobicContact CB-CG2 4.36Å; F115-I148 HydrophobicContact CD1-CB 4.25Å; F115-I148 HydrophobicContact CD1-CD1 3.34Å; F115-I148 HydrophobicContact CD1-CG1 4.38Å; F115-I148 HydrophobicContact CD1-CG2 4.22Å; F115-I148 HydrophobicContact CD2-CG2 4.21Å; F115-I148 HydrophobicContact CE1-CD1 2.99Å; F115-I148 HydrophobicContact CE1-CG1 4.34Å; F115-I148 HydrophobicContact CE2-CD1 4.38Å; F115-I148 HydrophobicContact CG-CB 4.46Å; F115-I148 HydrophobicContact CG-CD1 4.17Å; F115-I148 HydrophobicContact CG-CG2 4.01Å; F115-I148 HydrophobicContact CZ-CD1 3.58Å; F115-Q149 PolarHBondContact O-NE2 2.8Å
116V91.4Very high77Confident44 Ų4470.7 Ų70.727%0.26739%0.388SS..  trans-127.220.9178.8-62.90000112.7K111 L114 N118 R119K111-V116 HydrophobicContact CB-CG2 4.12Å; K111-V116 HydrophobicContact CG-CG2 4.34Å; K111-V116 PolarHBondContact O-N 3.32Å; L114-V116 VanDerWaalsContact C-N 3.28Å; L114-V116 HydrophobicContact CB-CG2 3.89Å; L114-V116 PolarHBondContact O-N 3.07Å; V116-N118 PolarHBondContact O-N 3.44Å; V116-R119 PolarHBondContact O-N 3.22Å
117S88.9Confident76Confident16 Ų1667.1 Ų67.111%0.11237%0.37CS..THydrogen-bonded Turntrans-69.4-6.8177.155.70000114.1K111 R119 T141 W142 S145K111-S117 PolarHBondContact O-N 2.81Å; S117-R119 VanDerWaalsContact C-N 3.33Å; S117-T141 VanDerWaalsContact CB-OG1 3.24Å; S117-T141 WeakPolarHBondContact CB-OG1 3.14Å; S117-T141 PolarHBondContact OG-O 3.27Å; S117-T141 PolarHBondContact OG-OG1 3.18Å; S117-W142 WeakPolarHBondContact OG-CA 3.35Å; S117-W142 PolarHBondContact OG-N 2.52Å; S117-S145 PolarHBondContact OG-OG 3.49Å
118N88.8Confident74.8Confident11 Ų1166.9 Ų66.96%0.05936%0.361CS..THydrogen-bonded Turntrans-86.96.2176.972.4-55.3000114.5V116 W142 V146 Q149 N194V116-N118 PolarHBondContact O-N 3.44Å; N118-W142 HydrophobicContact CB-CB 4.19Å; N118-V146 HydrophobicContact CB-CG2 3.66Å; N118-V146 WeakPolarHBondContact ND2-CG2 3.49Å; N118-Q149 PolarHBondContact ND2-OE1 3.01Å; N118-Q149 PolarHBondContact OD1-NE2 3.26Å; N118-N194 WeakPolarHBondContact CB-O 3.29Å; N118-N194 PolarHBondContact ND2-O 3.2Å; N118-N194 WeakPolarHBondContact O-CB 3.22Å
119R74.8Confident73.6Confident177 Ų17772 Ų7267%0.66838%0.384SS*.SBendtrans-78.7135.5172.2-71.5-166.1-174.5-149.73.2110.5V116 S117 H121V116-R119 PolarHBondContact O-N 3.22Å; S117-R119 VanDerWaalsContact C-N 3.33Å; R119-H121 PolarHBondContact O-N 3.42Å
120P58.8Low72.4Confident66 Ų6672.6 Ų72.643%0.42938%0.384SS..PPolyproline II helixtrans-59.7134.2174.924.8-32.6000109.8V191P120-V191 HydrophobicContact CB-CG2 4.19Å; P120-V191 HydrophobicContact CG-CG1 4.27Å; P120-V191 HydrophobicContact CG-CG2 4.16Å
121H55.9Low71Confident47 Ų4769.5 Ų69.522%0.21836%0.364CS..PPolyproline II helixtrans-74.4131.7171.7-72.280.4000107.8K111 R119 G123 E125K111-H121 PolarHBondContact NZ-CD2 3.4Å; K111-H121 PolarHBondContact NZ-NE2 3.49Å; R119-H121 PolarHBondContact O-N 3.42Å; H121-G123 PolarHBondContact O-N 3.22Å; H121-E125 HydrophobicContact CB-CB 3.74Å; H121-E125 VanDerWaalsContact CB-OE2 3.27Å; H121-E125 WeakPolarHBondContact CB-OE2 3.29Å; H121-E125 IonicContact CD2-OE2 2.71Å; H121-E125 PolarHBondContact CD2-OE2 3.31Å; H121-E125 IonicContact CG-OE2 3.93Å; H121-E125 IonicContact NE2-OE2 3.86Å
122T50.7Low69.6Low135 Ų13572 Ų7283%0.82838%0.38SS*.PPolyproline II helixtrans-71.1119.6-176.243.10000110.8E124T122-E124 VanDerWaalsContact C-N 3.34Å; T122-E124 PolarHBondContact O-N 2.98Å
123G51.8Low68Low83 Ų8377 Ų7786%0.85641%0.405SS*.SBendtrans75.6-32.7147.300000119.9H121H121-G123 PolarHBondContact O-N 3.22Å
124E49.3Very low66.6Low189 Ų18976 Ų7688%0.88341%0.41SS*.SBendtrans-122.88.2-173.1-65.5-175.1172.200113.6T122T122-E124 VanDerWaalsContact C-N 3.34Å; T122-E124 PolarHBondContact O-N 2.98Å
125E52.6Low65.5Low77 Ų7773.9 Ų73.936%0.3640%0.399SS..  trans-141.174.9-163.7-65.1-165.3142.600111.3H121 Y127 K130H121-E125 HydrophobicContact CB-CB 3.74Å; H121-E125 VanDerWaalsContact CB-OE2 3.27Å; H121-E125 WeakPolarHBondContact CB-OE2 3.29Å; H121-E125 IonicContact CD2-OE2 2.71Å; H121-E125 PolarHBondContact CD2-OE2 3.31Å; H121-E125 IonicContact CG-OE2 3.93Å; H121-E125 IonicContact NE2-OE2 3.86Å; E125-Y127 PolarHBondContact O-N 2.92Å; E125-K130 HydrophobicContact CB-CD 4.25Å; E125-K130 IonicContact OE1-NZ 3.11Å; E125-K130 PolarHBondContact OE1-NZ 3.32Å; E125-K130 IonicContact OE2-NZ 2.82Å; E125-K130 PolarHBondContact OE2-NZ 3.48Å
126D58.8Low64.9Low81 Ų8172.8 Ų72.843%0.43339%0.394SS..  trans-58.8113.5177.7-79.2-10.5000110.1F128 E129 K130D126-F128 PolarHBondContact O-N 3.43Å; D126-E129 HydrophobicContact CB-CB 3.94Å; D126-E129 HydrophobicContact CB-CG 3.98Å; D126-E129 PolarHBondContact O-N 3.45Å; D126-E129 VanDerWaalsContact O-N 3.11Å; D126-K130 PolarHBondContact O-N 2.85Å
127Y62.1Low64.6Low31 Ų3173 Ų7312%0.12239%0.394CS..Hα-helixtrans-54.6-40.8179.1163.8-92.9000111.3E125 K130 L131 T139 W142 F193E125-Y127 PolarHBondContact O-N 2.92Å; Y127-K130 PolarHBondContact O-N 3.09Å; Y127-L131 HydrophobicContact CE1-CD2 4.08Å; Y127-L131 WeakPolarHBondContact O-CB 3.28Å; Y127-L131 PolarHBondContact O-N 3.38Å; Y127-T139 HydrophobicContact CD2-CG2 3.92Å; Y127-T139 HydrophobicContact CE2-CG2 3.5Å; Y127-W142 AromaticContact CE2-CD1 3.76Å; Y127-W142 HydrophobicContact CE2-CG 4.34Å; Y127-W142 AromaticContact CZ-CD1 3.89Å; Y127-W142 AromaticContact CZ-NE1 3.73Å; Y127-W142 VanDerWaalsContact OH-CD1 3.29Å; Y127-W142 PolarHBondContact OH-NE1 3.4Å; Y127-F193 HydrophobicContact CE1-CD1 4.26Å; Y127-F193 HydrophobicContact CE1-CE1 4.15Å
128F60.6Low64.5Low61 Ų6172.3 Ų72.327%0.26839%0.389SS..Hα-helixtrans-68.4-38.7178.9-73.1-78.3000112.3D126 L131 L132 E190D126-F128 PolarHBondContact O-N 3.43Å; F128-L131 PolarHBondContact O-N 3.02Å; F128-L132 WeakPolarHBondContact O-CB 3.09Å; F128-L132 WeakPolarHBondContact O-CD1 3.23Å; F128-L132 WeakPolarHBondContact O-CG 3.48Å; F128-L132 PolarHBondContact O-N 3.2Å; F128-E190 HydrophobicContact CD2-CG 4.08Å; F128-E190 HydrophobicContact CE2-CG 3.93Å
129E62.8Low64.2Low114 Ų11472.4 Ų72.453%0.53339%0.389SS..Hα-helixtrans-65-45.8172.2-76.5-158.2145.100111.5D126 L131 L132 I133D126-E129 HydrophobicContact CB-CB 3.94Å; D126-E129 HydrophobicContact CB-CG 3.98Å; D126-E129 PolarHBondContact O-N 3.45Å; D126-E129 VanDerWaalsContact O-N 3.11Å; E129-L131 VanDerWaalsContact C-N 3.3Å; E129-L131 PolarHBondContact O-N 3.21Å; E129-L132 PolarHBondContact O-N 3.45Å; E129-I133 HydrophobicContact CB-CD1 4.19Å; E129-I133 WeakPolarHBondContact O-CB 3.32Å; E129-I133 WeakPolarHBondContact O-CG1 3.48Å; E129-I133 PolarHBondContact O-N 2.94Å
130K63.5Low64.7Low27 Ų2768.8 Ų68.812%0.11738%0.38CS..Hα-helixtrans-61.6-37.9177.6-73.7-175.6166.1-165.50112.7E125 D126 Y127 A134E125-K130 HydrophobicContact CB-CD 4.25Å; E125-K130 IonicContact OE1-NZ 3.11Å; E125-K130 PolarHBondContact OE1-NZ 3.32Å; E125-K130 IonicContact OE2-NZ 2.82Å; E125-K130 PolarHBondContact OE2-NZ 3.48Å; D126-K130 PolarHBondContact O-N 2.85Å; Y127-K130 PolarHBondContact O-N 3.09Å; K130-A134 WeakPolarHBondContact O-CA 3.46Å; K130-A134 PolarHBondContact O-N 2.98Å
131L62Low66.3Low13 Ų1365.9 Ų65.97%0.06836%0.361CS..Hα-helixtrans-67.1-38.5176.2-168.476.4000111.9F26 H27 Y127 F128 E129 T139F26-L131 HydrophobicContact CE1-CD2 4.33Å; H27-L131 WeakPolarHBondContact NE2-CD1 3.5Å; H27-L131 WeakPolarHBondContact NE2-CD2 3.5Å; H27-L131 WeakPolarHBondContact NE2-CG 3.47Å; Y127-L131 HydrophobicContact CE1-CD2 4.08Å; Y127-L131 WeakPolarHBondContact O-CB 3.28Å; Y127-L131 PolarHBondContact O-N 3.38Å; F128-L131 PolarHBondContact O-N 3.02Å; E129-L131 VanDerWaalsContact C-N 3.3Å; E129-L131 PolarHBondContact O-N 3.21Å; L131-T139 HydrophobicContact CB-CG2 4.39Å; L131-T139 HydrophobicContact CD1-CG2 3.64Å
132L60.5Low67.9Low103 Ų10364 Ų6454%0.53935%0.352SS..Hα-helixtrans-78.5-32.8179.8-70.7169.2000112.9F128 E129F128-L132 WeakPolarHBondContact O-CB 3.09Å; F128-L132 WeakPolarHBondContact O-CD1 3.23Å; F128-L132 WeakPolarHBondContact O-CG 3.48Å; F128-L132 PolarHBondContact O-N 3.2Å; E129-L132 PolarHBondContact O-N 3.45Å
133I59.1Low69.8Low104 Ų10459.2 Ų59.253%0.53332%0.324SS..Hα-helixtrans-97-5.7-175.9-52.2165.2000111.6E129 I135E129-I133 HydrophobicContact CB-CD1 4.19Å; E129-I133 WeakPolarHBondContact O-CB 3.32Å; E129-I133 WeakPolarHBondContact O-CG1 3.48Å; E129-I133 PolarHBondContact O-N 2.94Å; I133-I135 HydrophobicContact CB-CD1 3.97Å; I133-I135 HydrophobicContact CB-CG1 3.93Å; I133-I135 HydrophobicContact CG2-CD1 3.71Å; I133-I135 HydrophobicContact CG2-CG1 3.63Å; I133-I135 PolarHBondContact O-N 3.5Å
134A61.8Low71.7Confident70 Ų7057 Ų5758%0.57929%0.293SS*.THydrogen-bonded Turntrans54.432.6178.100000114.6K130 D136K130-A134 WeakPolarHBondContact O-CA 3.46Å; K130-A134 PolarHBondContact O-N 2.98Å; A134-D136 VanDerWaalsContact C-N 3.33Å
135I69.9Low73.8Confident70 Ų7048 Ų4836%0.35925%0.251SS..  trans-70-33.5-178.2-61.5172.9000111.1N105 I133N105-I135 PolarHBondContact ND2-O 2.83Å; N105-I135 VanDerWaalsContact ND2-O 3.15Å; I133-I135 HydrophobicContact CB-CD1 3.97Å; I133-I135 HydrophobicContact CB-CG1 3.93Å; I133-I135 HydrophobicContact CG2-CD1 3.71Å; I133-I135 HydrophobicContact CG2-CG1 3.63Å; I133-I135 PolarHBondContact O-N 3.5Å
136D79.9Confident75.8Confident9 Ų944.4 Ų44.45%0.04823%0.233CC..  trans-113.8112.2-179.1177.2-6.8000111N105 S108 A134 F138 T139N105-D136 WeakPolarHBondContact OD1-CA 3.3Å; N105-D136 PolarHBondContact OD1-OD1 3.44Å; S108-D136 VanDerWaalsContact CB-OD1 3.32Å; S108-D136 WeakPolarHBondContact CB-OD1 3.25Å; S108-D136 WeakPolarHBondContact CB-OD2 3.15Å; S108-D136 PolarHBondContact OG-OD2 3.38Å; A134-D136 VanDerWaalsContact C-N 3.33Å; D136-F138 PolarHBondContact O-N 3.38Å; D136-F138 PolarHBondContact OD1-N 3.29Å; D136-T139 VanDerWaalsContact CB-OG1 3.24Å; D136-T139 WeakPolarHBondContact CB-OG1 3.39Å; D136-T139 WeakPolarHBondContact O-CB 3.16Å; D136-T139 PolarHBondContact O-N 3.2Å; D136-T139 PolarHBondContact O-OG1 2.84Å; D136-T139 PolarHBondContact OD1-N 2.77Å
137L84.1Confident77.5Confident49 Ų4941.8 Ų41.826%0.25722%0.219SC..THydrogen-bonded Turntrans-67.7-21.6-176.8-60179.7000113T89 L93 F97 N105T89-L137 HydrophobicContact CG2-CB 3.75Å; T89-L137 HydrophobicContact CG2-CD1 3.85Å; T89-L137 HydrophobicContact CG2-CG 4.47Å; L93-L137 HydrophobicContact CD1-CD1 4.26Å; L93-L137 HydrophobicContact CD2-CD1 3.58Å; L93-L137 HydrophobicContact CG-CD1 3.76Å; F97-L137 HydrophobicContact CD2-CD1 4.45Å; F97-L137 HydrophobicContact CE2-CD1 4.09Å; F97-L137 HydrophobicContact CZ-CD1 4.21Å; F97-L137 HydrophobicContact CZ-CD2 4.36Å; N105-L137 PolarHBondContact OD1-N 3.38Å
138F86.9Confident78.9Confident2 Ų241.3 Ų41.31%0.00922%0.218CC..THydrogen-bonded Turntrans-95.8-0.8-179.8-63.3-83.5000112.8I86 T89 V90 L93 N105 A109 A112 D136 H140 T141I86-F138 HydrophobicContact CB-CE1 4.48Å; I86-F138 HydrophobicContact CG1-CE1 4.29Å; I86-F138 HydrophobicContact CG2-CE1 4.26Å; T89-F138 HydrophobicContact CG2-CE1 3.9Å; T89-F138 HydrophobicContact CG2-CE2 3.86Å; T89-F138 HydrophobicContact CG2-CZ 3.48Å; T89-F138 VanDerWaalsContact CG2-CZ 3.48Å; V90-F138 HydrophobicContact CG2-CZ 3.93Å; L93-F138 HydrophobicContact CD1-CE2 3.7Å; L93-F138 HydrophobicContact CD1-CZ 4.33Å; N105-F138 HydrophobicContact CB-CD2 4.4Å; N105-F138 HydrophobicContact CB-CE2 4.4Å; A109-F138 HydrophobicContact CB-CD2 3.96Å; A109-F138 HydrophobicContact CB-CE1 4.17Å; A109-F138 HydrophobicContact CB-CE2 3.47Å; A109-F138 VanDerWaalsContact CB-CE2 3.47Å; A109-F138 HydrophobicContact CB-CG 4.48Å; A109-F138 HydrophobicContact CB-CZ 3.59Å; A112-F138 HydrophobicContact CB-CB 4.24Å; A112-F138 HydrophobicContact CB-CD1 3.8Å; A112-F138 HydrophobicContact CB-CG 4.31Å; D136-F138 PolarHBondContact O-N 3.38Å; D136-F138 PolarHBondContact OD1-N 3.29Å; F138-H140 VanDerWaalsContact C-N 3.27Å; F138-H140 PolarHBondContact O-N 3.18Å; F138-T141 HydrophobicContact CB-CG2 4.47Å; F138-T141 HydrophobicContact CD1-CG2 4.44Å; F138-T141 WeakPolarHBondContact O-CB 3.28Å; F138-T141 WeakPolarHBondContact O-CG2 3.31Å; F138-T141 PolarHBondContact O-N 3.12Å; F138-T141 PolarHBondContact O-OG1 2.85Å
139T83.4Confident80.6Confident12 Ų1240.6 Ų40.67%0.07422%0.216CC..THydrogen-bonded Turntrans-50.3-47.5-178.6-57.40000111.3Y127 L131 D136 T141 W142Y127-T139 HydrophobicContact CD2-CG2 3.92Å; Y127-T139 HydrophobicContact CE2-CG2 3.5Å; L131-T139 HydrophobicContact CB-CG2 4.39Å; L131-T139 HydrophobicContact CD1-CG2 3.64Å; D136-T139 VanDerWaalsContact CB-OG1 3.24Å; D136-T139 WeakPolarHBondContact CB-OG1 3.39Å; D136-T139 WeakPolarHBondContact O-CB 3.16Å; D136-T139 PolarHBondContact O-N 3.2Å; D136-T139 PolarHBondContact O-OG1 2.84Å; D136-T139 PolarHBondContact OD1-N 2.77Å; T139-T141 PolarHBondContact O-N 3.2Å; T139-W142 PolarHBondContact O-N 2.52Å
140H85.1Confident82.2Confident102 Ų10235.2 Ų35.247%0.47219%0.19SC..THydrogen-bonded Turntrans-65.1-10.5-177.2-55.8-60.1000115.3H27 F138 W142H27-H140 AromaticContact CD2-CE1 3.78Å; H27-H140 AromaticContact NE2-CE1 3.4Å; H27-H140 PolarHBondContact NE2-CE1 2.9Å; H27-H140 AromaticContact NE2-ND1 3.88Å; F138-H140 VanDerWaalsContact C-N 3.27Å; F138-H140 PolarHBondContact O-N 3.18Å; H140-W142 PolarHBondContact O-N 3.25Å
141T90.8Very high83.6Confident5 Ų534.5 Ų34.53%0.03119%0.187CC..Hα-helixtrans-75.2-10.5179.468.10000113.5Y82 F85 A112 S117 F138 T139 S143 L144 S145Y82-T141 HydrophobicContact CE2-CG2 3.89Å; Y82-T141 WeakPolarHBondContact OH-CB 3.5Å; F85-T141 HydrophobicContact CD1-CG2 4.49Å; F85-T141 HydrophobicContact CE1-CG2 3.8Å; A112-T141 HydrophobicContact CB-CG2 4.09Å; S117-T141 VanDerWaalsContact CB-OG1 3.24Å; S117-T141 WeakPolarHBondContact CB-OG1 3.14Å; S117-T141 PolarHBondContact OG-O 3.27Å; S117-T141 PolarHBondContact OG-OG1 3.18Å; F138-T141 HydrophobicContact CB-CG2 4.47Å; F138-T141 HydrophobicContact CD1-CG2 4.44Å; F138-T141 WeakPolarHBondContact O-CB 3.28Å; F138-T141 WeakPolarHBondContact O-CG2 3.31Å; F138-T141 PolarHBondContact O-N 3.12Å; F138-T141 PolarHBondContact O-OG1 2.85Å; T139-T141 PolarHBondContact O-N 3.2Å; T141-S143 VanDerWaalsContact C-N 3.32Å; T141-S143 PolarHBondContact O-N 3.36Å; T141-L144 PolarHBondContact O-N 2.97Å; T141-S145 PolarHBondContact O-N 2.95Å; T141-S145 PolarHBondContact O-OG 2.91Å
142W90.4Very high85.1Confident8 Ų840.9 Ų40.93%0.0321%0.214CC..Hα-helixtrans-58.5-42.2-177.977.5-95.9000112.3V40 F44 S117 N118 Y127 T139 H140 S145 V146 F193 N194V40-W142 HydrophobicContact CG1-CH2 3.61Å; V40-W142 HydrophobicContact CG1-CZ2 3.84Å; V40-W142 HydrophobicContact CG2-CZ2 4.23Å; F44-W142 HydrophobicContact CE2-CH2 4.47Å; F44-W142 HydrophobicContact CE2-CZ3 4.35Å; F44-W142 HydrophobicContact CZ-CH2 4.32Å; F44-W142 HydrophobicContact CZ-CZ3 4.05Å; S117-W142 WeakPolarHBondContact OG-CA 3.35Å; S117-W142 PolarHBondContact OG-N 2.52Å; N118-W142 HydrophobicContact CB-CB 4.19Å; Y127-W142 AromaticContact CE2-CD1 3.76Å; Y127-W142 HydrophobicContact CE2-CG 4.34Å; Y127-W142 AromaticContact CZ-CD1 3.89Å; Y127-W142 AromaticContact CZ-NE1 3.73Å; Y127-W142 VanDerWaalsContact OH-CD1 3.29Å; Y127-W142 PolarHBondContact OH-NE1 3.4Å; T139-W142 PolarHBondContact O-N 2.52Å; H140-W142 PolarHBondContact O-N 3.25Å; W142-S145 WeakPolarHBondContact O-CB 3.2Å; W142-S145 PolarHBondContact O-N 2.96Å; W142-V146 HydrophobicContact CE3-CG2 4.08Å; W142-V146 HydrophobicContact CZ3-CG2 4.27Å; W142-V146 WeakPolarHBondContact O-CG2 3.38Å; W142-V146 PolarHBondContact O-N 2.96Å; W142-F193 AromaticContact CE2-CE1 3.99Å; W142-F193 AromaticContact CH2-CD1 3.81Å; W142-F193 HydrophobicContact CH2-CD1 3.81Å; W142-F193 AromaticContact CH2-CE1 3.42Å; W142-F193 HydrophobicContact CH2-CE1 3.42Å; W142-F193 VanDerWaalsContact CH2-CE1 3.42Å; W142-F193 AromaticContact CH2-CZ 3.91Å; W142-F193 HydrophobicContact CH2-CZ 3.91Å; W142-F193 AromaticContact CZ2-CD1 3.93Å; W142-F193 HydrophobicContact CZ2-CD1 3.93Å; W142-F193 AromaticContact CZ2-CE1 3.18Å; W142-F193 HydrophobicContact CZ2-CE1 3.18Å; W142-F193 AromaticContact CZ2-CZ 3.75Å; W142-F193 HydrophobicContact CZ2-CZ 3.75Å; W142-F193 HydrophobicContact CZ3-CD1 4.43Å; W142-F193 HydrophobicContact CZ3-CE1 4.41Å; W142-F193 VanDerWaalsContact CZ3-O 3.29Å; W142-F193 WeakPolarHBondContact CZ3-O 3.32Å; W142-N194 VanDerWaalsContact CD2-OD1 3.27Å; W142-N194 HydrophobicContact CE3-CB 4.34Å; W142-N194 VanDerWaalsContact CE3-OD1 3.24Å
143S90.7Very high86.8Confident34 Ų3438 Ų3824%0.23820%0.199CC..Hα-helixtrans-70.7-37.8-174.458.70000110.9T141 V146 E147T141-S143 VanDerWaalsContact C-N 3.32Å; T141-S143 PolarHBondContact O-N 3.36Å; S143-V146 PolarHBondContact O-N 3.17Å; S143-E147 WeakPolarHBondContact O-CB 3.27Å; S143-E147 PolarHBondContact O-N 3.29Å
144L91.7Very high88.6Confident37 Ų3733 Ų3319%0.19417%0.174CC..Hα-helixtrans-67.8-37.7172.4-171.769.4000111.8I78 Y82 T141 E147 I148I78-L144 HydrophobicContact CG2-CD1 4.14Å; I78-L144 HydrophobicContact CG2-CD2 4.42Å; Y82-L144 HydrophobicContact CD1-CD2 4.48Å; Y82-L144 HydrophobicContact CD2-CD2 3.18Å; Y82-L144 HydrophobicContact CE2-CD2 3.47Å; Y82-L144 VanDerWaalsContact CE2-CD2 3.47Å; Y82-L144 HydrophobicContact CG-CD2 3.72Å; T141-L144 PolarHBondContact O-N 2.97Å; L144-E147 WeakPolarHBondContact O-CB 3.45Å; L144-E147 PolarHBondContact O-N 3.31Å; L144-I148 HydrophobicContact CD1-CD1 4.35Å; L144-I148 HydrophobicContact CD2-CD1 4.39Å; L144-I148 HydrophobicContact CG-CD1 3.96Å; L144-I148 PolarHBondContact O-N 3.26Å
145S93.7Very high90.2Very high0 Ų029.8 Ų29.80%015%0.147CC..Hα-helixtrans-58.9-46.8173-69.20000111.3F115 S117 T141 W142 E147 I148 Q149F115-S145 WeakPolarHBondContact CA-OG 3.5Å; F115-S145 WeakPolarHBondContact O-CB 3.37Å; S117-S145 PolarHBondContact OG-OG 3.49Å; T141-S145 PolarHBondContact O-N 2.95Å; T141-S145 PolarHBondContact O-OG 2.91Å; W142-S145 WeakPolarHBondContact O-CB 3.2Å; W142-S145 PolarHBondContact O-N 2.96Å; S145-E147 VanDerWaalsContact C-N 3.32Å; S145-E147 PolarHBondContact O-N 3.41Å; S145-I148 PolarHBondContact O-N 3.39Å; S145-Q149 WeakPolarHBondContact O-CB 3.34Å; S145-Q149 WeakPolarHBondContact O-CG 3.43Å; S145-Q149 PolarHBondContact O-N 3.02Å
146V94.4Very high91.4Very high0 Ų031.8 Ų31.80%016%0.158CC..Hα-helixtrans-58.2-45.4174.3171.20000111.1F44 N118 W142 S143 I148 Q149 F150 N194 L196 F203F44-V146 HydrophobicContact CE1-CB 4.34Å; F44-V146 HydrophobicContact CE1-CG1 4.11Å; F44-V146 HydrophobicContact CE2-CG1 4.08Å; F44-V146 HydrophobicContact CZ-CB 3.91Å; F44-V146 HydrophobicContact CZ-CG1 3.66Å; N118-V146 HydrophobicContact CB-CG2 3.66Å; N118-V146 WeakPolarHBondContact ND2-CG2 3.49Å; W142-V146 HydrophobicContact CE3-CG2 4.08Å; W142-V146 HydrophobicContact CZ3-CG2 4.27Å; W142-V146 WeakPolarHBondContact O-CG2 3.38Å; W142-V146 PolarHBondContact O-N 2.96Å; S143-V146 PolarHBondContact O-N 3.17Å; V146-I148 PolarHBondContact O-N 3.29Å; V146-Q149 PolarHBondContact O-N 3.17Å; V146-F150 WeakPolarHBondContact O-CB 3.3Å; V146-F150 PolarHBondContact O-N 3.13Å; V146-N194 VanDerWaalsContact CG2-O 3.3Å; V146-N194 WeakPolarHBondContact CG2-O 3.43Å; V146-L196 HydrophobicContact CG1-CB 4.42Å; V146-L196 HydrophobicContact CG1-CD1 4.1Å; V146-F203 HydrophobicContact CG1-CE2 4.1Å; V146-F203 HydrophobicContact CG1-CZ 4.19Å
147E93.3Very high92.3Very high27 Ų2732.1 Ų32.113%0.12616%0.159CC..Hα-helixtrans-61.5-43.8179.9-179171.1-15300112.5S47 S143 L144 S145 F150 Y151S47-E147 VanDerWaalsContact CB-OE1 3.23Å; S47-E147 WeakPolarHBondContact CB-OE1 3.33Å; S47-E147 PolarHBondContact OG-OE1 3.38Å; S143-E147 WeakPolarHBondContact O-CB 3.27Å; S143-E147 PolarHBondContact O-N 3.29Å; L144-E147 WeakPolarHBondContact O-CB 3.45Å; L144-E147 PolarHBondContact O-N 3.31Å; S145-E147 VanDerWaalsContact C-N 3.32Å; S145-E147 PolarHBondContact O-N 3.41Å; E147-F150 WeakPolarHBondContact O-CB 3.27Å; E147-F150 PolarHBondContact O-N 3.13Å; E147-Y151 HydrophobicContact CG-CD1 4.22Å; E147-Y151 HydrophobicContact CG-CE1 3.46Å; E147-Y151 VanDerWaalsContact CG-CE1 3.46Å; E147-Y151 HydrophobicContact CG-CE2 3.97Å; E147-Y151 WeakPolarHBondContact CG-OH 3.27Å; E147-Y151 WeakPolarHBondContact O-CD1 3.3Å; E147-Y151 VanDerWaalsContact O-CG 3.22Å; E147-Y151 PolarHBondContact O-N 3.17Å; E147-Y151 VanDerWaalsContact OE1-CZ 3.31Å; E147-Y151 PolarHBondContact OE1-OH 3.4Å
148I93.2Very high92.8Very high20 Ų2030.1 Ų30.110%0.10315%0.148CC..Hα-helixtrans-70.1-39.3179.2-74168.8000111.5I78 F115 L144 S145 V146 F150 Y151 F152I78-I148 HydrophobicContact CG2-CD1 4.01Å; F115-I148 HydrophobicContact CB-CG2 4.36Å; F115-I148 HydrophobicContact CD1-CB 4.25Å; F115-I148 HydrophobicContact CD1-CD1 3.34Å; F115-I148 HydrophobicContact CD1-CG1 4.38Å; F115-I148 HydrophobicContact CD1-CG2 4.22Å; F115-I148 HydrophobicContact CD2-CG2 4.21Å; F115-I148 HydrophobicContact CE1-CD1 2.99Å; F115-I148 HydrophobicContact CE1-CG1 4.34Å; F115-I148 HydrophobicContact CE2-CD1 4.38Å; F115-I148 HydrophobicContact CG-CB 4.46Å; F115-I148 HydrophobicContact CG-CD1 4.17Å; F115-I148 HydrophobicContact CG-CG2 4.01Å; F115-I148 HydrophobicContact CZ-CD1 3.58Å; L144-I148 HydrophobicContact CD1-CD1 4.35Å; L144-I148 HydrophobicContact CD2-CD1 4.39Å; L144-I148 HydrophobicContact CG-CD1 3.96Å; L144-I148 PolarHBondContact O-N 3.26Å; S145-I148 PolarHBondContact O-N 3.39Å; V146-I148 PolarHBondContact O-N 3.29Å; I148-F150 VanDerWaalsContact C-N 3.29Å; I148-F150 PolarHBondContact O-N 2.79Å; I148-Y151 WeakPolarHBondContact O-CB 3.06Å; I148-Y151 PolarHBondContact O-N 3.45Å; I148-Y151 VanDerWaalsContact O-N 3.17Å; I148-F152 PolarHBondContact O-N 2.82Å; I148-F152 VanDerWaalsContact O-N 3.16Å
149Q95.3Very high93.2Very high47 Ų4732.4 Ų32.422%0.2216%0.16CC..Hα-helixtrans-62.6-39.8172.4-64.2165.76.300110.8F115 N118 S145 V146 Y151 F152 I153 L196F115-Q149 PolarHBondContact O-NE2 2.8Å; N118-Q149 PolarHBondContact ND2-OE1 3.01Å; N118-Q149 PolarHBondContact OD1-NE2 3.26Å; S145-Q149 WeakPolarHBondContact O-CB 3.34Å; S145-Q149 WeakPolarHBondContact O-CG 3.43Å; S145-Q149 PolarHBondContact O-N 3.02Å; V146-Q149 PolarHBondContact O-N 3.17Å; Q149-Y151 VanDerWaalsContact C-N 3.33Å; Q149-Y151 PolarHBondContact O-N 3.42Å; Q149-F152 WeakPolarHBondContact O-CB 3.15Å; Q149-F152 PolarHBondContact O-N 3.47Å; Q149-I153 PolarHBondContact O-N 3.06Å; Q149-L196 HydrophobicContact CB-CD2 3.66Å
150F95.8Very high93.8Very high0 Ų034.9 Ų34.90%017%0.173CC..Hα-helixtrans-61.1-41.7172.7177.8-103.9000111.7M51 V146 E147 I148 F152 I153 V154 I157 L196 F203 M207M51-F150 HydrophobicContact CG-CE1 4.29Å; V146-F150 WeakPolarHBondContact O-CB 3.3Å; V146-F150 PolarHBondContact O-N 3.13Å; E147-F150 WeakPolarHBondContact O-CB 3.27Å; E147-F150 PolarHBondContact O-N 3.13Å; I148-F150 VanDerWaalsContact C-N 3.29Å; I148-F150 PolarHBondContact O-N 2.79Å; F150-F152 PolarHBondContact O-N 2.72Å; F150-I153 HydrophobicContact CD2-CD1 4.15Å; F150-I153 HydrophobicContact CD2-CG1 4.12Å; F150-I153 WeakPolarHBondContact O-CG1 3.26Å; F150-I153 PolarHBondContact O-N 3.21Å; F150-V154 HydrophobicContact CD1-CB 4.2Å; F150-V154 HydrophobicContact CE1-CB 3.63Å; F150-V154 HydrophobicContact CE1-CG1 4.18Å; F150-V154 HydrophobicContact CE1-CG2 3.61Å; F150-V154 HydrophobicContact CE2-CB 4.13Å; F150-V154 HydrophobicContact CE2-CG2 4.26Å; F150-V154 HydrophobicContact CZ-CB 3.58Å; F150-V154 HydrophobicContact CZ-CG2 3.38Å; F150-V154 WeakPolarHBondContact O-CB 3.49Å; F150-V154 PolarHBondContact O-N 2.71Å; F150-I157 HydrophobicContact CE2-CD1 4.27Å; F150-L196 HydrophobicContact CB-CD1 3.78Å; F150-L196 HydrophobicContact CD2-CD1 4.45Å; F150-F203 HydrophobicContact CB-CD1 4.36Å; F150-F203 HydrophobicContact CB-CE1 4.03Å; F150-F203 HydrophobicContact CB-CE2 4.21Å; F150-F203 HydrophobicContact CB-CZ 3.94Å; F150-F203 HydrophobicContact CD1-CB 4.2Å; F150-F203 AromaticContact CD1-CD1 3.24Å; F150-F203 HydrophobicContact CD1-CD1 3.24Å; F150-F203 HydrophobicContact CD1-CD2 4.46Å; F150-F203 AromaticContact CD1-CE1 3.58Å; F150-F203 HydrophobicContact CD1-CE1 3.58Å; F150-F203 AromaticContact CD1-CG 3.74Å; F150-F203 HydrophobicContact CD1-CG 3.74Å; F150-F203 HydrophobicContact CD1-CZ 4.31Å; F150-F203 HydrophobicContact CD2-CB 4Å; F150-F203 HydrophobicContact CD2-CD1 4.16Å; F150-F203 AromaticContact CD2-CD2 3.96Å; F150-F203 HydrophobicContact CD2-CD2 3.96Å; F150-F203 HydrophobicContact CD2-CE2 4.45Å; F150-F203 AromaticContact CD2-CG 3.79Å; F150-F203 HydrophobicContact CD2-CG 3.79Å; F150-F203 HydrophobicContact CE1-CB 3.73Å; F150-F203 AromaticContact CE1-CD1 3.45Å; F150-F203 HydrophobicContact CE1-CD1 3.45Å; F150-F203 VanDerWaalsContact CE1-CD1 3.45Å; F150-F203 HydrophobicContact CE1-CE1 4.24Å; F150-F203 AromaticContact CE1-CG 3.78Å; F150-F203 HydrophobicContact CE1-CG 3.78Å; F150-F203 HydrophobicContact CE2-CB 3.49Å; F150-F203 VanDerWaalsContact CE2-CB 3.49Å; F150-F203 HydrophobicContact CE2-CD1 4.32Å; F150-F203 HydrophobicContact CE2-CD2 4.32Å; F150-F203 AromaticContact CE2-CG 3.82Å; F150-F203 HydrophobicContact CE2-CG 3.82Å; F150-F203 HydrophobicContact CG-CB 4.33Å; F150-F203 AromaticContact CG-CD1 3.64Å; F150-F203 HydrophobicContact CG-CD1 3.64Å; F150-F203 HydrophobicContact CG-CD2 4.04Å; F150-F203 AromaticContact CG-CE1 3.82Å; F150-F203 HydrophobicContact CG-CE1 3.82Å; F150-F203 HydrophobicContact CG-CE2 4.2Å; F150-F203 AromaticContact CG-CG 3.75Å; F150-F203 HydrophobicContact CG-CG 3.75Å; F150-F203 HydrophobicContact CG-CZ 4.09Å; F150-F203 HydrophobicContact CZ-CB 3.35Å; F150-F203 HydrophobicContact CZ-CD1 4Å; F150-F203 AromaticContact CZ-CG 3.83Å; F150-F203 HydrophobicContact CZ-CG 3.83Å; F150-M207 HydrophobicContact CZ-SD 4.2Å
151Y93.9Very high94.2Very high13 Ų1330 Ų305%0.05115%0.15CC..Hα-helixtrans-60.2-33.2178.3-67.3-4.5000112.7M51 Y71 I78 E147 I148 Q149 I153 P155M51-Y151 HydrophobicContact CE-CD1 4.2Å; M51-Y151 HydrophobicContact CE-CE1 3.37Å; M51-Y151 HydrophobicContact CE-CE2 4.11Å; M51-Y151 WeakPolarHBondContact CE-OH 3.48Å; M51-Y151 HydrophobicContact CG-CD1 3.62Å; M51-Y151 HydrophobicContact CG-CE1 3.5Å; M51-Y151 VanDerWaalsContact CG-CE1 3.5Å; M51-Y151 HydrophobicContact SD-CD1 3.68Å; M51-Y151 HydrophobicContact SD-CE1 3.47Å; M51-Y151 WeakPolarHBondContact SD-CE1 3.48Å; M51-Y151 HydrophobicContact SD-CE2 4.29Å; M51-Y151 HydrophobicContact SD-CG 4.21Å; Y71-Y151 VanDerWaalsContact CE1-O 3.27Å; Y71-Y151 WeakPolarHBondContact CE1-O 3.45Å; I78-Y151 HydrophobicContact CD1-CD2 4.27Å; I78-Y151 HydrophobicContact CD1-CE2 3.46Å; I78-Y151 VanDerWaalsContact CD1-CE2 3.46Å; E147-Y151 HydrophobicContact CG-CD1 4.22Å; E147-Y151 HydrophobicContact CG-CE1 3.46Å; E147-Y151 VanDerWaalsContact CG-CE1 3.46Å; E147-Y151 HydrophobicContact CG-CE2 3.97Å; E147-Y151 WeakPolarHBondContact CG-OH 3.27Å; E147-Y151 WeakPolarHBondContact O-CD1 3.3Å; E147-Y151 VanDerWaalsContact O-CG 3.22Å; E147-Y151 PolarHBondContact O-N 3.17Å; E147-Y151 VanDerWaalsContact OE1-CZ 3.31Å; E147-Y151 PolarHBondContact OE1-OH 3.4Å; I148-Y151 WeakPolarHBondContact O-CB 3.06Å; I148-Y151 PolarHBondContact O-N 3.45Å; I148-Y151 VanDerWaalsContact O-N 3.17Å; Q149-Y151 VanDerWaalsContact C-N 3.33Å; Q149-Y151 PolarHBondContact O-N 3.42Å; Y151-I153 VanDerWaalsContact C-N 3.34Å; Y151-P155 VanDerWaalsContact O-CD 3.26Å; Y151-P155 WeakPolarHBondContact O-CD 3.41Å
152F94.3Very high94.2Very high146 Ų14632.3 Ų32.364%0.6417%0.167SC*.Hα-helixtrans-69.1-30.1176-169-101.3000113.4Y71 I148 Q149 F150Y71-F152 PolarHBondContact OH-O 2.86Å; I148-F152 PolarHBondContact O-N 2.82Å; I148-F152 VanDerWaalsContact O-N 3.16Å; Q149-F152 WeakPolarHBondContact O-CB 3.15Å; Q149-F152 PolarHBondContact O-N 3.47Å; F150-F152 PolarHBondContact O-N 2.72Å
153I96.1Very high94.4Very high42 Ų4241.2 Ų41.222%0.21520%0.201CC..Hα-helixtrans-97.2-24-177.964.1169.1000113.4Q149 F150 Y151 P155 L156 I157 L196 I200Q149-I153 PolarHBondContact O-N 3.06Å; F150-I153 HydrophobicContact CD2-CD1 4.15Å; F150-I153 HydrophobicContact CD2-CG1 4.12Å; F150-I153 WeakPolarHBondContact O-CG1 3.26Å; F150-I153 PolarHBondContact O-N 3.21Å; Y151-I153 VanDerWaalsContact C-N 3.34Å; I153-P155 VanDerWaalsContact C-CD 3.45Å; I153-L156 WeakPolarHBondContact O-CB 3.35Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-L156 VanDerWaalsContact O-N 3.14Å; I153-I157 HydrophobicContact CD1-CD1 3.98Å; I153-I157 HydrophobicContact CG1-CD1 4.11Å; I153-I157 PolarHBondContact O-N 3.15Å; I153-I157 VanDerWaalsContact O-N 3.11Å; I153-L196 HydrophobicContact CD1-CD1 4.43Å; I153-L196 HydrophobicContact CD1-CD2 4.06Å; I153-I200 HydrophobicContact CD1-CD1 3.78Å; I153-I200 HydrophobicContact CD1-CG1 4.25Å
154V96.2Very high94.5Very high0 Ų043.7 Ų43.70%021%0.208CC..Hα-helixtrans-62-34.5-172.869.60000114.4M51 L55 F70 F150 L156 I157 F158 M207M51-V154 HydrophobicContact CB-CG1 4.05Å; M51-V154 HydrophobicContact CB-CG2 4.15Å; M51-V154 HydrophobicContact CG-CG1 4.13Å; L55-V154 HydrophobicContact CD1-CG1 4.17Å; L55-V154 HydrophobicContact CD1-CG2 4.03Å; F70-V154 HydrophobicContact CE1-CG1 4.12Å; F70-V154 HydrophobicContact CZ-CG1 3.72Å; F150-V154 HydrophobicContact CD1-CB 4.2Å; F150-V154 HydrophobicContact CE1-CB 3.63Å; F150-V154 HydrophobicContact CE1-CG1 4.18Å; F150-V154 HydrophobicContact CE1-CG2 3.61Å; F150-V154 HydrophobicContact CE2-CB 4.13Å; F150-V154 HydrophobicContact CE2-CG2 4.26Å; F150-V154 HydrophobicContact CZ-CB 3.58Å; F150-V154 HydrophobicContact CZ-CG2 3.38Å; F150-V154 WeakPolarHBondContact O-CB 3.49Å; F150-V154 PolarHBondContact O-N 2.71Å; V154-L156 VanDerWaalsContact C-N 3.3Å; V154-L156 PolarHBondContact O-N 3.14Å; V154-I157 PolarHBondContact O-N 3.36Å; V154-F158 VanDerWaalsContact O-CB 3.25Å; V154-F158 WeakPolarHBondContact O-CB 3.27Å; V154-F158 PolarHBondContact O-N 3.02Å; V154-M207 HydrophobicContact CG2-CE 4.03Å; V154-M207 HydrophobicContact CG2-SD 3.84Å
155P95.2Very high94.4Very high3 Ų346.4 Ų46.42%0.01923%0.23CC..Hα-helixtrans-64.4-37.6176.8-22.136.6000111.4L55 V67 F70 Y71 Y151 I153 F158 L159L55-P155 HydrophobicContact CD2-CB 4.03Å; L55-P155 HydrophobicContact CD2-CG 4.2Å; V67-P155 HydrophobicContact CG1-CB 4.25Å; V67-P155 HydrophobicContact CG2-CB 4.04Å; F70-P155 HydrophobicContact CD1-CG 3.84Å; F70-P155 HydrophobicContact CE1-CG 3.77Å; Y71-P155 HydrophobicContact CE1-CG 4.17Å; Y71-P155 HydrophobicContact CE2-CG 4.49Å; Y71-P155 WeakPolarHBondContact OH-CG 3.44Å; Y151-P155 VanDerWaalsContact O-CD 3.26Å; Y151-P155 WeakPolarHBondContact O-CD 3.41Å; I153-P155 VanDerWaalsContact C-CD 3.45Å; P155-F158 PolarHBondContact O-N 3.32Å; P155-L159 VanDerWaalsContact O-CB 3.3Å; P155-L159 WeakPolarHBondContact O-CB 3.44Å; P155-L159 WeakPolarHBondContact O-CG 3.39Å; P155-L159 PolarHBondContact O-N 3.1Å
156L96Very high94.1Very high112 Ų11248.7 Ų48.759%0.58625%0.254SS*.Hα-helixtrans-65.2-47.7175179.564.1000111.2I153 V154 F158 L159 I160I153-L156 WeakPolarHBondContact O-CB 3.35Å; I153-L156 PolarHBondContact O-N 2.95Å; I153-L156 VanDerWaalsContact O-N 3.14Å; V154-L156 VanDerWaalsContact C-N 3.3Å; V154-L156 PolarHBondContact O-N 3.14Å; L156-F158 PolarHBondContact O-N 3.27Å; L156-L159 PolarHBondContact O-N 3.37Å; L156-I160 HydrophobicContact CD1-CD1 3.91Å; L156-I160 HydrophobicContact CD1-CG1 4.22Å; L156-I160 HydrophobicContact CG-CD1 3.92Å; L156-I160 WeakPolarHBondContact O-CG1 3.29Å; L156-I160 PolarHBondContact O-N 3.45Å
157I97Very high93.9Very high16 Ų1656.6 Ų56.68%0.08229%0.289CS..Hα-helixtrans-55.7-45.1177.1-68.3172.6000110.4F150 I153 V154 G161 Y172 Y173 L176 L204 M207F150-I157 HydrophobicContact CE2-CD1 4.27Å; I153-I157 HydrophobicContact CD1-CD1 3.98Å; I153-I157 HydrophobicContact CG1-CD1 4.11Å; I153-I157 PolarHBondContact O-N 3.15Å; I153-I157 VanDerWaalsContact O-N 3.11Å; V154-I157 PolarHBondContact O-N 3.36Å; I157-G161 PolarHBondContact O-N 3.02Å; I157-Y172 HydrophobicContact CG2-CE1 4.38Å; I157-Y172 VanDerWaalsContact O-CE1 3.32Å; I157-Y172 WeakPolarHBondContact O-CE1 3.23Å; I157-Y172 PolarHBondContact O-OH 2.98Å; I157-Y173 HydrophobicContact CG2-CD1 4.46Å; I157-Y173 HydrophobicContact CG2-CE1 3.99Å; I157-L176 HydrophobicContact CD1-CD2 4.26Å; I157-L176 HydrophobicContact CG1-CD2 4.23Å; I157-L176 HydrophobicContact CG2-CD2 3.84Å; I157-L204 HydrophobicContact CG2-CD2 3.98Å; I157-M207 HydrophobicContact CG2-CE 4.46Å; I157-M207 HydrophobicContact CG2-SD 4.41Å
158F95.4Very high94Very high6 Ų663.4 Ų63.43%0.02631%0.314CS..Hα-helixtrans-68-45.2-179.1-178.9-90.1000112.7L55 T56 E59 V154 P155 L156 G161 S162 M207L55-F158 HydrophobicContact CB-CD1 3.77Å; L55-F158 HydrophobicContact CB-CD2 3.95Å; L55-F158 HydrophobicContact CB-CE1 3.8Å; L55-F158 HydrophobicContact CB-CE2 3.97Å; L55-F158 HydrophobicContact CB-CG 3.84Å; L55-F158 HydrophobicContact CB-CZ 3.88Å; L55-F158 HydrophobicContact CD1-CB 3.73Å; L55-F158 HydrophobicContact CD1-CD1 4.39Å; L55-F158 HydrophobicContact CD1-CD2 4.24Å; L55-F158 HydrophobicContact CD1-CG 3.88Å; L55-F158 HydrophobicContact CG-CG 4.42Å; T56-F158 WeakPolarHBondContact OG1-CE2 3.35Å; T56-F158 WeakPolarHBondContact OG1-CZ 3.35Å; E59-F158 HydrophobicContact CG-CE1 4.05Å; E59-F158 HydrophobicContact CG-CZ 4.24Å; E59-F158 WeakPolarHBondContact OE1-CE1 3.14Å; E59-F158 WeakPolarHBondContact OE1-CZ 3.41Å; V154-F158 VanDerWaalsContact O-CB 3.25Å; V154-F158 WeakPolarHBondContact O-CB 3.27Å; V154-F158 PolarHBondContact O-N 3.02Å; P155-F158 PolarHBondContact O-N 3.32Å; L156-F158 PolarHBondContact O-N 3.27Å; F158-G161 CarbonylContact O-C 3.35Å; F158-G161 WeakPolarHBondContact O-CA 3.49Å; F158-G161 PolarHBondContact O-N 3.37Å; F158-G161 VanDerWaalsContact O-N 3.13Å; F158-S162 PolarHBondContact O-N 3.06Å; F158-M207 HydrophobicContact CB-CE 4.12Å; F158-M207 HydrophobicContact CD2-CE 3.93Å
159L94.9Very high94Very high50 Ų5064 Ų6426%0.26232%0.316SS..Hα-helixtrans-64-40.3178.1-72.9170.2000111.7V63 V67 P155 L156 G161 S162 Y163V63-L159 HydrophobicContact CG1-CD1 3.73Å; V63-L159 HydrophobicContact CG1-CD2 3.91Å; V63-L159 HydrophobicContact CG2-CD2 4.5Å; V67-L159 HydrophobicContact CG2-CD1 4.15Å; P155-L159 VanDerWaalsContact O-CB 3.3Å; P155-L159 WeakPolarHBondContact O-CB 3.44Å; P155-L159 WeakPolarHBondContact O-CG 3.39Å; P155-L159 PolarHBondContact O-N 3.1Å; L156-L159 PolarHBondContact O-N 3.37Å; L159-G161 VanDerWaalsContact C-N 3.29Å; L159-G161 PolarHBondContact O-N 3.27Å; L159-S162 PolarHBondContact O-N 2.57Å; L159-S162 PolarHBondContact O-OG 3.31Å; L159-Y163 WeakPolarHBondContact O-CD2 3.33Å; L159-Y163 WeakPolarHBondContact O-CE2 3.31Å
160I95.9Very high94Very high65 Ų6564.9 Ų64.933%0.33332%0.318SS..Hα-helixtrans-62.6-43172.6-66.3168.5000109.9L156 S162 Y163 F164 Y172L156-I160 HydrophobicContact CD1-CD1 3.91Å; L156-I160 HydrophobicContact CD1-CG1 4.22Å; L156-I160 HydrophobicContact CG-CD1 3.92Å; L156-I160 WeakPolarHBondContact O-CG1 3.29Å; L156-I160 PolarHBondContact O-N 3.45Å; I160-S162 VanDerWaalsContact C-N 3.25Å; I160-S162 PolarHBondContact O-N 3.35Å; I160-Y163 PolarHBondContact O-N 3.32Å; I160-F164 HydrophobicContact CG2-CE2 4.13Å; I160-F164 WeakPolarHBondContact O-CD2 3.39Å; I160-F164 WeakPolarHBondContact O-CE2 3.48Å; I160-Y172 HydrophobicContact CB-CE2 4.42Å; I160-Y172 HydrophobicContact CG2-CD2 4.34Å; I160-Y172 HydrophobicContact CG2-CE1 4.48Å; I160-Y172 HydrophobicContact CG2-CE2 3.58Å
161G94.2Very high93.9Very high0 Ų066 Ų660%033%0.329CS..Hα-helixtrans-63.9-23.9176.900000114.7I157 F158 L159 F164I157-G161 PolarHBondContact O-N 3.02Å; F158-G161 CarbonylContact O-C 3.35Å; F158-G161 WeakPolarHBondContact O-CA 3.49Å; F158-G161 PolarHBondContact O-N 3.37Å; F158-G161 VanDerWaalsContact O-N 3.13Å; L159-G161 VanDerWaalsContact C-N 3.29Å; L159-G161 PolarHBondContact O-N 3.27Å; G161-F164 PolarHBondContact O-N 3.16Å
162S91.4Very high94.1Very high53 Ų5367.4 Ų67.437%0.37134%0.335SS..Hα-helixtrans-79.4-17.5-18072.40000113.4F158 L159 I160 F164F158-S162 PolarHBondContact O-N 3.06Å; L159-S162 PolarHBondContact O-N 2.57Å; L159-S162 PolarHBondContact O-OG 3.31Å; I160-S162 VanDerWaalsContact C-N 3.25Å; I160-S162 PolarHBondContact O-N 3.35Å; S162-F164 PolarHBondContact O-N 3.21Å
163Y92.9Very high94.2Very high195 Ų19560.6 Ų60.677%0.76531%0.305SS*.THydrogen-bonded Turntrans-69.7-20.3170-66.5-69.1000113.2L159 I160L159-Y163 WeakPolarHBondContact O-CD2 3.33Å; L159-Y163 WeakPolarHBondContact O-CE2 3.31Å; I160-Y163 PolarHBondContact O-N 3.32Å
164F93.2Very high94.3Very high85 Ų8565.4 Ų65.437%0.37332%0.324SS..  trans-97.4147.1178-55.6-73.3000111I160 G161 S162 K169 Y172I160-F164 HydrophobicContact CG2-CE2 4.13Å; I160-F164 WeakPolarHBondContact O-CD2 3.39Å; I160-F164 WeakPolarHBondContact O-CE2 3.48Å; G161-F164 PolarHBondContact O-N 3.16Å; S162-F164 PolarHBondContact O-N 3.21Å; F164-K169 HydrophobicContact CB-CB 4.03Å; F164-Y172 HydrophobicContact CD2-CD2 4.47Å; F164-Y172 HydrophobicContact CD2-CG 4.06Å; F164-Y172 AromaticContact CE2-CD2 3.97Å; F164-Y172 HydrophobicContact CE2-CD2 3.97Å; F164-Y172 HydrophobicContact CE2-CG 4.02Å
165S89.2Confident94.3Very high94 Ų9469.2 Ų69.266%0.65735%0.348SS*.  trans-123.8155.517666.40000111.6F167 Y168S165-F167 PolarHBondContact O-N 2.97Å; S165-Y168 PolarHBondContact O-N 3.44Å
166G88.8Confident94.5Very high49 Ų4971.3 Ų71.351%0.50536%0.358SS..Hα-helixtrans53.2-129.7176.500000113.4Y168 K169 Y170G166-Y168 VanDerWaalsContact C-N 3.32Å; G166-Y168 PolarHBondContact O-N 3.47Å; G166-K169 WeakPolarHBondContact O-CB 3.3Å; G166-K169 PolarHBondContact O-N 3Å; G166-Y170 WeakPolarHBondContact O-CD2 3.21Å
167F90.7Very high94.5Very high166 Ų16666.6 Ų66.673%0.72834%0.336SS*.Hα-helixtrans-57.8-39.1-177.7177.6-101000113.5S165 K169 Y170 G171S165-F167 PolarHBondContact O-N 2.97Å; F167-K169 VanDerWaalsContact C-N 3.28Å; F167-K169 PolarHBondContact O-N 3.03Å; F167-Y170 PolarHBondContact O-N 3.03Å; F167-G171 PolarHBondContact O-N 3.14Å
168Y94.2Very high94.5Very high169 Ų16969.9 Ų69.966%0.66335%0.354SS*.Hα-helixtrans-65.6-32-178.8-60.6-70.4000112.5S165 G166 G171 Y172S165-Y168 PolarHBondContact O-N 3.44Å; G166-Y168 VanDerWaalsContact C-N 3.32Å; G166-Y168 PolarHBondContact O-N 3.47Å; Y168-G171 PolarHBondContact O-N 3.4Å; Y168-Y172 PolarHBondContact O-N 2.83Å
169K93.8Very high94.7Very high34 Ų3474.7 Ų74.715%0.14838%0.379CS..Hα-helixtrans-63.4-46.5174.7-174169.6-171.2171.50111.1F164 G166 F167 Y172 Y173F164-K169 HydrophobicContact CB-CB 4.03Å; G166-K169 WeakPolarHBondContact O-CB 3.3Å; G166-K169 PolarHBondContact O-N 3Å; F167-K169 VanDerWaalsContact C-N 3.28Å; F167-K169 PolarHBondContact O-N 3.03Å; K169-Y172 PolarHBondContact O-N 3.19Å; K169-Y173 HydrophobicContact CG-CD2 4.27Å; K169-Y173 HydrophobicContact CG-CE2 3.81Å; K169-Y173 WeakPolarHBondContact O-CD2 3.43Å; K169-Y173 PolarHBondContact O-N 3.39Å
170Y94.1Very high94.8Very high65 Ų6572.6 Ų72.626%0.25537%0.368SS..Hα-helixtrans-67.3-38.2175.9-63.7-73.1000111.9G166 F167 Y172 Y173 F174 V208 N215G166-Y170 WeakPolarHBondContact O-CD2 3.21Å; F167-Y170 PolarHBondContact O-N 3.03Å; Y170-Y172 VanDerWaalsContact C-N 3.35Å; Y170-Y172 PolarHBondContact O-N 2.67Å; Y170-Y173 PolarHBondContact O-N 3.19Å; Y170-F174 VanDerWaalsContact O-CB 3.27Å; Y170-F174 WeakPolarHBondContact O-CB 3.32Å; Y170-F174 PolarHBondContact O-N 3.31Å; Y170-V208 HydrophobicContact CD1-CG1 4.11Å; Y170-V208 HydrophobicContact CE1-CG1 4.29Å; Y170-N215 PolarHBondContact OH-ND2 3.37Å; Y170-N215 VanDerWaalsContact OH-ND2 3.16Å
171G95.6Very high94.7Very high22 Ų2273.3 Ų73.323%0.22737%0.369CS..Hα-helixtrans-58.5-43.117400000112.8F167 Y168 F174 V175F167-G171 PolarHBondContact O-N 3.14Å; Y168-G171 PolarHBondContact O-N 3.4Å; G171-F174 PolarHBondContact O-N 2.99Å; G171-V175 WeakPolarHBondContact O-CB 3.36Å; G171-V175 VanDerWaalsContact O-CG2 3.31Å; G171-V175 WeakPolarHBondContact O-CG2 3.29Å; G171-V175 PolarHBondContact O-N 2.97Å
172Y97.4Very high94.8Very high44 Ų4476.8 Ų76.817%0.17339%0.39CS..Hα-helixtrans-58.4-52.4175.6164.3-105000112.4I157 I160 F164 Y168 K169 Y170 F174 V175 L176I157-Y172 HydrophobicContact CG2-CE1 4.38Å; I157-Y172 VanDerWaalsContact O-CE1 3.32Å; I157-Y172 WeakPolarHBondContact O-CE1 3.23Å; I157-Y172 PolarHBondContact O-OH 2.98Å; I160-Y172 HydrophobicContact CB-CE2 4.42Å; I160-Y172 HydrophobicContact CG2-CD2 4.34Å; I160-Y172 HydrophobicContact CG2-CE1 4.48Å; I160-Y172 HydrophobicContact CG2-CE2 3.58Å; F164-Y172 HydrophobicContact CD2-CD2 4.47Å; F164-Y172 HydrophobicContact CD2-CG 4.06Å; F164-Y172 AromaticContact CE2-CD2 3.97Å; F164-Y172 HydrophobicContact CE2-CD2 3.97Å; F164-Y172 HydrophobicContact CE2-CG 4.02Å; Y168-Y172 PolarHBondContact O-N 2.83Å; K169-Y172 PolarHBondContact O-N 3.19Å; Y170-Y172 VanDerWaalsContact C-N 3.35Å; Y170-Y172 PolarHBondContact O-N 2.67Å; Y172-F174 VanDerWaalsContact C-N 3.31Å; Y172-F174 PolarHBondContact O-N 3.39Å; Y172-V175 PolarHBondContact O-N 3.34Å; Y172-L176 WeakPolarHBondContact O-CB 3.29Å; Y172-L176 PolarHBondContact O-N 3.33Å
173Y97.1Very high95Very high3 Ų378 Ų781%0.01239%0.389CS..Hα-helixtrans-65.4-35.6178.7-68.3-63.2000112.4I157 K169 Y170 G177 L204 M207 V208 L211I157-Y173 HydrophobicContact CG2-CD1 4.46Å; I157-Y173 HydrophobicContact CG2-CE1 3.99Å; K169-Y173 HydrophobicContact CG-CD2 4.27Å; K169-Y173 HydrophobicContact CG-CE2 3.81Å; K169-Y173 WeakPolarHBondContact O-CD2 3.43Å; K169-Y173 PolarHBondContact O-N 3.39Å; Y170-Y173 PolarHBondContact O-N 3.19Å; Y173-G177 PolarHBondContact O-N 3.35Å; Y173-L204 HydrophobicContact CD1-CD2 3.98Å; Y173-M207 HydrophobicContact CE1-CE 3.78Å; Y173-M207 HydrophobicContact CE1-SD 4.34Å; Y173-V208 HydrophobicContact CD2-CG2 4.36Å; Y173-V208 HydrophobicContact CG-CG2 4.17Å; Y173-L211 HydrophobicContact CD2-CD1 3.99Å; Y173-L211 HydrophobicContact CE2-CD1 3.37Å
174F96.4Very high95Very high142 Ų14270.3 Ų70.362%0.62336%0.359SS*.Hα-helixtrans-64.5-48.5176.3178.4-98.7000111.8Y170 G171 Y172 L176 G177 L178Y170-F174 VanDerWaalsContact O-CB 3.27Å; Y170-F174 WeakPolarHBondContact O-CB 3.32Å; Y170-F174 PolarHBondContact O-N 3.31Å; G171-F174 PolarHBondContact O-N 2.99Å; Y172-F174 VanDerWaalsContact C-N 3.31Å; Y172-F174 PolarHBondContact O-N 3.39Å; F174-L176 PolarHBondContact O-N 2.86Å; F174-G177 PolarHBondContact O-N 3.49Å; F174-L178 HydrophobicContact CE1-CD2 4.31Å; F174-L178 WeakPolarHBondContact O-CB 3.24Å; F174-L178 PolarHBondContact O-N 2.96Å
175V97.9Very high94.9Very high81 Ų8169.9 Ų69.949%0.49137%0.367SS..Hα-helixtrans-62.2-44.8178.61700000110.8G171 Y172 G177 L178 I179G171-V175 WeakPolarHBondContact O-CB 3.36Å; G171-V175 VanDerWaalsContact O-CG2 3.31Å; G171-V175 WeakPolarHBondContact O-CG2 3.29Å; G171-V175 PolarHBondContact O-N 2.97Å; Y172-V175 PolarHBondContact O-N 3.34Å; V175-G177 VanDerWaalsContact C-N 3.33Å; V175-G177 PolarHBondContact O-N 3.28Å; V175-L178 PolarHBondContact O-N 3.5Å; V175-I179 HydrophobicContact CG1-CD1 3.94Å; V175-I179 VanDerWaalsContact O-CG1 3.3Å; V175-I179 WeakPolarHBondContact O-CG1 3.41Å; V175-I179 PolarHBondContact O-N 3.31Å
176L97.9Very high95.1Very high47 Ų4771.3 Ų71.325%0.24637%0.365CS..Hα-helixtrans-63.1-40.9177.5-172.664.6000111.8I157 Y172 F174 S180 L204I157-L176 HydrophobicContact CD1-CD2 4.26Å; I157-L176 HydrophobicContact CG1-CD2 4.23Å; I157-L176 HydrophobicContact CG2-CD2 3.84Å; Y172-L176 WeakPolarHBondContact O-CB 3.29Å; Y172-L176 PolarHBondContact O-N 3.33Å; F174-L176 PolarHBondContact O-N 2.86Å; L176-S180 PolarHBondContact O-N 3.32Å; L176-S180 VanDerWaalsContact O-N 3.08Å; L176-L204 HydrophobicContact CB-CD1 3.81Å; L176-L204 HydrophobicContact CD2-CD1 3.81Å; L176-L204 HydrophobicContact CD2-CD2 4.27Å; L176-L204 HydrophobicContact CG-CD1 3.7Å
177G97.3Very high95.1Very high12 Ų1271 Ų7112%0.12435%0.352CS..Hα-helixtrans-64.5-41174.400000112.6Y173 F174 V175 S180 F181 W201Y173-G177 PolarHBondContact O-N 3.35Å; F174-G177 PolarHBondContact O-N 3.49Å; V175-G177 VanDerWaalsContact C-N 3.33Å; V175-G177 PolarHBondContact O-N 3.28Å; G177-S180 PolarHBondContact O-N 3.05Å; G177-F181 WeakPolarHBondContact O-CB 3.18Å; G177-F181 PolarHBondContact O-N 3.47Å; G177-W201 WeakPolarHBondContact O-CB 3.23Å
178L97.1Very high94.9Very high86 Ų8667.2 Ų67.245%0.4534%0.344SS..Hα-helixtrans-64.1-44.6177.4-175.963000111.3F174 V175 S180 F181 T182F174-L178 HydrophobicContact CE1-CD2 4.31Å; F174-L178 WeakPolarHBondContact O-CB 3.24Å; F174-L178 PolarHBondContact O-N 2.96Å; V175-L178 PolarHBondContact O-N 3.5Å; L178-S180 VanDerWaalsContact C-N 3.33Å; L178-S180 PolarHBondContact O-N 2.97Å; L178-F181 PolarHBondContact O-N 3.48Å; L178-T182 WeakPolarHBondContact O-CB 3.14Å; L178-T182 PolarHBondContact O-N 3.25Å; L178-T182 PolarHBondContact O-OG1 3.05Å
179I97.8Very high94.4Very high107 Ų10763.1 Ų63.155%0.54933%0.333SS..Hα-helixtrans-58.3-47.2175.2-68.3164.8000110.5V175 T182 F183V175-I179 HydrophobicContact CG1-CD1 3.94Å; V175-I179 VanDerWaalsContact O-CG1 3.3Å; V175-I179 WeakPolarHBondContact O-CG1 3.41Å; V175-I179 PolarHBondContact O-N 3.31Å; I179-T182 PolarHBondContact O-N 3.44Å; I179-F183 WeakPolarHBondContact O-CB 3.3Å; I179-F183 PolarHBondContact O-N 3.3Å
180S97.3Very high93.6Very high6 Ų665.7 Ų65.74%0.04235%0.346CS..Hα-helixtrans-61.9-42.8177.71760000112.3L176 G177 L178 F183 Y184 F197 I200 W201L176-S180 PolarHBondContact O-N 3.32Å; L176-S180 VanDerWaalsContact O-N 3.08Å; G177-S180 PolarHBondContact O-N 3.05Å; L178-S180 VanDerWaalsContact C-N 3.33Å; L178-S180 PolarHBondContact O-N 2.97Å; S180-F183 WeakPolarHBondContact O-CB 3.49Å; S180-F183 PolarHBondContact O-N 3.11Å; S180-Y184 PolarHBondContact O-N 3.14Å; S180-F197 WeakPolarHBondContact CB-O 3.45Å; S180-F197 PolarHBondContact OG-O 3.49Å; S180-I200 WeakPolarHBondContact OG-CB 3.47Å; S180-I200 PolarHBondContact OG-N 3.28Å; S180-W201 PolarHBondContact OG-N 3.05Å
181F95.6Very high93.2Very high79 Ų7964.7 Ų64.735%0.34635%0.346SS..Hα-helixtrans-67.6-43.5178.3-178.4-98.9000112.2G177 L178 F183 Y184 S185 W201G177-F181 WeakPolarHBondContact O-CB 3.18Å; G177-F181 PolarHBondContact O-N 3.47Å; L178-F181 PolarHBondContact O-N 3.48Å; F181-F183 VanDerWaalsContact C-N 3.27Å; F181-F183 PolarHBondContact O-N 2.83Å; F181-Y184 VanDerWaalsContact O-CB 3.3Å; F181-Y184 WeakPolarHBondContact O-CB 3.39Å; F181-Y184 PolarHBondContact O-N 2.86Å; F181-Y184 VanDerWaalsContact O-N 3.11Å; F181-S185 PolarHBondContact O-N 2.89Å; F181-S185 PolarHBondContact O-OG 3.11Å; F181-W201 HydrophobicContact CB-CB 4.35Å; F181-W201 HydrophobicContact CB-CG 4.2Å; F181-W201 HydrophobicContact CD2-CD2 4.12Å; F181-W201 HydrophobicContact CD2-CG 4.43Å; F181-W201 HydrophobicContact CD2-CZ2 4.38Å
182T95.4Very high92.8Very high73 Ų7363.7 Ų63.745%0.44834%0.336SS..Hα-helixtrans-60.8-40.4173.6-58.40000110.9L178 I179 Y184 S185 I186L178-T182 WeakPolarHBondContact O-CB 3.14Å; L178-T182 PolarHBondContact O-N 3.25Å; L178-T182 PolarHBondContact O-OG1 3.05Å; I179-T182 PolarHBondContact O-N 3.44Å; T182-Y184 VanDerWaalsContact C-N 3.3Å; T182-Y184 PolarHBondContact O-N 3.37Å; T182-S185 PolarHBondContact O-N 2.9Å; T182-I186 PolarHBondContact O-N 3.48Å
183F94.9Very high92.3Very high79 Ų7962 Ų6235%0.34633%0.33SS..Hα-helixtrans-62.9-36.3175-169.4-117.4000112.5I179 S180 F181 I186 L187 F197 A198I179-F183 WeakPolarHBondContact O-CB 3.3Å; I179-F183 PolarHBondContact O-N 3.3Å; S180-F183 WeakPolarHBondContact O-CB 3.49Å; S180-F183 PolarHBondContact O-N 3.11Å; F181-F183 VanDerWaalsContact C-N 3.27Å; F181-F183 PolarHBondContact O-N 2.83Å; F183-I186 HydrophobicContact CD2-CD1 4.01Å; F183-I186 HydrophobicContact CD2-CG1 4.39Å; F183-I186 VanDerWaalsContact O-CG1 3.31Å; F183-I186 WeakPolarHBondContact O-CG1 3.37Å; F183-L187 HydrophobicContact CD1-CD1 3.9Å; F183-L187 HydrophobicContact CE1-CD1 3.5Å; F183-L187 HydrophobicContact CE1-CG 4.48Å; F183-L187 HydrophobicContact CE2-CD1 4.25Å; F183-L187 HydrophobicContact CE2-CG 4.41Å; F183-L187 HydrophobicContact CG-CD1 4.44Å; F183-L187 HydrophobicContact CZ-CD1 3.7Å; F183-L187 HydrophobicContact CZ-CD2 4.45Å; F183-L187 HydrophobicContact CZ-CG 4.29Å; F183-L187 WeakPolarHBondContact O-CG 3.24Å; F183-L187 PolarHBondContact O-N 2.79Å; F183-F197 HydrophobicContact CD1-CB 4.04Å; F183-F197 HydrophobicContact CE1-CB 3.94Å; F183-A198 HydrophobicContact CD1-CB 4.09Å
184Y92.9Very high91.8Very high33 Ų3362.1 Ų62.113%0.12933%0.33CS..Hα-helixtrans-62.7-44.8172.1-177.6-89.6000112.2S180 F181 T182 I186 L187 A192 A198S180-Y184 PolarHBondContact O-N 3.14Å; F181-Y184 VanDerWaalsContact O-CB 3.3Å; F181-Y184 WeakPolarHBondContact O-CB 3.39Å; F181-Y184 PolarHBondContact O-N 2.86Å; F181-Y184 VanDerWaalsContact O-N 3.11Å; T182-Y184 VanDerWaalsContact C-N 3.3Å; T182-Y184 PolarHBondContact O-N 3.37Å; Y184-I186 VanDerWaalsContact C-N 3.31Å; Y184-I186 PolarHBondContact O-N 3.41Å; Y184-L187 PolarHBondContact O-N 3.01Å; Y184-A192 HydrophobicContact CD2-CB 3.6Å; Y184-A192 HydrophobicContact CE2-CB 3.71Å; Y184-A192 HydrophobicContact CG-CB 4.11Å; Y184-A198 WeakPolarHBondContact CB-O 3.48Å; Y184-A198 HydrophobicContact CD2-CB 3.95Å; Y184-A198 HydrophobicContact CG-CB 4.46Å
185S92.3Very high91.5Very high77 Ų7756.4 Ų56.454%0.53831%0.308SS..Hα-helixtrans-69.4-22.7-176.4-57.50000114.7F181 T182F181-S185 PolarHBondContact O-N 2.89Å; F181-S185 PolarHBondContact O-OG 3.11Å; T182-S185 PolarHBondContact O-N 2.9Å
186I93.1Very high91.3Very high123 Ų12353 Ų5363%0.63129%0.287SS*.Hα-helixtrans-92.9-15.8179.964.1172.2000113.5T182 F183 Y184T182-I186 PolarHBondContact O-N 3.48Å; F183-I186 HydrophobicContact CD2-CD1 4.01Å; F183-I186 HydrophobicContact CD2-CG1 4.39Å; F183-I186 VanDerWaalsContact O-CG1 3.31Å; F183-I186 WeakPolarHBondContact O-CG1 3.37Å; Y184-I186 VanDerWaalsContact C-N 3.31Å; Y184-I186 PolarHBondContact O-N 3.41Å
187L88Confident91.2Very high44 Ų4456.9 Ų56.923%0.2330%0.302CS..SBendtrans-87.1150.7-179.4-77.9176.5000110.7F183 Y184 L189 V191 A192 A198F183-L187 HydrophobicContact CD1-CD1 3.9Å; F183-L187 HydrophobicContact CE1-CD1 3.5Å; F183-L187 HydrophobicContact CE1-CG 4.48Å; F183-L187 HydrophobicContact CE2-CD1 4.25Å; F183-L187 HydrophobicContact CE2-CG 4.41Å; F183-L187 HydrophobicContact CG-CD1 4.44Å; F183-L187 HydrophobicContact CZ-CD1 3.7Å; F183-L187 HydrophobicContact CZ-CD2 4.45Å; F183-L187 HydrophobicContact CZ-CG 4.29Å; F183-L187 WeakPolarHBondContact O-CG 3.24Å; F183-L187 PolarHBondContact O-N 2.79Å; Y184-L187 PolarHBondContact O-N 3.01Å; L187-L189 PolarHBondContact O-N 3.31Å; L187-V191 HydrophobicContact CD1-CG1 4.28Å; L187-V191 HydrophobicContact CD2-CG1 4.35Å; L187-A192 HydrophobicContact CB-CB 3.83Å; L187-A198 HydrophobicContact CD1-CB 4.28Å
188P88.1Confident91.1Very high85 Ų8556.3 Ų56.355%0.55230%0.296SS*.  trans-53.9138.8166.8-22.432.9000110.4E190 V191 A192P188-E190 PolarHBondContact O-N 3.14Å; P188-E190 VanDerWaalsContact O-N 3.12Å; P188-V191 HydrophobicContact CB-CG2 4.26Å; P188-V191 HydrophobicContact CG-CG2 4.41Å; P188-V191 PolarHBondContact O-N 3.01Å; P188-A192 WeakPolarHBondContact O-CB 3.33Å; P188-A192 PolarHBondContact O-N 3.16Å
189L82.3Confident90.9Very high84 Ų8452.2 Ų52.244%0.4428%0.275SS..Hα-helixtrans-51.6-42.2-172.4-179.562.1000112.7L187 V191 A192 F193 V297L187-L189 PolarHBondContact O-N 3.31Å; L189-V191 VanDerWaalsContact C-N 3.32Å; L189-V191 PolarHBondContact O-N 3.32Å; L189-A192 PolarHBondContact O-N 3.44Å; L189-F193 WeakPolarHBondContact O-CB 3.35Å; L189-F193 PolarHBondContact O-N 3.26Å; L189-V297 HydrophobicContact CD2-CG1 4.36Å
190E77.6Confident90.9Very high88 Ų8847.8 Ų47.841%0.41125%0.252SS..Hα-helixtrans-62.7-36.5179.4-65.6167.4-161.400113.5F128 P188 N194F128-E190 HydrophobicContact CD2-CG 4.08Å; F128-E190 HydrophobicContact CE2-CG 3.93Å; P188-E190 PolarHBondContact O-N 3.14Å; P188-E190 VanDerWaalsContact O-N 3.12Å; E190-N194 PolarHBondContact O-ND2 3.26Å
191V84.9Confident90.9Very high43 Ų4348.5 Ų48.526%0.26125%0.254SS..Hα-helixtrans-78.6-44.5177.7-178.30000109.7P120 L187 P188 L189 F193 N194 S195P120-V191 HydrophobicContact CB-CG2 4.19Å; P120-V191 HydrophobicContact CG-CG1 4.27Å; P120-V191 HydrophobicContact CG-CG2 4.16Å; L187-V191 HydrophobicContact CD1-CG1 4.28Å; L187-V191 HydrophobicContact CD2-CG1 4.35Å; P188-V191 HydrophobicContact CB-CG2 4.26Å; P188-V191 HydrophobicContact CG-CG2 4.41Å; P188-V191 PolarHBondContact O-N 3.01Å; L189-V191 VanDerWaalsContact C-N 3.32Å; L189-V191 PolarHBondContact O-N 3.32Å; V191-F193 VanDerWaalsContact C-N 3.32Å; V191-F193 PolarHBondContact O-N 3.19Å; V191-N194 PolarHBondContact O-N 3.15Å; V191-S195 WeakPolarHBondContact O-CB 3.44Å; V191-S195 PolarHBondContact O-N 2.72Å
192A88.6Confident90.9Very high1 Ų144.7 Ų44.71%0.00824%0.237CC..Hα-helixtrans-62.1-39.8-179.800000111.8Y184 L187 P188 L189 N194 S195 A198Y184-A192 HydrophobicContact CD2-CB 3.6Å; Y184-A192 HydrophobicContact CE2-CB 3.71Å; Y184-A192 HydrophobicContact CG-CB 4.11Å; L187-A192 HydrophobicContact CB-CB 3.83Å; P188-A192 WeakPolarHBondContact O-CB 3.33Å; P188-A192 PolarHBondContact O-N 3.16Å; L189-A192 PolarHBondContact O-N 3.44Å; A192-N194 VanDerWaalsContact C-N 3.34Å; A192-N194 PolarHBondContact O-N 3.25Å; A192-S195 PolarHBondContact O-N 2.86Å; A192-A198 HydrophobicContact CB-CB 4.44Å; A192-A198 WeakPolarHBondContact O-CB 3.32Å
193F85.3Confident91Very high10 Ų1041.2 Ų41.24%0.04422%0.216CC..Hα-helixtrans-62.8-38.7-178.4-172.8-99.5000112.9Y37 Y127 W142 L189 V191 R199Y37-F193 HydrophobicContact CD2-CE2 4.05Å; Y127-F193 HydrophobicContact CE1-CD1 4.26Å; Y127-F193 HydrophobicContact CE1-CE1 4.15Å; W142-F193 AromaticContact CE2-CE1 3.99Å; W142-F193 AromaticContact CH2-CD1 3.81Å; W142-F193 HydrophobicContact CH2-CD1 3.81Å; W142-F193 AromaticContact CH2-CE1 3.42Å; W142-F193 HydrophobicContact CH2-CE1 3.42Å; W142-F193 VanDerWaalsContact CH2-CE1 3.42Å; W142-F193 AromaticContact CH2-CZ 3.91Å; W142-F193 HydrophobicContact CH2-CZ 3.91Å; W142-F193 AromaticContact CZ2-CD1 3.93Å; W142-F193 HydrophobicContact CZ2-CD1 3.93Å; W142-F193 AromaticContact CZ2-CE1 3.18Å; W142-F193 HydrophobicContact CZ2-CE1 3.18Å; W142-F193 AromaticContact CZ2-CZ 3.75Å; W142-F193 HydrophobicContact CZ2-CZ 3.75Å; W142-F193 HydrophobicContact CZ3-CD1 4.43Å; W142-F193 HydrophobicContact CZ3-CE1 4.41Å; W142-F193 VanDerWaalsContact CZ3-O 3.29Å; W142-F193 WeakPolarHBondContact CZ3-O 3.32Å; L189-F193 WeakPolarHBondContact O-CB 3.35Å; L189-F193 PolarHBondContact O-N 3.26Å; V191-F193 VanDerWaalsContact C-N 3.32Å; V191-F193 PolarHBondContact O-N 3.19Å; F193-R199 VanDerWaalsContact CE2-NH2 3.31Å; F193-R199 PolarHBondContact O-NE 3.32Å
194N87.4Confident91.1Very high5 Ų537.6 Ų37.63%0.02720%0.2CC..Hα-helixtrans-96-12.7-177.1-64.3-46.9000113.7N118 W142 V146 E190 V191 A192N118-N194 WeakPolarHBondContact CB-O 3.29Å; N118-N194 PolarHBondContact ND2-O 3.2Å; N118-N194 WeakPolarHBondContact O-CB 3.22Å; W142-N194 VanDerWaalsContact CD2-OD1 3.27Å; W142-N194 HydrophobicContact CE3-CB 4.34Å; W142-N194 VanDerWaalsContact CE3-OD1 3.24Å; V146-N194 VanDerWaalsContact CG2-O 3.3Å; V146-N194 WeakPolarHBondContact CG2-O 3.43Å; E190-N194 PolarHBondContact O-ND2 3.26Å; V191-N194 PolarHBondContact O-N 3.15Å; A192-N194 VanDerWaalsContact C-N 3.34Å; A192-N194 PolarHBondContact O-N 3.25Å
195S91.1Very high91.3Very high21 Ų2137.9 Ų37.915%0.14720%0.203CC..  trans-76.9125.4-177171.20000112.2V191 A192 F197 A198 R199V191-S195 WeakPolarHBondContact O-CB 3.44Å; V191-S195 PolarHBondContact O-N 2.72Å; A192-S195 PolarHBondContact O-N 2.86Å; S195-F197 VanDerWaalsContact C-N 3.35Å; S195-F197 PolarHBondContact O-N 3.46Å; S195-F197 PolarHBondContact OG-N 3.31Å; S195-A198 PolarHBondContact O-N 3.45Å; S195-A198 PolarHBondContact OG-N 3.16Å; S195-R199 WeakPolarHBondContact O-CB 3.34Å; S195-R199 WeakPolarHBondContact O-CG 2.92Å; S195-R199 PolarHBondContact O-N 2.96Å
196L93.7Very high91.3Very high10 Ų1034.2 Ų34.25%0.05218%0.177CC..Hα-helixtrans-53-52.8171.6166.264.8000111.3V146 Q149 F150 I153 A198 R199 I200V146-L196 HydrophobicContact CG1-CB 4.42Å; V146-L196 HydrophobicContact CG1-CD1 4.1Å; Q149-L196 HydrophobicContact CB-CD2 3.66Å; F150-L196 HydrophobicContact CB-CD1 3.78Å; F150-L196 HydrophobicContact CD2-CD1 4.45Å; I153-L196 HydrophobicContact CD1-CD1 4.43Å; I153-L196 HydrophobicContact CD1-CD2 4.06Å; L196-A198 VanDerWaalsContact C-N 3.26Å; L196-A198 PolarHBondContact O-N 3.26Å; L196-R199 CarbonylContact O-C 3.58Å; L196-R199 PolarHBondContact O-N 3.02Å; L196-I200 HydrophobicContact CD1-CG1 4.18Å; L196-I200 HydrophobicContact CG-CG1 4.44Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 2.84Å
197F94.7Very high91.4Very high128 Ų12828.3 Ų28.356%0.56115%0.147SC*.Hα-helixtrans-64.7-32.7-171.9-61.8-67.7000112.5S180 F183 S195 R199 I200S180-F197 WeakPolarHBondContact CB-O 3.45Å; S180-F197 PolarHBondContact OG-O 3.49Å; F183-F197 HydrophobicContact CD1-CB 4.04Å; F183-F197 HydrophobicContact CE1-CB 3.94Å; S195-F197 VanDerWaalsContact C-N 3.35Å; S195-F197 PolarHBondContact O-N 3.46Å; S195-F197 PolarHBondContact OG-N 3.31Å; F197-R199 PolarHBondContact O-N 3.27Å; F197-I200 HydrophobicContact CD1-CD1 3.97Å
198A94.3Very high91.7Very high0 Ų028.3 Ų28.30%015%0.149CC..Hα-helixtrans-74.1-16.1174.900000112.7F183 Y184 L187 A192 S195 L196 W201F183-A198 HydrophobicContact CD1-CB 4.09Å; Y184-A198 WeakPolarHBondContact CB-O 3.48Å; Y184-A198 HydrophobicContact CD2-CB 3.95Å; Y184-A198 HydrophobicContact CG-CB 4.46Å; L187-A198 HydrophobicContact CD1-CB 4.28Å; A192-A198 HydrophobicContact CB-CB 4.44Å; A192-A198 WeakPolarHBondContact O-CB 3.32Å; S195-A198 PolarHBondContact O-N 3.45Å; S195-A198 PolarHBondContact OG-N 3.16Å; L196-A198 VanDerWaalsContact C-N 3.26Å; L196-A198 PolarHBondContact O-N 3.26Å; A198-W201 PolarHBondContact O-NE1 3.46Å; A198-W201 VanDerWaalsContact O-NE1 3.12Å
199R94.8Very high91.9Very high1 Ų126.1 Ų26.10%0.00413%0.132CC..Hα-helixtrans-110.1-6.7-174.9-60.4-67.4-118.715513.7113.7D41 F44 F193 S195 L196 F197 W201 Q202D41-R199 IonicContact OD1-CZ 2.72Å; D41-R199 IonicContact OD1-NH1 2.8Å; D41-R199 PolarHBondContact OD1-NH1 3.29Å; D41-R199 IonicContact OD1-NH2 2.86Å; D41-R199 PolarHBondContact OD1-NH2 3.43Å; D41-R199 IonicContact OD2-NH1 3.62Å; F44-R199 HydrophobicContact CD2-CB 4.31Å; F44-R199 HydrophobicContact CE2-CB 4.26Å; F44-R199 HydrophobicContact CE2-CG 4.38Å; F193-R199 VanDerWaalsContact CE2-NH2 3.31Å; F193-R199 PolarHBondContact O-NE 3.32Å; S195-R199 WeakPolarHBondContact O-CB 3.34Å; S195-R199 WeakPolarHBondContact O-CG 2.92Å; S195-R199 PolarHBondContact O-N 2.96Å; L196-R199 CarbonylContact O-C 3.58Å; L196-R199 PolarHBondContact O-N 3.02Å; F197-R199 PolarHBondContact O-N 3.27Å; R199-W201 PolarHBondContact O-N 3.29Å; R199-W201 VanDerWaalsContact O-N 3.1Å; R199-Q202 VanDerWaalsContact CD-OE1 3.25Å; R199-Q202 WeakPolarHBondContact O-CB 3.3Å; R199-Q202 PolarHBondContact O-N 3.37Å; R199-Q202 PolarHBondContact O-OE1 2.85Å
200I96.8Very high92.4Very high14 Ų1423.1 Ų23.17%0.07212%0.115CC..Hα-helixtrans-49.5-39.2177.5-77.3170.7000112I153 S180 L196 F197 Q202 F203 L204I153-I200 HydrophobicContact CD1-CD1 3.78Å; I153-I200 HydrophobicContact CD1-CG1 4.25Å; S180-I200 WeakPolarHBondContact OG-CB 3.47Å; S180-I200 PolarHBondContact OG-N 3.28Å; L196-I200 HydrophobicContact CD1-CG1 4.18Å; L196-I200 HydrophobicContact CG-CG1 4.44Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 2.84Å; F197-I200 HydrophobicContact CD1-CD1 3.97Å; I200-Q202 PolarHBondContact O-N 2.79Å; I200-Q202 VanDerWaalsContact O-N 3.12Å; I200-F203 PolarHBondContact O-N 3.43Å; I200-F203 VanDerWaalsContact O-N 3.09Å; I200-L204 HydrophobicContact CG2-CD1 3.63Å; I200-L204 HydrophobicContact CG2-CD2 4.39Å; I200-L204 HydrophobicContact CG2-CG 3.76Å; I200-L204 WeakPolarHBondContact O-CG 3.44Å; I200-L204 PolarHBondContact O-N 3.38Å
201W96.9Very high92.9Very high20 Ų2019.4 Ų19.48%0.07610%0.098CC..Hα-helixtrans-53.7-34-179.768.6-90.4000113.8G177 S180 F181 A198 R199 L204 I205G177-W201 WeakPolarHBondContact O-CB 3.23Å; S180-W201 PolarHBondContact OG-N 3.05Å; F181-W201 HydrophobicContact CB-CB 4.35Å; F181-W201 HydrophobicContact CB-CG 4.2Å; F181-W201 HydrophobicContact CD2-CD2 4.12Å; F181-W201 HydrophobicContact CD2-CG 4.43Å; F181-W201 HydrophobicContact CD2-CZ2 4.38Å; A198-W201 PolarHBondContact O-NE1 3.46Å; A198-W201 VanDerWaalsContact O-NE1 3.12Å; R199-W201 PolarHBondContact O-N 3.29Å; R199-W201 VanDerWaalsContact O-N 3.1Å; W201-L204 PolarHBondContact O-N 3.1Å; W201-I205 HydrophobicContact CE3-CD1 3.51Å; W201-I205 HydrophobicContact CZ3-CD1 3.61Å; W201-I205 WeakPolarHBondContact O-CG1 3.49Å; W201-I205 PolarHBondContact O-N 3.11Å
202Q95.8Very high93.1Very high0 Ų022.4 Ų22.40%011%0.109CC..Hα-helixtrans-69-45.8179-63.8161.7-50.100111.1D41 F44 V45 R199 I200 L204 I205 G206D41-Q202 VanDerWaalsContact CB-NE2 3.27Å; D41-Q202 PolarHBondContact OD1-NE2 3.31Å; D41-Q202 PolarHBondContact OD2-NE2 3.39Å; F44-Q202 HydrophobicContact CB-CB 3.95Å; V45-Q202 WeakPolarHBondContact CA-O 3.45Å; V45-Q202 HydrophobicContact CG2-CB 4.15Å; V45-Q202 WeakPolarHBondContact CG2-O 3.44Å; R199-Q202 VanDerWaalsContact CD-OE1 3.25Å; R199-Q202 WeakPolarHBondContact O-CB 3.3Å; R199-Q202 PolarHBondContact O-N 3.37Å; R199-Q202 PolarHBondContact O-OE1 2.85Å; I200-Q202 PolarHBondContact O-N 2.79Å; I200-Q202 VanDerWaalsContact O-N 3.12Å; Q202-L204 VanDerWaalsContact C-N 3.29Å; Q202-L204 PolarHBondContact O-N 3.22Å; Q202-I205 PolarHBondContact O-N 3.18Å; Q202-G206 PolarHBondContact O-N 3.16Å
203F97.4Very high92.9Very high0 Ų025.2 Ų25.20%013%0.129CC..Hα-helixtrans-60.7-42174.4-63.8-88.2000111.1F44 G48 V146 F150 I200 I205 G206 M207F44-F203 HydrophobicContact CB-CD1 4.21Å; F44-F203 HydrophobicContact CB-CD2 4.08Å; F44-F203 HydrophobicContact CB-CE1 3.91Å; F44-F203 HydrophobicContact CB-CE2 3.76Å; F44-F203 HydrophobicContact CB-CG 4.3Å; F44-F203 HydrophobicContact CB-CZ 3.68Å; F44-F203 AromaticContact CD1-CE1 3.87Å; F44-F203 HydrophobicContact CD1-CE1 3.87Å; F44-F203 AromaticContact CD1-CE2 3.96Å; F44-F203 HydrophobicContact CD1-CE2 3.96Å; F44-F203 AromaticContact CD1-CZ 3.29Å; F44-F203 HydrophobicContact CD1-CZ 3.29Å; F44-F203 AromaticContact CD2-CE2 4Å; F44-F203 HydrophobicContact CD2-CE2 4Å; F44-F203 HydrophobicContact CD2-CZ 4.18Å; F44-F203 AromaticContact CE1-CZ 3.89Å; F44-F203 HydrophobicContact CE1-CZ 3.89Å; F44-F203 HydrophobicContact CG-CD2 4.44Å; F44-F203 HydrophobicContact CG-CE1 4.1Å; F44-F203 AromaticContact CG-CE2 3.65Å; F44-F203 HydrophobicContact CG-CE2 3.65Å; F44-F203 AromaticContact CG-CZ 3.45Å; F44-F203 HydrophobicContact CG-CZ 3.45Å; F44-F203 VanDerWaalsContact CG-CZ 3.45Å; F44-F203 WeakPolarHBondContact O-CD1 3.3Å; G48-F203 WeakPolarHBondContact CA-O 3.47Å; V146-F203 HydrophobicContact CG1-CE2 4.1Å; V146-F203 HydrophobicContact CG1-CZ 4.19Å; F150-F203 HydrophobicContact CB-CD1 4.36Å; F150-F203 HydrophobicContact CB-CE1 4.03Å; F150-F203 HydrophobicContact CB-CE2 4.21Å; F150-F203 HydrophobicContact CB-CZ 3.94Å; F150-F203 HydrophobicContact CD1-CB 4.2Å; F150-F203 AromaticContact CD1-CD1 3.24Å; F150-F203 HydrophobicContact CD1-CD1 3.24Å; F150-F203 HydrophobicContact CD1-CD2 4.46Å; F150-F203 AromaticContact CD1-CE1 3.58Å; F150-F203 HydrophobicContact CD1-CE1 3.58Å; F150-F203 AromaticContact CD1-CG 3.74Å; F150-F203 HydrophobicContact CD1-CG 3.74Å; F150-F203 HydrophobicContact CD1-CZ 4.31Å; F150-F203 HydrophobicContact CD2-CB 4Å; F150-F203 HydrophobicContact CD2-CD1 4.16Å; F150-F203 AromaticContact CD2-CD2 3.96Å; F150-F203 HydrophobicContact CD2-CD2 3.96Å; F150-F203 HydrophobicContact CD2-CE2 4.45Å; F150-F203 AromaticContact CD2-CG 3.79Å; F150-F203 HydrophobicContact CD2-CG 3.79Å; F150-F203 HydrophobicContact CE1-CB 3.73Å; F150-F203 AromaticContact CE1-CD1 3.45Å; F150-F203 HydrophobicContact CE1-CD1 3.45Å; F150-F203 VanDerWaalsContact CE1-CD1 3.45Å; F150-F203 HydrophobicContact CE1-CE1 4.24Å; F150-F203 AromaticContact CE1-CG 3.78Å; F150-F203 HydrophobicContact CE1-CG 3.78Å; F150-F203 HydrophobicContact CE2-CB 3.49Å; F150-F203 VanDerWaalsContact CE2-CB 3.49Å; F150-F203 HydrophobicContact CE2-CD1 4.32Å; F150-F203 HydrophobicContact CE2-CD2 4.32Å; F150-F203 AromaticContact CE2-CG 3.82Å; F150-F203 HydrophobicContact CE2-CG 3.82Å; F150-F203 HydrophobicContact CG-CB 4.33Å; F150-F203 AromaticContact CG-CD1 3.64Å; F150-F203 HydrophobicContact CG-CD1 3.64Å; F150-F203 HydrophobicContact CG-CD2 4.04Å; F150-F203 AromaticContact CG-CE1 3.82Å; F150-F203 HydrophobicContact CG-CE1 3.82Å; F150-F203 HydrophobicContact CG-CE2 4.2Å; F150-F203 AromaticContact CG-CG 3.75Å; F150-F203 HydrophobicContact CG-CG 3.75Å; F150-F203 HydrophobicContact CG-CZ 4.09Å; F150-F203 HydrophobicContact CZ-CB 3.35Å; F150-F203 HydrophobicContact CZ-CD1 4Å; F150-F203 AromaticContact CZ-CG 3.83Å; F150-F203 HydrophobicContact CZ-CG 3.83Å; I200-F203 PolarHBondContact O-N 3.43Å; I200-F203 VanDerWaalsContact O-N 3.09Å; F203-I205 PolarHBondContact O-N 3.46Å; F203-G206 WeakPolarHBondContact O-CA 3.46Å; F203-G206 PolarHBondContact O-N 2.9Å; F203-M207 WeakPolarHBondContact O-CG 3.47Å; F203-M207 PolarHBondContact O-N 2.83Å
204L97.4Very high92.7Very high3 Ų328.1 Ų28.12%0.01615%0.147CC..Hα-helixtrans-64.2-37.3179.6-65.3-176.9000113I157 Y173 L176 I200 W201 Q202 G206 M207 V208I157-L204 HydrophobicContact CG2-CD2 3.98Å; Y173-L204 HydrophobicContact CD1-CD2 3.98Å; L176-L204 HydrophobicContact CB-CD1 3.81Å; L176-L204 HydrophobicContact CD2-CD1 3.81Å; L176-L204 HydrophobicContact CD2-CD2 4.27Å; L176-L204 HydrophobicContact CG-CD1 3.7Å; I200-L204 HydrophobicContact CG2-CD1 3.63Å; I200-L204 HydrophobicContact CG2-CD2 4.39Å; I200-L204 HydrophobicContact CG2-CG 3.76Å; I200-L204 WeakPolarHBondContact O-CG 3.44Å; I200-L204 PolarHBondContact O-N 3.38Å; W201-L204 PolarHBondContact O-N 3.1Å; Q202-L204 VanDerWaalsContact C-N 3.29Å; Q202-L204 PolarHBondContact O-N 3.22Å; L204-G206 PolarHBondContact O-N 2.93Å; L204-M207 HydrophobicContact CD2-SD 3.7Å; L204-M207 PolarHBondContact O-N 3.41Å; L204-M207 VanDerWaalsContact O-N 3.16Å; L204-V208 WeakPolarHBondContact O-CG2 3.4Å; L204-V208 PolarHBondContact O-N 3.17Å
205I96.2Very high91.5Very high38 Ų3832.6 Ų32.620%0.19517%0.171CC..Hα-helixtrans-55.1-46.5171-71165.9000109.7V45 W201 Q202 F203 M207 V208 I209 V285V45-I205 HydrophobicContact CG1-CB 4.24Å; V45-I205 HydrophobicContact CG1-CG2 3.86Å; W201-I205 HydrophobicContact CE3-CD1 3.51Å; W201-I205 HydrophobicContact CZ3-CD1 3.61Å; W201-I205 WeakPolarHBondContact O-CG1 3.49Å; W201-I205 PolarHBondContact O-N 3.11Å; Q202-I205 PolarHBondContact O-N 3.18Å; F203-I205 PolarHBondContact O-N 3.46Å; I205-M207 PolarHBondContact O-N 3.4Å; I205-V208 PolarHBondContact O-N 3.24Å; I205-I209 HydrophobicContact CG2-CD1 3.72Å; I205-I209 HydrophobicContact CG2-CG1 4.38Å; I205-I209 VanDerWaalsContact O-CG1 3.25Å; I205-I209 WeakPolarHBondContact O-CG1 3.32Å; I205-I209 PolarHBondContact O-N 3.15Å; I205-V285 HydrophobicContact CD1-CG1 4.12Å
206G93.9Very high89.4Confident0 Ų037.3 Ų37.30%020%0.201CC..Hα-helixtrans-58.9-44.8176.300000113.2V45 F49 Q202 F203 L204 I209 Y210V45-G206 VanDerWaalsContact O-CA 3.28Å; V45-G206 WeakPolarHBondContact O-CA 3.41Å; F49-G206 VanDerWaalsContact CA-O 3.29Å; F49-G206 WeakPolarHBondContact CA-O 3.22Å; F49-G206 WeakPolarHBondContact CB-O 3.08Å; Q202-G206 PolarHBondContact O-N 3.16Å; F203-G206 WeakPolarHBondContact O-CA 3.46Å; F203-G206 PolarHBondContact O-N 2.9Å; L204-G206 PolarHBondContact O-N 2.93Å; G206-I209 PolarHBondContact O-N 3.41Å; G206-Y210 PolarHBondContact O-N 3.35Å; G206-Y210 VanDerWaalsContact O-N 3.09Å
207M95.1Very high86.7Confident0 Ų041.7 Ų41.70%023%0.233CC..Hα-helixtrans-61.1-46.1176.7-60.8-175.565.100111.6G48 C52 F150 V154 I157 F158 Y173 F203 L204 I205 Y210 L211G48-M207 WeakPolarHBondContact O-CG 3.18Å; C52-M207 HydrophobicContact CB-CB 3.98Å; C52-M207 HydrophobicContact CB-CE 4.32Å; C52-M207 HydrophobicContact CB-CG 3.92Å; F150-M207 HydrophobicContact CZ-SD 4.2Å; V154-M207 HydrophobicContact CG2-CE 4.03Å; V154-M207 HydrophobicContact CG2-SD 3.84Å; I157-M207 HydrophobicContact CG2-CE 4.46Å; I157-M207 HydrophobicContact CG2-SD 4.41Å; F158-M207 HydrophobicContact CB-CE 4.12Å; F158-M207 HydrophobicContact CD2-CE 3.93Å; Y173-M207 HydrophobicContact CE1-CE 3.78Å; Y173-M207 HydrophobicContact CE1-SD 4.34Å; F203-M207 WeakPolarHBondContact O-CG 3.47Å; F203-M207 PolarHBondContact O-N 2.83Å; L204-M207 HydrophobicContact CD2-SD 3.7Å; L204-M207 PolarHBondContact O-N 3.41Å; L204-M207 VanDerWaalsContact O-N 3.16Å; I205-M207 PolarHBondContact O-N 3.4Å; M207-Y210 PolarHBondContact O-N 2.99Å; M207-L211 VanDerWaalsContact O-CG 3.31Å; M207-L211 WeakPolarHBondContact O-CG 3.47Å; M207-L211 PolarHBondContact O-N 2.97Å
208V94.4Very high84Confident44 Ų4445.7 Ų45.727%0.26725%0.25SC..Hα-helixtrans-63.7-42.6179.61700000111.4Y170 Y173 L204 I205 Y210 L211 H212Y170-V208 HydrophobicContact CD1-CG1 4.11Å; Y170-V208 HydrophobicContact CE1-CG1 4.29Å; Y173-V208 HydrophobicContact CD2-CG2 4.36Å; Y173-V208 HydrophobicContact CG-CG2 4.17Å; L204-V208 WeakPolarHBondContact O-CG2 3.4Å; L204-V208 PolarHBondContact O-N 3.17Å; I205-V208 PolarHBondContact O-N 3.24Å; V208-Y210 VanDerWaalsContact C-N 3.3Å; V208-Y210 PolarHBondContact O-N 3.48Å; V208-L211 PolarHBondContact O-N 2.79Å; V208-H212 WeakPolarHBondContact O-CB 3.44Å; V208-H212 PolarHBondContact O-N 3.19Å
209I92.3Very high80.9Confident39 Ų3950.8 Ų50.820%0.229%0.285CS..Hα-helixtrans-58.2-45.5175.6-70.5169000110.4V45 F49 I205 G206 H212 S213 M282V45-I209 HydrophobicContact CG1-CD1 4.44Å; F49-I209 HydrophobicContact CD2-CB 4.44Å; F49-I209 HydrophobicContact CD2-CG2 4.02Å; F49-I209 HydrophobicContact CE2-CG2 4.17Å; I205-I209 HydrophobicContact CG2-CD1 3.72Å; I205-I209 HydrophobicContact CG2-CG1 4.38Å; I205-I209 VanDerWaalsContact O-CG1 3.25Å; I205-I209 WeakPolarHBondContact O-CG1 3.32Å; I205-I209 PolarHBondContact O-N 3.15Å; G206-I209 PolarHBondContact O-N 3.41Å; I209-H212 PolarHBondContact O-N 2.94Å; I209-S213 PolarHBondContact O-N 3.11Å; I209-M282 HydrophobicContact CD1-CB 4.07Å; I209-M282 HydrophobicContact CD1-CG 3.67Å
210Y90.8Very high77.9Confident21 Ų2154 Ų548%0.08232%0.319CS..Hα-helixtrans-61.7-49.8176.4175.2-100.1000112F49 C52 M53 T56 G206 M207 V208 H212 S213 V214F49-Y210 HydrophobicContact CD2-CD2 4.47Å; F49-Y210 HydrophobicContact CE1-CD2 4.24Å; F49-Y210 AromaticContact CE2-CD2 3.94Å; F49-Y210 HydrophobicContact CE2-CD2 3.94Å; F49-Y210 HydrophobicContact CE2-CG 4.35Å; F49-Y210 AromaticContact CZ-CD2 3.81Å; F49-Y210 HydrophobicContact CZ-CD2 3.81Å; C52-Y210 HydrophobicContact CB-CD1 3.84Å; C52-Y210 HydrophobicContact CB-CG 4.27Å; C52-Y210 VanDerWaalsContact SG-CD1 3.6Å; M53-Y210 HydrophobicContact CB-CD2 3.76Å; M53-Y210 HydrophobicContact CB-CE1 4.25Å; M53-Y210 HydrophobicContact CB-CE2 3.46Å; M53-Y210 VanDerWaalsContact CB-CE2 3.46Å; M53-Y210 HydrophobicContact CB-CG 4.27Å; M53-Y210 HydrophobicContact CG-CD2 4.2Å; M53-Y210 HydrophobicContact CG-CE2 3.48Å; M53-Y210 VanDerWaalsContact CG-CE2 3.48Å; M53-Y210 HydrophobicContact SD-CE2 4.48Å; T56-Y210 HydrophobicContact CG2-CE1 4.12Å; T56-Y210 WeakPolarHBondContact OG1-CE1 3.47Å; G206-Y210 PolarHBondContact O-N 3.35Å; G206-Y210 VanDerWaalsContact O-N 3.09Å; M207-Y210 PolarHBondContact O-N 2.99Å; V208-Y210 VanDerWaalsContact C-N 3.3Å; V208-Y210 PolarHBondContact O-N 3.48Å; Y210-H212 PolarHBondContact O-N 2.87Å; Y210-S213 WeakPolarHBondContact O-CB 3.4Å; Y210-S213 PolarHBondContact O-N 2.69Å; Y210-S213 PolarHBondContact O-OG 3.04Å; Y210-V214 HydrophobicContact CD2-CG2 4.19Å; Y210-V214 HydrophobicContact CE1-CG2 4.08Å; Y210-V214 HydrophobicContact CE2-CG2 3.57Å; Y210-V214 PolarHBondContact O-N 3.27Å
211L89.4Confident74.5Confident9 Ų961 Ų615%0.04736%0.357CS..Hα-helixtrans-60.6-33.7-179.7-70.1171.5000112.7Y173 M207 V208 N215Y173-L211 HydrophobicContact CD2-CD1 3.99Å; Y173-L211 HydrophobicContact CE2-CD1 3.37Å; M207-L211 VanDerWaalsContact O-CG 3.31Å; M207-L211 WeakPolarHBondContact O-CG 3.47Å; M207-L211 PolarHBondContact O-N 2.97Å; V208-L211 PolarHBondContact O-N 2.79Å; L211-N215 PolarHBondContact O-N 2.93Å; L211-N215 PolarHBondContact O-ND2 3.06Å
212H88.6Confident71.6Confident106 Ų10666 Ų6649%0.49140%0.395SS..Hα-helixtrans-71.1-39.3174.1-163.475.2000111.6V208 I209 Y210 V214 N215 F278V208-H212 WeakPolarHBondContact O-CB 3.44Å; V208-H212 PolarHBondContact O-N 3.19Å; I209-H212 PolarHBondContact O-N 2.94Å; Y210-H212 PolarHBondContact O-N 2.87Å; H212-V214 PolarHBondContact O-N 3.31Å; H212-N215 PolarHBondContact O-N 2.94Å; H212-F278 AromaticContact CD2-CE1 3.9Å
213S85.6Confident68.2Low60 Ų6070.4 Ų70.442%0.4243%0.425SS..Hα-helixtrans-65.8-22.517975.40000114.2I209 Y210I209-S213 PolarHBondContact O-N 3.11Å; Y210-S213 WeakPolarHBondContact O-CB 3.4Å; Y210-S213 PolarHBondContact O-N 2.69Å; Y210-S213 PolarHBondContact O-OG 3.04Å
214V80.8Confident64.9Low71 Ų7175 Ų7543%0.4346%0.457SS..THydrogen-bonded Turntrans-102.7-4.7-177.3-179.20000113Y210 H212 P216Y210-V214 HydrophobicContact CD2-CG2 4.19Å; Y210-V214 HydrophobicContact CE1-CG2 4.08Å; Y210-V214 HydrophobicContact CE2-CG2 3.57Å; Y210-V214 PolarHBondContact O-N 3.27Å; H212-V214 PolarHBondContact O-N 3.31Å; V214-P216 VanDerWaalsContact C-CD 3.46Å; V214-P216 WeakPolarHBondContact O-CD 3.41Å
215N62.4Low61.4Low99 Ų9985.2 Ų85.253%0.52950%0.497SS..  trans-95.689174.1-86.1-53.5000111.1Y170 L211 H212 S217Y170-N215 PolarHBondContact OH-ND2 3.37Å; Y170-N215 VanDerWaalsContact OH-ND2 3.16Å; L211-N215 PolarHBondContact O-N 2.93Å; L211-N215 PolarHBondContact O-ND2 3.06Å; H212-N215 PolarHBondContact O-N 2.94Å; N215-S217 PolarHBondContact O-N 3.02Å; N215-S217 VanDerWaalsContact O-N 3.07Å
216P46.3Very low58.4Low121 Ų12192.3 Ų92.379%0.78653%0.527SS*.  trans-69109.1164.328.4-30.9000108V214 K218V214-P216 VanDerWaalsContact C-CD 3.46Å; V214-P216 WeakPolarHBondContact O-CD 3.41Å; P216-K218 PolarHBondContact O-N 3.09Å
217S36.3Very low55.2Low102 Ų10299.4 Ų99.471%0.71356%0.564SS**  trans-49.3135.9160.9177.80000109.3N215 S219N215-S217 PolarHBondContact O-N 3.02Å; N215-S217 VanDerWaalsContact O-N 3.07Å; S217-S219 PolarHBondContact O-N 3.21Å
218K38Very low52Low212 Ų212105.9 Ų105.992%0.92260%0.598SS**  trans-50.787.4156.8-69.8173.2175.4177.10108.9P216P216-K218 PolarHBondContact O-N 3.09Å
219S29.9Very low49Very low106 Ų106112.8 Ų112.874%0.74163%0.627SS**  trans-112.290.1168.8-172.90000107.8S217 N221S217-S219 PolarHBondContact O-N 3.21Å; S219-N221 PolarHBondContact O-N 3.09Å
220G31.8Very low46.1Very low70 Ų70116.8 Ų116.872%0.72265%0.654SS**  trans-64.1110.2163.200000108.9
221N24.2Very low43.1Very low161 Ų161120.1 Ų120.186%0.86169%0.686SS**  trans-171.6121.7131.5-104.5-14.9000109.8S219 S223S219-N221 PolarHBondContact O-N 3.09Å; N221-S223 PolarHBondContact O-N 2.83Å
222S36.6Very low40.3Very low125 Ų125128 Ų12887%0.87472%0.722SS**  trans-60119.8166.3-173.50000109.4
223S25.8Very low37.4Very low91 Ų91130.4 Ų130.464%0.63674%0.738SS**  trans-156.492.9150.3-157.80000110.2N221N221-S223 PolarHBondContact O-N 2.83Å
224S28.1Very low35Very low96 Ų96131.4 Ų131.467%0.67176%0.759SS**  trans21.3109.9134.5-143.20000117.6
225Y24Very low32.5Very low219 Ų219137 Ų13786%0.85978%0.78SS**  trans-12887.2145.4-65.1-75.1000108.7L227Y225-L227 PolarHBondContact O-N 3.18Å
226K31.2Very low30.9Very low186 Ų186138.2 Ų138.281%0.80980%0.796SS**  trans-51.7106.7162-170.3-179.9-168.1179.60109.7
227L27.5Very low29.9Very low149 Ų149140.6 Ų140.678%0.7880%0.797SS**  trans-177.3103.9164.1-94.4162.1000103.9Y225Y225-L227 PolarHBondContact O-N 3.18Å
228L28.2Very low29.4Very low137 Ų137145.4 Ų145.472%0.71781%0.805SS**  cis-155.793.931.1-74.3150.9000107.8T230L228-T230 PolarHBondContact O-N 3.01Å
229E31.3Very low28.9Very low189 Ų189138.7 Ų138.788%0.88378%0.781SS**  trans-75.268.5152.9-85.1-173.9150.300107.6
230T30.8Very low28.6Very low123 Ų123139.1 Ų139.176%0.75578%0.784SS**  trans-165.971.5167.4-7.70000110.7L228L228-T230 PolarHBondContact O-N 3.01Å
231A29.3Very low28.4Very low91 Ų91142 Ų14275%0.75278%0.783SS**SBendtrans-178.388.8143.100000109.5
232E28.9Very low28.7Very low175 Ų175138.4 Ų138.482%0.81877%0.766SS**  trans62.1111.4139.9-67.2-179149.200120.9
233N28Very low28.5Very low155 Ų155136 Ų13683%0.82974%0.743SS**  trans82.9103.6144.9-60.4-19.1000116.8
234G36.2Very low28.7Very low82 Ų82134.2 Ų134.285%0.84573%0.727SS**  trans-66.8131.9-178.600000113.2
235E27.2Very low28.7Very low189 Ų189133.3 Ų133.388%0.88371%0.711SS**  trans-150.6137144-106.2172.7-164.900107.2E237E235-E237 PolarHBondContact O-N 2.97Å
236S28.9Very low28.9Very low124 Ų124127.3 Ų127.387%0.86770%0.701SS**  trans-71.399.3-173.7-174.60000110.4K238S236-K238 PolarHBondContact O-N 3.41Å
237E25.8Very low29Very low170 Ų170125.5 Ų125.579%0.79470%0.696SS**  trans-71.9108.3173.7-86.1-172.8153.500111.5E235 V239E235-E237 PolarHBondContact O-N 2.97Å; E237-V239 HydrophobicContact CB-CG2 4.39Å; E237-V239 PolarHBondContact O-N 3.11Å
238K26.5Very low29.2Very low203 Ų203125.6 Ų125.688%0.88370%0.697SS**  trans-80.2101.4163-89.3178.7175.4173.10109.2S236 S240S236-K238 PolarHBondContact O-N 3.41Å; K238-S240 PolarHBondContact O-N 3.2Å
239V26.5Very low29.5Very low71 Ų71127.9 Ų127.943%0.4370%0.704SS.*  trans-87.4100.8176.5-179.80000109.6E237 L241E237-V239 HydrophobicContact CB-CG2 4.39Å; E237-V239 PolarHBondContact O-N 3.11Å; V239-L241 HydrophobicContact CG1-CD2 3.59Å; V239-L241 HydrophobicContact CG1-CG 3.87Å
240S23.5Very low29.5Very low115 Ų115124.6 Ų124.680%0.80470%0.697SS**  trans-84.1117.9167.959.90000109.8K238K238-S240 PolarHBondContact O-N 3.2Å
241L28.2Very low29.3Very low131 Ų131127.6 Ų127.669%0.68670%0.702SS**  trans-104.274.2-174.1-67.3174.8000112.8V239V239-L241 HydrophobicContact CG1-CD2 3.59Å; V239-L241 HydrophobicContact CG1-CG 3.87Å
242V29.3Very low29.3Very low85 Ų85130.3 Ų130.352%0.51570%0.704SS.*  trans-153.1113.9158.5-168.80000110.3
243D32.6Very low29.2Very low74 Ų74130.6 Ų130.640%0.39671%0.705SS.*  172.3145.4123.3-86.1-41.9000105.6S6 R73S6-D243 VanDerWaalsContact CB-O 3.23Å; S6-D243 WeakPolarHBondContact CB-O 3.5Å; S6-D243 PolarHBondContact OG-O 3.37Å; R73-D243 IonicContact NH1-OD1 3.77Å
244D30.3Very low29.1Very low54 Ų54130.8 Ų130.829%0.28971%0.705SS.*  -175117.6102.1174.817.4000108K8K8-D244 HydrophobicContact CB-CB 4.11Å; K8-D244 WeakPolarHBondContact CB-OD2 3.43Å; K8-D244 WeakPolarHBondContact CD-OD2 3.38Å; K8-D244 WeakPolarHBondContact CE-OD2 3.2Å; K8-D244 HydrophobicContact CG-CB 3.96Å; K8-D244 WeakPolarHBondContact CG-OD2 3.33Å; K8-D244 IonicContact NZ-OD2 3.91Å
245F27.9Very low28.7Very low77 Ų77132.1 Ų132.134%0.33870%0.696SS.*SBend-152.4112.1129-81-80.8000107Q13 R77Q13-F245 HydrophobicContact CG-CE1 4.19Å; Q13-F245 HydrophobicContact CG-CZ 3.6Å; Q13-F245 VanDerWaalsContact NE2-CZ 3.28Å; R77-F245 VanDerWaalsContact CZ-CD2 3.43Å; R77-F245 VanDerWaalsContact NH2-CD1 3.33Å
246S29.6Very low28.8Very low93 Ų93130.5 Ų130.565%0.6569%0.693SS**  trans69.683.2175.669.30000115.9D248S246-D248 PolarHBondContact O-N 3.29Å
247E33Very low28.9Very low149 Ų149131.6 Ų131.670%0.69669%0.688SS**  trans-67.899.2144.1-74.9176.1-177.100107.5
248D30.3Very low29.3Very low151 Ų151128 Ų12881%0.80769%0.688SS**  trans-156125.8143.3-84.1-38.9000105.2S246S246-D248 PolarHBondContact O-N 3.29Å
249E35.3Very low29.5Very low184 Ų184126.9 Ų126.986%0.8668%0.683SS**  trans76.785.8171.4-52.8-176.5174.300118.6
250V31Very low29.9Very low121 Ų121128.3 Ų128.373%0.73369%0.694SS**  trans-154.377.4131.9-1690000108.6
251E27.3Very low30.4Very low185 Ų185129 Ų12986%0.86470%0.695SS**  trans-81.4144.2140.8-77.9-174164.100106.1
252D28.2Very low30.9Very low149 Ų149127.9 Ų127.980%0.79769%0.694SS**  trans84.481178.2-52.8-29.3000118
253E26.6Very low31.1Very low180 Ų180129.2 Ų129.284%0.84170%0.704SS**  -175.191.6123.4-105.7-176.7170.900109.7V255E253-V255 PolarHBondContact O-N 3.31Å
254I26.9Very low31.1Very low160 Ų160131.8 Ų131.882%0.82173%0.725SS**  trans-84.3102.9167.4-59.5176.3000107.3
255V27Very low31.1Very low109 Ų109133.3 Ų133.366%0.66175%0.745SS**  trans-97.9106.9161.1-179.70000107.5E253 I257E253-V255 PolarHBondContact O-N 3.31Å; V255-I257 HydrophobicContact CG1-CD1 4.47Å; V255-I257 HydrophobicContact CG1-CG1 4.2Å; V255-I257 PolarHBondContact O-N 3.02Å; V255-I257 VanDerWaalsContact O-N 3.11Å
256D29.6Very low31.1Very low155 Ų155135.5 Ų135.583%0.82977%0.767SS**  trans-62.2105.5175.5-101.8-35.4000110.6
257I31.9Very low31.5Very low148 Ų148136.2 Ų136.276%0.75977%0.772SS**  trans-120.8118.1165-57.1180000107.7V255 K259V255-I257 HydrophobicContact CG1-CD1 4.47Å; V255-I257 HydrophobicContact CG1-CG1 4.2Å; V255-I257 PolarHBondContact O-N 3.02Å; V255-I257 VanDerWaalsContact O-N 3.11Å; I257-K259 PolarHBondContact O-N 3.22Å
258A33.5Very low31.7Very low95 Ų95134.7 Ų134.779%0.78577%0.773SS**PPolyproline II helixtrans-47.9131.9-177.900000113P260A258-P260 WeakPolarHBondContact O-CD 3.21Å
259K30.9Very low32.1Very low179 Ų179136.8 Ų136.878%0.77877%0.771SS**PPolyproline II helixtrans-68.4116.2-173.7-174.1175.6-176.5175.60112.5I257I257-K259 PolarHBondContact O-N 3.22Å
260P34.5Very low32.2Very low101 Ų101132.2 Ų132.266%0.65675%0.752SS**PPolyproline II helixtrans-74.3159.6167.429.5-30.8000111.4A258 T262A258-P260 WeakPolarHBondContact O-CD 3.21Å; P260-T262 PolarHBondContact O-N 3.4Å
261P35.3Very low32.1Very low128 Ų128128.4 Ų128.483%0.83174%0.737SS**PPolyproline II helixtrans-60.4135.4-171.623-32.6000112.3
262T37Very low32.8Very low109 Ų109124.2 Ų124.267%0.66973%0.726SS**PPolyproline II helixtrans-64.7122.8-176.542.90000111.9P260P260-T262 PolarHBondContact O-N 3.4Å
263P33.7Very low33Very low112 Ų112125.5 Ų125.573%0.72773%0.725SS**PPolyproline II helixtrans-68.2153.4168.327.3-31.3000110.8
264P32.4Very low33.7Very low128 Ų128119 Ų11983%0.83170%0.7SS**PPolyproline II helixtrans-62.6142.7-178.324.9-32.2000111.7
265A30.6Very low34.4Very low86 Ų86116.8 Ų116.871%0.71168%0.684SS**PPolyproline II helixtrans-59.5141.1-176.200000112.4S267A265-S267 PolarHBondContact O-N 2.85Å; A265-S267 VanDerWaalsContact O-N 3.08Å
266P28.8Very low35.2Very low124 Ų124118 Ų11881%0.80568%0.678SS**  trans-74.5100.1172.229.3-30.1000109.4
267S37.4Very low35.8Very low108 Ų108114.3 Ų114.376%0.75566%0.663SS**  trans-90.992.3167.9580000109.9A265A265-S267 PolarHBondContact O-N 2.85Å; A265-S267 VanDerWaalsContact O-N 3.08Å
268T38Very low36.6Very low116 Ų116112 Ų11271%0.71265%0.647SS**  trans-154.991.4158.7-20.90000111.1L270T268-L270 VanDerWaalsContact C-N 3.29Å; T268-L270 PolarHBondContact O-N 2.87Å
269Y37.8Very low37.3Very low196 Ų196109.1 Ų109.177%0.76962%0.619SS**  trans-6691.9157.7-87.9-87000108.1G271Y269-G271 PolarHBondContact O-N 3.49Å
270L37.1Very low38.2Very low87 Ų87105.5 Ų105.546%0.45561%0.607SS.*  trans-67.8116.5162.7-87.9120000108.2T268 S274 K275T268-L270 VanDerWaalsContact C-N 3.29Å; T268-L270 PolarHBondContact O-N 2.87Å; L270-S274 VanDerWaalsContact CD2-OG 3.27Å; L270-S274 WeakPolarHBondContact CD2-OG 3.35Å; L270-K275 WeakPolarHBondContact O-CE 3.25Å
271G30.6Very low38.8Very low41 Ų41103.6 Ų103.642%0.42359%0.594SS.*  trans-56160.5177.800000113.1Y269 F273 S274Y269-G271 PolarHBondContact O-N 3.49Å; G271-F273 PolarHBondContact O-N 3.11Å; G271-F273 VanDerWaalsContact O-N 3.1Å; G271-S274 PolarHBondContact O-N 3.12Å
272P40.4Very low39.3Very low98 Ų9897.9 Ų97.964%0.63656%0.557SS**Hα-helixtrans-57.5-32.8-17020.2-31.1000113.1S274 Y276P272-S274 PolarHBondContact O-N 3.3Å; P272-Y276 HydrophobicContact CB-CE2 4.49Å; P272-Y276 WeakPolarHBondContact O-CD2 3.3Å; P272-Y276 VanDerWaalsContact O-CE2 3.23Å; P272-Y276 WeakPolarHBondContact O-CE2 3.36Å
273F34Very low39.8Very low175 Ų17594.6 Ų94.677%0.76854%0.541SS*.Hα-helixtrans-71.2-31.4-175-133.1-96.3000114.5G271 C277G271-F273 PolarHBondContact O-N 3.11Å; G271-F273 VanDerWaalsContact O-N 3.1Å; F273-C277 PolarHBondContact O-N 2.94Å
274S40.4Very low40.5Very low45 Ų4594.9 Ų94.932%0.31553%0.531SS..Hα-helixtrans-74.9-29.2-179.5-179.20000112.4L270 G271 P272 Y276 C277 F278L270-S274 VanDerWaalsContact CD2-OG 3.27Å; L270-S274 WeakPolarHBondContact CD2-OG 3.35Å; G271-S274 PolarHBondContact O-N 3.12Å; P272-S274 PolarHBondContact O-N 3.3Å; S274-Y276 VanDerWaalsContact C-N 3.34Å; S274-Y276 PolarHBondContact O-N 3.37Å; S274-C277 PolarHBondContact O-N 2.94Å; S274-F278 WeakPolarHBondContact O-CD2 3.46Å
275K41.1Very low41.3Very low113 Ų11392.3 Ų92.349%0.49151%0.513SS..Hα-helixtrans-64.9-37.3176.7-65-179.6-179.2176.20111.8L270 L279L270-K275 WeakPolarHBondContact O-CE 3.25Å; K275-L279 VanDerWaalsContact O-CD1 3.27Å; K275-L279 WeakPolarHBondContact O-CD1 3.14Å; K275-L279 VanDerWaalsContact O-CG 3.26Å; K275-L279 WeakPolarHBondContact O-CG 3.44Å
276Y43.6Very low42.2Very low135 Ų13588.5 Ų88.553%0.52948%0.48SS..Hα-helixtrans-78.7-27.3179.9-60.4-68.6000113.6P272 S274 F278 L279 I280P272-Y276 HydrophobicContact CB-CE2 4.49Å; P272-Y276 WeakPolarHBondContact O-CD2 3.3Å; P272-Y276 VanDerWaalsContact O-CE2 3.23Å; P272-Y276 WeakPolarHBondContact O-CE2 3.36Å; S274-Y276 VanDerWaalsContact C-N 3.34Å; S274-Y276 PolarHBondContact O-N 3.37Å; Y276-F278 VanDerWaalsContact C-N 3.25Å; Y276-F278 PolarHBondContact O-N 3.32Å; Y276-L279 HydrophobicContact CD1-CD1 4.2Å; Y276-L279 PolarHBondContact O-N 3.26Å; Y276-L279 VanDerWaalsContact O-N 3.14Å; Y276-I280 WeakPolarHBondContact O-CG1 3.41Å; Y276-I280 PolarHBondContact O-N 2.92Å
277C43.9Very low43.1Very low76 Ų7685 Ų8551%0.51446%0.456SS..Hα-helixtrans-64.6-23.3177.8-82.60000114.4F273 S274 P281F273-C277 PolarHBondContact O-N 2.94Å; S274-C277 PolarHBondContact O-N 2.94Å; C277-P281 WeakPolarHBondContact O-CD 3.36Å; C277-P281 WeakPolarHBondContact O-CG 3.37Å
278F48.4Very low43.5Very low99 Ų9986.5 Ų86.543%0.43445%0.447SS..Hα-helixtrans-93-18.2173.5-70.6-76.1000113.6H212 S274 Y276H212-F278 AromaticContact CD2-CE1 3.9Å; S274-F278 WeakPolarHBondContact O-CD2 3.46Å; Y276-F278 VanDerWaalsContact C-N 3.25Å; Y276-F278 PolarHBondContact O-N 3.32Å
279L48.5Very low43.9Very low35 Ų3583.5 Ų83.518%0.18343%0.429CS..Hα-helixtrans-84.6-29.7-178.6-68.2169.8000112.8I15 K275 Y276 M282 A283I15-L279 HydrophobicContact CD1-CB 4.44Å; I15-L279 HydrophobicContact CD1-CD1 3.98Å; I15-L279 HydrophobicContact CD1-CD2 3.6Å; I15-L279 HydrophobicContact CD1-CG 4.2Å; K275-L279 VanDerWaalsContact O-CD1 3.27Å; K275-L279 WeakPolarHBondContact O-CD1 3.14Å; K275-L279 VanDerWaalsContact O-CG 3.26Å; K275-L279 WeakPolarHBondContact O-CG 3.44Å; Y276-L279 HydrophobicContact CD1-CD1 4.2Å; Y276-L279 PolarHBondContact O-N 3.26Å; Y276-L279 VanDerWaalsContact O-N 3.14Å; L279-M282 HydrophobicContact CD2-SD 4.15Å; L279-M282 WeakPolarHBondContact O-CB 3.32Å; L279-M282 PolarHBondContact O-N 3.18Å; L279-A283 PolarHBondContact O-N 2.9Å
280I47.8Very low44.3Very low104 Ų10476.5 Ų76.553%0.53341%0.405SS..Hα-helixtrans-67.6-44.9175.6-63.4167.8000111.5Y276 M282 A283 F284Y276-I280 WeakPolarHBondContact O-CG1 3.41Å; Y276-I280 PolarHBondContact O-N 2.92Å; I280-M282 PolarHBondContact O-N 3.06Å; I280-A283 PolarHBondContact O-N 2.93Å; I280-F284 HydrophobicContact CG2-CD2 4.09Å; I280-F284 HydrophobicContact CG2-CE2 4.32Å; I280-F284 WeakPolarHBondContact O-CD2 3.48Å; I280-F284 PolarHBondContact O-N 3.24Å; I280-F284 VanDerWaalsContact O-N 3.14Å
281P47.4Very low44.5Very low60 Ų6076.2 Ų76.239%0.3942%0.415SS..Hα-helixtrans-60.9-31.1170.1-22.332.1000113.3C277 A283 F284 V285C277-P281 WeakPolarHBondContact O-CD 3.36Å; C277-P281 WeakPolarHBondContact O-CG 3.37Å; P281-A283 VanDerWaalsContact C-N 3.3Å; P281-A283 PolarHBondContact O-N 3.48Å; P281-F284 PolarHBondContact O-N 3.46Å; P281-V285 WeakPolarHBondContact O-CB 3.43Å; P281-V285 WeakPolarHBondContact O-CG2 3.25Å; P281-V285 PolarHBondContact O-N 3.38Å
282M46.1Very low44.8Very low9 Ų980.1 Ų80.14%0.04442%0.423CS..Hα-helixtrans-64.7-32.7178.4-164.7-170177.900112.6V45 L46 I209 L279 I280V45-M282 HydrophobicContact CB-CE 3.73Å; V45-M282 HydrophobicContact CG1-CE 3.27Å; V45-M282 HydrophobicContact CG1-CG 3.96Å; V45-M282 HydrophobicContact CG1-SD 4.49Å; L46-M282 HydrophobicContact CB-CE 4.41Å; L46-M282 HydrophobicContact CD2-CE 3.71Å; L46-M282 HydrophobicContact CD2-SD 4.28Å; L46-M282 HydrophobicContact CG-CE 3.82Å; I209-M282 HydrophobicContact CD1-CB 4.07Å; I209-M282 HydrophobicContact CD1-CG 3.67Å; L279-M282 HydrophobicContact CD2-SD 4.15Å; L279-M282 WeakPolarHBondContact O-CB 3.32Å; L279-M282 PolarHBondContact O-N 3.18Å; I280-M282 PolarHBondContact O-N 3.06Å
283A47Very low44.9Very low40 Ų4081.2 Ų81.233%0.33142%0.418SS..Hα-helixtrans-80.1-30.6171.900000112.8L279 I280 P281 T287L279-A283 PolarHBondContact O-N 2.9Å; I280-A283 PolarHBondContact O-N 2.93Å; P281-A283 VanDerWaalsContact C-N 3.3Å; P281-A283 PolarHBondContact O-N 3.48Å; A283-T287 VanDerWaalsContact O-CG2 3.24Å; A283-T287 WeakPolarHBondContact O-CG2 3.34Å; A283-T287 PolarHBondContact O-OG1 3.37Å
284F48.8Very low45.3Very low118 Ų11876.1 Ų76.152%0.51840%0.403SS..Hα-helixtrans-81.1-42.8-179-93.9-92.3000113.7I280 P281 V286 T287 Y288I280-F284 HydrophobicContact CG2-CD2 4.09Å; I280-F284 HydrophobicContact CG2-CE2 4.32Å; I280-F284 WeakPolarHBondContact O-CD2 3.48Å; I280-F284 PolarHBondContact O-N 3.24Å; I280-F284 VanDerWaalsContact O-N 3.14Å; P281-F284 PolarHBondContact O-N 3.46Å; F284-V286 PolarHBondContact O-N 2.84Å; F284-V286 VanDerWaalsContact O-N 3.13Å; F284-T287 WeakPolarHBondContact CA-OG1 3.31Å; F284-T287 PolarHBondContact O-N 3.25Å; F284-T287 PolarHBondContact O-OG1 3.12Å; F284-T287 VanDerWaalsContact O-OG1 3.11Å; F284-Y288 AromaticContact CD1-CD2 3.89Å; F284-Y288 HydrophobicContact CD1-CD2 3.89Å; F284-Y288 HydrophobicContact CD1-CE2 4.19Å; F284-Y288 HydrophobicContact CE1-CD2 4.44Å; F284-Y288 HydrophobicContact CE1-CE2 4.4Å; F284-Y288 VanDerWaalsContact O-CB 3.32Å; F284-Y288 WeakPolarHBondContact O-CB 3.48Å; F284-Y288 PolarHBondContact O-N 2.92Å
285V50.5Low45.4Very low74 Ų7482.5 Ų82.545%0.44843%0.425SS..Hα-helixtrans-62.1-25.9-177.2171.10000112.3I205 P281 P289I205-V285 HydrophobicContact CD1-CG1 4.12Å; P281-V285 WeakPolarHBondContact O-CB 3.43Å; P281-V285 WeakPolarHBondContact O-CG2 3.25Å; P281-V285 PolarHBondContact O-N 3.38Å; V285-P289 VanDerWaalsContact O-CD 3.31Å; V285-P289 WeakPolarHBondContact O-CD 3.33Å
286V48.6Very low45.3Very low5 Ų583.8 Ų83.83%0.0344%0.437CS..Hα-helixtrans-83.5-31.6176.8179.40000112.3D41 V45 F284D41-V286 HydrophobicContact CB-CG1 3.27Å; V45-V286 HydrophobicContact CG2-CG2 3.52Å; F284-V286 PolarHBondContact O-N 2.84Å; F284-V286 VanDerWaalsContact O-N 3.13Å
287T47.6Very low45.3Very low50 Ų5081.5 Ų81.531%0.30744%0.437SS..Hα-helixtrans-93.2-25.3-174.3520000113.2L38 A283 F284 A291L38-T287 HydrophobicContact CD1-CG2 3.94Å; A283-T287 VanDerWaalsContact O-CG2 3.24Å; A283-T287 WeakPolarHBondContact O-CG2 3.34Å; A283-T287 PolarHBondContact O-OG1 3.37Å; F284-T287 WeakPolarHBondContact CA-OG1 3.31Å; F284-T287 PolarHBondContact O-N 3.25Å; F284-T287 PolarHBondContact O-OG1 3.12Å; F284-T287 VanDerWaalsContact O-OG1 3.11Å; T287-A291 PolarHBondContact O-N 3.41Å
288Y45.8Very low44.9Very low140 Ų14088.8 Ų88.855%0.54946%0.463SS..Hα-helixtrans-73-38.6-172.2-135.8-104.5000116.3F284 I290 M292F284-Y288 AromaticContact CD1-CD2 3.89Å; F284-Y288 HydrophobicContact CD1-CD2 3.89Å; F284-Y288 HydrophobicContact CD1-CE2 4.19Å; F284-Y288 HydrophobicContact CE1-CD2 4.44Å; F284-Y288 HydrophobicContact CE1-CE2 4.4Å; F284-Y288 VanDerWaalsContact O-CB 3.32Å; F284-Y288 WeakPolarHBondContact O-CB 3.48Å; F284-Y288 PolarHBondContact O-N 2.92Å; Y288-I290 PolarHBondContact O-N 2.85Å; Y288-M292 HydrophobicContact CE1-CG 4.43Å
289P45.9Very low44.7Very low54 Ų5488.3 Ų88.335%0.35146%0.464SS..Hα-helixtrans-70.1-32.4-177.3-16.929.4000113V285V285-P289 VanDerWaalsContact O-CD 3.31Å; V285-P289 WeakPolarHBondContact O-CD 3.33Å
290I46.9Very low44.6Very low48 Ų4891.1 Ų91.125%0.24648%0.479CS..Hα-helixtrans-82.9-32.7-174.5-59.6174.2000110.9L38 Y288L38-I290 HydrophobicContact CD2-CD1 4.24Å; Y288-I290 PolarHBondContact O-N 2.85Å
291A42Very low44.4Very low81 Ų8190.4 Ų90.467%0.66948%0.476SS*.Hα-helixtrans-77.1-25.5-17900000114.6T287T287-A291 PolarHBondContact O-N 3.41Å
292M36.1Very low44.2Very low123 Ų12392.2 Ų92.261%0.60648%0.481SS*.Hα-helixtrans-92.2-17.4-176.3-81.4-79.8-92.800114.4Y288 P294Y288-M292 HydrophobicContact CE1-CG 4.43Å; M292-P294 WeakPolarHBondContact O-CD 3.22Å
293F42.4Very low44.1Very low121 Ų12197.4 Ų97.453%0.53151%0.509SS..  trans-125.562.6-179.2-59.7-76.3000112.7F295 L296F293-F295 PolarHBondContact O-N 3.35Å; F293-L296 HydrophobicContact CB-CB 4.21Å; F293-L296 HydrophobicContact CB-CD1 3.67Å; F293-L296 HydrophobicContact CB-CG 4.08Å; F293-L296 HydrophobicContact CD1-CD1 4.41Å; F293-L296 HydrophobicContact CD2-CD1 4.48Å; F293-L296 HydrophobicContact CG-CD1 3.96Å; F293-L296 PolarHBondContact O-N 2.94Å
294P42.5Very low43.9Very low68 Ų68101.2 Ų101.244%0.44252%0.521SS..G310 helixtrans-57.8-21.6173.223.1-31.4000112.7M292 L296 V297M292-P294 WeakPolarHBondContact O-CD 3.22Å; P294-L296 VanDerWaalsContact C-N 3.32Å; P294-L296 PolarHBondContact O-N 2.84Å; P294-V297 PolarHBondContact O-N 2.96Å
295F42.4Very low43.5Very low179 Ų179100 Ų10079%0.78552%0.521SS*.G310 helixtrans-76.1-10.6176.8-53.2-80.2000115F293 V297F293-F295 PolarHBondContact O-N 3.35Å; F295-V297 VanDerWaalsContact C-N 3.33Å
296L39.3Very low43Very low140 Ų140102 Ų10273%0.73353%0.526SS*.G310 helixtrans-88.9-1.1173.9-78.1171.1000112.7F293 P294F293-L296 HydrophobicContact CB-CB 4.21Å; F293-L296 HydrophobicContact CB-CD1 3.67Å; F293-L296 HydrophobicContact CB-CG 4.08Å; F293-L296 HydrophobicContact CD1-CD1 4.41Å; F293-L296 HydrophobicContact CD2-CD1 4.48Å; F293-L296 HydrophobicContact CG-CD1 3.96Å; F293-L296 PolarHBondContact O-N 2.94Å; P294-L296 VanDerWaalsContact C-N 3.32Å; P294-L296 PolarHBondContact O-N 2.84Å
297V44Very low42.5Very low88 Ų88110.1 Ų110.153%0.53357%0.568SS.*  trans-115.417.6-176.3-168.50000111.6L189 P294 F295L189-V297 HydrophobicContact CD2-CG1 4.36Å; P294-V297 PolarHBondContact O-N 2.96Å; F295-V297 VanDerWaalsContact C-N 3.33Å
298H35.3Very low42.1Very low229 Ų229115.5 Ų115.5100%1.0659%0.591SS**  trans-113.80175.2-77-50.2000112.2

Retrieved 298 of 298 residues in 170 ms (Link to these results)