A0A087WQJ1_MOUSE Loading...

Free fatty acid receptor 2

AlphaFold DB , UniProt , Accession A0A087WQJ1, Species MOUSE (Mus musculus, Mouse), Gene Ffar2, Length 142 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
1M44.3Very low72.1Confident242 Ų242107.3 Ų107.3100%1.19256%0.555SS**  089.90-85.5105.4169.500108.3
2T50.7Low73.4Confident113 Ų113104.5 Ų104.569%0.69355%0.547SS*.  trans-76.3132.5168.241.80000107.8D4T2-D4 PolarHBondContact O-N 3.23Å; T2-D4 VanDerWaalsContact O-N 3.14Å
3P55.1Low74.6Confident83 Ų8399.6 Ų99.654%0.53953%0.531SS..  trans-66.1113.5166.626.1-29000107.3W5P3-W5 PolarHBondContact O-N 3.03Å
4D70Confident75.6Confident91 Ų9196.8 Ų96.849%0.48751%0.51SS..  trans-68.999.7174.4-55.5-40.8000107.3T2 H6 S7 S8T2-D4 PolarHBondContact O-N 3.23Å; T2-D4 VanDerWaalsContact O-N 3.14Å; D4-H6 PolarHBondContact O-N 3.2Å; D4-S7 PolarHBondContact O-N 3.36Å; D4-S8 PolarHBondContact O-N 3.39Å
5W73.6Confident76.5Confident189 Ų18994.7 Ų94.772%0.71650%0.498SS*.Hα-helixtrans-50.8-32-177.2-63.2106.2000112.5P3 S8 L9P3-W5 PolarHBondContact O-N 3.03Å; W5-S8 PolarHBondContact O-N 3.29Å; W5-L9 WeakPolarHBondContact O-CB 3.36Å; W5-L9 WeakPolarHBondContact O-CD1 3.49Å; W5-L9 WeakPolarHBondContact O-CG 3.4Å; W5-L9 PolarHBondContact O-N 3.15Å
6H79.1Confident77.5Confident147 Ų14795 Ų9568%0.68150%0.5SS*.Hα-helixtrans-57.9-49.6175.4-64.6-77.1000113.1D4 S8 L9 I10D4-H6 PolarHBondContact O-N 3.2Å; H6-S8 VanDerWaalsContact C-N 3.31Å; H6-S8 PolarHBondContact O-N 3.43Å; H6-L9 PolarHBondContact O-N 2.91Å; H6-I10 WeakPolarHBondContact O-CD1 3.18Å; H6-I10 VanDerWaalsContact O-CG1 3.25Å; H6-I10 WeakPolarHBondContact O-CG1 3.47Å; H6-I10 PolarHBondContact O-N 3.45Å
7S78.4Confident78.3Confident31 Ų3194.2 Ų94.222%0.21750%0.495CS..Hα-helixtrans-63.9-39.7-178.6-53.10000111.3D4 I10 L11D4-S7 PolarHBondContact O-N 3.36Å; S7-I10 PolarHBondContact O-N 3.42Å; S7-L11 WeakPolarHBondContact O-CB 3.46Å; S7-L11 PolarHBondContact O-N 3.2Å
8S82.1Confident79Confident59 Ų5992.4 Ų92.441%0.41348%0.483SS..Hα-helixtrans-67.5-40.2178-59.60000112.1D4 W5 H6 T12D4-S8 PolarHBondContact O-N 3.39Å; W5-S8 PolarHBondContact O-N 3.29Å; H6-S8 VanDerWaalsContact C-N 3.31Å; H6-S8 PolarHBondContact O-N 3.43Å; S8-T12 WeakPolarHBondContact O-CB 3.35Å; S8-T12 PolarHBondContact O-N 3.16Å; S8-T12 PolarHBondContact O-OG1 3.35Å
9L87.4Confident79.7Confident117 Ų11793.4 Ų93.461%0.61349%0.487SS*.Hα-helixtrans-64.8-45.4175.5-72.5165.8000111.6W5 H6 T12 A13W5-L9 WeakPolarHBondContact O-CB 3.36Å; W5-L9 WeakPolarHBondContact O-CD1 3.49Å; W5-L9 WeakPolarHBondContact O-CG 3.4Å; W5-L9 PolarHBondContact O-N 3.15Å; H6-L9 PolarHBondContact O-N 2.91Å; L9-T12 PolarHBondContact O-N 3.47Å; L9-A13 WeakPolarHBondContact O-CB 3.37Å; L9-A13 PolarHBondContact O-N 3.08Å
10I85.8Confident80.3Confident61 Ų6193.2 Ų93.231%0.31349%0.491SS..Hα-helixtrans-61.4-47.2178.8-68.2164.2000110.7H6 S7 T12 A13 Y14 F73H6-I10 WeakPolarHBondContact O-CD1 3.18Å; H6-I10 VanDerWaalsContact O-CG1 3.25Å; H6-I10 WeakPolarHBondContact O-CG1 3.47Å; H6-I10 PolarHBondContact O-N 3.45Å; S7-I10 PolarHBondContact O-N 3.42Å; I10-T12 PolarHBondContact O-N 3.42Å; I10-A13 PolarHBondContact O-N 3.3Å; I10-Y14 HydrophobicContact CG2-CD2 3.88Å; I10-Y14 HydrophobicContact CG2-CE1 4.27Å; I10-Y14 HydrophobicContact CG2-CE2 3.41Å; I10-Y14 VanDerWaalsContact CG2-CE2 3.41Å; I10-Y14 HydrophobicContact CG2-CG 4.48Å; I10-Y14 PolarHBondContact O-N 3.23Å; I10-F73 HydrophobicContact CD1-CZ 4.44Å
11L86.3Confident80.7Confident47 Ų4789.3 Ų89.325%0.24647%0.473CS..Hα-helixtrans-61.2-45.7178.8-170.5115.4000111.5S7 A13 Y14 I15 I66 A69 A70S7-L11 WeakPolarHBondContact O-CB 3.46Å; S7-L11 PolarHBondContact O-N 3.2Å; L11-A13 PolarHBondContact O-N 3.34Å; L11-Y14 PolarHBondContact O-N 2.86Å; L11-I15 HydrophobicContact CD2-CD1 3.73Å; L11-I15 HydrophobicContact CG-CD1 4.05Å; L11-I15 VanDerWaalsContact O-CG1 3.3Å; L11-I15 WeakPolarHBondContact O-CG1 3.44Å; L11-I15 PolarHBondContact O-N 2.81Å; L11-I66 HydrophobicContact CD1-CG2 4.12Å; L11-I66 HydrophobicContact CG-CG2 4.45Å; L11-A69 HydrophobicContact CD1-CB 4.12Å; L11-A70 HydrophobicContact CD1-CB 3.83Å
12T88Confident82.9Confident74 Ų7480 Ų8045%0.45443%0.428SS..Hα-helixtrans-61.7-45.7177.8-54.60000111S8 L9 I10 Y14 I15 L16S8-T12 WeakPolarHBondContact O-CB 3.35Å; S8-T12 PolarHBondContact O-N 3.16Å; S8-T12 PolarHBondContact O-OG1 3.35Å; L9-T12 PolarHBondContact O-N 3.47Å; I10-T12 PolarHBondContact O-N 3.42Å; T12-Y14 PolarHBondContact O-N 3.19Å; T12-I15 PolarHBondContact O-N 3.38Å; T12-L16 HydrophobicContact CG2-CD1 4.1Å; T12-L16 HydrophobicContact CG2-CG 4.48Å; T12-L16 WeakPolarHBondContact O-CB 3.43Å; T12-L16 WeakPolarHBondContact O-CG 3.46Å; T12-L16 PolarHBondContact O-N 3.2Å
13A89.3Confident84.8Confident41 Ų4177.6 Ų77.634%0.33941%0.414SS..Hα-helixtrans-60.5-46.3177.500000111.6L9 I10 L11 I15 L16 I17L9-A13 WeakPolarHBondContact O-CB 3.37Å; L9-A13 PolarHBondContact O-N 3.08Å; I10-A13 PolarHBondContact O-N 3.3Å; L11-A13 PolarHBondContact O-N 3.34Å; A13-I15 PolarHBondContact O-N 3.05Å; A13-L16 PolarHBondContact O-N 2.98Å; A13-I17 WeakPolarHBondContact O-CB 3.39Å; A13-I17 WeakPolarHBondContact O-CD1 3.22Å; A13-I17 WeakPolarHBondContact O-CG1 3.39Å; A13-I17 PolarHBondContact O-N 2.86Å
14Y88.9Confident86.5Confident60 Ų6076.3 Ų76.324%0.23541%0.411CS..Hα-helixtrans-61.8-43.2177.4-69.7-15.6000112.6I10 L11 T12 L16 I17 F18 L62 R65 I66I10-Y14 HydrophobicContact CG2-CD2 3.88Å; I10-Y14 HydrophobicContact CG2-CE1 4.27Å; I10-Y14 HydrophobicContact CG2-CE2 3.41Å; I10-Y14 VanDerWaalsContact CG2-CE2 3.41Å; I10-Y14 HydrophobicContact CG2-CG 4.48Å; I10-Y14 PolarHBondContact O-N 3.23Å; L11-Y14 PolarHBondContact O-N 2.86Å; T12-Y14 PolarHBondContact O-N 3.19Å; Y14-L16 PolarHBondContact O-N 3.28Å; Y14-I17 PolarHBondContact O-N 3.08Å; Y14-F18 WeakPolarHBondContact O-CB 3.42Å; Y14-F18 PolarHBondContact O-N 3.46Å; Y14-L62 HydrophobicContact CD1-CD2 4.42Å; Y14-L62 HydrophobicContact CG-CD2 4.34Å; Y14-L62 WeakPolarHBondContact O-CD2 3.41Å; Y14-R65 HydrophobicContact CD2-CB 4.28Å; Y14-R65 HydrophobicContact CE2-CB 4.03Å; Y14-I66 HydrophobicContact CD2-CG1 4.27Å; Y14-I66 HydrophobicContact CG-CG1 4.39Å
15I88.8Confident87.5Confident66 Ų6673.4 Ų73.434%0.33840%0.395SS..Hα-helixtrans-62.2-44.7176.8-68165.8000110.8L11 T12 A13 F18 L19 I66L11-I15 HydrophobicContact CD2-CD1 3.73Å; L11-I15 HydrophobicContact CG-CD1 4.05Å; L11-I15 VanDerWaalsContact O-CG1 3.3Å; L11-I15 WeakPolarHBondContact O-CG1 3.44Å; L11-I15 PolarHBondContact O-N 2.81Å; T12-I15 PolarHBondContact O-N 3.38Å; A13-I15 PolarHBondContact O-N 3.05Å; I15-F18 PolarHBondContact O-N 2.99Å; I15-L19 HydrophobicContact CG2-CD1 3.79Å; I15-L19 HydrophobicContact CG2-CG 4.33Å; I15-L19 WeakPolarHBondContact O-CB 3.33Å; I15-L19 WeakPolarHBondContact O-CG 3.23Å; I15-L19 PolarHBondContact O-N 2.52Å; I15-I66 HydrophobicContact CG1-CD1 3.94Å; I15-I66 HydrophobicContact CG1-CG1 4.49Å; I15-I66 HydrophobicContact CG1-CG2 4.24Å
16L92.1Very high88.2Confident99 Ų9968.1 Ų68.152%0.51838%0.381SS..Hα-helixtrans-63.7-44.8177.8-71.8175000112T12 A13 Y14 F18 L19 T20T12-L16 HydrophobicContact CG2-CD1 4.1Å; T12-L16 HydrophobicContact CG2-CG 4.48Å; T12-L16 WeakPolarHBondContact O-CB 3.43Å; T12-L16 WeakPolarHBondContact O-CG 3.46Å; T12-L16 PolarHBondContact O-N 3.2Å; A13-L16 PolarHBondContact O-N 2.98Å; Y14-L16 PolarHBondContact O-N 3.28Å; L16-F18 VanDerWaalsContact C-N 3.3Å; L16-F18 PolarHBondContact O-N 2.98Å; L16-L19 PolarHBondContact O-N 3.5Å; L16-T20 WeakPolarHBondContact O-CB 3.43Å; L16-T20 WeakPolarHBondContact O-CG2 3.33Å; L16-T20 PolarHBondContact O-N 3.46Å; L16-T20 PolarHBondContact O-OG1 3.26Å
17I91.4Very high88.8Confident82 Ų8267 Ų6742%0.42138%0.379SS..Hα-helixtrans-61-41.3176.6-69.5162.9000110.4A13 Y14 G21 L59 L62A13-I17 WeakPolarHBondContact O-CB 3.39Å; A13-I17 WeakPolarHBondContact O-CD1 3.22Å; A13-I17 WeakPolarHBondContact O-CG1 3.39Å; A13-I17 PolarHBondContact O-N 2.86Å; Y14-I17 PolarHBondContact O-N 3.08Å; I17-G21 WeakPolarHBondContact O-CA 3.45Å; I17-G21 PolarHBondContact O-N 2.95Å; I17-L59 HydrophobicContact CG2-CD2 4.05Å; I17-L59 WeakPolarHBondContact O-CD2 3.26Å; I17-L62 HydrophobicContact CB-CD2 4.22Å; I17-L62 HydrophobicContact CG2-CD1 4.42Å; I17-L62 HydrophobicContact CG2-CD2 4.12Å
18F90.7Very high89.2Confident62 Ų6266.8 Ų66.827%0.27238%0.379SS..Hα-helixtrans-64.6-53.4176.2-176-96.6000111.5Y14 I15 L16 T20 L22 L59 L62 P63Y14-F18 WeakPolarHBondContact O-CB 3.42Å; Y14-F18 PolarHBondContact O-N 3.46Å; I15-F18 PolarHBondContact O-N 2.99Å; L16-F18 VanDerWaalsContact C-N 3.3Å; L16-F18 PolarHBondContact O-N 2.98Å; F18-T20 VanDerWaalsContact C-N 3.31Å; F18-T20 PolarHBondContact O-N 3.18Å; F18-L22 HydrophobicContact CD1-CD1 4.34Å; F18-L22 HydrophobicContact CD2-CD1 3.76Å; F18-L22 HydrophobicContact CE1-CD1 3.83Å; F18-L22 HydrophobicContact CE2-CD1 3.18Å; F18-L22 HydrophobicContact CG-CD1 4.31Å; F18-L22 HydrophobicContact CZ-CD1 3.21Å; F18-L22 WeakPolarHBondContact O-CB 3.49Å; F18-L22 PolarHBondContact O-N 3.4Å; F18-L59 VanDerWaalsContact CD2-O 3.3Å; F18-L59 WeakPolarHBondContact CD2-O 3.2Å; F18-L59 VanDerWaalsContact CE2-O 3.31Å; F18-L59 WeakPolarHBondContact CE2-O 3.32Å; F18-L62 HydrophobicContact CB-CD2 4.03Å; F18-L62 HydrophobicContact CD2-CB 4.36Å; F18-P63 HydrophobicContact CE2-CG 4.18Å
19L91.4Very high89.5Confident110 Ų11065 Ų6558%0.57637%0.365SS*.Hα-helixtrans-62.8-34.8-176.6-74.6174.2000113.5I15 L16 P23I15-L19 HydrophobicContact CG2-CD1 3.79Å; I15-L19 HydrophobicContact CG2-CG 4.33Å; I15-L19 WeakPolarHBondContact O-CB 3.33Å; I15-L19 WeakPolarHBondContact O-CG 3.23Å; I15-L19 PolarHBondContact O-N 2.52Å; L16-L19 PolarHBondContact O-N 3.5Å; L19-P23 WeakPolarHBondContact O-CD 3.11Å; L19-P23 WeakPolarHBondContact O-CG 3.4Å
20T91.8Very high89.4Confident90 Ų9068.7 Ų68.755%0.55237%0.37SS*.Hα-helixtrans-89.5-40.6179.558.20000112L16 F18 P23 A24L16-T20 WeakPolarHBondContact O-CB 3.43Å; L16-T20 WeakPolarHBondContact O-CG2 3.33Å; L16-T20 PolarHBondContact O-N 3.46Å; L16-T20 PolarHBondContact O-OG1 3.26Å; F18-T20 VanDerWaalsContact C-N 3.31Å; F18-T20 PolarHBondContact O-N 3.18Å; T20-P23 WeakPolarHBondContact O-CD 3.49Å; T20-P23 WeakPolarHBondContact O-CG 3.4Å; T20-A24 VanDerWaalsContact O-CB 3.23Å; T20-A24 WeakPolarHBondContact O-CB 3.3Å; T20-A24 PolarHBondContact O-N 2.92Å
21G88.9Confident89.4Confident12 Ų1268.5 Ų68.512%0.12438%0.378CS..Hα-helixtrans-71.5-39.1-174.400000113.4I17 N25 L59I17-G21 WeakPolarHBondContact O-CA 3.45Å; I17-G21 PolarHBondContact O-N 2.95Å; G21-N25 VanDerWaalsContact O-CB 3.28Å; G21-N25 WeakPolarHBondContact O-CB 3.39Å; G21-N25 PolarHBondContact O-N 3.24Å; G21-N25 PolarHBondContact O-ND2 2.86Å; G21-L59 WeakPolarHBondContact O-CD1 3.33Å
22L90.5Very high89.1Confident46 Ų4668.5 Ų68.524%0.24138%0.376CS..Hα-helixtrans-63.1-53.5179.8-126.2153.8000112.9F18 A24 L26 L56 L59F18-L22 HydrophobicContact CD1-CD1 4.34Å; F18-L22 HydrophobicContact CD2-CD1 3.76Å; F18-L22 HydrophobicContact CE1-CD1 3.83Å; F18-L22 HydrophobicContact CE2-CD1 3.18Å; F18-L22 HydrophobicContact CG-CD1 4.31Å; F18-L22 HydrophobicContact CZ-CD1 3.21Å; F18-L22 WeakPolarHBondContact O-CB 3.49Å; F18-L22 PolarHBondContact O-N 3.4Å; L22-A24 VanDerWaalsContact C-N 3.34Å; L22-A24 PolarHBondContact O-N 2.85Å; L22-L26 WeakPolarHBondContact O-CB 3.27Å; L22-L26 PolarHBondContact O-N 2.82Å; L22-L56 HydrophobicContact CD2-CD2 4.4Å; L22-L59 HydrophobicContact CG-CB 4.44Å
23P90.8Very high88.5Confident63 Ų6369.3 Ų69.341%0.40938%0.376SS..Hα-helixtrans-64.3-40.2177.424-32000111.6L19 T20 L26 L27L19-P23 WeakPolarHBondContact O-CD 3.11Å; L19-P23 WeakPolarHBondContact O-CG 3.4Å; T20-P23 WeakPolarHBondContact O-CD 3.49Å; T20-P23 WeakPolarHBondContact O-CG 3.4Å; P23-L26 PolarHBondContact O-N 3.42Å; P23-L27 WeakPolarHBondContact O-CB 3.14Å; P23-L27 WeakPolarHBondContact O-CG 3.28Å; P23-L27 PolarHBondContact O-N 2.93Å
24A90.8Very high87.7Confident56 Ų5669.5 Ų69.546%0.46338%0.382SS..Hα-helixtrans-61.2-49.8178.900000112.3T20 L22 L27 A28T20-A24 VanDerWaalsContact O-CB 3.23Å; T20-A24 WeakPolarHBondContact O-CB 3.3Å; T20-A24 PolarHBondContact O-N 2.92Å; L22-A24 VanDerWaalsContact C-N 3.34Å; L22-A24 PolarHBondContact O-N 2.85Å; A24-L27 PolarHBondContact O-N 3.47Å; A24-A28 WeakPolarHBondContact O-CB 3.44Å; A24-A28 PolarHBondContact O-N 3.3Å
25N91.1Very high86.8Confident29 Ų2974.2 Ų74.216%0.15540%0.399CS..Hα-helixtrans-69.7-33.3179.7-77.7-70.6000112.6G21 A28 L29 L56 L59G21-N25 VanDerWaalsContact O-CB 3.28Å; G21-N25 WeakPolarHBondContact O-CB 3.39Å; G21-N25 PolarHBondContact O-N 3.24Å; G21-N25 PolarHBondContact O-ND2 2.86Å; N25-A28 PolarHBondContact O-N 3.43Å; N25-L29 WeakPolarHBondContact O-CB 3.17Å; N25-L29 PolarHBondContact O-N 2.84Å; N25-L56 HydrophobicContact CB-CD2 3.87Å; N25-L56 HydrophobicContact CB-CG 4Å; N25-L59 HydrophobicContact CB-CD1 4.3Å
26L89.6Confident85.6Confident79 Ų7973.4 Ų73.441%0.41440%0.397SS..Hα-helixtrans-67.9-41.6175.5-17264.5000111.8L22 P23 L29 R30L22-L26 WeakPolarHBondContact O-CB 3.27Å; L22-L26 PolarHBondContact O-N 2.82Å; P23-L26 PolarHBondContact O-N 3.42Å; L26-L29 PolarHBondContact O-N 3.28Å; L26-R30 WeakPolarHBondContact O-CG 3.22Å; L26-R30 PolarHBondContact O-N 2.86Å
27L89.9Confident84.2Confident124 Ų12479 Ų7965%0.64941%0.411SS*.Hα-helixtrans-62.7-44.2173.3-72.2169.5000111P23 A24 R30 A31P23-L27 WeakPolarHBondContact O-CB 3.14Å; P23-L27 WeakPolarHBondContact O-CG 3.28Å; P23-L27 PolarHBondContact O-N 2.93Å; A24-L27 PolarHBondContact O-N 3.47Å; L27-R30 PolarHBondContact O-N 3.22Å; L27-A31 WeakPolarHBondContact O-CB 3.49Å; L27-A31 PolarHBondContact O-N 2.84Å
28A87.6Confident83Confident26 Ų2680.9 Ų80.922%0.21542%0.419CS..Hα-helixtrans-60.8-45.4175.800000111.8A24 N25 R30 A31 F32 T52A24-A28 WeakPolarHBondContact O-CB 3.44Å; A24-A28 PolarHBondContact O-N 3.3Å; N25-A28 PolarHBondContact O-N 3.43Å; A28-R30 PolarHBondContact O-N 3.44Å; A28-A31 PolarHBondContact O-N 3.27Å; A28-F32 HydrophobicContact CB-CD2 4.34Å; A28-F32 HydrophobicContact CB-CE2 3.89Å; A28-F32 WeakPolarHBondContact O-CB 3.35Å; A28-F32 WeakPolarHBondContact O-CD2 3.4Å; A28-F32 VanDerWaalsContact O-CG 3.28Å; A28-F32 WeakPolarHBondContact O-CG 3.4Å; A28-F32 PolarHBondContact O-N 2.78Å; A28-T52 HydrophobicContact CB-CG2 3.85Å
29L87.7Confident81.1Confident22 Ų2283.6 Ų83.612%0.11544%0.443CS..Hα-helixtrans-58.4-46.5175.7-178.868.8000111.2N25 L26 A31 F32 M33 L49 L53 L56N25-L29 WeakPolarHBondContact O-CB 3.17Å; N25-L29 PolarHBondContact O-N 2.84Å; L26-L29 PolarHBondContact O-N 3.28Å; L29-A31 PolarHBondContact O-N 3.36Å; L29-F32 PolarHBondContact O-N 3.29Å; L29-M33 HydrophobicContact CD1-CE 4.45Å; L29-M33 HydrophobicContact CG-CE 4.27Å; L29-M33 WeakPolarHBondContact O-CB 3.32Å; L29-M33 PolarHBondContact O-N 3.29Å; L29-L49 HydrophobicContact CD1-CD1 4.4Å; L29-L49 HydrophobicContact CD1-CG 4.25Å; L29-L53 HydrophobicContact CD1-CD2 3.99Å; L29-L53 HydrophobicContact CD1-CG 4.23Å; L29-L53 HydrophobicContact CD2-CD2 4.38Å; L29-L56 HydrophobicContact CB-CD1 4.4Å; L29-L56 HydrophobicContact CD2-CD1 3.73Å
30R86.8Confident79.5Confident193 Ų19386.5 Ų86.573%0.72845%0.453SS*.Hα-helixtrans-61.1-43.9176.9-70.2-132.6-175.9-154.82.3111.9L26 L27 A28 G34L26-R30 WeakPolarHBondContact O-CG 3.22Å; L26-R30 PolarHBondContact O-N 2.86Å; L27-R30 PolarHBondContact O-N 3.22Å; A28-R30 PolarHBondContact O-N 3.44Å; R30-G34 PolarHBondContact O-N 3.4Å
31A84.7Confident78Confident58 Ų5884 Ų8448%0.47944%0.438SS..Hα-helixtrans-64.1-46.2178.600000111.9L27 A28 L29 G34 R35L27-A31 WeakPolarHBondContact O-CB 3.49Å; L27-A31 PolarHBondContact O-N 2.84Å; A28-A31 PolarHBondContact O-N 3.27Å; L29-A31 PolarHBondContact O-N 3.36Å; A31-G34 PolarHBondContact O-N 3.3Å; A31-R35 WeakPolarHBondContact O-CG 3.44Å; A31-R35 PolarHBondContact O-N 3.01Å
32F80.8Confident77Confident46 Ų4684.9 Ų84.920%0.20245%0.445CS..Hα-helixtrans-70.9-35.4179.8-61.5-37.2000112.8A28 L29 G34 R35 V36 L48 T52A28-F32 HydrophobicContact CB-CD2 4.34Å; A28-F32 HydrophobicContact CB-CE2 3.89Å; A28-F32 WeakPolarHBondContact O-CB 3.35Å; A28-F32 WeakPolarHBondContact O-CD2 3.4Å; A28-F32 VanDerWaalsContact O-CG 3.28Å; A28-F32 WeakPolarHBondContact O-CG 3.4Å; A28-F32 PolarHBondContact O-N 2.78Å; L29-F32 PolarHBondContact O-N 3.29Å; F32-G34 VanDerWaalsContact C-N 3.27Å; F32-G34 PolarHBondContact O-N 3.48Å; F32-R35 CarbonylContact O-C 3.58Å; F32-R35 PolarHBondContact O-N 2.93Å; F32-V36 WeakPolarHBondContact O-CB 3.31Å; F32-V36 WeakPolarHBondContact O-CG2 3.47Å; F32-V36 PolarHBondContact O-N 3.34Å; F32-L48 HydrophobicContact CD2-CB 4.09Å; F32-L48 HydrophobicContact CE1-CD2 4.08Å; F32-L48 HydrophobicContact CE2-CB 3.94Å; F32-L48 HydrophobicContact CE2-CD2 3.68Å; F32-L48 HydrophobicContact CE2-CG 4.45Å; F32-L48 HydrophobicContact CG-CB 4.49Å; F32-L48 HydrophobicContact CZ-CB 4.22Å; F32-L48 HydrophobicContact CZ-CD2 3.38Å; F32-L48 HydrophobicContact CZ-CG 4.36Å; F32-T52 HydrophobicContact CD2-CG2 3.82Å; F32-T52 HydrophobicContact CE2-CG2 3.73Å
33M75.9Confident75.9Confident92 Ų9283.6 Ų83.645%0.45344%0.439SS..Hα-helixtrans-61.4-37.5174-169.5-179.5-64.600111.7L29 R35 R37L29-M33 HydrophobicContact CD1-CE 4.45Å; L29-M33 HydrophobicContact CG-CE 4.27Å; L29-M33 WeakPolarHBondContact O-CB 3.32Å; L29-M33 PolarHBondContact O-N 3.29Å; M33-R35 VanDerWaalsContact C-N 3.34Å; M33-R37 PolarHBondContact O-N 2.87Å
34G72.4Confident74.9Confident45 Ų4582 Ų8246%0.46443%0.428SS..Hα-helixtrans-65.6-33.8172.100000113.6R30 A31 F32R30-G34 PolarHBondContact O-N 3.4Å; A31-G34 PolarHBondContact O-N 3.3Å; F32-G34 VanDerWaalsContact C-N 3.27Å; F32-G34 PolarHBondContact O-N 3.48Å
35R68.4Low74.2Confident159 Ų15981.7 Ų81.760%0.642%0.417SS*.Hα-helixtrans-81.1-31.1178.7-64.9-66.3-172.2125.30.2113.5A31 F32 M33 R37 Q38A31-R35 WeakPolarHBondContact O-CG 3.44Å; A31-R35 PolarHBondContact O-N 3.01Å; F32-R35 CarbonylContact O-C 3.58Å; F32-R35 PolarHBondContact O-N 2.93Å; M33-R35 VanDerWaalsContact C-N 3.34Å; R35-R37 VanDerWaalsContact C-N 3.32Å; R35-Q38 WeakPolarHBondContact O-CB 3.16Å; R35-Q38 WeakPolarHBondContact O-CG 3.42Å; R35-Q38 PolarHBondContact O-N 3.24Å
36V64.8Low73.4Confident49 Ų4983.5 Ų83.530%0.29743%0.426SS..Hα-helixtrans-70-28.4176.4160.20000112.2F32 Q38 H45 L49F32-V36 WeakPolarHBondContact O-CB 3.31Å; F32-V36 WeakPolarHBondContact O-CG2 3.47Å; F32-V36 PolarHBondContact O-N 3.34Å; V36-Q38 PolarHBondContact O-N 2.99Å; V36-H45 HydrophobicContact CG2-CB 4.04Å; V36-L49 HydrophobicContact CG2-CD1 4.22Å
37R62.8Low72.6Confident215 Ų21579.8 Ų79.881%0.81141%0.407SS*.THydrogen-bonded Turntrans-68.5-6.2174.3-95.9-179173.5142.6-1.5114.7M33 R35M33-R37 PolarHBondContact O-N 2.87Å; R35-R37 VanDerWaalsContact C-N 3.32Å
38Q66.2Low72.1Confident122 Ų12275.7 Ų75.757%0.5739%0.385SS*.SBendtrans-71.3148.7174.7-70.5-78.3-22.400110.6R35 V36 Q40 P41R35-Q38 WeakPolarHBondContact O-CB 3.16Å; R35-Q38 WeakPolarHBondContact O-CG 3.42Å; R35-Q38 PolarHBondContact O-N 3.24Å; V36-Q38 PolarHBondContact O-N 2.99Å; Q38-Q40 PolarHBondContact O-N 2.99Å; Q38-P41 WeakPolarHBondContact O-CD 3.09Å
39P50.7Low71.7Confident120 Ų12076.1 Ų76.178%0.77938%0.383SS*.SBendtrans-62-17.5-173.6-22.432.4000115.5
40Q57.1Low71.4Confident171 Ų17178 Ų7880%0.79939%0.394SS*.SBendtrans-135.271.3179.7-64-171.6-1.600111.3Q38 A42Q38-Q40 PolarHBondContact O-N 2.99Å; Q40-A42 PolarHBondContact O-N 3.5Å
41P61Low71.2Confident37 Ų3769.6 Ų69.624%0.2436%0.363CS..  trans-64.9130.3178.927.1-29.4000109.4Q38 R121Q38-P41 WeakPolarHBondContact O-CD 3.09Å; P41-R121 PolarHBondContact O-NH1 3.41Å
42A67.3Low71.3Confident31 Ų3167.1 Ų67.126%0.25634%0.342SS..  trans-63.9141.1169.500000109.2Q40 V44 H45Q40-A42 PolarHBondContact O-N 3.5Å; A42-V44 HydrophobicContact CB-CG1 3.78Å; A42-V44 PolarHBondContact O-N 3.01Å; A42-V44 VanDerWaalsContact O-N 3.08Å; A42-H45 WeakPolarHBondContact O-CB 3.46Å; A42-H45 PolarHBondContact O-N 3.23Å
43P67.4Low71.3Confident19 Ų1968.8 Ų68.812%0.12335%0.353CS..Hα-helixtrans-53-34.7-178.5-26.133.5000112.8H45 I46 L47 E106 R121 Y125P43-H45 VanDerWaalsContact C-N 3.26Å; P43-H45 PolarHBondContact O-N 3.34Å; P43-I46 PolarHBondContact O-N 3Å; P43-L47 PolarHBondContact O-N 3.24Å; P43-E106 WeakPolarHBondContact CB-OE2 3.45Å; P43-R121 HydrophobicContact CG-CG 4.13Å; P43-Y125 PolarHBondContact O-OH 3.08Å
44V69.8Low71.7Confident29 Ų2965 Ų6518%0.17634%0.336CS..Hα-helixtrans-55.4-35.4174.672.60000112.8A42 L47 L48 I103A42-V44 HydrophobicContact CB-CG1 3.78Å; A42-V44 PolarHBondContact O-N 3.01Å; A42-V44 VanDerWaalsContact O-N 3.08Å; V44-L47 WeakPolarHBondContact O-CB 3.25Å; V44-L47 PolarHBondContact O-N 2.88Å; V44-L48 HydrophobicContact CB-CD1 4.48Å; V44-L48 HydrophobicContact CG2-CD1 3.57Å; V44-L48 WeakPolarHBondContact O-CB 3.48Å; V44-L48 WeakPolarHBondContact O-CD1 3.47Å; V44-L48 PolarHBondContact O-N 3.42Å; V44-I103 HydrophobicContact CG2-CG2 4.26Å
45H75.4Confident72.4Confident50 Ų5064.6 Ų64.623%0.23132%0.323CS..Hα-helixtrans-70-36.2179.5-68.5-53.3000113.2V36 A42 P43 L49V36-H45 HydrophobicContact CG2-CB 4.04Å; A42-H45 WeakPolarHBondContact O-CB 3.46Å; A42-H45 PolarHBondContact O-N 3.23Å; P43-H45 VanDerWaalsContact C-N 3.26Å; P43-H45 PolarHBondContact O-N 3.34Å; H45-L49 WeakPolarHBondContact O-CB 3.19Å; H45-L49 PolarHBondContact O-N 3.45Å
46I74.3Confident73.3Confident66 Ų6658.1 Ų58.134%0.33830%0.3SS..Hα-helixtrans-65.9-38.1173.9-59.8172.3000109.2P43 L49 N50 Y125P43-I46 PolarHBondContact O-N 3Å; I46-L49 PolarHBondContact O-N 3.25Å; I46-N50 PolarHBondContact O-N 3.18Å; I46-N50 PolarHBondContact O-ND2 2.91Å; I46-Y125 HydrophobicContact CB-CE2 4.29Å; I46-Y125 HydrophobicContact CG2-CD2 4.08Å; I46-Y125 HydrophobicContact CG2-CE2 4.24Å
47L74.4Confident74.2Confident2 Ų260.2 Ų60.21%0.0131%0.309CS..Hα-helixtrans-68.1-45.2-179.6-150.247.3000113.2P43 V44 L49 N50 L51 L99 G102 I103 E106 Y125P43-L47 PolarHBondContact O-N 3.24Å; V44-L47 WeakPolarHBondContact O-CB 3.25Å; V44-L47 PolarHBondContact O-N 2.88Å; L47-L49 VanDerWaalsContact C-N 3.3Å; L47-L49 PolarHBondContact O-N 2.86Å; L47-N50 PolarHBondContact O-N 2.87Å; L47-L51 WeakPolarHBondContact O-CB 3.34Å; L47-L51 PolarHBondContact O-N 3.44Å; L47-L99 HydrophobicContact CD1-CD2 3.64Å; L47-G102 VanDerWaalsContact CD2-C 3.5Å; L47-I103 HydrophobicContact CB-CG1 4.04Å; L47-I103 HydrophobicContact CD2-CB 4.42Å; L47-I103 HydrophobicContact CD2-CG1 3.69Å; L47-I103 HydrophobicContact CG-CD1 4.48Å; L47-I103 HydrophobicContact CG-CG1 3.71Å; L47-E106 HydrophobicContact CD2-CG 4.14Å; L47-Y125 HydrophobicContact CB-CE1 4.16Å; L47-Y125 HydrophobicContact CD1-CD1 3.24Å; L47-Y125 HydrophobicContact CD1-CE1 2.89Å; L47-Y125 HydrophobicContact CD1-CG 4.29Å; L47-Y125 HydrophobicContact CD2-CE1 3.64Å; L47-Y125 WeakPolarHBondContact CD2-OH 3.3Å; L47-Y125 HydrophobicContact CG-CD1 4.45Å; L47-Y125 HydrophobicContact CG-CE1 3.7Å
48L78.4Confident75.2Confident38 Ų3851.4 Ų51.420%0.19928%0.278CS..Hα-helixtrans-62.3-37171.1-87.3122.3000112.1F32 V44 L51 T52 I103F32-L48 HydrophobicContact CD2-CB 4.09Å; F32-L48 HydrophobicContact CE1-CD2 4.08Å; F32-L48 HydrophobicContact CE2-CB 3.94Å; F32-L48 HydrophobicContact CE2-CD2 3.68Å; F32-L48 HydrophobicContact CE2-CG 4.45Å; F32-L48 HydrophobicContact CG-CB 4.49Å; F32-L48 HydrophobicContact CZ-CB 4.22Å; F32-L48 HydrophobicContact CZ-CD2 3.38Å; F32-L48 HydrophobicContact CZ-CG 4.36Å; V44-L48 HydrophobicContact CB-CD1 4.48Å; V44-L48 HydrophobicContact CG2-CD1 3.57Å; V44-L48 WeakPolarHBondContact O-CB 3.48Å; V44-L48 WeakPolarHBondContact O-CD1 3.47Å; V44-L48 PolarHBondContact O-N 3.42Å; L48-L51 PolarHBondContact O-N 3.43Å; L48-T52 WeakPolarHBondContact O-CG2 3.25Å; L48-T52 PolarHBondContact O-N 3.44Å; L48-T52 PolarHBondContact O-OG1 3.4Å; L48-I103 HydrophobicContact CG-CD1 4.05Å
49L80.1Confident76.2Confident34 Ų3445.9 Ų45.918%0.17825%0.253CS..Hα-helixtrans-65.5-46.1177.1-171.3134.1000111.5L29 V36 H45 I46 L47 L51 T52 L53L29-L49 HydrophobicContact CD1-CD1 4.4Å; L29-L49 HydrophobicContact CD1-CG 4.25Å; V36-L49 HydrophobicContact CG2-CD1 4.22Å; H45-L49 WeakPolarHBondContact O-CB 3.19Å; H45-L49 PolarHBondContact O-N 3.45Å; I46-L49 PolarHBondContact O-N 3.25Å; L47-L49 VanDerWaalsContact C-N 3.3Å; L47-L49 PolarHBondContact O-N 2.86Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 3.23Å; L49-T52 PolarHBondContact O-N 2.86Å; L49-T52 PolarHBondContact O-OG1 3.35Å; L49-L53 HydrophobicContact CD2-CD1 3.74Å; L49-L53 HydrophobicContact CD2-CG 4.49Å; L49-L53 WeakPolarHBondContact O-CG 3.36Å; L49-L53 PolarHBondContact O-N 2.89Å
50N81.1Confident77.9Confident62 Ų6245.2 Ų45.233%0.33224%0.242SC..Hα-helixtrans-60.2-38.8173.8-77.6-34.4000112.3I46 L47 L53 A54 L99I46-N50 PolarHBondContact O-N 3.18Å; I46-N50 PolarHBondContact O-ND2 2.91Å; L47-N50 PolarHBondContact O-N 2.87Å; N50-L53 PolarHBondContact O-N 2.83Å; N50-A54 PolarHBondContact O-N 2.87Å; N50-L99 HydrophobicContact CB-CD1 4.22Å; N50-L99 HydrophobicContact CB-CD2 4.03Å
51L81.7Confident79.2Confident17 Ų1738.1 Ų38.19%0.08921%0.209CC..Hα-helixtrans-62-49.9175.7-17966.8000111.1L47 L48 L49 L53 A54 D55 S96 L99 L100 I103L47-L51 WeakPolarHBondContact O-CB 3.34Å; L47-L51 PolarHBondContact O-N 3.44Å; L48-L51 PolarHBondContact O-N 3.43Å; L49-L51 VanDerWaalsContact C-N 3.29Å; L49-L51 PolarHBondContact O-N 3.23Å; L51-L53 VanDerWaalsContact C-N 3.26Å; L51-L53 PolarHBondContact O-N 3.25Å; L51-A54 PolarHBondContact O-N 2.78Å; L51-A54 VanDerWaalsContact O-N 3.13Å; L51-D55 PolarHBondContact O-N 3.03Å; L51-S96 VanDerWaalsContact CD1-CA 3.49Å; L51-L99 HydrophobicContact CB-CB 4.27Å; L51-L99 HydrophobicContact CB-CD1 4.17Å; L51-L99 HydrophobicContact CD1-CB 3.97Å; L51-L99 HydrophobicContact CD1-CD1 4.29Å; L51-L100 HydrophobicContact CD1-CG 4.22Å; L51-L100 HydrophobicContact CD2-CD2 3.75Å; L51-L100 HydrophobicContact CD2-CG 4.14Å; L51-I103 HydrophobicContact CD2-CD1 3.8Å
52T86.2Confident80.4Confident6 Ų636.5 Ų36.54%0.03720%0.198CC..Hα-helixtrans-62.4-32.5178.455.60000113.2A28 F32 L48 L49 L56A28-T52 HydrophobicContact CB-CG2 3.85Å; F32-T52 HydrophobicContact CD2-CG2 3.82Å; F32-T52 HydrophobicContact CE2-CG2 3.73Å; L48-T52 WeakPolarHBondContact O-CG2 3.25Å; L48-T52 PolarHBondContact O-N 3.44Å; L48-T52 PolarHBondContact O-OG1 3.4Å; L49-T52 PolarHBondContact O-N 2.86Å; L49-T52 PolarHBondContact O-OG1 3.35Å; T52-L56 WeakPolarHBondContact O-CB 3.28Å; T52-L56 VanDerWaalsContact O-CG 3.26Å; T52-L56 WeakPolarHBondContact O-CG 3.41Å; T52-L56 PolarHBondContact O-N 3.14Å
53L82.3Confident81.1Confident81 Ų8137.1 Ų37.142%0.42420%0.2SC..Hα-helixtrans-70.1-41.3174.9-72.6172.7000111.8L29 L49 N50 L51 L56 L57L29-L53 HydrophobicContact CD1-CD2 3.99Å; L29-L53 HydrophobicContact CD1-CG 4.23Å; L29-L53 HydrophobicContact CD2-CD2 4.38Å; L49-L53 HydrophobicContact CD2-CD1 3.74Å; L49-L53 HydrophobicContact CD2-CG 4.49Å; L49-L53 WeakPolarHBondContact O-CG 3.36Å; L49-L53 PolarHBondContact O-N 2.89Å; N50-L53 PolarHBondContact O-N 2.83Å; L51-L53 VanDerWaalsContact C-N 3.26Å; L51-L53 PolarHBondContact O-N 3.25Å; L53-L56 PolarHBondContact O-N 3.31Å; L53-L57 PolarHBondContact O-N 2.94Å
54A83.8Confident82Confident11 Ų1139.8 Ų39.89%0.09121%0.21CC..Hα-helixtrans-62.9-42.9174.500000111.6N50 L51 L57 L58 C95 L99N50-A54 PolarHBondContact O-N 2.87Å; L51-A54 PolarHBondContact O-N 2.78Å; L51-A54 VanDerWaalsContact O-N 3.13Å; A54-L57 WeakPolarHBondContact O-CB 3.29Å; A54-L57 PolarHBondContact O-N 3.42Å; A54-L58 PolarHBondContact O-N 3.03Å; A54-C95 HydrophobicContact CB-CB 4.46Å; A54-L99 HydrophobicContact CB-CD1 4.4Å
55D87.6Confident82.6Confident37 Ų3740.2 Ų40.220%0.19821%0.208CC..Hα-helixtrans-66.5-37.8177.7-66.3-24.9000111.9L51 L58 L59 S96L51-D55 PolarHBondContact O-N 3.03Å; D55-L58 WeakPolarHBondContact O-CB 3.2Å; D55-L58 PolarHBondContact O-N 3.47Å; D55-L59 WeakPolarHBondContact O-CB 3.43Å; D55-L59 WeakPolarHBondContact O-CD1 3.27Å; D55-L59 VanDerWaalsContact O-CG 3.22Å; D55-L59 WeakPolarHBondContact O-CG 3.36Å; D55-L59 PolarHBondContact O-N 3.42Å; D55-S96 PolarHBondContact OD1-OG 2.94Å
56L86.1Confident83Confident24 Ų2439.2 Ų39.213%0.12620%0.204CC..Hα-helixtrans-64.4-40.1172.5-76.4169.9000112.1L22 N25 L29 T52 L53 L59 L60L22-L56 HydrophobicContact CD2-CD2 4.4Å; N25-L56 HydrophobicContact CB-CD2 3.87Å; N25-L56 HydrophobicContact CB-CG 4Å; L29-L56 HydrophobicContact CB-CD1 4.4Å; L29-L56 HydrophobicContact CD2-CD1 3.73Å; T52-L56 WeakPolarHBondContact O-CB 3.28Å; T52-L56 VanDerWaalsContact O-CG 3.26Å; T52-L56 WeakPolarHBondContact O-CG 3.41Å; T52-L56 PolarHBondContact O-N 3.14Å; L53-L56 PolarHBondContact O-N 3.31Å; L56-L59 PolarHBondContact O-N 2.87Å; L56-L60 VanDerWaalsContact O-CG 3.29Å; L56-L60 WeakPolarHBondContact O-CG 3.46Å; L56-L60 PolarHBondContact O-N 3.29Å
57L84Confident83.5Confident93 Ų9339.7 Ų39.749%0.48721%0.21SC..Hα-helixtrans-61.9-44.1175.3-173.467.9000111.1L53 A54 L59 L60 L61L53-L57 PolarHBondContact O-N 2.94Å; A54-L57 WeakPolarHBondContact O-CB 3.29Å; A54-L57 PolarHBondContact O-N 3.42Å; L57-L59 PolarHBondContact O-N 3.43Å; L57-L60 PolarHBondContact O-N 3.41Å; L57-L61 WeakPolarHBondContact O-CG 3.47Å; L57-L61 PolarHBondContact O-N 3.23Å; L57-L61 VanDerWaalsContact O-N 3.15Å
58L84.6Confident83.9Confident30 Ų3040.9 Ų40.916%0.15722%0.216CC..Hα-helixtrans-57.2-48.1173.1-176.980.3000111.5A54 D55 L60 L61 L62 F89 I93A54-L58 PolarHBondContact O-N 3.03Å; D55-L58 WeakPolarHBondContact O-CB 3.2Å; D55-L58 PolarHBondContact O-N 3.47Å; L58-L60 VanDerWaalsContact C-N 3.29Å; L58-L60 PolarHBondContact O-N 2.95Å; L58-L61 PolarHBondContact O-N 2.99Å; L58-L62 HydrophobicContact CG-CD1 4.31Å; L58-L62 PolarHBondContact O-N 2.98Å; L58-F89 HydrophobicContact CD1-CB 4.42Å; L58-F89 HydrophobicContact CD1-CD2 3.39Å; L58-F89 HydrophobicContact CD1-CE2 3.69Å; L58-F89 HydrophobicContact CD1-CG 3.91Å; L58-F89 HydrophobicContact CD1-CZ 4.41Å; L58-F89 WeakPolarHBondContact CD1-O 3.26Å; L58-F89 HydrophobicContact CG-CD2 4.32Å; L58-F89 HydrophobicContact CG-CE2 4.35Å; L58-I93 HydrophobicContact CD1-CG1 4.21Å
59L88Confident83.9Confident6 Ų639.5 Ų39.53%0.03121%0.21CC..Hα-helixtrans-64.7-32.7-179.4-71.8164.1000112.5I17 F18 G21 L22 N25 D55 L56 L57 L61 L62 P63I17-L59 HydrophobicContact CG2-CD2 4.05Å; I17-L59 WeakPolarHBondContact O-CD2 3.26Å; F18-L59 VanDerWaalsContact CD2-O 3.3Å; F18-L59 WeakPolarHBondContact CD2-O 3.2Å; F18-L59 VanDerWaalsContact CE2-O 3.31Å; F18-L59 WeakPolarHBondContact CE2-O 3.32Å; G21-L59 WeakPolarHBondContact O-CD1 3.33Å; L22-L59 HydrophobicContact CG-CB 4.44Å; N25-L59 HydrophobicContact CB-CD1 4.3Å; D55-L59 WeakPolarHBondContact O-CB 3.43Å; D55-L59 WeakPolarHBondContact O-CD1 3.27Å; D55-L59 VanDerWaalsContact O-CG 3.22Å; D55-L59 WeakPolarHBondContact O-CG 3.36Å; D55-L59 PolarHBondContact O-N 3.42Å; L56-L59 PolarHBondContact O-N 2.87Å; L57-L59 PolarHBondContact O-N 3.43Å; L59-L61 VanDerWaalsContact C-N 3.31Å; L59-L62 WeakPolarHBondContact O-CB 3.46Å; L59-L62 PolarHBondContact O-N 2.95Å; L59-P63 WeakPolarHBondContact O-CD 3.49Å
60L85.8Confident83.9Confident105 Ų10541.1 Ų41.155%0.5523%0.228SC..Hα-helixtrans-69.4-27.8172.8-72.9169.3000112.8L56 L57 L58 P63L56-L60 VanDerWaalsContact O-CG 3.29Å; L56-L60 WeakPolarHBondContact O-CG 3.46Å; L56-L60 PolarHBondContact O-N 3.29Å; L57-L60 PolarHBondContact O-N 3.41Å; L58-L60 VanDerWaalsContact C-N 3.29Å; L58-L60 PolarHBondContact O-N 2.95Å; L60-P63 VanDerWaalsContact O-CD 3.3Å; L60-P63 WeakPolarHBondContact O-CD 3.41Å; L60-P63 VanDerWaalsContact O-CG 3.24Å; L60-P63 WeakPolarHBondContact O-CG 3.38Å
61L83.9Confident84Confident22 Ų2239.4 Ų39.412%0.11522%0.221CC..Hα-helixtrans-84.7-24.1176-65.2174.3000113.1L57 L58 L59 F64 R65 T85 G88L57-L61 WeakPolarHBondContact O-CG 3.47Å; L57-L61 PolarHBondContact O-N 3.23Å; L57-L61 VanDerWaalsContact O-N 3.15Å; L58-L61 PolarHBondContact O-N 2.99Å; L59-L61 VanDerWaalsContact C-N 3.31Å; L61-F64 WeakPolarHBondContact O-CB 3.15Å; L61-F64 PolarHBondContact O-N 2.97Å; L61-R65 PolarHBondContact O-N 3.15Å; L61-T85 HydrophobicContact CB-CG2 4.48Å; L61-G88 VanDerWaalsContact CD1-CA 3.47Å
62L85.6Confident83.8Confident3 Ų344 Ų442%0.01625%0.245CC..Hα-helixtrans-52.5-44.4175.9-125.5102.2000115.4Y14 I17 F18 L58 L59 F64 R65 I66 F89Y14-L62 HydrophobicContact CD1-CD2 4.42Å; Y14-L62 HydrophobicContact CG-CD2 4.34Å; Y14-L62 WeakPolarHBondContact O-CD2 3.41Å; I17-L62 HydrophobicContact CB-CD2 4.22Å; I17-L62 HydrophobicContact CG2-CD1 4.42Å; I17-L62 HydrophobicContact CG2-CD2 4.12Å; F18-L62 HydrophobicContact CB-CD2 4.03Å; F18-L62 HydrophobicContact CD2-CB 4.36Å; L58-L62 HydrophobicContact CG-CD1 4.31Å; L58-L62 PolarHBondContact O-N 2.98Å; L59-L62 WeakPolarHBondContact O-CB 3.46Å; L59-L62 PolarHBondContact O-N 2.95Å; L62-F64 PolarHBondContact O-N 3.13Å; L62-R65 WeakPolarHBondContact O-CA 3.48Å; L62-R65 WeakPolarHBondContact O-CB 3.44Å; L62-R65 PolarHBondContact O-N 2.92Å; L62-I66 WeakPolarHBondContact O-CG1 3.37Å; L62-I66 PolarHBondContact O-N 3.28Å; L62-F89 HydrophobicContact CD1-CE2 3.94Å
63P83.7Confident83.2Confident45 Ų4548.9 Ų48.929%0.29227%0.266SS..Hα-helixtrans-60.7-32.7179.121.5-34.2000113F18 L59 L60 R65 I66 V67F18-P63 HydrophobicContact CE2-CG 4.18Å; L59-P63 WeakPolarHBondContact O-CD 3.49Å; L60-P63 VanDerWaalsContact O-CD 3.3Å; L60-P63 WeakPolarHBondContact O-CD 3.41Å; L60-P63 VanDerWaalsContact O-CG 3.24Å; L60-P63 WeakPolarHBondContact O-CG 3.38Å; P63-R65 VanDerWaalsContact C-N 3.32Å; P63-R65 PolarHBondContact O-N 3Å; P63-I66 PolarHBondContact O-N 3.41Å; P63-V67 WeakPolarHBondContact O-CG2 3.42Å; P63-V67 PolarHBondContact O-N 2.92Å
64F84.5Confident82.9Confident75 Ų7552.1 Ų52.133%0.32927%0.273SS..Hα-helixtrans-65.6-36.8174.3-63.6-84.6000111.7L61 L62 V67 E68 W75 L77 V81 T85L61-F64 WeakPolarHBondContact O-CB 3.15Å; L61-F64 PolarHBondContact O-N 2.97Å; L62-F64 PolarHBondContact O-N 3.13Å; F64-V67 PolarHBondContact O-N 3.44Å; F64-E68 PolarHBondContact O-N 2.74Å; F64-E68 VanDerWaalsContact O-N 3.1Å; F64-W75 HydrophobicContact CB-CH2 4.14Å; F64-L77 HydrophobicContact CD1-CD2 3.89Å; F64-L77 HydrophobicContact CE1-CD2 3.96Å; F64-V81 HydrophobicContact CD1-CG1 4.13Å; F64-V81 HydrophobicContact CE1-CG1 4.2Å; F64-T85 HydrophobicContact CB-CG2 3.73Å
65R83.1Confident82.6Confident38 Ų3854.2 Ų54.214%0.14328%0.278CS..Hα-helixtrans-69.5-35.1172.5-68.3-60.9-163.6173.75.4113Y14 L61 L62 P63 E68 A69 T85Y14-R65 HydrophobicContact CD2-CB 4.28Å; Y14-R65 HydrophobicContact CE2-CB 4.03Å; L61-R65 PolarHBondContact O-N 3.15Å; L62-R65 WeakPolarHBondContact O-CA 3.48Å; L62-R65 WeakPolarHBondContact O-CB 3.44Å; L62-R65 PolarHBondContact O-N 2.92Å; P63-R65 VanDerWaalsContact C-N 3.32Å; P63-R65 PolarHBondContact O-N 3Å; R65-E68 VanDerWaalsContact CD-OE2 3.3Å; R65-E68 WeakPolarHBondContact CD-OE2 3.04Å; R65-E68 IonicContact CZ-OE2 3.71Å; R65-E68 IonicContact NE-OE2 3.94Å; R65-E68 IonicContact NH1-OE1 3.47Å; R65-E68 PolarHBondContact NH1-OE1 3.32Å; R65-E68 IonicContact NH1-OE2 2.72Å; R65-E68 PolarHBondContact NH1-OE2 2.89Å; R65-E68 PolarHBondContact O-N 2.83Å; R65-A69 WeakPolarHBondContact O-CB 3.49Å; R65-A69 PolarHBondContact O-N 2.86Å; R65-T85 HydrophobicContact CG-CG2 3.95Å
66I84.7Confident82.1Confident29 Ų2960.1 Ų60.115%0.14930%0.299CS..Hα-helixtrans-63.5-43.8174.5-65.9168000110.3L11 Y14 I15 L62 P63 A69 A70L11-I66 HydrophobicContact CD1-CG2 4.12Å; L11-I66 HydrophobicContact CG-CG2 4.45Å; Y14-I66 HydrophobicContact CD2-CG1 4.27Å; Y14-I66 HydrophobicContact CG-CG1 4.39Å; I15-I66 HydrophobicContact CG1-CD1 3.94Å; I15-I66 HydrophobicContact CG1-CG1 4.49Å; I15-I66 HydrophobicContact CG1-CG2 4.24Å; L62-I66 WeakPolarHBondContact O-CG1 3.37Å; L62-I66 PolarHBondContact O-N 3.28Å; P63-I66 PolarHBondContact O-N 3.41Å; I66-A69 PolarHBondContact O-N 3.39Å; I66-A70 VanDerWaalsContact O-CB 3.3Å; I66-A70 WeakPolarHBondContact O-CB 3.42Å; I66-A70 PolarHBondContact O-N 2.66Å
67V84.3Confident81.7Confident75 Ų7561.8 Ų61.846%0.45531%0.308SS..Hα-helixtrans-64.2-40.1177.21730000111.5P63 F64 S71 L77P63-V67 WeakPolarHBondContact O-CG2 3.42Å; P63-V67 PolarHBondContact O-N 2.92Å; F64-V67 PolarHBondContact O-N 3.44Å; V67-S71 WeakPolarHBondContact O-CB 3.05Å; V67-S71 PolarHBondContact O-N 3.28Å; V67-S71 VanDerWaalsContact O-N 3.08Å; V67-S71 PolarHBondContact O-OG 3.19Å; V67-L77 HydrophobicContact CG1-CD1 4.43Å
68E82.2Confident81.7Confident28 Ų2861.3 Ų61.313%0.13131%0.31CS..Hα-helixtrans-61.5-48.6173.5179.8-177.5-122.200111.8F64 R65 S71 F73 W75F64-E68 PolarHBondContact O-N 2.74Å; F64-E68 VanDerWaalsContact O-N 3.1Å; R65-E68 VanDerWaalsContact CD-OE2 3.3Å; R65-E68 WeakPolarHBondContact CD-OE2 3.04Å; R65-E68 IonicContact CZ-OE2 3.71Å; R65-E68 IonicContact NE-OE2 3.94Å; R65-E68 IonicContact NH1-OE1 3.47Å; R65-E68 PolarHBondContact NH1-OE1 3.32Å; R65-E68 IonicContact NH1-OE2 2.72Å; R65-E68 PolarHBondContact NH1-OE2 2.89Å; R65-E68 PolarHBondContact O-N 2.83Å; E68-S71 WeakPolarHBondContact O-CB 3.31Å; E68-S71 PolarHBondContact O-N 2.9Å; E68-S71 VanDerWaalsContact O-N 3.13Å; E68-F73 VanDerWaalsContact O-CA 3.23Å; E68-F73 WeakPolarHBondContact O-CA 3.34Å; E68-F73 PolarHBondContact O-N 3.48Å; E68-W75 HydrophobicContact CB-CE3 3.8Å; E68-W75 HydrophobicContact CB-CZ3 3.93Å; E68-W75 HydrophobicContact CG-CE3 3.84Å; E68-W75 HydrophobicContact CG-CZ3 4.33Å; E68-W75 VanDerWaalsContact OE1-CE3 3.26Å
69A79.4Confident81.3Confident9 Ų968.9 Ų68.97%0.07434%0.342CS..Hα-helixtrans-64.2-41.3178.900000112.2L11 R65 I66 S71 N72L11-A69 HydrophobicContact CD1-CB 4.12Å; R65-A69 WeakPolarHBondContact O-CB 3.49Å; R65-A69 PolarHBondContact O-N 2.86Å; I66-A69 PolarHBondContact O-N 3.39Å; A69-S71 PolarHBondContact O-N 3.24Å; A69-N72 PolarHBondContact O-N 2.96Å
70A79.4Confident80.7Confident67 Ų6775.2 Ų75.255%0.55437%0.374SS*.Hα-helixtrans-63.2-27.2174.700000112.6L11 I66 N72L11-A70 HydrophobicContact CD1-CB 3.83Å; I66-A70 VanDerWaalsContact O-CB 3.3Å; I66-A70 WeakPolarHBondContact O-CB 3.42Å; I66-A70 PolarHBondContact O-N 2.66Å; A70-N72 VanDerWaalsContact C-N 3.25Å; A70-N72 PolarHBondContact O-N 3.33Å
71S82.4Confident80.2Confident27 Ų2772 Ų7219%0.18936%0.359CS..THydrogen-bonded Turntrans-8617.7-178.8-66.90000113.8V67 E68 A69 F73 R74V67-S71 WeakPolarHBondContact O-CB 3.05Å; V67-S71 PolarHBondContact O-N 3.28Å; V67-S71 VanDerWaalsContact O-N 3.08Å; V67-S71 PolarHBondContact O-OG 3.19Å; E68-S71 WeakPolarHBondContact O-CB 3.31Å; E68-S71 PolarHBondContact O-N 2.9Å; E68-S71 VanDerWaalsContact O-N 3.13Å; A69-S71 PolarHBondContact O-N 3.24Å; S71-F73 VanDerWaalsContact C-N 3.32Å; S71-R74 WeakPolarHBondContact CB-O 3.38Å; S71-R74 VanDerWaalsContact O-CB 3.31Å; S71-R74 WeakPolarHBondContact O-CB 3.18Å; S71-R74 PolarHBondContact O-N 3.35Å
72N77.9Confident80.1Confident113 Ų11373 Ų7360%0.60437%0.367SS*.THydrogen-bonded Turntrans56.742.4-169.7-62.3-81.6000112.5A69 A70 R74A69-N72 PolarHBondContact O-N 2.96Å; A70-N72 VanDerWaalsContact C-N 3.25Å; A70-N72 PolarHBondContact O-N 3.33Å; N72-R74 PolarHBondContact O-N 3.38Å; N72-R74 VanDerWaalsContact O-N 3.12Å
73F74.4Confident79.7Confident109 Ų10974.5 Ų74.548%0.47838%0.38SS..THydrogen-bonded Turntrans58.621.5-175.5-58.2-84.9000114.1I10 E68 S71I10-F73 HydrophobicContact CD1-CZ 4.44Å; E68-F73 VanDerWaalsContact O-CA 3.23Å; E68-F73 WeakPolarHBondContact O-CA 3.34Å; E68-F73 PolarHBondContact O-N 3.48Å; S71-F73 VanDerWaalsContact C-N 3.32Å
74R75.7Confident79.4Confident149 Ų14977.6 Ų77.656%0.56239%0.393SS*.  trans-91.7118.5172-60.7-163.7-68.8-135.8-0.7109.6S71 N72 Y76S71-R74 WeakPolarHBondContact CB-O 3.38Å; S71-R74 VanDerWaalsContact O-CB 3.31Å; S71-R74 WeakPolarHBondContact O-CB 3.18Å; S71-R74 PolarHBondContact O-N 3.35Å; N72-R74 PolarHBondContact O-N 3.38Å; N72-R74 VanDerWaalsContact O-N 3.12Å; R74-Y76 HydrophobicContact CB-CD2 4.49Å; R74-Y76 HydrophobicContact CB-CE2 3.8Å; R74-Y76 PolarHBondContact NE-OH 2.93Å; R74-Y76 PolarHBondContact NH2-OH 3.39Å; R74-Y76 VanDerWaalsContact O-CD2 3.3Å; R74-Y76 WeakPolarHBondContact O-CD2 3.23Å
75W77.3Confident79.2Confident55 Ų5574.1 Ų74.121%0.20838%0.378CS..  trans-86111.8179.5-170.6-89.5000111.1F64 E68 L77 P78 V81 C82 T85F64-W75 HydrophobicContact CB-CH2 4.14Å; E68-W75 HydrophobicContact CB-CE3 3.8Å; E68-W75 HydrophobicContact CB-CZ3 3.93Å; E68-W75 HydrophobicContact CG-CE3 3.84Å; E68-W75 HydrophobicContact CG-CZ3 4.33Å; E68-W75 VanDerWaalsContact OE1-CE3 3.26Å; W75-L77 HydrophobicContact CZ2-CB 3.69Å; W75-L77 HydrophobicContact CZ2-CD1 4.48Å; W75-L77 HydrophobicContact CZ2-CG 4.48Å; W75-L77 VanDerWaalsContact NE1-C 3.3Å; W75-L77 VanDerWaalsContact NE1-CB 3.33Å; W75-L77 PolarHBondContact NE1-O 2.87Å; W75-P78 PolarHBondContact NE1-O 3.25Å; W75-V81 HydrophobicContact CH2-CG1 4.5Å; W75-V81 HydrophobicContact CZ2-CB 4.02Å; W75-V81 HydrophobicContact CZ2-CG1 3.91Å; W75-C82 HydrophobicContact CD2-CB 3.79Å; W75-C82 VanDerWaalsContact CE2-CA 3.42Å; W75-C82 VanDerWaalsContact CE2-CB 3.42Å; W75-C82 HydrophobicContact CG-CB 4Å; W75-C82 HydrophobicContact CZ2-CB 3.9Å; W75-T85 HydrophobicContact CH2-CG2 4.28Å
76Y77Confident79Confident160 Ų16072.8 Ų72.863%0.62738%0.376SS*.  trans-98.3-11.4180-66.1-78.3000113.9R74R74-Y76 HydrophobicContact CB-CD2 4.49Å; R74-Y76 HydrophobicContact CB-CE2 3.8Å; R74-Y76 PolarHBondContact NE-OH 2.93Å; R74-Y76 PolarHBondContact NH2-OH 3.39Å; R74-Y76 VanDerWaalsContact O-CD2 3.3Å; R74-Y76 WeakPolarHBondContact O-CD2 3.23Å
77L78.4Confident78.6Confident60 Ų6074.4 Ų74.431%0.31438%0.383SS..SBendtrans-79169.3177.3-81.295.9000111.3F64 V67 W75 V81F64-L77 HydrophobicContact CD1-CD2 3.89Å; F64-L77 HydrophobicContact CE1-CD2 3.96Å; V67-L77 HydrophobicContact CG1-CD1 4.43Å; W75-L77 HydrophobicContact CZ2-CB 3.69Å; W75-L77 HydrophobicContact CZ2-CD1 4.48Å; W75-L77 HydrophobicContact CZ2-CG 4.48Å; W75-L77 VanDerWaalsContact NE1-C 3.3Å; W75-L77 VanDerWaalsContact NE1-CB 3.33Å; W75-L77 PolarHBondContact NE1-O 2.87Å; L77-V81 HydrophobicContact CB-CB 4.36Å; L77-V81 HydrophobicContact CD2-CB 4.41Å; L77-V81 HydrophobicContact CD2-CG1 3.91Å
78P82.9Confident78.3Confident82 Ų8271.3 Ų71.353%0.53237%0.366SS..  trans-56.3146.9175.5-22.131.6000111.9W75 I80 V81 C82W75-P78 PolarHBondContact NE1-O 3.25Å; P78-I80 PolarHBondContact O-N 3.4Å; P78-I80 VanDerWaalsContact O-N 3.16Å; P78-V81 HydrophobicContact CB-CG2 4.15Å; P78-V81 HydrophobicContact CG-CG2 4.12Å; P78-V81 PolarHBondContact O-N 2.91Å; P78-C82 PolarHBondContact O-N 3.49Å
79K77.3Confident78.2Confident189 Ų18971.5 Ų71.582%0.82237%0.366SS*.Hα-helixtrans-54.5-35177.6-68.3-177.1178.6-177.20112.8V81 C82 A83K79-V81 VanDerWaalsContact C-N 3.3Å; K79-V81 PolarHBondContact O-N 3.46Å; K79-C82 WeakPolarHBondContact O-CB 3.39Å; K79-C82 PolarHBondContact O-N 3.06Å; K79-A83 PolarHBondContact O-N 2.87Å
80I74.8Confident78.2Confident139 Ų13977.6 Ų77.671%0.71339%0.388SS*.Hα-helixtrans-60.8-41.1176.9-61.8163.8000110.7P78 A83 L84P78-I80 PolarHBondContact O-N 3.4Å; P78-I80 VanDerWaalsContact O-N 3.16Å; I80-A83 PolarHBondContact O-N 2.92Å; I80-L84 VanDerWaalsContact O-CB 3.3Å; I80-L84 WeakPolarHBondContact O-CB 3.24Å; I80-L84 PolarHBondContact O-N 2.97Å
81V76.1Confident78Confident38 Ų3875.4 Ų75.423%0.2337%0.369CS..Hα-helixtrans-71.1-37.5179-171.20000110.4F64 W75 L77 P78 K79 A83 L84 T85F64-V81 HydrophobicContact CD1-CG1 4.13Å; F64-V81 HydrophobicContact CE1-CG1 4.2Å; W75-V81 HydrophobicContact CH2-CG1 4.5Å; W75-V81 HydrophobicContact CZ2-CB 4.02Å; W75-V81 HydrophobicContact CZ2-CG1 3.91Å; L77-V81 HydrophobicContact CB-CB 4.36Å; L77-V81 HydrophobicContact CD2-CB 4.41Å; L77-V81 HydrophobicContact CD2-CG1 3.91Å; P78-V81 HydrophobicContact CB-CG2 4.15Å; P78-V81 HydrophobicContact CG-CG2 4.12Å; P78-V81 PolarHBondContact O-N 2.91Å; K79-V81 VanDerWaalsContact C-N 3.3Å; K79-V81 PolarHBondContact O-N 3.46Å; V81-A83 PolarHBondContact O-N 3.03Å; V81-L84 PolarHBondContact O-N 3.41Å; V81-T85 VanDerWaalsContact O-CB 3.3Å; V81-T85 WeakPolarHBondContact O-CB 3.3Å; V81-T85 PolarHBondContact O-N 3.47Å; V81-T85 PolarHBondContact O-OG1 3.25Å
82C81Confident78Confident43 Ų4374.3 Ų74.329%0.29136%0.361SS..Hα-helixtrans-56.9-52174-172.60000111.2W75 P78 K79 L84 T85 G86W75-C82 HydrophobicContact CD2-CB 3.79Å; W75-C82 VanDerWaalsContact CE2-CA 3.42Å; W75-C82 VanDerWaalsContact CE2-CB 3.42Å; W75-C82 HydrophobicContact CG-CB 4Å; W75-C82 HydrophobicContact CZ2-CB 3.9Å; P78-C82 PolarHBondContact O-N 3.49Å; K79-C82 WeakPolarHBondContact O-CB 3.39Å; K79-C82 PolarHBondContact O-N 3.06Å; C82-L84 PolarHBondContact O-N 2.88Å; C82-T85 PolarHBondContact O-N 3.29Å; C82-G86 PolarHBondContact O-N 2.94Å
83A77.3Confident78.1Confident34 Ų3472.2 Ų72.228%0.28135%0.349SS..Hα-helixtrans-59.9-47.817900000110.9K79 I80 V81 T85 G86 F87K79-A83 PolarHBondContact O-N 2.87Å; I80-A83 PolarHBondContact O-N 2.92Å; V81-A83 PolarHBondContact O-N 3.03Å; A83-T85 PolarHBondContact O-N 3.48Å; A83-G86 PolarHBondContact O-N 3.38Å; A83-F87 WeakPolarHBondContact O-CB 3.22Å; A83-F87 PolarHBondContact O-N 3.06Å
84L77.3Confident78.4Confident110 Ų11074 Ų7458%0.57635%0.354SS*.Hα-helixtrans-64-41.9179.6-167.972.1000112.6I80 V81 C82 G88I80-L84 VanDerWaalsContact O-CB 3.3Å; I80-L84 WeakPolarHBondContact O-CB 3.24Å; I80-L84 PolarHBondContact O-N 2.97Å; V81-L84 PolarHBondContact O-N 3.41Å; C82-L84 PolarHBondContact O-N 2.88Å; L84-G88 WeakPolarHBondContact O-CA 3.09Å; L84-G88 PolarHBondContact O-N 3.4Å
85T80.3Confident78.3Confident2 Ų268.3 Ų68.31%0.01234%0.337CS..Hα-helixtrans-65.6-44.9177.2-60.60000111L61 F64 R65 W75 V81 C82 A83 F89L61-T85 HydrophobicContact CB-CG2 4.48Å; F64-T85 HydrophobicContact CB-CG2 3.73Å; R65-T85 HydrophobicContact CG-CG2 3.95Å; W75-T85 HydrophobicContact CH2-CG2 4.28Å; V81-T85 VanDerWaalsContact O-CB 3.3Å; V81-T85 WeakPolarHBondContact O-CB 3.3Å; V81-T85 PolarHBondContact O-N 3.47Å; V81-T85 PolarHBondContact O-OG1 3.25Å; C82-T85 PolarHBondContact O-N 3.29Å; A83-T85 PolarHBondContact O-N 3.48Å; T85-F89 VanDerWaalsContact O-CB 3.23Å; T85-F89 WeakPolarHBondContact O-CB 3.46Å; T85-F89 PolarHBondContact O-N 3.48Å
86G78.4Confident78.5Confident10 Ų1066.2 Ų66.210%0.10333%0.331CS..Hα-helixtrans-64.9-52177.300000112.2C82 A83 G88 F89 Y90C82-G86 PolarHBondContact O-N 2.94Å; A83-G86 PolarHBondContact O-N 3.38Å; G86-G88 PolarHBondContact O-N 3.15Å; G86-F89 PolarHBondContact O-N 3.16Å; G86-Y90 WeakPolarHBondContact O-CD2 3.44Å; G86-Y90 PolarHBondContact O-N 3.19Å; G86-Y90 VanDerWaalsContact O-N 3.11Å
87F77.3Confident78.7Confident63 Ų6362.5 Ų62.528%0.27633%0.325SS..Hα-helixtrans-57.2-50.2177.7177.9-102.7000112.6A83 F89 Y90 S91 M136 H140A83-F87 WeakPolarHBondContact O-CB 3.22Å; A83-F87 PolarHBondContact O-N 3.06Å; F87-F89 VanDerWaalsContact C-N 3.29Å; F87-F89 PolarHBondContact O-N 3.21Å; F87-Y90 PolarHBondContact O-N 2.94Å; F87-S91 WeakPolarHBondContact O-CB 3.24Å; F87-S91 PolarHBondContact O-N 3.48Å; F87-M136 HydrophobicContact CD1-SD 4.47Å; F87-M136 HydrophobicContact CE1-CB 4.33Å; F87-M136 HydrophobicContact CE1-CG 4.02Å; F87-M136 HydrophobicContact CE1-SD 3.38Å; F87-M136 WeakPolarHBondContact CE1-SD 3.21Å; F87-M136 HydrophobicContact CE2-CB 4.19Å; F87-M136 HydrophobicContact CE2-CG 4.04Å; F87-M136 HydrophobicContact CE2-SD 4.44Å; F87-M136 HydrophobicContact CZ-CB 3.45Å; F87-M136 VanDerWaalsContact CZ-CB 3.45Å; F87-M136 HydrophobicContact CZ-CG 3.36Å; F87-M136 WeakPolarHBondContact CZ-O 3.44Å; F87-M136 HydrophobicContact CZ-SD 3.41Å; F87-M136 WeakPolarHBondContact CZ-SD 3.45Å; F87-H140 AromaticContact CD2-CD2 3.84Å
88G76.9Confident78.5Confident10 Ų1067 Ų6710%0.10334%0.338CS..Hα-helixtrans-64.1-34.4179.900000112.6L61 L84 G86 S92L61-G88 VanDerWaalsContact CD1-CA 3.47Å; L84-G88 WeakPolarHBondContact O-CA 3.09Å; L84-G88 PolarHBondContact O-N 3.4Å; G86-G88 PolarHBondContact O-N 3.15Å; G88-S92 WeakPolarHBondContact O-CB 3.36Å; G88-S92 PolarHBondContact O-N 2.96Å; G88-S92 PolarHBondContact O-OG 2.9Å
89F80.8Confident78.2Confident32 Ų3263.6 Ų63.614%0.1432%0.315CS..Hα-helixtrans-64.5-52.5176-171.5-93.5000111.7L58 L62 T85 G86 F87 S92 I93L58-F89 HydrophobicContact CD1-CB 4.42Å; L58-F89 HydrophobicContact CD1-CD2 3.39Å; L58-F89 HydrophobicContact CD1-CE2 3.69Å; L58-F89 HydrophobicContact CD1-CG 3.91Å; L58-F89 HydrophobicContact CD1-CZ 4.41Å; L58-F89 WeakPolarHBondContact CD1-O 3.26Å; L58-F89 HydrophobicContact CG-CD2 4.32Å; L58-F89 HydrophobicContact CG-CE2 4.35Å; L62-F89 HydrophobicContact CD1-CE2 3.94Å; T85-F89 VanDerWaalsContact O-CB 3.23Å; T85-F89 WeakPolarHBondContact O-CB 3.46Å; T85-F89 PolarHBondContact O-N 3.48Å; G86-F89 PolarHBondContact O-N 3.16Å; F87-F89 VanDerWaalsContact C-N 3.29Å; F87-F89 PolarHBondContact O-N 3.21Å; F89-S92 PolarHBondContact O-N 3.43Å; F89-I93 HydrophobicContact CD1-CD1 3.75Å; F89-I93 HydrophobicContact CE1-CD1 3.44Å; F89-I93 VanDerWaalsContact CE1-CD1 3.44Å; F89-I93 HydrophobicContact CZ-CD1 4.07Å; F89-I93 WeakPolarHBondContact O-CG1 3.49Å; F89-I93 PolarHBondContact O-N 3.38Å
90Y78.9Confident78.3Confident137 Ų13759.3 Ų59.354%0.53730%0.3SS..Hα-helixtrans-65.4-44.8178.4-70-68.3000111.9G86 F87 S92 I93 Y94G86-Y90 WeakPolarHBondContact O-CD2 3.44Å; G86-Y90 PolarHBondContact O-N 3.19Å; G86-Y90 VanDerWaalsContact O-N 3.11Å; F87-Y90 PolarHBondContact O-N 2.94Å; Y90-S92 VanDerWaalsContact C-N 3.32Å; Y90-S92 PolarHBondContact O-N 3.49Å; Y90-I93 PolarHBondContact O-N 3.02Å; Y90-Y94 WeakPolarHBondContact O-CD2 3.44Å; Y90-Y94 PolarHBondContact O-N 3.25Å
91S76.9Confident78.5Confident22 Ų2255.2 Ų55.215%0.15429%0.287CS..Hα-helixtrans-58.7-43.6178.5179.40000111.9F87 I93 Y94 C95 M136F87-S91 WeakPolarHBondContact O-CB 3.24Å; F87-S91 PolarHBondContact O-N 3.48Å; S91-I93 PolarHBondContact O-N 2.92Å; S91-Y94 PolarHBondContact O-N 2.79Å; S91-C95 VanDerWaalsContact O-CB 3.27Å; S91-C95 WeakPolarHBondContact O-CB 3.23Å; S91-C95 PolarHBondContact O-N 3.34Å; S91-M136 PolarHBondContact OG-SD 2.97Å
92S80.6Confident78.4Confident3 Ų354.1 Ų54.12%0.02128%0.284CS..Hα-helixtrans-63.7-40.1178.1-57.40000111.7G88 F89 Y90 Y94 C95 S96G88-S92 WeakPolarHBondContact O-CB 3.36Å; G88-S92 PolarHBondContact O-N 2.96Å; G88-S92 PolarHBondContact O-OG 2.9Å; F89-S92 PolarHBondContact O-N 3.43Å; Y90-S92 VanDerWaalsContact C-N 3.32Å; Y90-S92 PolarHBondContact O-N 3.49Å; S92-Y94 PolarHBondContact O-N 2.92Å; S92-C95 PolarHBondContact O-N 2.81Å; S92-S96 WeakPolarHBondContact O-CB 3.22Å; S92-S96 PolarHBondContact O-N 3.25Å; S92-S96 PolarHBondContact O-OG 3.47Å
93I81.5Confident78.3Confident69 Ų6952.9 Ų52.935%0.35427%0.274SS..Hα-helixtrans-61.1-46.1175.1-68.3167.2000111.5L58 F89 Y90 S91 T97L58-I93 HydrophobicContact CD1-CG1 4.21Å; F89-I93 HydrophobicContact CD1-CD1 3.75Å; F89-I93 HydrophobicContact CE1-CD1 3.44Å; F89-I93 VanDerWaalsContact CE1-CD1 3.44Å; F89-I93 HydrophobicContact CZ-CD1 4.07Å; F89-I93 WeakPolarHBondContact O-CG1 3.49Å; F89-I93 PolarHBondContact O-N 3.38Å; Y90-I93 PolarHBondContact O-N 3.02Å; S91-I93 PolarHBondContact O-N 2.92Å; I93-T97 WeakPolarHBondContact O-CB 3.3Å; I93-T97 PolarHBondContact O-N 3.19Å; I93-T97 PolarHBondContact O-OG1 3.19Å
94Y79.1Confident78.4Confident147 Ų14755 Ų5558%0.57629%0.287SS*.Hα-helixtrans-64.4-45.6177.7-75.2-65.3000111Y90 S91 S92 S96 T97 W98Y90-Y94 WeakPolarHBondContact O-CD2 3.44Å; Y90-Y94 PolarHBondContact O-N 3.25Å; S91-Y94 PolarHBondContact O-N 2.79Å; S92-Y94 PolarHBondContact O-N 2.92Å; Y94-S96 PolarHBondContact O-N 3.38Å; Y94-T97 WeakPolarHBondContact O-CB 3.3Å; Y94-T97 PolarHBondContact O-N 3.38Å; Y94-W98 PolarHBondContact O-N 3.48Å
95C74.8Confident78.4Confident30 Ų3055.3 Ų55.320%0.20329%0.287CS..Hα-helixtrans-57-51.1177.7-1680000111A54 S91 S92 T97 W98 L99A54-C95 HydrophobicContact CB-CB 4.46Å; S91-C95 VanDerWaalsContact O-CB 3.27Å; S91-C95 WeakPolarHBondContact O-CB 3.23Å; S91-C95 PolarHBondContact O-N 3.34Å; S92-C95 PolarHBondContact O-N 2.81Å; C95-T97 VanDerWaalsContact C-N 3.29Å; C95-T97 PolarHBondContact O-N 3.48Å; C95-W98 PolarHBondContact O-N 3.11Å; C95-L99 WeakPolarHBondContact O-CB 3.47Å; C95-L99 WeakPolarHBondContact O-CD1 3.39Å; C95-L99 WeakPolarHBondContact O-CG 3.09Å; C95-L99 PolarHBondContact O-N 3.41Å
96S80.4Confident78.1Confident11 Ų1156.8 Ų56.88%0.07729%0.294CS..Hα-helixtrans-59.5-39.5177.6-640000112L51 D55 S92 Y94 L99 L100L51-S96 VanDerWaalsContact CD1-CA 3.49Å; D55-S96 PolarHBondContact OD1-OG 2.94Å; S92-S96 WeakPolarHBondContact O-CB 3.22Å; S92-S96 PolarHBondContact O-N 3.25Å; S92-S96 PolarHBondContact O-OG 3.47Å; Y94-S96 PolarHBondContact O-N 3.38Å; S96-L99 PolarHBondContact O-N 3.39Å; S96-L100 WeakPolarHBondContact O-CB 3.46Å; S96-L100 VanDerWaalsContact O-CG 3.24Å; S96-L100 WeakPolarHBondContact O-CG 3.04Å; S96-L100 PolarHBondContact O-N 2.84Å
97T81.5Confident78.2Confident82 Ų8264.4 Ų64.450%0.50332%0.319SS..Hα-helixtrans-62.9-47176.7-55.30000112.3I93 Y94 C95 L100 A101I93-T97 WeakPolarHBondContact O-CB 3.3Å; I93-T97 PolarHBondContact O-N 3.19Å; I93-T97 PolarHBondContact O-OG1 3.19Å; Y94-T97 WeakPolarHBondContact O-CB 3.3Å; Y94-T97 PolarHBondContact O-N 3.38Å; C95-T97 VanDerWaalsContact C-N 3.29Å; C95-T97 PolarHBondContact O-N 3.48Å; T97-L100 PolarHBondContact O-N 3.03Å; T97-A101 WeakPolarHBondContact O-CB 3.09Å; T97-A101 PolarHBondContact O-N 2.76Å
98W75.4Confident78.3Confident155 Ų15568.8 Ų68.859%0.58734%0.335SS*.Hα-helixtrans-65.3-39.1177.3-81.9104.6000112.2Y94 C95 A101 G102Y94-W98 PolarHBondContact O-N 3.48Å; C95-W98 PolarHBondContact O-N 3.11Å; W98-A101 PolarHBondContact O-N 3.01Å; W98-G102 PolarHBondContact O-N 3.5Å
99L75.4Confident78.2Confident10 Ų1070.7 Ų70.75%0.05234%0.342CS..Hα-helixtrans-65.6-42.6176-68.5168000111.3L47 N50 L51 A54 C95 S96 G102 I103L47-L99 HydrophobicContact CD1-CD2 3.64Å; N50-L99 HydrophobicContact CB-CD1 4.22Å; N50-L99 HydrophobicContact CB-CD2 4.03Å; L51-L99 HydrophobicContact CB-CB 4.27Å; L51-L99 HydrophobicContact CB-CD1 4.17Å; L51-L99 HydrophobicContact CD1-CB 3.97Å; L51-L99 HydrophobicContact CD1-CD1 4.29Å; A54-L99 HydrophobicContact CB-CD1 4.4Å; C95-L99 WeakPolarHBondContact O-CB 3.47Å; C95-L99 WeakPolarHBondContact O-CD1 3.39Å; C95-L99 WeakPolarHBondContact O-CG 3.09Å; C95-L99 PolarHBondContact O-N 3.41Å; S96-L99 PolarHBondContact O-N 3.39Å; L99-G102 PolarHBondContact O-N 3.46Å; L99-I103 VanDerWaalsContact O-CG1 3.27Å; L99-I103 WeakPolarHBondContact O-CG1 3.42Å; L99-I103 PolarHBondContact O-N 3.32Å
100L79.2Confident77.9Confident98 Ų9870.6 Ų70.651%0.51335%0.351SS..Hα-helixtrans-62.1-42.3173.7-75.5168.9000112L51 S96 T97 G102 I103 S104L51-L100 HydrophobicContact CD1-CG 4.22Å; L51-L100 HydrophobicContact CD2-CD2 3.75Å; L51-L100 HydrophobicContact CD2-CG 4.14Å; S96-L100 WeakPolarHBondContact O-CB 3.46Å; S96-L100 VanDerWaalsContact O-CG 3.24Å; S96-L100 WeakPolarHBondContact O-CG 3.04Å; S96-L100 PolarHBondContact O-N 2.84Å; T97-L100 PolarHBondContact O-N 3.03Å; L100-G102 VanDerWaalsContact C-N 3.33Å; L100-G102 PolarHBondContact O-N 2.82Å; L100-I103 PolarHBondContact O-N 2.76Å; L100-S104 WeakPolarHBondContact O-CB 3.3Å; L100-S104 PolarHBondContact O-N 3.44Å
101A79.5Confident78Confident54 Ų5470.3 Ų70.345%0.44636%0.363SS..Hα-helixtrans-60.6-43.7174.100000111.3T97 W98 S104 M105T97-A101 WeakPolarHBondContact O-CB 3.09Å; T97-A101 PolarHBondContact O-N 2.76Å; W98-A101 PolarHBondContact O-N 3.01Å; A101-S104 WeakPolarHBondContact O-CB 3.34Å; A101-S104 PolarHBondContact O-N 3.33Å; A101-M105 WeakPolarHBondContact O-CB 3.38Å; A101-M105 PolarHBondContact O-N 3.03Å
102G73.1Confident78.2Confident15 Ų1571.2 Ų71.216%0.15537%0.372CS..Hα-helixtrans-59.1-47172.600000112.5L47 W98 L99 L100 S104 M105 E106L47-G102 VanDerWaalsContact CD2-C 3.5Å; W98-G102 PolarHBondContact O-N 3.5Å; L99-G102 PolarHBondContact O-N 3.46Å; L100-G102 VanDerWaalsContact C-N 3.33Å; L100-G102 PolarHBondContact O-N 2.82Å; G102-S104 VanDerWaalsContact C-N 3.31Å; G102-S104 PolarHBondContact O-N 2.88Å; G102-M105 PolarHBondContact O-N 2.88Å; G102-E106 WeakPolarHBondContact O-CB 3.39Å; G102-E106 WeakPolarHBondContact O-CG 3.48Å; G102-E106 PolarHBondContact O-N 3.39Å
103I79.4Confident78.1Confident16 Ų1675.8 Ų75.88%0.08239%0.392CS..Hα-helixtrans-60.4-42.6177.6-66.9161.7000110.9V44 L47 L48 L51 L99 L100 E106 R107V44-I103 HydrophobicContact CG2-CG2 4.26Å; L47-I103 HydrophobicContact CB-CG1 4.04Å; L47-I103 HydrophobicContact CD2-CB 4.42Å; L47-I103 HydrophobicContact CD2-CG1 3.69Å; L47-I103 HydrophobicContact CG-CD1 4.48Å; L47-I103 HydrophobicContact CG-CG1 3.71Å; L48-I103 HydrophobicContact CG-CD1 4.05Å; L51-I103 HydrophobicContact CD2-CD1 3.8Å; L99-I103 VanDerWaalsContact O-CG1 3.27Å; L99-I103 WeakPolarHBondContact O-CG1 3.42Å; L99-I103 PolarHBondContact O-N 3.32Å; L100-I103 PolarHBondContact O-N 2.76Å; I103-E106 PolarHBondContact O-N 2.67Å; I103-R107 WeakPolarHBondContact O-CG 3.36Å; I103-R107 PolarHBondContact O-N 2.94Å
104S80.1Confident77.5Confident78 Ų7876.7 Ų76.755%0.54540%0.402SS..Hα-helixtrans-61.7-46177.2-172.50000111.2L100 A101 G102 R107 Y108L100-S104 WeakPolarHBondContact O-CB 3.3Å; L100-S104 PolarHBondContact O-N 3.44Å; A101-S104 WeakPolarHBondContact O-CB 3.34Å; A101-S104 PolarHBondContact O-N 3.33Å; G102-S104 VanDerWaalsContact C-N 3.31Å; G102-S104 PolarHBondContact O-N 2.88Å; S104-R107 PolarHBondContact O-N 3.48Å; S104-Y108 WeakPolarHBondContact O-CB 3.39Å; S104-Y108 PolarHBondContact O-N 2.94Å
105M77.4Confident76.9Confident117 Ų11775.3 Ų75.358%0.57641%0.408SS*.Hα-helixtrans-65-43.5178.6-170.6164.3-174.300112.2A101 G102 R107 Y108 L109A101-M105 WeakPolarHBondContact O-CB 3.38Å; A101-M105 PolarHBondContact O-N 3.03Å; G102-M105 PolarHBondContact O-N 2.88Å; M105-R107 VanDerWaalsContact C-N 3.34Å; M105-R107 PolarHBondContact O-N 3.01Å; M105-Y108 PolarHBondContact O-N 3.01Å; M105-L109 HydrophobicContact CE-CD1 4.4Å; M105-L109 HydrophobicContact CG-CD1 4.1Å; M105-L109 HydrophobicContact CG-CG 4.45Å; M105-L109 WeakPolarHBondContact O-CB 3.06Å; M105-L109 WeakPolarHBondContact O-CG 3.46Å; M105-L109 PolarHBondContact O-N 3.27Å
106E72.6Confident76.2Confident34 Ų3480.3 Ų80.316%0.15943%0.429CS..Hα-helixtrans-59.8-43.6175.6-71.2-7194.200111.4P43 L47 G102 I103 G110 Y117P43-E106 WeakPolarHBondContact CB-OE2 3.45Å; L47-E106 HydrophobicContact CD2-CG 4.14Å; G102-E106 WeakPolarHBondContact O-CB 3.39Å; G102-E106 WeakPolarHBondContact O-CG 3.48Å; G102-E106 PolarHBondContact O-N 3.39Å; I103-E106 PolarHBondContact O-N 2.67Å; E106-G110 PolarHBondContact O-N 3.23Å; E106-Y117 WeakPolarHBondContact CB-OH 3.3Å; E106-Y117 WeakPolarHBondContact OE1-CE2 3.38Å; E106-Y117 PolarHBondContact OE1-OH 2.86Å; E106-Y117 PolarHBondContact OE2-OH 3.26Å
107R80.4Confident75.1Confident169 Ų16982.1 Ų82.164%0.63843%0.434SS*.Hα-helixtrans-65-42.2175.3-76.5-178175.2-100.12.2112I103 S104 M105 G110 V111I103-R107 WeakPolarHBondContact O-CG 3.36Å; I103-R107 PolarHBondContact O-N 2.94Å; S104-R107 PolarHBondContact O-N 3.48Å; M105-R107 VanDerWaalsContact C-N 3.34Å; M105-R107 PolarHBondContact O-N 3.01Å; R107-G110 PolarHBondContact O-N 3.1Å; R107-V111 WeakPolarHBondContact O-CG2 3.38Å; R107-V111 PolarHBondContact O-N 2.72Å
108Y80.5Confident74Confident156 Ų15686.8 Ų86.861%0.61245%0.447SS*.Hα-helixtrans-62.2-48.8178.4178.5-99.6000111.4S104 M105 G110 V111 A112S104-Y108 WeakPolarHBondContact O-CB 3.39Å; S104-Y108 PolarHBondContact O-N 2.94Å; M105-Y108 PolarHBondContact O-N 3.01Å; Y108-G110 VanDerWaalsContact C-N 3.34Å; Y108-G110 PolarHBondContact O-N 2.98Å; Y108-V111 PolarHBondContact O-N 3.47Å; Y108-A112 HydrophobicContact CE1-CB 4.38Å; Y108-A112 WeakPolarHBondContact O-CB 3.46Å; Y108-A112 PolarHBondContact O-N 3.48Å
109L74.4Confident73Confident49 Ų4986.6 Ų86.626%0.25746%0.457SS..Hα-helixtrans-64.1-37.6178.2-70.2171.6000112.4M105 V111 F113 Y117M105-L109 HydrophobicContact CE-CD1 4.4Å; M105-L109 HydrophobicContact CG-CD1 4.1Å; M105-L109 HydrophobicContact CG-CG 4.45Å; M105-L109 WeakPolarHBondContact O-CB 3.06Å; M105-L109 WeakPolarHBondContact O-CG 3.46Å; M105-L109 PolarHBondContact O-N 3.27Å; L109-V111 VanDerWaalsContact C-N 3.3Å; L109-V111 PolarHBondContact O-N 2.96Å; L109-F113 HydrophobicContact CD2-CD2 4.23Å; L109-F113 CarbonylContact O-C 3.37Å; L109-F113 WeakPolarHBondContact O-CA 3.39Å; L109-F113 PolarHBondContact O-N 3.49Å; L109-Y117 HydrophobicContact CB-CD2 3.47Å; L109-Y117 VanDerWaalsContact CB-CD2 3.47Å; L109-Y117 HydrophobicContact CB-CE2 3.78Å; L109-Y117 HydrophobicContact CB-CG 4.26Å; L109-Y117 HydrophobicContact CD1-CD2 4.16Å; L109-Y117 HydrophobicContact CD1-CE2 4.21Å; L109-Y117 HydrophobicContact CG-CD2 4.45Å
110G74Confident71.9Confident31 Ų3190.7 Ų90.732%0.3249%0.487SS..Hα-helixtrans-64.1-31.8176.100000113.9E106 R107 Y108E106-G110 PolarHBondContact O-N 3.23Å; R107-G110 PolarHBondContact O-N 3.1Å; Y108-G110 VanDerWaalsContact C-N 3.34Å; Y108-G110 PolarHBondContact O-N 2.98Å
111V80.8Confident70.9Confident130 Ų13092.7 Ų92.779%0.78849%0.487SS*.Hα-helixtrans-85-43.7177.4174.80000111.5R107 Y108 L109R107-V111 WeakPolarHBondContact O-CG2 3.38Å; R107-V111 PolarHBondContact O-N 2.72Å; Y108-V111 PolarHBondContact O-N 3.47Å; L109-V111 VanDerWaalsContact C-N 3.3Å; L109-V111 PolarHBondContact O-N 2.96Å
112A82.9Confident70Confident42 Ų42100.5 Ų100.535%0.34751%0.505SS..Hα-helixtrans-80.5-34.8-174.800000113.4Y108Y108-A112 HydrophobicContact CE1-CB 4.38Å; Y108-A112 WeakPolarHBondContact O-CB 3.46Å; Y108-A112 PolarHBondContact O-N 3.48Å
113F77.4Confident69Low99 Ų99104.6 Ų104.643%0.43453%0.529SS..  trans-136.965.6-172.6-60.2-76.4000113.1L109 V115 Q116 Y117L109-F113 HydrophobicContact CD2-CD2 4.23Å; L109-F113 CarbonylContact O-C 3.37Å; L109-F113 WeakPolarHBondContact O-CA 3.39Å; L109-F113 PolarHBondContact O-N 3.49Å; F113-V115 VanDerWaalsContact C-N 3.27Å; F113-V115 PolarHBondContact O-N 3.31Å; F113-V115 VanDerWaalsContact O-N 3.15Å; F113-Q116 PolarHBondContact O-N 3.35Å; F113-Y117 WeakPolarHBondContact O-CB 3.3Å; F113-Y117 PolarHBondContact O-N 3.49Å; F113-Y117 VanDerWaalsContact O-N 3.16Å
114P69.6Low68Low88 Ų88108.1 Ų108.157%0.57155%0.548SS*.Hα-helixtrans-61.4-28.6-172.522.9-33.8000114.6
115V65.9Low66.9Low117 Ų117106.8 Ų106.871%0.70953%0.531SS*.Hα-helixtrans-83.3-44.7-177.1-178.90000112.4F113F113-V115 VanDerWaalsContact C-N 3.27Å; F113-V115 PolarHBondContact O-N 3.31Å; F113-V115 VanDerWaalsContact O-N 3.15Å
116Q59.3Low65.7Low135 Ų135103.6 Ų103.663%0.63153%0.528SS*.Hα-helixtrans-73.3-32.6-178.8-70.1174.5-14.900112.2F113 K118 L119 S120F113-Q116 PolarHBondContact O-N 3.35Å; Q116-K118 VanDerWaalsContact C-N 3.28Å; Q116-K118 PolarHBondContact O-N 3.39Å; Q116-L119 PolarHBondContact O-N 3.48Å; Q116-S120 PolarHBondContact O-N 2.99Å
117Y59Low65Low50 Ų50105.7 Ų105.720%0.19654%0.543CS..Hα-helixtrans-66.1-28.3-179.5-174.4-108.8000113.3E106 L109 F113 L119 S120E106-Y117 WeakPolarHBondContact CB-OH 3.3Å; E106-Y117 WeakPolarHBondContact OE1-CE2 3.38Å; E106-Y117 PolarHBondContact OE1-OH 2.86Å; E106-Y117 PolarHBondContact OE2-OH 3.26Å; L109-Y117 HydrophobicContact CB-CD2 3.47Å; L109-Y117 VanDerWaalsContact CB-CD2 3.47Å; L109-Y117 HydrophobicContact CB-CE2 3.78Å; L109-Y117 HydrophobicContact CB-CG 4.26Å; L109-Y117 HydrophobicContact CD1-CD2 4.16Å; L109-Y117 HydrophobicContact CD1-CE2 4.21Å; L109-Y117 HydrophobicContact CG-CD2 4.45Å; F113-Y117 WeakPolarHBondContact O-CB 3.3Å; F113-Y117 PolarHBondContact O-N 3.49Å; F113-Y117 VanDerWaalsContact O-N 3.16Å; Y117-L119 PolarHBondContact O-N 3.35Å; Y117-S120 PolarHBondContact O-N 3.47Å
118K57.3Low64.1Low179 Ų17999 Ų9978%0.77852%0.52SS*.THydrogen-bonded Turntrans-65-26176.1-132.9-177.9-173.6-176.50113.1Q116Q116-K118 VanDerWaalsContact C-N 3.28Å; Q116-K118 PolarHBondContact O-N 3.39Å
119L54.5Low63.1Low152 Ų15294.4 Ų94.480%0.79651%0.514SS*.THydrogen-bonded Turntrans-92-26.9-179.6-85.7123000113.7Q116 Y117 R121Q116-L119 PolarHBondContact O-N 3.48Å; Y117-L119 PolarHBondContact O-N 3.35Å; L119-R121 VanDerWaalsContact C-N 3.3Å; L119-R121 PolarHBondContact O-N 2.86Å
120S53Low62.3Low95 Ų9594.6 Ų94.666%0.66452%0.522SS*.  trans-90.635.6-173.9-156.50000114Q116 Y117 R122Q116-S120 PolarHBondContact O-N 2.99Å; Y117-S120 PolarHBondContact O-N 3.47Å; S120-R122 PolarHBondContact O-N 3.36Å; S120-R122 VanDerWaalsContact O-N 3.08Å
121R57.6Low61.8Low141 Ų14197.7 Ų97.753%0.53253%0.531SS..  trans-80.974.7175.3-77.3-170.2170.7-153.22.6110.7P41 P43 L119P41-R121 PolarHBondContact O-NH1 3.41Å; P43-R121 HydrophobicContact CG-CG 4.13Å; L119-R121 VanDerWaalsContact C-N 3.3Å; L119-R121 PolarHBondContact O-N 2.86Å
122R60.5Low61.1Low218 Ų21892.9 Ų92.982%0.82350%0.502SS*.  trans-141.5176.7174.9-61.5-157.2-179.5-144.45.3113.8S120 L124S120-R122 PolarHBondContact O-N 3.36Å; S120-R122 VanDerWaalsContact O-N 3.08Å; R122-L124 VanDerWaalsContact C-N 3.3Å; R122-L124 PolarHBondContact O-N 2.92Å
123P51.5Low59.9Low101 Ų10193 Ų9366%0.65650%0.503SS*.  -88.945.3-115.932.8-9.1000112.4Y125 G126 V127P123-Y125 PolarHBondContact O-N 2.75Å; P123-G126 PolarHBondContact O-N 2.91Å; P123-V127 PolarHBondContact O-N 3.5Å
124L58.8Low59.2Low89 Ų8996.6 Ų96.647%0.46651%0.514SS..Hα-helixtrans-61.6-32.3-171.6-163.371.5000112.5R122 G126 V127 I128R122-L124 VanDerWaalsContact C-N 3.3Å; R122-L124 PolarHBondContact O-N 2.92Å; L124-G126 PolarHBondContact O-N 2.71Å; L124-V127 PolarHBondContact O-N 3.33Å; L124-I128 HydrophobicContact CD2-CD1 4.03Å; L124-I128 HydrophobicContact CG-CD1 3.73Å; L124-I128 HydrophobicContact CG-CG1 4.28Å; L124-I128 WeakPolarHBondContact O-CB 3.33Å; L124-I128 VanDerWaalsContact O-CG1 3.23Å; L124-I128 WeakPolarHBondContact O-CG1 3.49Å; L124-I128 PolarHBondContact O-N 3.37Å
125Y57.1Low59Low50 Ų5098 Ų9820%0.19652%0.515CS..Hα-helixtrans-66-36.6-179.9-52-40.5000113.6P43 I46 L47 P123 A129P43-Y125 PolarHBondContact O-OH 3.08Å; I46-Y125 HydrophobicContact CB-CE2 4.29Å; I46-Y125 HydrophobicContact CG2-CD2 4.08Å; I46-Y125 HydrophobicContact CG2-CE2 4.24Å; L47-Y125 HydrophobicContact CB-CE1 4.16Å; L47-Y125 HydrophobicContact CD1-CD1 3.24Å; L47-Y125 HydrophobicContact CD1-CE1 2.89Å; L47-Y125 HydrophobicContact CD1-CG 4.29Å; L47-Y125 HydrophobicContact CD2-CE1 3.64Å; L47-Y125 WeakPolarHBondContact CD2-OH 3.3Å; L47-Y125 HydrophobicContact CG-CD1 4.45Å; L47-Y125 HydrophobicContact CG-CE1 3.7Å; P123-Y125 PolarHBondContact O-N 2.75Å; Y125-A129 VanDerWaalsContact O-CB 3.26Å; Y125-A129 WeakPolarHBondContact O-CB 3.3Å; Y125-A129 PolarHBondContact O-N 3.39Å
126G52.7Low58.8Low50 Ų5095.2 Ų95.252%0.51550%0.495SS..Hα-helixtrans-70.8-38175.200000111.9P123 L124 A130P123-G126 PolarHBondContact O-N 2.91Å; L124-G126 PolarHBondContact O-N 2.71Å; G126-A130 WeakPolarHBondContact O-CB 3.21Å; G126-A130 PolarHBondContact O-N 3.02Å
127V57.7Low58.5Low78 Ų7892.9 Ų92.947%0.47349%0.494SS..Hα-helixtrans-68.4-41176.5178.50000111.2P123 L124 A130 L131P123-V127 PolarHBondContact O-N 3.5Å; L124-V127 PolarHBondContact O-N 3.33Å; V127-A130 PolarHBondContact O-N 3.33Å; V127-L131 HydrophobicContact CG1-CD1 4.01Å; V127-L131 WeakPolarHBondContact O-CB 3.39Å; V127-L131 WeakPolarHBondContact O-CG 3.16Å; V127-L131 PolarHBondContact O-N 3.47Å
128I62.3Low58.5Low29 Ų2997.3 Ų97.315%0.14951%0.514CS..Hα-helixtrans-68.1-45.5176.8-67.9167.9000110.6L124 A130 L131 V132L124-I128 HydrophobicContact CD2-CD1 4.03Å; L124-I128 HydrophobicContact CG-CD1 3.73Å; L124-I128 HydrophobicContact CG-CG1 4.28Å; L124-I128 WeakPolarHBondContact O-CB 3.33Å; L124-I128 VanDerWaalsContact O-CG1 3.23Å; L124-I128 WeakPolarHBondContact O-CG1 3.49Å; L124-I128 PolarHBondContact O-N 3.37Å; I128-A130 VanDerWaalsContact C-N 3.29Å; I128-A130 PolarHBondContact O-N 2.88Å; I128-L131 PolarHBondContact O-N 3.02Å; I128-V132 HydrophobicContact CG2-CG2 4.29Å; I128-V132 WeakPolarHBondContact O-CB 3.34Å; I128-V132 VanDerWaalsContact O-CG2 3.25Å; I128-V132 WeakPolarHBondContact O-CG2 3.2Å; I128-V132 PolarHBondContact O-N 3.02Å
129A58.6Low58.5Low60 Ų6091.3 Ų91.350%0.49650%0.503SS..Hα-helixtrans-60.7-39.6175.100000111.8Y125 A133Y125-A129 VanDerWaalsContact O-CB 3.26Å; Y125-A129 WeakPolarHBondContact O-CB 3.3Å; Y125-A129 PolarHBondContact O-N 3.39Å; A129-A133 VanDerWaalsContact O-CB 3.31Å; A129-A133 WeakPolarHBondContact O-CB 3.23Å; A129-A133 PolarHBondContact O-N 3.29Å
130A57Low58.3Low52 Ų5289.1 Ų89.143%0.4349%0.489SS..Hα-helixtrans-66.8-41.6174.600000112.7G126 V127 I128 A133 W134G126-A130 WeakPolarHBondContact O-CB 3.21Å; G126-A130 PolarHBondContact O-N 3.02Å; V127-A130 PolarHBondContact O-N 3.33Å; I128-A130 VanDerWaalsContact C-N 3.29Å; I128-A130 PolarHBondContact O-N 2.88Å; A130-A133 PolarHBondContact O-N 2.93Å; A130-W134 VanDerWaalsContact O-CB 3.3Å; A130-W134 WeakPolarHBondContact O-CB 3.38Å; A130-W134 PolarHBondContact O-N 3.47Å
131L64Low58Low97 Ų9790 Ų9051%0.50849%0.494SS..Hα-helixtrans-63.4-43.2174.4-82.9166.3000111.7V127 I128 W134 I135V127-L131 HydrophobicContact CG1-CD1 4.01Å; V127-L131 WeakPolarHBondContact O-CB 3.39Å; V127-L131 WeakPolarHBondContact O-CG 3.16Å; V127-L131 PolarHBondContact O-N 3.47Å; I128-L131 PolarHBondContact O-N 3.02Å; L131-W134 WeakPolarHBondContact O-CB 3.48Å; L131-W134 PolarHBondContact O-N 3.48Å; L131-I135 WeakPolarHBondContact O-CB 3.37Å; L131-I135 VanDerWaalsContact O-CG1 3.25Å; L131-I135 WeakPolarHBondContact O-CG1 3.38Å; L131-I135 PolarHBondContact O-N 3.3Å
132V66.3Low57.2Low29 Ų2992.8 Ų92.818%0.17653%0.527CS..Hα-helixtrans-63.4-48.2176.3170.70000109.8I128 W134 I135 M136I128-V132 HydrophobicContact CG2-CG2 4.29Å; I128-V132 WeakPolarHBondContact O-CB 3.34Å; I128-V132 VanDerWaalsContact O-CG2 3.25Å; I128-V132 WeakPolarHBondContact O-CG2 3.2Å; I128-V132 PolarHBondContact O-N 3.02Å; V132-W134 VanDerWaalsContact C-N 3.28Å; V132-W134 PolarHBondContact O-N 3.33Å; V132-I135 PolarHBondContact O-N 3.18Å; V132-M136 HydrophobicContact CG1-CE 4.15Å; V132-M136 HydrophobicContact CG1-CG 4.35Å; V132-M136 HydrophobicContact CG1-SD 4.45Å; V132-M136 WeakPolarHBondContact O-CB 3.31Å; V132-M136 WeakPolarHBondContact O-CG 3.44Å; V132-M136 PolarHBondContact O-N 3.13Å
133A58.7Low57.1Low44 Ų4486.6 Ų86.636%0.36451%0.512SS..Hα-helixtrans-60.4-35.7175.300000112.9A129 A130 S137A129-A133 VanDerWaalsContact O-CB 3.31Å; A129-A133 WeakPolarHBondContact O-CB 3.23Å; A129-A133 PolarHBondContact O-N 3.29Å; A130-A133 PolarHBondContact O-N 2.93Å; A133-S137 WeakPolarHBondContact O-CB 3.47Å; A133-S137 PolarHBondContact O-N 3.41Å; A133-S137 PolarHBondContact O-OG 2.99Å
134W61.9Low57.4Low174 Ų17485.8 Ų85.866%0.65950%0.504SS*.Hα-helixtrans-67-53.4175.2-108.764.8000112.3A130 L131 V132 M136 S137 F138A130-W134 VanDerWaalsContact O-CB 3.3Å; A130-W134 WeakPolarHBondContact O-CB 3.38Å; A130-W134 PolarHBondContact O-N 3.47Å; L131-W134 WeakPolarHBondContact O-CB 3.48Å; L131-W134 PolarHBondContact O-N 3.48Å; V132-W134 VanDerWaalsContact C-N 3.28Å; V132-W134 PolarHBondContact O-N 3.33Å; W134-M136 PolarHBondContact O-N 2.98Å; W134-S137 PolarHBondContact O-N 3.4Å; W134-F138 HydrophobicContact CD2-CE2 4.07Å; W134-F138 AromaticContact CE3-CD2 3.99Å; W134-F138 HydrophobicContact CE3-CD2 3.99Å; W134-F138 AromaticContact CE3-CE2 3.57Å; W134-F138 HydrophobicContact CE3-CE2 3.57Å; W134-F138 HydrophobicContact CH2-CE2 4.12Å; W134-F138 HydrophobicContact CZ3-CD2 4.35Å; W134-F138 AromaticContact CZ3-CE2 3.6Å; W134-F138 HydrophobicContact CZ3-CE2 3.6Å; W134-F138 HydrophobicContact CZ3-CZ 4.27Å; W134-F138 WeakPolarHBondContact O-CD2 3.25Å; W134-F138 PolarHBondContact O-N 3.12Å; W134-F138 VanDerWaalsContact O-N 3.14Å
135I66.2Low57.3Low118 Ų11885.6 Ų85.661%0.60551%0.506SS*.Hα-helixtrans-60.7-38.6179.2-66.8166000110.2L131 V132 S137 F138 G139L131-I135 WeakPolarHBondContact O-CB 3.37Å; L131-I135 VanDerWaalsContact O-CG1 3.25Å; L131-I135 WeakPolarHBondContact O-CG1 3.38Å; L131-I135 PolarHBondContact O-N 3.3Å; V132-I135 PolarHBondContact O-N 3.18Å; I135-S137 VanDerWaalsContact C-N 3.35Å; I135-S137 PolarHBondContact O-N 3.44Å; I135-F138 PolarHBondContact O-N 3.02Å; I135-G139 PolarHBondContact O-N 3.14Å
136M60.1Low57.3Low59 Ų5987.7 Ų87.729%0.29153%0.525SS..Hα-helixtrans-60-39173-85.7-150.3-54.400113.7F87 S91 V132 W134F87-M136 HydrophobicContact CD1-SD 4.47Å; F87-M136 HydrophobicContact CE1-CB 4.33Å; F87-M136 HydrophobicContact CE1-CG 4.02Å; F87-M136 HydrophobicContact CE1-SD 3.38Å; F87-M136 WeakPolarHBondContact CE1-SD 3.21Å; F87-M136 HydrophobicContact CE2-CB 4.19Å; F87-M136 HydrophobicContact CE2-CG 4.04Å; F87-M136 HydrophobicContact CE2-SD 4.44Å; F87-M136 HydrophobicContact CZ-CB 3.45Å; F87-M136 VanDerWaalsContact CZ-CB 3.45Å; F87-M136 HydrophobicContact CZ-CG 3.36Å; F87-M136 WeakPolarHBondContact CZ-O 3.44Å; F87-M136 HydrophobicContact CZ-SD 3.41Å; F87-M136 WeakPolarHBondContact CZ-SD 3.45Å; S91-M136 PolarHBondContact OG-SD 2.97Å; V132-M136 HydrophobicContact CG1-CE 4.15Å; V132-M136 HydrophobicContact CG1-CG 4.35Å; V132-M136 HydrophobicContact CG1-SD 4.45Å; V132-M136 WeakPolarHBondContact O-CB 3.31Å; V132-M136 WeakPolarHBondContact O-CG 3.44Å; V132-M136 PolarHBondContact O-N 3.13Å; W134-M136 PolarHBondContact O-N 2.98Å
137S54.3Low57.6Low85 Ų8590.1 Ų90.159%0.59453%0.525SS*.Hα-helixtrans-74.3-31.9-179.6-60.80000112.7A133 W134 I135A133-S137 WeakPolarHBondContact O-CB 3.47Å; A133-S137 PolarHBondContact O-N 3.41Å; A133-S137 PolarHBondContact O-OG 2.99Å; W134-S137 PolarHBondContact O-N 3.4Å; I135-S137 VanDerWaalsContact C-N 3.35Å; I135-S137 PolarHBondContact O-N 3.44Å
138F58.5Low57.6Low143 Ų14390.9 Ų90.963%0.62753%0.529SS*.Hα-helixtrans-89-22.4-178.8-77.9-76.5000114.1W134 I135 H140W134-F138 HydrophobicContact CD2-CE2 4.07Å; W134-F138 AromaticContact CE3-CD2 3.99Å; W134-F138 HydrophobicContact CE3-CD2 3.99Å; W134-F138 AromaticContact CE3-CE2 3.57Å; W134-F138 HydrophobicContact CE3-CE2 3.57Å; W134-F138 HydrophobicContact CH2-CE2 4.12Å; W134-F138 HydrophobicContact CZ3-CD2 4.35Å; W134-F138 AromaticContact CZ3-CE2 3.6Å; W134-F138 HydrophobicContact CZ3-CE2 3.6Å; W134-F138 HydrophobicContact CZ3-CZ 4.27Å; W134-F138 WeakPolarHBondContact O-CD2 3.25Å; W134-F138 PolarHBondContact O-N 3.12Å; W134-F138 VanDerWaalsContact O-N 3.14Å; I135-F138 PolarHBondContact O-N 3.02Å; F138-H140 VanDerWaalsContact C-N 3.35Å; F138-H140 PolarHBondContact O-N 2.94Å
139G56.4Low57.2Low53 Ų5395.3 Ų95.355%0.54656%0.556SS.*THydrogen-bonded Turntrans-80-7.7-178.200000116I135I135-G139 PolarHBondContact O-N 3.14Å
140H51.3Low57.1Low107 Ų10798 Ų9850%0.49556%0.56SS.*THydrogen-bonded Turntrans-112.715.3-172.9-147.8-99.9000113.6F87 F138F87-H140 AromaticContact CD2-CD2 3.84Å; F138-H140 VanDerWaalsContact C-N 3.35Å; F138-H140 PolarHBondContact O-N 2.94Å
141C45.7Very low57.1Low114 Ų114101.8 Ų101.877%0.7757%0.571SS**  trans-121.158.5170.7-80.50000110.4
142T42.2Very low56.5Low199 Ų199102.3 Ų102.3100%1.22158%0.577SS**  trans-150.90159.746.30000109.7

Retrieved 142 of 142 residues in 389.4 ms (Link to these results)