A0A093GXV9_STRCA Loading...

Potassium channel subfamily K member

AlphaFold DB , UniProt , Accession A0A093GXV9, Species STRCA (Struthio camelus australis), Gene n/a, Length 374 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
1M65.2Low84.8Confident177 Ų17794.5 Ų94.587%0.87247%0.466SS*.  0135.90-159.5-179.1-87.600107.4N5 V6M1-N5 HydrophobicContact CG-CB 3.95Å; M1-N5 HydrophobicContact SD-CB 4.41Å; M1-V6 HydrophobicContact CB-CG2 3.97Å; M1-V6 HydrophobicContact CG-CG2 4.11Å; M1-V6 HydrophobicContact SD-CG2 3.98Å
2K80.3Confident85.6Confident119 Ų11993.3 Ų93.352%0.51746%0.462SS..  trans-59.8143.1-179.6-69.9-175.7178.6-179.40110.2Q4 N5 V6K2-Q4 PolarHBondContact O-N 3.46Å; K2-Q4 VanDerWaalsContact O-N 3.13Å; K2-N5 PolarHBondContact O-N 2.8Å; K2-V6 PolarHBondContact O-N 2.87Å; K2-V6 VanDerWaalsContact O-N 3.08Å
3R79.8Confident86.5Confident199 Ų19993.3 Ų93.375%0.75146%0.463SS*.Hα-helixtrans-54.3-33.7-179.6-169.1177.4179.8-171.5-1.1112.5R7R3-R7 PolarHBondContact O-N 3.41Å
4Q76.8Confident87.3Confident22 Ų2292.3 Ų92.310%0.10347%0.468CS..Hα-helixtrans-64.6-50.5173.2-70.8152.2-0.600112.7K2 V6 R7 T8 E254 D257K2-Q4 PolarHBondContact O-N 3.46Å; K2-Q4 VanDerWaalsContact O-N 3.13Å; Q4-V6 PolarHBondContact O-N 3.48Å; Q4-R7 PolarHBondContact O-N 2.78Å; Q4-T8 PolarHBondContact O-N 3.42Å; Q4-T8 PolarHBondContact O-OG1 3.17Å; Q4-E254 VanDerWaalsContact NE2-CG 3.3Å; Q4-D257 PolarHBondContact NE2-OD2 2.98Å; Q4-D257 VanDerWaalsContact NE2-OD2 3.1Å
5N87Confident87.8Confident87 Ų8791.7 Ų91.747%0.46547%0.471SS..Hα-helixtrans-59.6-37.2178.3-65.64.3000111M1 K2 L9M1-N5 HydrophobicContact CG-CB 3.95Å; M1-N5 HydrophobicContact SD-CB 4.41Å; K2-N5 PolarHBondContact O-N 2.8Å; N5-L9 WeakPolarHBondContact O-CB 3.41Å; N5-L9 PolarHBondContact O-N 3.27Å
6V89.8Confident88.5Confident65 Ų6594.4 Ų94.439%0.39448%0.479SS..Hα-helixtrans-64.5-49.9173.2179.50000110.5M1 K2 Q4 T8 L9 S10M1-V6 HydrophobicContact CB-CG2 3.97Å; M1-V6 HydrophobicContact CG-CG2 4.11Å; M1-V6 HydrophobicContact SD-CG2 3.98Å; K2-V6 PolarHBondContact O-N 2.87Å; K2-V6 VanDerWaalsContact O-N 3.08Å; Q4-V6 PolarHBondContact O-N 3.48Å; V6-T8 PolarHBondContact O-N 3.41Å; V6-L9 PolarHBondContact O-N 3.3Å; V6-S10 VanDerWaalsContact O-CB 3.31Å; V6-S10 WeakPolarHBondContact O-CB 3.45Å; V6-S10 PolarHBondContact O-N 3.2Å; V6-S10 PolarHBondContact O-OG 3.34Å
7R87.3Confident89Confident52 Ų5293.1 Ų93.120%0.19648%0.476CS..Hα-helixtrans-56.9-47.9176.8176.8172.260.1-146.6-25112.1R3 Q4 S10 L11 N250 D253R3-R7 PolarHBondContact O-N 3.41Å; Q4-R7 PolarHBondContact O-N 2.78Å; R7-S10 PolarHBondContact O-N 3.3Å; R7-L11 HydrophobicContact CG-CD1 4.16Å; R7-L11 WeakPolarHBondContact O-CG 3.28Å; R7-L11 PolarHBondContact O-N 3.31Å; R7-N250 VanDerWaalsContact CZ-OD1 3.25Å; R7-N250 PolarHBondContact NE-OD1 2.84Å; R7-N250 VanDerWaalsContact NH2-CA 3.28Å; R7-N250 PolarHBondContact NH2-OD1 3.05Å; R7-D253 IonicContact CZ-OD2 3.03Å; R7-D253 IonicContact NH1-OD2 3.53Å; R7-D253 PolarHBondContact NH1-OD2 2.84Å; R7-D253 IonicContact NH2-OD2 3.27Å; R7-D253 PolarHBondContact NH2-OD2 3.06Å
8T88.4Confident89.5Confident69 Ų6998.3 Ų98.342%0.42349%0.49SS..Hα-helixtrans-64.2-46.4-179.5-57.60000111.2Q4 V6 S10 L11 I12Q4-T8 PolarHBondContact O-N 3.42Å; Q4-T8 PolarHBondContact O-OG1 3.17Å; V6-T8 PolarHBondContact O-N 3.41Å; T8-S10 VanDerWaalsContact C-N 3.34Å; T8-S10 PolarHBondContact O-N 3.18Å; T8-L11 PolarHBondContact O-N 2.92Å; T8-I12 HydrophobicContact CG2-CD1 4.08Å; T8-I12 VanDerWaalsContact O-CG1 3.31Å; T8-I12 WeakPolarHBondContact O-CG1 3.42Å; T8-I12 PolarHBondContact O-N 3.07Å
9L93Very high89.9Confident84 Ų8498.7 Ų98.744%0.4449%0.494SS..Hα-helixtrans-63.1-41.3176.9-175.165.2000111.5N5 V6 I12 I13N5-L9 WeakPolarHBondContact O-CB 3.41Å; N5-L9 PolarHBondContact O-N 3.27Å; V6-L9 PolarHBondContact O-N 3.3Å; L9-I12 PolarHBondContact O-N 2.98Å; L9-I13 HydrophobicContact CD1-CD1 4.32Å; L9-I13 HydrophobicContact CG-CD1 3.96Å; L9-I13 VanDerWaalsContact O-CG1 3.3Å; L9-I13 WeakPolarHBondContact O-CG1 3.47Å; L9-I13 PolarHBondContact O-N 3.42Å
10S92.8Very high90.4Very high57 Ų57100 Ų10040%0.39950%0.502SS..Hα-helixtrans-61.3-43.5174.6-66.10000112.1V6 R7 T8 I13 C14V6-S10 VanDerWaalsContact O-CB 3.31Å; V6-S10 WeakPolarHBondContact O-CB 3.45Å; V6-S10 PolarHBondContact O-N 3.2Å; V6-S10 PolarHBondContact O-OG 3.34Å; R7-S10 PolarHBondContact O-N 3.3Å; T8-S10 VanDerWaalsContact C-N 3.34Å; T8-S10 PolarHBondContact O-N 3.18Å; S10-I13 PolarHBondContact O-N 3.43Å; S10-C14 VanDerWaalsContact O-CB 3.32Å; S10-C14 WeakPolarHBondContact O-CB 3.35Å; S10-C14 PolarHBondContact O-N 3.49Å; S10-C14 PolarHBondContact O-SG 3Å
11L91.9Very high90.8Very high108 Ų10899.7 Ų99.757%0.56551%0.505SS*.Hα-helixtrans-62.2-44.4175.8-75171.5000111.5R7 T8 C14 T15R7-L11 HydrophobicContact CG-CD1 4.16Å; R7-L11 WeakPolarHBondContact O-CG 3.28Å; R7-L11 PolarHBondContact O-N 3.31Å; T8-L11 PolarHBondContact O-N 2.92Å; L11-C14 PolarHBondContact O-N 2.97Å; L11-T15 WeakPolarHBondContact O-CB 3.49Å; L11-T15 PolarHBondContact O-N 2.93Å; L11-T15 PolarHBondContact O-OG1 2.68Å; L11-T15 VanDerWaalsContact O-OG1 3.05Å
12I95.1Very high92.3Very high81 Ų8192.2 Ų92.242%0.41547%0.473SS..Hα-helixtrans-58.8-51.1176.7-68.8166.6000110.4T8 L9 C14 T15 F16T8-I12 HydrophobicContact CG2-CD1 4.08Å; T8-I12 VanDerWaalsContact O-CG1 3.31Å; T8-I12 WeakPolarHBondContact O-CG1 3.42Å; T8-I12 PolarHBondContact O-N 3.07Å; L9-I12 PolarHBondContact O-N 2.98Å; I12-C14 PolarHBondContact O-N 3.37Å; I12-T15 PolarHBondContact O-N 2.95Å; I12-F16 HydrophobicContact CG2-CD2 3.66Å; I12-F16 HydrophobicContact CG2-CE2 3.72Å; I12-F16 VanDerWaalsContact O-CD2 3.3Å; I12-F16 WeakPolarHBondContact O-CD2 3.22Å; I12-F16 PolarHBondContact O-N 2.99Å
13I97.3Very high93.2Very high93 Ų9389.5 Ų89.548%0.47747%0.473SS..Hα-helixtrans-60-47179.5-67.8167.7000110.5L9 S10 T15 F16 T17L9-I13 HydrophobicContact CD1-CD1 4.32Å; L9-I13 HydrophobicContact CG-CD1 3.96Å; L9-I13 VanDerWaalsContact O-CG1 3.3Å; L9-I13 WeakPolarHBondContact O-CG1 3.47Å; L9-I13 PolarHBondContact O-N 3.42Å; S10-I13 PolarHBondContact O-N 3.43Å; I13-T15 PolarHBondContact O-N 3.1Å; I13-F16 PolarHBondContact O-N 2.85Å; I13-T17 HydrophobicContact CG2-CG2 4.4Å; I13-T17 WeakPolarHBondContact O-CG2 3.47Å; I13-T17 PolarHBondContact O-N 2.99Å; I13-T17 PolarHBondContact O-OG1 3.21Å; I13-T17 VanDerWaalsContact O-OG1 3.12Å
14C96.9Very high94Very high79 Ų7982.9 Ų82.953%0.53446%0.461SS..Hα-helixtrans-60.7-40.4177.9-730000112.8S10 L11 I12 T17 Y18S10-C14 VanDerWaalsContact O-CB 3.32Å; S10-C14 WeakPolarHBondContact O-CB 3.35Å; S10-C14 PolarHBondContact O-N 3.49Å; S10-C14 PolarHBondContact O-SG 3Å; L11-C14 PolarHBondContact O-N 2.97Å; I12-C14 PolarHBondContact O-N 3.37Å; C14-T17 WeakPolarHBondContact CA-OG1 3.46Å; C14-T17 PolarHBondContact O-OG1 2.91Å; C14-Y18 VanDerWaalsContact O-CB 3.24Å; C14-Y18 WeakPolarHBondContact O-CB 3.34Å; C14-Y18 PolarHBondContact O-N 3.32Å
15T95.8Very high95.1Very high83 Ų8385.3 Ų85.351%0.50948%0.477SS..Hα-helixtrans-67.8-42.7177.1-60.40000111.3L11 I12 I13 Y18 L19L11-T15 WeakPolarHBondContact O-CB 3.49Å; L11-T15 PolarHBondContact O-N 2.93Å; L11-T15 PolarHBondContact O-OG1 2.68Å; L11-T15 VanDerWaalsContact O-OG1 3.05Å; I12-T15 PolarHBondContact O-N 2.95Å; I13-T15 PolarHBondContact O-N 3.1Å; T15-Y18 PolarHBondContact O-N 3.5Å; T15-L19 HydrophobicContact CG2-CD1 4.45Å; T15-L19 WeakPolarHBondContact O-CG 3.48Å; T15-L19 PolarHBondContact O-N 3.37Å
16F97.9Very high95.6Very high136 Ų13687.9 Ų87.960%0.59648%0.484SS*.Hα-helixtrans-63.1-44176-88.4-71000112.3I12 I13 Y18 L19 L20I12-F16 HydrophobicContact CG2-CD2 3.66Å; I12-F16 HydrophobicContact CG2-CE2 3.72Å; I12-F16 VanDerWaalsContact O-CD2 3.3Å; I12-F16 WeakPolarHBondContact O-CD2 3.22Å; I12-F16 PolarHBondContact O-N 2.99Å; I13-F16 PolarHBondContact O-N 2.85Å; F16-Y18 VanDerWaalsContact C-N 3.33Å; F16-Y18 PolarHBondContact O-N 3.4Å; F16-L19 PolarHBondContact O-N 3.33Å; F16-L20 WeakPolarHBondContact O-CG 3.14Å; F16-L20 PolarHBondContact O-N 3.27Å
17T98.1Very high96Very high72 Ų7289.7 Ų89.744%0.44249%0.492SS..Hα-helixtrans-65.6-37.9176.1550000111.7I13 C14 L19 L20 V21I13-T17 HydrophobicContact CG2-CG2 4.4Å; I13-T17 WeakPolarHBondContact O-CG2 3.47Å; I13-T17 PolarHBondContact O-N 2.99Å; I13-T17 PolarHBondContact O-OG1 3.21Å; I13-T17 VanDerWaalsContact O-OG1 3.12Å; C14-T17 WeakPolarHBondContact CA-OG1 3.46Å; C14-T17 PolarHBondContact O-OG1 2.91Å; T17-L19 VanDerWaalsContact C-N 3.34Å; T17-L19 PolarHBondContact O-N 3.5Å; T17-L20 PolarHBondContact O-N 3.36Å; T17-V21 WeakPolarHBondContact O-CG2 3.33Å; T17-V21 PolarHBondContact O-N 2.61Å
18Y97.5Very high96.5Very high186 Ų18691 Ų9173%0.72951%0.514SS*.Hα-helixtrans-61-41.2174.1-171.3-95.5000112.1C14 T15 F16 G22C14-Y18 VanDerWaalsContact O-CB 3.24Å; C14-Y18 WeakPolarHBondContact O-CB 3.34Å; C14-Y18 PolarHBondContact O-N 3.32Å; T15-Y18 PolarHBondContact O-N 3.5Å; F16-Y18 VanDerWaalsContact C-N 3.33Å; F16-Y18 PolarHBondContact O-N 3.4Å; Y18-G22 PolarHBondContact O-N 3.46Å
19L98.2Very high96.9Very high107 Ų10793.3 Ų93.356%0.5652%0.523SS*.Hα-helixtrans-64.4-42.8174.3-72.6171.5000112.3T15 F16 T17 G22 A23T15-L19 HydrophobicContact CG2-CD1 4.45Å; T15-L19 WeakPolarHBondContact O-CG 3.48Å; T15-L19 PolarHBondContact O-N 3.37Å; F16-L19 PolarHBondContact O-N 3.33Å; T17-L19 VanDerWaalsContact C-N 3.34Å; T17-L19 PolarHBondContact O-N 3.5Å; L19-G22 PolarHBondContact O-N 3.47Å; L19-A23 WeakPolarHBondContact O-CB 3.23Å; L19-A23 PolarHBondContact O-N 3.17Å
20L98.3Very high97.1Very high124 Ų12494.4 Ų94.465%0.64953%0.526SS*.Hα-helixtrans-64.1-43.5177.8-70.7173000112.1F16 T17 A23 A24F16-L20 WeakPolarHBondContact O-CG 3.14Å; F16-L20 PolarHBondContact O-N 3.27Å; T17-L20 PolarHBondContact O-N 3.36Å; L20-A23 PolarHBondContact O-N 2.95Å; L20-A24 PolarHBondContact O-N 3.07Å
21V98.4Very high97.3Very high94 Ų9493.2 Ų93.257%0.5752%0.518SS*.Hα-helixtrans-62.7-45.6174.7172.10000110.3T17 A23 A24 V25T17-V21 WeakPolarHBondContact O-CG2 3.33Å; T17-V21 PolarHBondContact O-N 2.61Å; V21-A23 PolarHBondContact O-N 2.89Å; V21-A24 PolarHBondContact O-N 3.47Å; V21-V25 HydrophobicContact CG1-CG2 4.42Å; V21-V25 VanDerWaalsContact O-CG2 3.32Å; V21-V25 WeakPolarHBondContact O-CG2 3.35Å; V21-V25 PolarHBondContact O-N 3.45Å
22G97.9Very high97.5Very high20 Ų2093.2 Ų93.221%0.20652%0.518CS..Hα-helixtrans-57.7-47.6175.900000112.4Y18 L19 A24 V25 F26Y18-G22 PolarHBondContact O-N 3.46Å; L19-G22 PolarHBondContact O-N 3.47Å; G22-A24 PolarHBondContact O-N 2.88Å; G22-V25 PolarHBondContact O-N 3Å; G22-F26 WeakPolarHBondContact O-CD2 3.38Å; G22-F26 PolarHBondContact O-N 3.37Å
23A98.3Very high97.5Very high61 Ų6193.3 Ų93.350%0.50452%0.52SS..Hα-helixtrans-59.5-45.8178.200000112.1L19 L20 V21 V25 F26 D27L19-A23 WeakPolarHBondContact O-CB 3.23Å; L19-A23 PolarHBondContact O-N 3.17Å; L20-A23 PolarHBondContact O-N 2.95Å; V21-A23 PolarHBondContact O-N 2.89Å; A23-V25 VanDerWaalsContact C-N 3.35Å; A23-V25 PolarHBondContact O-N 3.19Å; A23-F26 PolarHBondContact O-N 2.98Å; A23-D27 VanDerWaalsContact O-CB 3.29Å; A23-D27 WeakPolarHBondContact O-CB 3.14Å; A23-D27 PolarHBondContact O-N 3.45Å
24A98.3Very high97.4Very high60 Ų6095.4 Ų95.450%0.49653%0.527SS..Hα-helixtrans-64.4-38.2177.900000112.6L20 V21 G22 A28L20-A24 PolarHBondContact O-N 3.07Å; V21-A24 PolarHBondContact O-N 3.47Å; G22-A24 PolarHBondContact O-N 2.88Å; A24-A28 WeakPolarHBondContact O-CB 3.28Å; A24-A28 PolarHBondContact O-N 2.91Å; A24-A28 VanDerWaalsContact O-N 3.08Å
25V98.3Very high97.3Very high74 Ų7496.8 Ų96.845%0.44853%0.527SS..Hα-helixtrans-70.1-43.7177.6172.20000111.2V21 G22 A23 A28 L29V21-V25 HydrophobicContact CG1-CG2 4.42Å; V21-V25 VanDerWaalsContact O-CG2 3.32Å; V21-V25 WeakPolarHBondContact O-CG2 3.35Å; V21-V25 PolarHBondContact O-N 3.45Å; G22-V25 PolarHBondContact O-N 3Å; A23-V25 VanDerWaalsContact C-N 3.35Å; A23-V25 PolarHBondContact O-N 3.19Å; V25-A28 PolarHBondContact O-N 3.28Å; V25-L29 HydrophobicContact CG1-CD1 3.7Å; V25-L29 HydrophobicContact CG1-CG 4.37Å; V25-L29 WeakPolarHBondContact O-CB 3.39Å; V25-L29 VanDerWaalsContact O-CG 3.25Å; V25-L29 WeakPolarHBondContact O-CG 3.41Å; V25-L29 PolarHBondContact O-N 3.04Å
26F98.1Very high97.4Very high140 Ų140100 Ų10061%0.61453%0.53SS*.Hα-helixtrans-65.7-41.1177.3-74.3-57.8000112.1G22 A23 A28 L29 E30G22-F26 WeakPolarHBondContact O-CD2 3.38Å; G22-F26 PolarHBondContact O-N 3.37Å; A23-F26 PolarHBondContact O-N 2.98Å; F26-A28 VanDerWaalsContact C-N 3.33Å; F26-A28 PolarHBondContact O-N 3.27Å; F26-L29 PolarHBondContact O-N 3.41Å; F26-E30 WeakPolarHBondContact O-CB 3.22Å; F26-E30 PolarHBondContact O-N 3.34Å
27D98Very high97.2Very high103 Ų10398.7 Ų98.755%0.55153%0.526SS*.Hα-helixtrans-58.2-46173.6-179.441000111.3A23 L29 S31A23-D27 VanDerWaalsContact O-CB 3.29Å; A23-D27 WeakPolarHBondContact O-CB 3.14Å; A23-D27 PolarHBondContact O-N 3.45Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 2.88Å; D27-S31 WeakPolarHBondContact CA-OG 3.38Å; D27-S31 WeakPolarHBondContact O-CB 3.41Å; D27-S31 PolarHBondContact O-N 3.22Å; D27-S31 PolarHBondContact O-OG 2.91Å; D27-S31 WeakPolarHBondContact OD1-CB 3.27Å; D27-S31 PolarHBondContact OD1-OG 2.99Å
28A97.8Very high97Very high81 Ų8199.9 Ų99.967%0.66953%0.526SS*.Hα-helixtrans-66.9-25.9178.700000114.4A24 V25 F26A24-A28 WeakPolarHBondContact O-CB 3.28Å; A24-A28 PolarHBondContact O-N 2.91Å; A24-A28 VanDerWaalsContact O-N 3.08Å; V25-A28 PolarHBondContact O-N 3.28Å; F26-A28 VanDerWaalsContact C-N 3.33Å; F26-A28 PolarHBondContact O-N 3.27Å
29L96.9Very high97Very high117 Ų11797 Ų9761%0.61352%0.52SS*.Hα-helixtrans-95.4-36.9-176.7-68.9175.6000113.2V25 F26 D27V25-L29 HydrophobicContact CG1-CD1 3.7Å; V25-L29 HydrophobicContact CG1-CG 4.37Å; V25-L29 WeakPolarHBondContact O-CB 3.39Å; V25-L29 VanDerWaalsContact O-CG 3.25Å; V25-L29 WeakPolarHBondContact O-CG 3.41Å; V25-L29 PolarHBondContact O-N 3.04Å; F26-L29 PolarHBondContact O-N 3.41Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 2.88Å
30E97.1Very high96.9Very high106 Ų10698.8 Ų98.850%0.49552%0.523SS..Hα-helixtrans-108.4-29.2-167.9-61.5-63.2159.700113.7F26 D32 N33 E34F26-E30 WeakPolarHBondContact O-CB 3.22Å; F26-E30 PolarHBondContact O-N 3.34Å; E30-D32 PolarHBondContact O-N 3.21Å; E30-N33 WeakPolarHBondContact O-CB 3.45Å; E30-N33 PolarHBondContact O-N 3.47Å; E30-E34 PolarHBondContact O-N 3.38Å
31S96.4Very high96.7Very high33 Ų3398.3 Ų98.323%0.23152%0.521CS..Hα-helixtrans-62-44.4-170.7-63.20000113.3D27 N33 E34 M35D27-S31 WeakPolarHBondContact CA-OG 3.38Å; D27-S31 WeakPolarHBondContact O-CB 3.41Å; D27-S31 PolarHBondContact O-N 3.22Å; D27-S31 PolarHBondContact O-OG 2.91Å; D27-S31 WeakPolarHBondContact OD1-CB 3.27Å; D27-S31 PolarHBondContact OD1-OG 2.99Å; S31-N33 VanDerWaalsContact C-N 3.27Å; S31-N33 PolarHBondContact O-N 3.26Å; S31-E34 PolarHBondContact O-N 3.47Å; S31-M35 WeakPolarHBondContact O-CG 3.45Å; S31-M35 PolarHBondContact O-N 2.93Å; S31-M35 VanDerWaalsContact O-N 3.08Å
32D96.4Very high96.5Very high108 Ų10898.9 Ų98.958%0.57852%0.515SS*.Hα-helixtrans-65.2-32.4176.4-85.6-2.8000112.2E30 R36E30-D32 PolarHBondContact O-N 3.21Å; D32-R36 WeakPolarHBondContact O-CD 3.15Å; D32-R36 WeakPolarHBondContact O-CG 3.27Å; D32-R36 PolarHBondContact O-N 2.95Å
33N95.3Very high96.4Very high83 Ų83100.7 Ų100.744%0.44453%0.528SS..Hα-helixtrans-74-44.8179.1-177.469000111E30 S31 M35 R36 E37E30-N33 WeakPolarHBondContact O-CB 3.45Å; E30-N33 PolarHBondContact O-N 3.47Å; S31-N33 VanDerWaalsContact C-N 3.27Å; S31-N33 PolarHBondContact O-N 3.26Å; N33-M35 PolarHBondContact O-N 3.08Å; N33-R36 PolarHBondContact O-N 3.13Å; N33-E37 WeakPolarHBondContact O-CB 3.38Å; N33-E37 PolarHBondContact O-N 3.42Å
34E95.4Very high96.2Very high136 Ų136101.9 Ų101.964%0.63652%0.524SS*.Hα-helixtrans-57.6-48.9175.9-177.3-179.7-150.700111.2E30 S31 R36 E37 E38E30-E34 PolarHBondContact O-N 3.38Å; S31-E34 PolarHBondContact O-N 3.47Å; E34-R36 VanDerWaalsContact C-N 3.33Å; E34-R36 PolarHBondContact O-N 2.73Å; E34-E37 PolarHBondContact O-N 3.43Å; E34-E37 VanDerWaalsContact O-N 3.16Å; E34-E38 PolarHBondContact O-N 2.95Å
35M95.8Very high96Very high108 Ų108101.9 Ų101.953%0.53251%0.513SS..Hα-helixtrans-58.3-44178.1-74.1-176.858.500112.2S31 N33 E37 E38 E39S31-M35 WeakPolarHBondContact O-CG 3.45Å; S31-M35 PolarHBondContact O-N 2.93Å; S31-M35 VanDerWaalsContact O-N 3.08Å; N33-M35 PolarHBondContact O-N 3.08Å; M35-E37 VanDerWaalsContact C-N 3.34Å; M35-E37 PolarHBondContact O-N 3.33Å; M35-E38 PolarHBondContact O-N 3.45Å; M35-E39 WeakPolarHBondContact O-CG 3.43Å; M35-E39 PolarHBondContact O-N 3.01Å
36R96.3Very high95.8Very high151 Ų151104.1 Ų104.157%0.5752%0.521SS*.Hα-helixtrans-67.2-35.7178.4-72173.4-165.5-1456.3112.3D32 N33 E34 K40D32-R36 WeakPolarHBondContact O-CD 3.15Å; D32-R36 WeakPolarHBondContact O-CG 3.27Å; D32-R36 PolarHBondContact O-N 2.95Å; N33-R36 PolarHBondContact O-N 3.13Å; E34-R36 VanDerWaalsContact C-N 3.33Å; E34-R36 PolarHBondContact O-N 2.73Å; R36-K40 VanDerWaalsContact O-CG 3.24Å; R36-K40 WeakPolarHBondContact O-CG 3.44Å; R36-K40 PolarHBondContact O-N 3.31Å; R36-K40 VanDerWaalsContact O-N 3.12Å
37E94.8Very high95.6Very high108 Ų108103.2 Ų103.251%0.50551%0.514SS..Hα-helixtrans-69.2-43.4177.4-170.7165.1-170.600110.9N33 E34 M35 E39 K40 L41N33-E37 WeakPolarHBondContact O-CB 3.38Å; N33-E37 PolarHBondContact O-N 3.42Å; E34-E37 PolarHBondContact O-N 3.43Å; E34-E37 VanDerWaalsContact O-N 3.16Å; M35-E37 VanDerWaalsContact C-N 3.34Å; M35-E37 PolarHBondContact O-N 3.33Å; E37-E39 PolarHBondContact O-N 2.96Å; E37-K40 PolarHBondContact O-N 3.35Å; E37-L41 HydrophobicContact CG-CD1 4.22Å; E37-L41 WeakPolarHBondContact O-CB 3.47Å; E37-L41 VanDerWaalsContact O-CG 3.32Å; E37-L41 WeakPolarHBondContact O-CG 3.37Å; E37-L41 PolarHBondContact O-N 2.93Å
38E94.4Very high95.5Very high97 Ų97100.8 Ų100.845%0.45350%0.501SS..Hα-helixtrans-59.1-45.3174.4-168.7-171.5-174.900111.7E34 M35 K40 L41 K42E34-E38 PolarHBondContact O-N 2.95Å; M35-E38 PolarHBondContact O-N 3.45Å; E38-K40 PolarHBondContact O-N 3.49Å; E38-L41 PolarHBondContact O-N 2.92Å; E38-K42 HydrophobicContact CG-CD 4.27Å; E38-K42 WeakPolarHBondContact O-CB 3.39Å; E38-K42 WeakPolarHBondContact O-CG 3.3Å; E38-K42 PolarHBondContact O-N 3.05Å; E38-K42 WeakPolarHBondContact OE1-CE 3.35Å; E38-K42 IonicContact OE1-NZ 3.77Å; E38-K42 PolarHBondContact OE1-NZ 2.96Å; E38-K42 IonicContact OE2-NZ 3.79Å
39E96.1Very high95.4Very high127 Ų12798.7 Ų98.759%0.59348%0.476SS*.Hα-helixtrans-60-44176.1-76.3-178.9170.300112.2M35 E37 K42 A43M35-E39 WeakPolarHBondContact O-CG 3.43Å; M35-E39 PolarHBondContact O-N 3.01Å; E37-E39 PolarHBondContact O-N 2.96Å; E39-K42 PolarHBondContact O-N 2.85Å; E39-A43 WeakPolarHBondContact O-CB 3.31Å; E39-A43 PolarHBondContact O-N 3.46Å
40K96.2Very high95.3Very high143 Ų14396.1 Ų96.162%0.62248%0.478SS*.Hα-helixtrans-63.4-43.8176.6-74168.8-173.9171.40111.7R36 E37 E38 A43 E44R36-K40 VanDerWaalsContact O-CG 3.24Å; R36-K40 WeakPolarHBondContact O-CG 3.44Å; R36-K40 PolarHBondContact O-N 3.31Å; R36-K40 VanDerWaalsContact O-N 3.12Å; E37-K40 PolarHBondContact O-N 3.35Å; E38-K40 PolarHBondContact O-N 3.49Å; K40-A43 PolarHBondContact O-N 2.99Å; K40-E44 PolarHBondContact O-N 3.28Å
41L94.7Very high95.3Very high115 Ų11597.2 Ų97.260%0.60248%0.481SS*.Hα-helixtrans-64-44.1179.2-71.9172.9000111.3E37 E38 A43 E44 E45E37-L41 HydrophobicContact CG-CD1 4.22Å; E37-L41 WeakPolarHBondContact O-CB 3.47Å; E37-L41 VanDerWaalsContact O-CG 3.32Å; E37-L41 WeakPolarHBondContact O-CG 3.37Å; E37-L41 PolarHBondContact O-N 2.93Å; E38-L41 PolarHBondContact O-N 2.92Å; L41-A43 PolarHBondContact O-N 3.16Å; L41-E44 PolarHBondContact O-N 3.49Å; L41-E45 PolarHBondContact O-N 3.38Å
42K94.4Very high95.2Very high105 Ų105102 Ų10246%0.45750%0.495SS..Hα-helixtrans-62.5-41.5174.9-74.2175.3-178166.40112.2E38 E39 E44 E45 I46E38-K42 HydrophobicContact CG-CD 4.27Å; E38-K42 WeakPolarHBondContact O-CB 3.39Å; E38-K42 WeakPolarHBondContact O-CG 3.3Å; E38-K42 PolarHBondContact O-N 3.05Å; E38-K42 WeakPolarHBondContact OE1-CE 3.35Å; E38-K42 IonicContact OE1-NZ 3.77Å; E38-K42 PolarHBondContact OE1-NZ 2.96Å; E38-K42 IonicContact OE2-NZ 3.79Å; E39-K42 PolarHBondContact O-N 2.85Å; K42-E44 VanDerWaalsContact C-N 3.34Å; K42-E45 PolarHBondContact O-N 3.29Å; K42-I46 WeakPolarHBondContact O-CG1 3.38Å; K42-I46 PolarHBondContact O-N 3.32Å
43A95.6Very high95.2Very high58 Ų58104.1 Ų104.148%0.47951%0.506SS..Hα-helixtrans-62.7-42.3176.400000111.7E39 K40 L41 I46 R47E39-A43 WeakPolarHBondContact O-CB 3.31Å; E39-A43 PolarHBondContact O-N 3.46Å; K40-A43 PolarHBondContact O-N 2.99Å; L41-A43 PolarHBondContact O-N 3.16Å; A43-I46 PolarHBondContact O-N 3.47Å; A43-R47 WeakPolarHBondContact O-CB 3.3Å; A43-R47 PolarHBondContact O-N 2.76Å
44E93.9Very high95.2Very high87 Ų87102.4 Ų102.441%0.40750%0.497SS..Hα-helixtrans-68-38.4175.8-79.1-61.2138.500112.9K40 L41 K42 R47 L48K40-E44 PolarHBondContact O-N 3.28Å; L41-E44 PolarHBondContact O-N 3.49Å; K42-E44 VanDerWaalsContact C-N 3.34Å; E44-R47 VanDerWaalsContact CD-NE 3.32Å; E44-R47 PolarHBondContact O-N 3.41Å; E44-R47 IonicContact OE1-CZ 2.84Å; E44-R47 IonicContact OE1-NE 2.61Å; E44-R47 PolarHBondContact OE1-NE 3.09Å; E44-R47 VanDerWaalsContact OE1-NE 3.16Å; E44-R47 IonicContact OE1-NH2 3.35Å; E44-R47 IonicContact OE2-CZ 2.96Å; E44-R47 IonicContact OE2-NE 3.16Å; E44-R47 PolarHBondContact OE2-NE 3.06Å; E44-R47 IonicContact OE2-NH2 3.92Å; E44-R47 PolarHBondContact OE2-NH2 3.13Å; E44-L48 WeakPolarHBondContact O-CB 3.39Å; E44-L48 VanDerWaalsContact O-CG 3.31Å; E44-L48 WeakPolarHBondContact O-CG 3.42Å; E44-L48 PolarHBondContact O-N 3Å
45E93.2Very high95.2Very high60 Ų6099.4 Ų99.428%0.2849%0.488SS..Hα-helixtrans-55.5-53.5171.7176.2-171.6160.400110.4L41 K42 R47 L48 K49 Y59L41-E45 PolarHBondContact O-N 3.38Å; K42-E45 PolarHBondContact O-N 3.29Å; E45-R47 VanDerWaalsContact C-N 3.28Å; E45-R47 PolarHBondContact O-N 3.45Å; E45-L48 PolarHBondContact O-N 3.4Å; E45-K49 HydrophobicContact CG-CD 3.57Å; E45-K49 HydrophobicContact CG-CG 4.35Å; E45-K49 WeakPolarHBondContact O-CG 3.35Å; E45-K49 PolarHBondContact O-N 2.9Å; E45-K49 WeakPolarHBondContact OE1-CD 3.44Å; E45-K49 IonicContact OE1-NZ 2.95Å; E45-K49 PolarHBondContact OE1-NZ 3.2Å; E45-Y59 HydrophobicContact CB-CE1 4.48Å; E45-Y59 HydrophobicContact CG-CD1 4.14Å; E45-Y59 HydrophobicContact CG-CE1 3.6Å; E45-Y59 HydrophobicContact CG-CE2 4.33Å
46I94.3Very high95Very high121 Ų12199 Ų9962%0.62149%0.491SS*.Hα-helixtrans-59.5-43.6-179.1-67.4166.7000110.2K42 A43 L48 K49 G50K42-I46 WeakPolarHBondContact O-CG1 3.38Å; K42-I46 PolarHBondContact O-N 3.32Å; A43-I46 PolarHBondContact O-N 3.47Å; I46-L48 PolarHBondContact O-N 3.27Å; I46-K49 PolarHBondContact O-N 3.37Å; I46-G50 PolarHBondContact O-N 2.95Å
47R95.8Very high94.9Very high121 Ų12196 Ų9646%0.45748%0.484SS..Hα-helixtrans-60.3-44.6177.7-169.3-172.871.391.32.7111.7A43 E44 E45 K51A43-R47 WeakPolarHBondContact O-CB 3.3Å; A43-R47 PolarHBondContact O-N 2.76Å; E44-R47 VanDerWaalsContact CD-NE 3.32Å; E44-R47 PolarHBondContact O-N 3.41Å; E44-R47 IonicContact OE1-CZ 2.84Å; E44-R47 IonicContact OE1-NE 2.61Å; E44-R47 PolarHBondContact OE1-NE 3.09Å; E44-R47 VanDerWaalsContact OE1-NE 3.16Å; E44-R47 IonicContact OE1-NH2 3.35Å; E44-R47 IonicContact OE2-CZ 2.96Å; E44-R47 IonicContact OE2-NE 3.16Å; E44-R47 PolarHBondContact OE2-NE 3.06Å; E44-R47 IonicContact OE2-NH2 3.92Å; E44-R47 PolarHBondContact OE2-NH2 3.13Å; E45-R47 VanDerWaalsContact C-N 3.28Å; E45-R47 PolarHBondContact O-N 3.45Å; R47-K51 WeakPolarHBondContact O-CB 3.32Å; R47-K51 PolarHBondContact O-N 3.1Å
48L95.2Very high94.8Very high52 Ų5295.2 Ų95.227%0.27248%0.483SS..Hα-helixtrans-68.5-44.6179.5-72.6173000111.8E44 E45 I46 G50 K51 Y52E44-L48 WeakPolarHBondContact O-CB 3.39Å; E44-L48 VanDerWaalsContact O-CG 3.31Å; E44-L48 WeakPolarHBondContact O-CG 3.42Å; E44-L48 PolarHBondContact O-N 3Å; E45-L48 PolarHBondContact O-N 3.4Å; I46-L48 PolarHBondContact O-N 3.27Å; L48-G50 VanDerWaalsContact C-N 3.34Å; L48-G50 PolarHBondContact O-N 2.86Å; L48-K51 PolarHBondContact O-N 2.65Å; L48-Y52 HydrophobicContact CD2-CD2 4.09Å; L48-Y52 HydrophobicContact CD2-CE2 3.66Å; L48-Y52 WeakPolarHBondContact O-CD2 3.24Å; L48-Y52 PolarHBondContact O-N 3.16Å
49K94.8Very high94.8Very high36 Ų3693 Ų9316%0.15747%0.471CS..Hα-helixtrans-60.2-44.1177.5-72167.377.91740111.5E45 I46 N53 I54 T56 Y59E45-K49 HydrophobicContact CG-CD 3.57Å; E45-K49 HydrophobicContact CG-CG 4.35Å; E45-K49 WeakPolarHBondContact O-CG 3.35Å; E45-K49 PolarHBondContact O-N 2.9Å; E45-K49 WeakPolarHBondContact OE1-CD 3.44Å; E45-K49 IonicContact OE1-NZ 2.95Å; E45-K49 PolarHBondContact OE1-NZ 3.2Å; I46-K49 PolarHBondContact O-N 3.37Å; K49-N53 CarbonylContact O-C 3.41Å; K49-N53 WeakPolarHBondContact O-CA 3.4Å; K49-N53 PolarHBondContact O-N 3.28Å; K49-I54 PolarHBondContact O-N 3.45Å; K49-T56 PolarHBondContact NZ-OG1 3.28Å; K49-T56 VanDerWaalsContact NZ-OG1 3.07Å; K49-Y59 HydrophobicContact CD-CD1 4.46Å; K49-Y59 HydrophobicContact CD-CD2 4.28Å; K49-Y59 HydrophobicContact CD-CG 4.09Å; K49-Y59 HydrophobicContact CG-CD2 3.82Å; K49-Y59 HydrophobicContact CG-CE2 4.37Å; K49-Y59 HydrophobicContact CG-CG 4.08Å
50G95.1Very high94.6Very high63 Ų6392.7 Ų92.765%0.64946%0.464SS*.Hα-helixtrans-67.6-45.2175.700000113.1I46 L48 Y52 N53I46-G50 PolarHBondContact O-N 2.95Å; L48-G50 VanDerWaalsContact C-N 3.34Å; L48-G50 PolarHBondContact O-N 2.86Å; G50-Y52 VanDerWaalsContact C-N 3.35Å; G50-Y52 PolarHBondContact O-N 3.47Å; G50-N53 PolarHBondContact O-N 3.38Å
51K96.6Very high94.5Very high129 Ų12990 Ų9056%0.56145%0.454SS*.Hα-helixtrans-63.3-38.3-177.9-177.4-179.7178.8-165.30113.1R47 L48R47-K51 WeakPolarHBondContact O-CB 3.32Å; R47-K51 PolarHBondContact O-N 3.1Å; L48-K51 PolarHBondContact O-N 2.65Å
52Y95.8Very high94.4Very high135 Ų13588.4 Ų88.453%0.52945%0.446SS..Hα-helixtrans-1063.9-176.1-63.7-72.1000113.5L48 G50 I54L48-Y52 HydrophobicContact CD2-CD2 4.09Å; L48-Y52 HydrophobicContact CD2-CE2 3.66Å; L48-Y52 WeakPolarHBondContact O-CD2 3.24Å; L48-Y52 PolarHBondContact O-N 3.16Å; G50-Y52 VanDerWaalsContact C-N 3.35Å; G50-Y52 PolarHBondContact O-N 3.47Å; Y52-I54 VanDerWaalsContact C-N 3.3Å; Y52-I54 PolarHBondContact O-N 3.08Å
53N96.1Very high94.3Very high151 Ų15188.3 Ų88.381%0.80745%0.447SS*.THydrogen-bonded Turntrans51.845.9-177.8-162.740.3000112.9K49 G50K49-N53 CarbonylContact O-C 3.41Å; K49-N53 WeakPolarHBondContact O-CA 3.4Å; K49-N53 PolarHBondContact O-N 3.28Å; G50-N53 PolarHBondContact O-N 3.38Å
54I95.2Very high94.1Very high47 Ų4789 Ų8924%0.24144%0.442CS..  trans-90.2130-177.7-55.7172.5000109K49 Y52 D58K49-I54 PolarHBondContact O-N 3.45Å; Y52-I54 VanDerWaalsContact C-N 3.3Å; Y52-I54 PolarHBondContact O-N 3.08Å; I54-D58 HydrophobicContact CG2-CB 3.82Å
55T94.8Very high94Very high74 Ų7489.2 Ų89.245%0.45445%0.449SS..  trans-69.5157174.975.50000111.1E57 D58 Y59T55-E57 PolarHBondContact O-N 3.35Å; T55-D58 PolarHBondContact O-N 2.89Å; T55-D58 WeakPolarHBondContact OG1-CB 3.38Å; T55-D58 PolarHBondContact OG1-N 3.16Å; T55-D58 PolarHBondContact OG1-OD2 3.32Å; T55-Y59 WeakPolarHBondContact O-CB 3.32Å; T55-Y59 PolarHBondContact O-N 2.94Å
56T92.5Very high93.9Very high98 Ų9889.6 Ų89.660%0.60145%0.453SS*.Hα-helixtrans-60.7-34.6178.3-600000112.6K49 R60K49-T56 PolarHBondContact NZ-OG1 3.28Å; K49-T56 VanDerWaalsContact NZ-OG1 3.07Å; T56-R60 PolarHBondContact O-N 2.9Å; T56-R60 VanDerWaalsContact O-N 3.1Å
57E92.9Very high93.5Very high90 Ų9090.2 Ų90.242%0.42146%0.455SS..Hα-helixtrans-72-42.6178.2-175.455.9-154.600111.6T55 Y59 R60 Q61T55-E57 PolarHBondContact O-N 3.35Å; E57-Y59 VanDerWaalsContact C-N 3.3Å; E57-Y59 PolarHBondContact O-N 3.45Å; E57-R60 WeakPolarHBondContact O-CB 3.48Å; E57-R60 PolarHBondContact O-N 3.49Å; E57-R60 VanDerWaalsContact O-N 3.17Å; E57-R60 IonicContact OE1-CZ 3.53Å; E57-R60 IonicContact OE1-NE 3.42Å; E57-R60 PolarHBondContact OE1-NE 2.97Å; E57-R60 IonicContact OE1-NH2 2.78Å; E57-R60 PolarHBondContact OE1-NH2 2.98Å; E57-R60 IonicContact OE2-CZ 3.71Å; E57-R60 IonicContact OE2-NE 3.06Å; E57-R60 PolarHBondContact OE2-NE 3.39Å; E57-R60 IonicContact OE2-NH2 3.51Å; E57-Q61 WeakPolarHBondContact O-CG 3.24Å; E57-Q61 PolarHBondContact O-N 3.02Å; E57-Q61 PolarHBondContact OE1-NE2 3.5Å
58D94.3Very high93.1Very high91 Ų9191 Ų9149%0.48746%0.463SS..Hα-helixtrans-64.2-37.7176.8-63.8-39.1000111.6I54 T55 R60 Q61 L62I54-D58 HydrophobicContact CG2-CB 3.82Å; T55-D58 PolarHBondContact O-N 2.89Å; T55-D58 WeakPolarHBondContact OG1-CB 3.38Å; T55-D58 PolarHBondContact OG1-N 3.16Å; T55-D58 PolarHBondContact OG1-OD2 3.32Å; D58-R60 VanDerWaalsContact C-N 3.33Å; D58-Q61 PolarHBondContact O-N 3.37Å; D58-L62 WeakPolarHBondContact O-CB 3.33Å; D58-L62 PolarHBondContact O-N 3.33Å
59Y93.7Very high92.6Very high50 Ų5090.3 Ų90.320%0.19646%0.463CS..Hα-helixtrans-63-41.1174.7-169-92.7000111.4E45 K49 T55 E57 Q61 L62 E63E45-Y59 HydrophobicContact CB-CE1 4.48Å; E45-Y59 HydrophobicContact CG-CD1 4.14Å; E45-Y59 HydrophobicContact CG-CE1 3.6Å; E45-Y59 HydrophobicContact CG-CE2 4.33Å; K49-Y59 HydrophobicContact CD-CD1 4.46Å; K49-Y59 HydrophobicContact CD-CD2 4.28Å; K49-Y59 HydrophobicContact CD-CG 4.09Å; K49-Y59 HydrophobicContact CG-CD2 3.82Å; K49-Y59 HydrophobicContact CG-CE2 4.37Å; K49-Y59 HydrophobicContact CG-CG 4.08Å; T55-Y59 WeakPolarHBondContact O-CB 3.32Å; T55-Y59 PolarHBondContact O-N 2.94Å; E57-Y59 VanDerWaalsContact C-N 3.3Å; E57-Y59 PolarHBondContact O-N 3.45Å; Y59-Q61 PolarHBondContact O-N 3.23Å; Y59-L62 WeakPolarHBondContact O-CB 3.5Å; Y59-L62 PolarHBondContact O-N 3.12Å; Y59-E63 WeakPolarHBondContact O-CB 3.25Å; Y59-E63 PolarHBondContact O-N 3.44Å
60R92.3Very high92Very high120 Ų12092.8 Ų92.845%0.45348%0.475SS..Hα-helixtrans-63.3-40.4175.6-165.6179.274.499.43.8112T56 E57 D58 E63 L64T56-R60 PolarHBondContact O-N 2.9Å; T56-R60 VanDerWaalsContact O-N 3.1Å; E57-R60 WeakPolarHBondContact O-CB 3.48Å; E57-R60 PolarHBondContact O-N 3.49Å; E57-R60 VanDerWaalsContact O-N 3.17Å; E57-R60 IonicContact OE1-CZ 3.53Å; E57-R60 IonicContact OE1-NE 3.42Å; E57-R60 PolarHBondContact OE1-NE 2.97Å; E57-R60 IonicContact OE1-NH2 2.78Å; E57-R60 PolarHBondContact OE1-NH2 2.98Å; E57-R60 IonicContact OE2-CZ 3.71Å; E57-R60 IonicContact OE2-NE 3.06Å; E57-R60 PolarHBondContact OE2-NE 3.39Å; E57-R60 IonicContact OE2-NH2 3.51Å; D58-R60 VanDerWaalsContact C-N 3.33Å; R60-E63 PolarHBondContact O-N 2.68Å; R60-L64 VanDerWaalsContact O-CG 3.28Å; R60-L64 WeakPolarHBondContact O-CG 3.31Å; R60-L64 PolarHBondContact O-N 2.82Å
61Q93.9Very high91.1Very high86 Ų8692.9 Ų92.940%0.40246%0.464SS..Hα-helixtrans-64.7-41.1173.8-64.4-56.2-38.500111.6E57 D58 Y59 L64 V65E57-Q61 WeakPolarHBondContact O-CG 3.24Å; E57-Q61 PolarHBondContact O-N 3.02Å; E57-Q61 PolarHBondContact OE1-NE2 3.5Å; D58-Q61 PolarHBondContact O-N 3.37Å; Y59-Q61 PolarHBondContact O-N 3.23Å; Q61-L64 PolarHBondContact O-N 3.09Å; Q61-V65 WeakPolarHBondContact O-CG2 3.13Å; Q61-V65 PolarHBondContact O-N 3.03Å
62L93Very high90.2Very high82 Ų8293.5 Ų93.543%0.42947%0.469SS..Hα-helixtrans-61.4-45.5175.4-179.563.7000111.5D58 Y59 L64 V65 I66D58-L62 WeakPolarHBondContact O-CB 3.33Å; D58-L62 PolarHBondContact O-N 3.33Å; Y59-L62 WeakPolarHBondContact O-CB 3.5Å; Y59-L62 PolarHBondContact O-N 3.12Å; L62-L64 PolarHBondContact O-N 3.16Å; L62-V65 PolarHBondContact O-N 3.25Å; L62-I66 HydrophobicContact CD1-CD1 4.14Å; L62-I66 HydrophobicContact CD1-CG1 4.41Å; L62-I66 HydrophobicContact CG-CD1 3.89Å; L62-I66 VanDerWaalsContact O-CG1 3.28Å; L62-I66 WeakPolarHBondContact O-CG1 3.35Å; L62-I66 PolarHBondContact O-N 3.22Å
63E91.3Very high89.2Confident104 Ų10494.7 Ų94.749%0.48647%0.472SS..Hα-helixtrans-57.8-47.6175.5-176.8-178.5-152.900111.4Y59 R60 V65 I66 M67Y59-E63 WeakPolarHBondContact O-CB 3.25Å; Y59-E63 PolarHBondContact O-N 3.44Å; R60-E63 PolarHBondContact O-N 2.68Å; E63-V65 VanDerWaalsContact C-N 3.34Å; E63-V65 PolarHBondContact O-N 3.41Å; E63-I66 PolarHBondContact O-N 2.82Å; E63-M67 HydrophobicContact CG-CG 4.39Å; E63-M67 WeakPolarHBondContact O-CB 3.48Å; E63-M67 VanDerWaalsContact O-CG 3.22Å; E63-M67 WeakPolarHBondContact O-CG 3.43Å; E63-M67 PolarHBondContact O-N 2.89Å
64L90.7Very high88.1Confident72 Ų7288.5 Ų88.538%0.37744%0.442SS..Hα-helixtrans-58.9-43.9176.7-73.1170.8000112.2R60 Q61 L62 Q68R60-L64 VanDerWaalsContact O-CG 3.28Å; R60-L64 WeakPolarHBondContact O-CG 3.31Å; R60-L64 PolarHBondContact O-N 2.82Å; Q61-L64 PolarHBondContact O-N 3.09Å; L62-L64 PolarHBondContact O-N 3.16Å; L64-Q68 WeakPolarHBondContact O-CB 3.27Å; L64-Q68 VanDerWaalsContact O-CG 3.27Å; L64-Q68 WeakPolarHBondContact O-CG 3.41Å; L64-Q68 PolarHBondContact O-N 3.35Å
65V92.7Very high87.3Confident91 Ų9187.7 Ų87.755%0.55245%0.445SS*.Hα-helixtrans-64.9-42.8177.61710000111.1Q61 L62 E63 Q68 S69Q61-V65 WeakPolarHBondContact O-CG2 3.13Å; Q61-V65 PolarHBondContact O-N 3.03Å; L62-V65 PolarHBondContact O-N 3.25Å; E63-V65 VanDerWaalsContact C-N 3.34Å; E63-V65 PolarHBondContact O-N 3.41Å; V65-Q68 PolarHBondContact O-N 3.44Å; V65-S69 VanDerWaalsContact O-CB 3.27Å; V65-S69 WeakPolarHBondContact O-CB 3.36Å; V65-S69 PolarHBondContact O-N 3.45Å; V65-S69 PolarHBondContact O-OG 2.87Å
66I90.8Very high86.7Confident69 Ų6988.3 Ų88.335%0.35445%0.449SS..Hα-helixtrans-61.2-52.5177.9-70.2167000109.7L62 E63 Q68 S69 E70L62-I66 HydrophobicContact CD1-CD1 4.14Å; L62-I66 HydrophobicContact CD1-CG1 4.41Å; L62-I66 HydrophobicContact CG-CD1 3.89Å; L62-I66 VanDerWaalsContact O-CG1 3.28Å; L62-I66 WeakPolarHBondContact O-CG1 3.35Å; L62-I66 PolarHBondContact O-N 3.22Å; E63-I66 PolarHBondContact O-N 2.82Å; I66-Q68 VanDerWaalsContact C-N 3.32Å; I66-Q68 PolarHBondContact O-N 2.85Å; I66-S69 PolarHBondContact O-N 3.48Å; I66-S69 PolarHBondContact O-OG 3.45Å; I66-E70 PolarHBondContact O-N 3.23Å; I66-E70 VanDerWaalsContact O-N 3.13Å
67M87.2Confident86.3Confident134 Ų13484.5 Ų84.566%0.6642%0.424SS*.Hα-helixtrans-55.7-43.3178.9-72.8-87.4-81.600112.3E63 S69E63-M67 HydrophobicContact CG-CG 4.39Å; E63-M67 WeakPolarHBondContact O-CB 3.48Å; E63-M67 VanDerWaalsContact O-CG 3.22Å; E63-M67 WeakPolarHBondContact O-CG 3.43Å; E63-M67 PolarHBondContact O-N 2.89Å; M67-S69 VanDerWaalsContact C-N 3.34Å
68Q86.1Confident86.1Confident137 Ų13786.1 Ų86.164%0.6443%0.426SS*.Hα-helixtrans-72.9-25.5177.5-70.7178.12.400113.4L64 V65 I66 H72L64-Q68 WeakPolarHBondContact O-CB 3.27Å; L64-Q68 VanDerWaalsContact O-CG 3.27Å; L64-Q68 WeakPolarHBondContact O-CG 3.41Å; L64-Q68 PolarHBondContact O-N 3.35Å; V65-Q68 PolarHBondContact O-N 3.44Å; I66-Q68 VanDerWaalsContact C-N 3.32Å; I66-Q68 PolarHBondContact O-N 2.85Å; Q68-H72 PolarHBondContact O-ND1 3.26Å; Q68-H72 VanDerWaalsContact O-ND1 3.08Å
69S85.2Confident85.9Confident37 Ų3787.6 Ų87.626%0.25943%0.428SS..Hα-helixtrans-79-25.617978.10000113.5V65 I66 M67 H72 R73V65-S69 VanDerWaalsContact O-CB 3.27Å; V65-S69 WeakPolarHBondContact O-CB 3.36Å; V65-S69 PolarHBondContact O-N 3.45Å; V65-S69 PolarHBondContact O-OG 2.87Å; I66-S69 PolarHBondContact O-N 3.48Å; I66-S69 PolarHBondContact O-OG 3.45Å; M67-S69 VanDerWaalsContact C-N 3.34Å; S69-H72 WeakPolarHBondContact O-CA 3.48Å; S69-H72 WeakPolarHBondContact O-CB 3.38Å; S69-H72 PolarHBondContact O-N 3.46Å; S69-R73 PolarHBondContact O-N 2.82Å
70E81.1Confident85.7Confident88 Ų8893.3 Ų93.341%0.41146%0.455SS..Hα-helixtrans-50.1-51.5-175-80.8-60.4128.400113.9I66 H72 R73I66-E70 PolarHBondContact O-N 3.23Å; I66-E70 VanDerWaalsContact O-N 3.13Å; E70-H72 PolarHBondContact O-N 3.4Å; E70-R73 WeakPolarHBondContact O-CB 3.46Å; E70-R73 PolarHBondContact O-N 2.82Å; E70-R73 VanDerWaalsContact OE1-CD 3.32Å; E70-R73 WeakPolarHBondContact OE1-CD 3.4Å; E70-R73 IonicContact OE1-CZ 2.68Å; E70-R73 IonicContact OE1-NE 2.76Å; E70-R73 PolarHBondContact OE1-NE 3.06Å; E70-R73 IonicContact OE1-NH1 3.99Å; E70-R73 PolarHBondContact OE1-NH1 3.29Å; E70-R73 IonicContact OE1-NH2 3.14Å
71P76.1Confident85.6Confident65 Ų6588.7 Ų88.742%0.42244%0.442SS..Hα-helixtrans-61.4-24.1179.5-22.333.7000113.8
72H78.9Confident85.5Confident143 Ų14384.9 Ų84.966%0.66243%0.425SS*.Hα-helixtrans-86.4-17.4-179.5-55.790.5000112.3Q68 S69 E70 A74 G75Q68-H72 PolarHBondContact O-ND1 3.26Å; Q68-H72 VanDerWaalsContact O-ND1 3.08Å; S69-H72 WeakPolarHBondContact O-CA 3.48Å; S69-H72 WeakPolarHBondContact O-CB 3.38Å; S69-H72 PolarHBondContact O-N 3.46Å; E70-H72 PolarHBondContact O-N 3.4Å; H72-A74 VanDerWaalsContact C-N 3.34Å; H72-A74 PolarHBondContact O-N 3.45Å; H72-G75 PolarHBondContact O-N 2.91Å; H72-G75 VanDerWaalsContact O-N 3.16Å
73R74.9Confident85.6Confident160 Ų16083 Ų8360%0.60442%0.419SS*.Hα-helixtrans-66.3-34.1179.3-71.9-174.6174-174.5-4.8112.9S69 E70 G75S69-R73 PolarHBondContact O-N 2.82Å; E70-R73 WeakPolarHBondContact O-CB 3.46Å; E70-R73 PolarHBondContact O-N 2.82Å; E70-R73 VanDerWaalsContact OE1-CD 3.32Å; E70-R73 WeakPolarHBondContact OE1-CD 3.4Å; E70-R73 IonicContact OE1-CZ 2.68Å; E70-R73 IonicContact OE1-NE 2.76Å; E70-R73 PolarHBondContact OE1-NE 3.06Å; E70-R73 IonicContact OE1-NH1 3.99Å; E70-R73 PolarHBondContact OE1-NH1 3.29Å; E70-R73 IonicContact OE1-NH2 3.14Å; R73-G75 PolarHBondContact O-N 3.15Å
74A71.6Confident85.8Confident20 Ų2082.6 Ų82.617%0.16542%0.416CS..THydrogen-bonded Turntrans-71.7-8.8176.600000113.4H72 Q209 G212H72-A74 VanDerWaalsContact C-N 3.34Å; H72-A74 PolarHBondContact O-N 3.45Å; A74-Q209 WeakPolarHBondContact CA-O 3.38Å; A74-Q209 HydrophobicContact CB-CB 4.12Å; A74-Q209 WeakPolarHBondContact CB-O 3.38Å; A74-G212 PolarHBondContact O-N 3.22Å
75G79.3Confident85.9Confident30 Ų3079.2 Ų79.231%0.30940%0.398SS..  trans103-159.2176.900000113.1H72 R73 Q77H72-G75 PolarHBondContact O-N 2.91Å; H72-G75 VanDerWaalsContact O-N 3.16Å; R73-G75 PolarHBondContact O-N 3.15Å; G75-Q77 PolarHBondContact O-N 2.95Å; G75-Q77 VanDerWaalsContact O-N 3.15Å
76V81.6Confident86.1Confident88 Ų8876.4 Ų76.453%0.53338%0.379SS..  trans-78.6102.8-175.4-170.50000110.7K79V76-K79 HydrophobicContact CB-CG 4.43Å; V76-K79 HydrophobicContact CG1-CD 4.46Å; V76-K79 HydrophobicContact CG1-CG 3.7Å
77Q84.1Confident86.4Confident17 Ų1774.1 Ų74.18%0.07937%0.37CS..  trans-78.7-33.1180-57.1-61-18.500113.4G75 K79 G82 A99G75-Q77 PolarHBondContact O-N 2.95Å; G75-Q77 VanDerWaalsContact O-N 3.15Å; Q77-K79 VanDerWaalsContact C-N 3.34Å; Q77-K79 PolarHBondContact O-N 3.34Å; Q77-G82 CarbonylContact O-C 3.59Å; Q77-G82 WeakPolarHBondContact O-CA 3.5Å; Q77-A99 HydrophobicContact CB-CB 4.33Å
78W88.6Confident86.8Confident124 Ų12468 Ų6847%0.4734%0.34SS..SBendtrans-94.741.2-172.2-64.8107.2000114.4F86 A99W78-F86 HydrophobicContact CH2-CB 4.33Å; W78-F86 AromaticContact CH2-CD1 3.72Å; W78-F86 HydrophobicContact CH2-CD1 3.72Å; W78-F86 AromaticContact CH2-CD2 3.85Å; W78-F86 HydrophobicContact CH2-CD2 3.85Å; W78-F86 AromaticContact CH2-CE1 3.95Å; W78-F86 HydrophobicContact CH2-CE1 3.95Å; W78-F86 HydrophobicContact CH2-CE2 4.07Å; W78-F86 AromaticContact CH2-CG 3.68Å; W78-F86 HydrophobicContact CH2-CG 3.68Å; W78-F86 HydrophobicContact CH2-CZ 4.13Å; W78-F86 HydrophobicContact CZ3-CB 4.28Å; W78-F86 AromaticContact CZ3-CD1 3.82Å; W78-F86 HydrophobicContact CZ3-CD1 3.82Å; W78-F86 HydrophobicContact CZ3-CE1 4.33Å; W78-F86 AromaticContact CZ3-CG 3.96Å; W78-F86 HydrophobicContact CZ3-CG 3.96Å; W78-A99 HydrophobicContact CZ2-CB 4.33Å
79K90Very high87.3Confident122 Ų12261.7 Ų61.753%0.5331%0.311SS..SBendtrans-100.1167.4163-68.1-65-177.2-178.40109.3V76 Q77 A81 G82 S83V76-K79 HydrophobicContact CB-CG 4.43Å; V76-K79 HydrophobicContact CG1-CD 4.46Å; V76-K79 HydrophobicContact CG1-CG 3.7Å; Q77-K79 VanDerWaalsContact C-N 3.34Å; Q77-K79 PolarHBondContact O-N 3.34Å; K79-A81 VanDerWaalsContact C-N 3.29Å; K79-A81 PolarHBondContact O-N 2.94Å; K79-G82 PolarHBondContact O-N 3.42Å; K79-S83 PolarHBondContact O-N 3.03Å; K79-S83 PolarHBondContact O-OG 3.35Å
80F90.8Very high87.9Confident171 Ų17160.9 Ų60.975%0.7531%0.305SS*.Hα-helixtrans-45.4-48.2-173.6-177.3-97.8000114.2G82 S83 F84F80-G82 PolarHBondContact O-N 2.91Å; F80-S83 PolarHBondContact O-N 3.46Å; F80-F84 VanDerWaalsContact O-CB 3.26Å; F80-F84 WeakPolarHBondContact O-CB 3.34Å; F80-F84 PolarHBondContact O-N 2.57Å
81A90.4Very high88.6Confident23 Ų2358.4 Ų58.419%0.1929%0.294CS..Hα-helixtrans-60.4-43.9178.800000113.3K79 F84 Y85 L214 V221 F225K79-A81 VanDerWaalsContact C-N 3.29Å; K79-A81 PolarHBondContact O-N 2.94Å; A81-F84 PolarHBondContact O-N 2.89Å; A81-Y85 PolarHBondContact O-N 2.98Å; A81-L214 HydrophobicContact CB-CG 4.44Å; A81-V221 HydrophobicContact CB-CG1 4.42Å; A81-F225 WeakPolarHBondContact O-CZ 3.24Å
82G91.6Very high89.5Confident5 Ų555.5 Ų55.55%0.05228%0.275CS..Hα-helixtrans-77.4-33.4178.200000113.6Q77 K79 F80 F84 Y85 F86Q77-G82 CarbonylContact O-C 3.59Å; Q77-G82 WeakPolarHBondContact O-CA 3.5Å; K79-G82 PolarHBondContact O-N 3.42Å; F80-G82 PolarHBondContact O-N 2.91Å; G82-F84 VanDerWaalsContact C-N 3.3Å; G82-F84 PolarHBondContact O-N 3.15Å; G82-Y85 PolarHBondContact O-N 3.42Å; G82-F86 WeakPolarHBondContact O-CB 3.2Å; G82-F86 PolarHBondContact O-N 3.27Å
83S94.8Very high90.4Very high43 Ų4351.9 Ų51.930%0.30126%0.263SS..Hα-helixtrans-62.1-38.2168.9-61.20000111.9K79 F80 A87K79-S83 PolarHBondContact O-N 3.03Å; K79-S83 PolarHBondContact O-OG 3.35Å; F80-S83 PolarHBondContact O-N 3.46Å; S83-A87 WeakPolarHBondContact O-CB 3.19Å; S83-A87 PolarHBondContact O-N 2.96Å
84F94.6Very high91.4Very high95 Ų9544.4 Ų44.442%0.41724%0.235SC..Hα-helixtrans-69.8-40.6174.9-171.2-96.8000111.5F80 A81 G82 A87 I88 F225F80-F84 VanDerWaalsContact O-CB 3.26Å; F80-F84 WeakPolarHBondContact O-CB 3.34Å; F80-F84 PolarHBondContact O-N 2.57Å; A81-F84 PolarHBondContact O-N 2.89Å; G82-F84 VanDerWaalsContact C-N 3.3Å; G82-F84 PolarHBondContact O-N 3.15Å; F84-A87 PolarHBondContact O-N 3.29Å; F84-I88 HydrophobicContact CD1-CD1 3.73Å; F84-I88 HydrophobicContact CD1-CG1 4.34Å; F84-I88 HydrophobicContact CE1-CD1 3.51Å; F84-I88 HydrophobicContact CE1-CG1 4.16Å; F84-I88 HydrophobicContact CZ-CD1 4.36Å; F84-I88 WeakPolarHBondContact O-CG1 3.41Å; F84-I88 PolarHBondContact O-N 3.49Å; F84-F225 AromaticContact CD1-CD2 3.58Å; F84-F225 HydrophobicContact CD1-CD2 3.58Å; F84-F225 AromaticContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CE2 3.41Å; F84-F225 VanDerWaalsContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CG 4.38Å; F84-F225 HydrophobicContact CD1-CZ 4.09Å; F84-F225 AromaticContact CE1-CD2 3.69Å; F84-F225 HydrophobicContact CE1-CD2 3.69Å; F84-F225 HydrophobicContact CE1-CE2 4.03Å; F84-F225 HydrophobicContact CE1-CG 4.35Å; F84-F225 HydrophobicContact CG-CE2 4.42Å
85Y94.5Very high92.6Very high2 Ų245.8 Ų45.81%0.00825%0.251CS..Hα-helixtrans-59.7-47173-173.3-142.2000111.7A81 G82 A87 I88 T89 Y96 H98 V206 F225 I228A81-Y85 PolarHBondContact O-N 2.98Å; G82-Y85 PolarHBondContact O-N 3.42Å; Y85-A87 VanDerWaalsContact C-N 3.34Å; Y85-A87 PolarHBondContact O-N 2.95Å; Y85-I88 WeakPolarHBondContact O-CB 3.41Å; Y85-I88 PolarHBondContact O-N 3Å; Y85-T89 HydrophobicContact CD2-CG2 4.35Å; Y85-T89 HydrophobicContact CE2-CG2 4.2Å; Y85-T89 WeakPolarHBondContact O-CG2 3.48Å; Y85-T89 PolarHBondContact O-N 3.32Å; Y85-Y96 HydrophobicContact CE2-CE2 4.22Å; Y85-Y96 AromaticContact CZ-CE2 3.8Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.2Å; Y85-H98 AromaticContact CD1-CE1 3.82Å; Y85-H98 AromaticContact CD1-NE2 3.64Å; Y85-H98 AromaticContact CE1-CE1 3.43Å; Y85-H98 VanDerWaalsContact CE1-CE1 3.43Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.08Å; Y85-H98 AromaticContact CE1-NE2 3.55Å; Y85-V206 HydrophobicContact CE1-CG1 4.05Å; Y85-F225 AromaticContact CD2-CD1 4Å; Y85-F225 HydrophobicContact CD2-CD1 4Å; Y85-F225 AromaticContact CD2-CE1 3.45Å; Y85-F225 HydrophobicContact CD2-CE1 3.45Å; Y85-F225 VanDerWaalsContact CD2-CE1 3.45Å; Y85-F225 HydrophobicContact CD2-CZ 4.45Å; Y85-F225 HydrophobicContact CE2-CE1 4.34Å; Y85-F225 AromaticContact CG-CE1 3.74Å; Y85-F225 HydrophobicContact CG-CE1 3.74Å; Y85-F225 HydrophobicContact CG-CZ 4.39Å; Y85-I228 HydrophobicContact CE2-CD1 3.87Å
86F95.6Very high93.2Very high31 Ų3144.7 Ų44.714%0.13624%0.237CC..Hα-helixtrans-59.9-41.7173.9176.1-96.5000112.2W78 G82 I88 T89 V90 A99 P101W78-F86 HydrophobicContact CH2-CB 4.33Å; W78-F86 AromaticContact CH2-CD1 3.72Å; W78-F86 HydrophobicContact CH2-CD1 3.72Å; W78-F86 AromaticContact CH2-CD2 3.85Å; W78-F86 HydrophobicContact CH2-CD2 3.85Å; W78-F86 AromaticContact CH2-CE1 3.95Å; W78-F86 HydrophobicContact CH2-CE1 3.95Å; W78-F86 HydrophobicContact CH2-CE2 4.07Å; W78-F86 AromaticContact CH2-CG 3.68Å; W78-F86 HydrophobicContact CH2-CG 3.68Å; W78-F86 HydrophobicContact CH2-CZ 4.13Å; W78-F86 HydrophobicContact CZ3-CB 4.28Å; W78-F86 AromaticContact CZ3-CD1 3.82Å; W78-F86 HydrophobicContact CZ3-CD1 3.82Å; W78-F86 HydrophobicContact CZ3-CE1 4.33Å; W78-F86 AromaticContact CZ3-CG 3.96Å; W78-F86 HydrophobicContact CZ3-CG 3.96Å; G82-F86 WeakPolarHBondContact O-CB 3.2Å; G82-F86 PolarHBondContact O-N 3.27Å; F86-I88 VanDerWaalsContact C-N 3.34Å; F86-I88 PolarHBondContact O-N 3.27Å; F86-T89 WeakPolarHBondContact CA-OG1 3.31Å; F86-T89 PolarHBondContact O-N 3.34Å; F86-T89 PolarHBondContact O-OG1 2.84Å; F86-V90 HydrophobicContact CD1-CG2 4.23Å; F86-V90 HydrophobicContact CD2-CG2 4.5Å; F86-V90 HydrophobicContact CE1-CG2 3.73Å; F86-V90 HydrophobicContact CE2-CG2 4.03Å; F86-V90 HydrophobicContact CZ-CG2 3.6Å; F86-V90 WeakPolarHBondContact O-CG2 3.3Å; F86-V90 PolarHBondContact O-N 3.46Å; F86-A99 WeakPolarHBondContact CD2-O 3.38Å; F86-A99 WeakPolarHBondContact CE2-O 3.26Å; F86-P101 HydrophobicContact CE1-CG 4.27Å; F86-P101 HydrophobicContact CE2-CG 4.43Å; F86-P101 HydrophobicContact CZ-CG 3.68Å
87A97.1Very high93.7Very high21 Ų2143.2 Ų43.217%0.17424%0.239CC..Hα-helixtrans-61.3-42.5176.300000111.8S83 F84 Y85 V90 I91 Y113S83-A87 WeakPolarHBondContact O-CB 3.19Å; S83-A87 PolarHBondContact O-N 2.96Å; F84-A87 PolarHBondContact O-N 3.29Å; Y85-A87 VanDerWaalsContact C-N 3.34Å; Y85-A87 PolarHBondContact O-N 2.95Å; A87-V90 PolarHBondContact O-N 3.43Å; A87-I91 WeakPolarHBondContact O-CG1 3.3Å; A87-I91 PolarHBondContact O-N 3.36Å; A87-I91 VanDerWaalsContact O-N 3.09Å; A87-Y113 HydrophobicContact CB-CE1 4.15Å
88I95.8Very high93.8Very high6 Ų644 Ų443%0.03124%0.243CC..Hα-helixtrans-57.8-51.8173.1-68.7166.9000109.9F84 Y85 F86 V90 I91 T92 F225 I228F84-I88 HydrophobicContact CD1-CD1 3.73Å; F84-I88 HydrophobicContact CD1-CG1 4.34Å; F84-I88 HydrophobicContact CE1-CD1 3.51Å; F84-I88 HydrophobicContact CE1-CG1 4.16Å; F84-I88 HydrophobicContact CZ-CD1 4.36Å; F84-I88 WeakPolarHBondContact O-CG1 3.41Å; F84-I88 PolarHBondContact O-N 3.49Å; Y85-I88 WeakPolarHBondContact O-CB 3.41Å; Y85-I88 PolarHBondContact O-N 3Å; F86-I88 VanDerWaalsContact C-N 3.34Å; F86-I88 PolarHBondContact O-N 3.27Å; I88-V90 PolarHBondContact O-N 2.93Å; I88-I91 PolarHBondContact O-N 3.31Å; I88-T92 HydrophobicContact CG2-CG2 4.01Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.49Å; I88-T92 VanDerWaalsContact O-CG2 3.32Å; I88-T92 WeakPolarHBondContact O-CG2 3.38Å; I88-T92 PolarHBondContact O-N 3.22Å; I88-T92 PolarHBondContact O-OG1 2.85Å; I88-F225 HydrophobicContact CD1-CB 4Å; I88-F225 HydrophobicContact CD1-CD1 3.85Å; I88-F225 HydrophobicContact CD1-CD2 4.28Å; I88-F225 HydrophobicContact CD1-CE1 4.43Å; I88-F225 HydrophobicContact CD1-CG 3.78Å; I88-I228 HydrophobicContact CG2-CG2 4.11Å
89T96.3Very high93.8Very high4 Ų438.9 Ų38.93%0.02523%0.227CC..Hα-helixtrans-63.2-30.9-175.161.40000112.7Y85 F86 T93 I94 G95 Y96Y85-T89 HydrophobicContact CD2-CG2 4.35Å; Y85-T89 HydrophobicContact CE2-CG2 4.2Å; Y85-T89 WeakPolarHBondContact O-CG2 3.48Å; Y85-T89 PolarHBondContact O-N 3.32Å; F86-T89 WeakPolarHBondContact CA-OG1 3.31Å; F86-T89 PolarHBondContact O-N 3.34Å; F86-T89 PolarHBondContact O-OG1 2.84Å; T89-T93 PolarHBondContact O-N 3.36Å; T89-I94 PolarHBondContact O-N 3.03Å; T89-G95 PolarHBondContact O-N 3.28Å; T89-G95 VanDerWaalsContact O-N 3.11Å; T89-Y96 HydrophobicContact CG2-CD2 3.61Å; T89-Y96 HydrophobicContact CG2-CE2 3.83Å
90V97.4Very high93.9Very high21 Ų2136.1 Ų36.113%0.12723%0.227CC..Hα-helixtrans-70.5-55174.5172.80000111.5F86 A87 I88 T92 T93 Y113 A114F86-V90 HydrophobicContact CD1-CG2 4.23Å; F86-V90 HydrophobicContact CD2-CG2 4.5Å; F86-V90 HydrophobicContact CE1-CG2 3.73Å; F86-V90 HydrophobicContact CE2-CG2 4.03Å; F86-V90 HydrophobicContact CZ-CG2 3.6Å; F86-V90 WeakPolarHBondContact O-CG2 3.3Å; F86-V90 PolarHBondContact O-N 3.46Å; A87-V90 PolarHBondContact O-N 3.43Å; I88-V90 PolarHBondContact O-N 2.93Å; V90-T92 VanDerWaalsContact C-N 3.28Å; V90-T92 PolarHBondContact O-N 3.48Å; V90-T93 PolarHBondContact O-N 3.45Å; V90-T93 VanDerWaalsContact O-N 3.16Å; V90-Y113 HydrophobicContact CB-CD1 4.43Å; V90-Y113 HydrophobicContact CB-CE1 4.45Å; V90-Y113 HydrophobicContact CG1-CD1 3.89Å; V90-Y113 HydrophobicContact CG1-CE1 4.31Å; V90-A114 HydrophobicContact CG1-CB 3.88Å
91I96.9Very high94Very high35 Ų3529.3 Ų29.318%0.17920%0.2CC..Hα-helixtrans-71.7-23.9-174.268.2-175.7000113.3A87 I88 T93 Y113 T121A87-I91 WeakPolarHBondContact O-CG1 3.3Å; A87-I91 PolarHBondContact O-N 3.36Å; A87-I91 VanDerWaalsContact O-N 3.09Å; I88-I91 PolarHBondContact O-N 3.31Å; I91-T93 VanDerWaalsContact C-N 3.35Å; I91-Y113 HydrophobicContact CG2-CD1 4.15Å; I91-Y113 HydrophobicContact CG2-CE1 3.34Å; I91-Y113 HydrophobicContact CG2-CE2 4.48Å; I91-Y113 WeakPolarHBondContact CG2-OH 3.32Å; I91-T121 WeakPolarHBondContact CB-OG1 3.35Å; I91-T121 WeakPolarHBondContact O-CB 3.31Å; I91-T121 WeakPolarHBondContact O-CG2 3.36Å; I91-T121 PolarHBondContact O-OG1 2.99Å
92T95.8Very high94Very high5 Ų531.4 Ų31.43%0.03122%0.224CC..THydrogen-bonded Turntrans-91.81.7175.959.80000113I88 V90 I94 T121 F125 T199 L232I88-T92 HydrophobicContact CG2-CG2 4.01Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.49Å; I88-T92 VanDerWaalsContact O-CG2 3.32Å; I88-T92 WeakPolarHBondContact O-CG2 3.38Å; I88-T92 PolarHBondContact O-N 3.22Å; I88-T92 PolarHBondContact O-OG1 2.85Å; V90-T92 VanDerWaalsContact C-N 3.28Å; V90-T92 PolarHBondContact O-N 3.48Å; T92-I94 PolarHBondContact O-N 3.21Å; T92-I94 VanDerWaalsContact O-N 3.09Å; T92-I94 VanDerWaalsContact OG1-CD1 3.3Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.15Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.29Å; T92-T121 HydrophobicContact CG2-CG2 4.32Å; T92-F125 HydrophobicContact CG2-CE2 4.2Å; T92-F125 HydrophobicContact CG2-CZ 4.38Å; T92-T199 VanDerWaalsContact O-CG2 3.22Å; T92-T199 WeakPolarHBondContact O-CG2 3.39Å; T92-L232 HydrophobicContact CG2-CD1 3.56Å
93T96.7Very high94.2Very high66 Ų6635.5 Ų35.541%0.40525%0.248SC..THydrogen-bonded Turntrans5523.7-178.967.30000114.9T89 V90 I91 I118T89-T93 PolarHBondContact O-N 3.36Å; V90-T93 PolarHBondContact O-N 3.45Å; V90-T93 VanDerWaalsContact O-N 3.16Å; I91-T93 VanDerWaalsContact C-N 3.35Å; T93-I118 HydrophobicContact CG2-CB 4.42Å; T93-I118 HydrophobicContact CG2-CD1 3.66Å; T93-I118 HydrophobicContact CG2-CG1 3.69Å; T93-I118 HydrophobicContact CG2-CG2 3.86Å
94I96.8Very high94.3Very high4 Ų439.6 Ų39.62%0.02127%0.267CS..  trans-73-51.7173.9-60.2167000109.9T89 T92 Y96 T196 T199 G201 I228 L232T89-I94 PolarHBondContact O-N 3.03Å; T92-I94 PolarHBondContact O-N 3.21Å; T92-I94 VanDerWaalsContact O-N 3.09Å; T92-I94 VanDerWaalsContact OG1-CD1 3.3Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.15Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.29Å; I94-Y96 HydrophobicContact CG2-CD1 3.91Å; I94-Y96 HydrophobicContact CG2-CD2 4.13Å; I94-Y96 HydrophobicContact CG2-CE1 3.59Å; I94-Y96 HydrophobicContact CG2-CE2 3.8Å; I94-Y96 HydrophobicContact CG2-CG 4.17Å; I94-Y96 PolarHBondContact O-N 2.88Å; I94-T196 HydrophobicContact CD1-CG2 4.14Å; I94-T199 HydrophobicContact CG1-CG2 4.1Å; I94-G201 WeakPolarHBondContact O-CA 3.41Å; I94-I228 HydrophobicContact CD1-CG2 3.73Å; I94-L232 HydrophobicContact CD1-CD1 4.27Å
95G95.3Very high94.4Very high48 Ų4838.7 Ų38.750%0.49528%0.277SS..  trans58.742.8169.400000118.1T89 G97T89-G95 PolarHBondContact O-N 3.28Å; T89-G95 VanDerWaalsContact O-N 3.11Å; G95-G97 PolarHBondContact O-N 3.03Å
96Y93.6Very high94.5Very high8 Ų839.6 Ų39.63%0.03129%0.286CS..  trans-47.3-19.1-179-62.8-61.3000118.3Y85 T89 I94 H98 Y192 T196 G201 G203 V206Y85-Y96 HydrophobicContact CE2-CE2 4.22Å; Y85-Y96 AromaticContact CZ-CE2 3.8Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.2Å; T89-Y96 HydrophobicContact CG2-CD2 3.61Å; T89-Y96 HydrophobicContact CG2-CE2 3.83Å; I94-Y96 HydrophobicContact CG2-CD1 3.91Å; I94-Y96 HydrophobicContact CG2-CD2 4.13Å; I94-Y96 HydrophobicContact CG2-CE1 3.59Å; I94-Y96 HydrophobicContact CG2-CE2 3.8Å; I94-Y96 HydrophobicContact CG2-CG 4.17Å; I94-Y96 PolarHBondContact O-N 2.88Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.31Å; Y96-H98 AromaticContact CD2-ND1 3.95Å; Y96-H98 PolarHBondContact O-N 3.18Å; Y96-Y192 HydrophobicContact CE1-CE2 4.14Å; Y96-Y192 AromaticContact CZ-CE2 3.98Å; Y96-Y192 WeakPolarHBondContact OH-CE2 3.49Å; Y96-Y192 PolarHBondContact OH-OH 3.49Å; Y96-T196 WeakPolarHBondContact OH-CB 3.24Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.33Å; Y96-T196 PolarHBondContact OH-OG1 2.8Å; Y96-G201 VanDerWaalsContact CA-O 3.31Å; Y96-G201 WeakPolarHBondContact CA-O 3.4Å; Y96-G203 VanDerWaalsContact O-CA 3.25Å; Y96-G203 WeakPolarHBondContact O-CA 3.43Å; Y96-V206 HydrophobicContact CD1-CG2 4.14Å; Y96-V206 HydrophobicContact CD2-CG1 4.17Å; Y96-V206 HydrophobicContact CG-CG1 4.37Å; Y96-V206 HydrophobicContact CG-CG2 4.03Å
97G90.6Very high94.6Very high56 Ų5642.6 Ų42.658%0.57730%0.3SS*.  trans72.8-10.5-179.700000116.9G95 A99G95-G97 PolarHBondContact O-N 3.03Å; G97-A99 PolarHBondContact O-N 2.72Å; G97-A99 VanDerWaalsContact O-N 3.09Å
98H86.8Confident94.7Very high35 Ų3543.5 Ų43.516%0.16231%0.307CS..SBendtrans-57-26.6177.370.4-86.3000114.1Y85 Y96 V206 Q209Y85-H98 AromaticContact CD1-CE1 3.82Å; Y85-H98 AromaticContact CD1-NE2 3.64Å; Y85-H98 AromaticContact CE1-CE1 3.43Å; Y85-H98 VanDerWaalsContact CE1-CE1 3.43Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.08Å; Y85-H98 AromaticContact CE1-NE2 3.55Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.31Å; Y96-H98 AromaticContact CD2-ND1 3.95Å; Y96-H98 PolarHBondContact O-N 3.18Å; H98-V206 HydrophobicContact CB-CG1 4.4Å; H98-V206 HydrophobicContact CB-CG2 4.2Å; H98-Q209 PolarHBondContact CD2-NE2 3.09Å
99A88.1Confident94.8Very high16 Ų1649.9 Ų49.913%0.13234%0.335CS..SBendtrans-136.8128.1171.200000109.2Q77 W78 F86 G97Q77-A99 HydrophobicContact CB-CB 4.33Å; W78-A99 HydrophobicContact CZ2-CB 4.33Å; F86-A99 WeakPolarHBondContact CD2-O 3.38Å; F86-A99 WeakPolarHBondContact CE2-O 3.26Å; G97-A99 PolarHBondContact O-N 2.72Å; G97-A99 VanDerWaalsContact O-N 3.09Å
100A91.9Very high94.8Very high64 Ų6451 Ų5153%0.52934%0.342SS..  trans-133.4149.8178.400000110.9G102A100-G102 PolarHBondContact O-N 3.11Å; A100-G102 VanDerWaalsContact O-N 3.1Å
101P93.7Very high94.9Very high27 Ų2755.9 Ų55.918%0.17537%0.365CS..  trans-63.7113.3178.2-18.530.9000111.1F86 K107 C110F86-P101 HydrophobicContact CE1-CG 4.27Å; F86-P101 HydrophobicContact CE2-CG 4.43Å; F86-P101 HydrophobicContact CZ-CG 3.68Å; P101-K107 HydrophobicContact CB-CG 4.13Å; P101-K107 VanDerWaalsContact O-CE 3.23Å; P101-K107 WeakPolarHBondContact O-CE 3.42Å; P101-K107 WeakPolarHBondContact O-CG 3.39Å; P101-C110 HydrophobicContact CG-CB 4.17Å
102G90.3Very high94.9Very high68 Ų6861.5 Ų61.570%0.70139%0.389SS*.  trans-77.1-21.5177.300000113.9A100A100-G102 PolarHBondContact O-N 3.11Å; A100-G102 VanDerWaalsContact O-N 3.1Å
103T95.3Very high95Very high91 Ų9165.1 Ų65.156%0.55840%0.402SS*.SBendtrans-96.3146.2-177.262.10000111.9A105 G106 K107T103-A105 VanDerWaalsContact C-N 3.3Å; T103-A105 PolarHBondContact O-N 3.44Å; T103-G106 PolarHBondContact O-N 3.04Å; T103-G106 VanDerWaalsContact O-N 3.07Å; T103-G106 PolarHBondContact OG1-N 3.09Å; T103-G106 VanDerWaalsContact OG1-N 3.17Å; T103-K107 WeakPolarHBondContact O-CG 3.22Å; T103-K107 PolarHBondContact O-N 3.21Å
104D97.2Very high95Very high128 Ų12862.9 Ų62.968%0.68439%0.391SS*.Hα-helixtrans-62-38.4179-63.2-25.1000112.2G106 K107 A108D104-G106 VanDerWaalsContact C-N 3.35Å; D104-G106 PolarHBondContact O-N 3.45Å; D104-K107 PolarHBondContact O-N 3.36Å; D104-K107 IonicContact OD1-NZ 2.65Å; D104-A108 WeakPolarHBondContact O-CB 3.4Å; D104-A108 PolarHBondContact O-N 3.49Å
105A97.3Very high95.1Very high77 Ų7767.6 Ų67.664%0.63642%0.42SS*.Hα-helixtrans-61.9-41172.900000112.3T103 A108 F109T103-A105 VanDerWaalsContact C-N 3.3Å; T103-A105 PolarHBondContact O-N 3.44Å; A105-A108 PolarHBondContact O-N 2.92Å; A105-F109 WeakPolarHBondContact O-CB 3.42Å; A105-F109 PolarHBondContact O-N 3.23Å
106G97Very high95.1Very high20 Ų2071.8 Ų71.821%0.20643%0.43CS..Hα-helixtrans-66.4-39.1176.900000112.5T103 D104 C110T103-G106 PolarHBondContact O-N 3.04Å; T103-G106 VanDerWaalsContact O-N 3.07Å; T103-G106 PolarHBondContact OG1-N 3.09Å; T103-G106 VanDerWaalsContact OG1-N 3.17Å; D104-G106 VanDerWaalsContact C-N 3.35Å; D104-G106 PolarHBondContact O-N 3.45Å; G106-C110 VanDerWaalsContact O-CB 3.3Å; G106-C110 WeakPolarHBondContact O-CB 3.36Å; G106-C110 PolarHBondContact O-N 2.93Å
107K97.6Very high95.3Very high95 Ų9571.9 Ų71.941%0.41343%0.433SS..Hα-helixtrans-63.7-48.2174-67.4172.4-172.2164.70111.2P101 T103 D104 F109 C110 M111P101-K107 HydrophobicContact CB-CG 4.13Å; P101-K107 VanDerWaalsContact O-CE 3.23Å; P101-K107 WeakPolarHBondContact O-CE 3.42Å; P101-K107 WeakPolarHBondContact O-CG 3.39Å; T103-K107 WeakPolarHBondContact O-CG 3.22Å; T103-K107 PolarHBondContact O-N 3.21Å; D104-K107 PolarHBondContact O-N 3.36Å; D104-K107 IonicContact OD1-NZ 2.65Å; K107-F109 PolarHBondContact O-N 3.04Å; K107-C110 WeakPolarHBondContact O-CB 3.22Å; K107-C110 PolarHBondContact O-N 3.37Å; K107-M111 HydrophobicContact CB-CE 4.21Å; K107-M111 WeakPolarHBondContact O-CG 3.36Å; K107-M111 PolarHBondContact O-N 2.58Å
108A97.9Very high95.5Very high40 Ų4071.7 Ų71.733%0.33142%0.418SS..Hα-helixtrans-59.2-47.1177.400000111.6D104 A105 C110 M111 F112D104-A108 WeakPolarHBondContact O-CB 3.4Å; D104-A108 PolarHBondContact O-N 3.49Å; A105-A108 PolarHBondContact O-N 2.92Å; A108-C110 VanDerWaalsContact C-N 3.34Å; A108-C110 PolarHBondContact O-N 2.92Å; A108-M111 PolarHBondContact O-N 2.96Å; A108-F112 WeakPolarHBondContact O-CD2 3.3Å; A108-F112 PolarHBondContact O-N 3.24Å
109F97.9Very high96Very high140 Ų14073.4 Ų73.461%0.61443%0.432SS*.Hα-helixtrans-59-44.3175176.1-100.3000112.3A105 K107 M111 F112 Y113A105-F109 WeakPolarHBondContact O-CB 3.42Å; A105-F109 PolarHBondContact O-N 3.23Å; K107-F109 PolarHBondContact O-N 3.04Å; F109-M111 VanDerWaalsContact C-N 3.31Å; F109-M111 PolarHBondContact O-N 3.39Å; F109-F112 PolarHBondContact O-N 3.23Å; F109-Y113 HydrophobicContact CE1-CG 4.35Å; F109-Y113 HydrophobicContact CZ-CD2 4.25Å; F109-Y113 HydrophobicContact CZ-CG 4.46Å; F109-Y113 VanDerWaalsContact O-CB 3.24Å; F109-Y113 WeakPolarHBondContact O-CB 3.37Å; F109-Y113 PolarHBondContact O-N 2.95Å
110C97.9Very high96.3Very high27 Ų2778.6 Ų78.618%0.18246%0.458CS..Hα-helixtrans-57.7-42.1177.8-171.70000112P101 G106 K107 A108 Y113 A114P101-C110 HydrophobicContact CG-CB 4.17Å; G106-C110 VanDerWaalsContact O-CB 3.3Å; G106-C110 WeakPolarHBondContact O-CB 3.36Å; G106-C110 PolarHBondContact O-N 2.93Å; K107-C110 WeakPolarHBondContact O-CB 3.22Å; K107-C110 PolarHBondContact O-N 3.37Å; A108-C110 VanDerWaalsContact C-N 3.34Å; A108-C110 PolarHBondContact O-N 2.92Å; C110-Y113 PolarHBondContact O-N 3.33Å; C110-A114 WeakPolarHBondContact O-CB 3.31Å; C110-A114 PolarHBondContact O-N 3.24Å
111M97.7Very high96.4Very high124 Ų12476 Ų7661%0.61144%0.435SS*.Hα-helixtrans-59.6-51.2176.6-64.6174.9-14500111.6K107 A108 F109 Y113 A114 V115K107-M111 HydrophobicContact CB-CE 4.21Å; K107-M111 WeakPolarHBondContact O-CG 3.36Å; K107-M111 PolarHBondContact O-N 2.58Å; A108-M111 PolarHBondContact O-N 2.96Å; F109-M111 VanDerWaalsContact C-N 3.31Å; F109-M111 PolarHBondContact O-N 3.39Å; M111-Y113 VanDerWaalsContact C-N 3.35Å; M111-Y113 PolarHBondContact O-N 3Å; M111-A114 PolarHBondContact O-N 2.95Å; M111-V115 VanDerWaalsContact O-CG2 3.3Å; M111-V115 WeakPolarHBondContact O-CG2 3.4Å; M111-V115 PolarHBondContact O-N 3.25Å; M111-V115 VanDerWaalsContact O-N 3.13Å
112F97.8Very high96.3Very high153 Ų15379.9 Ų79.967%0.67145%0.454SS*.Hα-helixtrans-64.9-39178.5-70.2-68.3000112.6A108 F109 V115 L116A108-F112 WeakPolarHBondContact O-CD2 3.3Å; A108-F112 PolarHBondContact O-N 3.24Å; F109-F112 PolarHBondContact O-N 3.23Å; F112-V115 PolarHBondContact O-N 2.95Å; F112-L116 PolarHBondContact O-N 3.17Å
113Y97.9Very high96.4Very high80 Ų8081 Ų8131%0.31445%0.446SS..Hα-helixtrans-63.3-42.7177.9-176.5-110.8000111.8A87 V90 I91 F109 C110 M111 G117A87-Y113 HydrophobicContact CB-CE1 4.15Å; V90-Y113 HydrophobicContact CB-CD1 4.43Å; V90-Y113 HydrophobicContact CB-CE1 4.45Å; V90-Y113 HydrophobicContact CG1-CD1 3.89Å; V90-Y113 HydrophobicContact CG1-CE1 4.31Å; I91-Y113 HydrophobicContact CG2-CD1 4.15Å; I91-Y113 HydrophobicContact CG2-CE1 3.34Å; I91-Y113 HydrophobicContact CG2-CE2 4.48Å; I91-Y113 WeakPolarHBondContact CG2-OH 3.32Å; F109-Y113 HydrophobicContact CE1-CG 4.35Å; F109-Y113 HydrophobicContact CZ-CD2 4.25Å; F109-Y113 HydrophobicContact CZ-CG 4.46Å; F109-Y113 VanDerWaalsContact O-CB 3.24Å; F109-Y113 WeakPolarHBondContact O-CB 3.37Å; F109-Y113 PolarHBondContact O-N 2.95Å; C110-Y113 PolarHBondContact O-N 3.33Å; M111-Y113 VanDerWaalsContact C-N 3.35Å; M111-Y113 PolarHBondContact O-N 3Å; Y113-G117 WeakPolarHBondContact O-CA 3.37Å; Y113-G117 PolarHBondContact O-N 3Å
114A97.5Very high96.3Very high20 Ų2080.4 Ų80.417%0.16544%0.438CS..Hα-helixtrans-65.7-42.7177.300000112.3V90 C110 M111 L116 G117 I118V90-A114 HydrophobicContact CG1-CB 3.88Å; C110-A114 WeakPolarHBondContact O-CB 3.31Å; C110-A114 PolarHBondContact O-N 3.24Å; M111-A114 PolarHBondContact O-N 2.95Å; A114-L116 VanDerWaalsContact C-N 3.28Å; A114-L116 PolarHBondContact O-N 3.08Å; A114-G117 PolarHBondContact O-N 3.07Å; A114-I118 HydrophobicContact CB-CD1 4Å; A114-I118 WeakPolarHBondContact O-CB 3.48Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.44Å; A114-I118 PolarHBondContact O-N 3.19Å
115V97.3Very high96Very high103 Ų10375.3 Ų75.362%0.62441%0.41SS*.Hα-helixtrans-56.8-40.4-179.6167.10000112.2M111 F112 P119M111-V115 VanDerWaalsContact O-CG2 3.3Å; M111-V115 WeakPolarHBondContact O-CG2 3.4Å; M111-V115 PolarHBondContact O-N 3.25Å; M111-V115 VanDerWaalsContact O-N 3.13Å; F112-V115 PolarHBondContact O-N 2.95Å; V115-P119 WeakPolarHBondContact O-CD 3.29Å; V115-P119 WeakPolarHBondContact O-CG 3.45Å
116L95.7Very high95.6Very high136 Ų13676.5 Ų76.571%0.71240%0.403SS*.Hα-helixtrans-90.1-36178.7-62.5177.9000112.8F112 A114 L120F112-L116 PolarHBondContact O-N 3.17Å; A114-L116 VanDerWaalsContact C-N 3.28Å; A114-L116 PolarHBondContact O-N 3.08Å; L116-L120 WeakPolarHBondContact O-CB 3.12Å; L116-L120 PolarHBondContact O-N 3.13Å
117G97.1Very high95.4Very high9 Ų978.5 Ų78.59%0.09341%0.414CS..Hα-helixtrans-71.7-40.1-174.300000113.6Y113 A114 L120 T121Y113-G117 WeakPolarHBondContact O-CA 3.37Å; Y113-G117 PolarHBondContact O-N 3Å; A114-G117 PolarHBondContact O-N 3.07Å; G117-L120 PolarHBondContact O-N 3Å; G117-T121 WeakPolarHBondContact O-CB 3.42Å; G117-T121 PolarHBondContact O-N 3.42Å; G117-T121 PolarHBondContact O-OG1 3.27Å
118I96.7Very high95.2Very high52 Ų5277.8 Ų77.827%0.26741%0.414SS..Hα-helixtrans-64.4-51-178-63.5166.1000111.2T93 A114 L120 T121 L122T93-I118 HydrophobicContact CG2-CB 4.42Å; T93-I118 HydrophobicContact CG2-CD1 3.66Å; T93-I118 HydrophobicContact CG2-CG1 3.69Å; T93-I118 HydrophobicContact CG2-CG2 3.86Å; A114-I118 HydrophobicContact CB-CD1 4Å; A114-I118 WeakPolarHBondContact O-CB 3.48Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.44Å; A114-I118 PolarHBondContact O-N 3.19Å; I118-L120 VanDerWaalsContact C-N 3.32Å; I118-L120 PolarHBondContact O-N 3.08Å; I118-T121 PolarHBondContact O-N 3.37Å; I118-L122 HydrophobicContact CG2-CD1 4.04Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 WeakPolarHBondContact O-CG 3.47Å; I118-L122 PolarHBondContact O-N 2.98Å
119P96.6Very high94.8Very high71 Ų7175.9 Ų75.946%0.46140%0.398SS..Hα-helixtrans-59.6-41.3177-24.434.8000113V115 T121 L122 V123V115-P119 WeakPolarHBondContact O-CD 3.29Å; V115-P119 WeakPolarHBondContact O-CG 3.45Å; P119-T121 PolarHBondContact O-N 3.19Å; P119-L122 PolarHBondContact O-N 3.4Å; P119-V123 WeakPolarHBondContact O-CG2 3.46Å; P119-V123 PolarHBondContact O-N 3.31Å
120L95.3Very high94.5Very high126 Ų12674.8 Ų74.866%0.6640%0.395SS*.Hα-helixtrans-60.5-46.5177.4178.163.6000111.2L116 G117 I118 V123 M124L116-L120 WeakPolarHBondContact O-CB 3.12Å; L116-L120 PolarHBondContact O-N 3.13Å; G117-L120 PolarHBondContact O-N 3Å; I118-L120 VanDerWaalsContact C-N 3.32Å; I118-L120 PolarHBondContact O-N 3.08Å; L120-V123 PolarHBondContact O-N 3.39Å; L120-M124 WeakPolarHBondContact O-CB 3.46Å; L120-M124 PolarHBondContact O-N 3.46Å
121T93.9Very high94.3Very high10 Ų1082.9 Ų82.96%0.06142%0.421CS..Hα-helixtrans-64.2-41.5178.1-62.70000112.1I91 T92 G117 I118 P119 M124 F125I91-T121 WeakPolarHBondContact CB-OG1 3.35Å; I91-T121 WeakPolarHBondContact O-CB 3.31Å; I91-T121 WeakPolarHBondContact O-CG2 3.36Å; I91-T121 PolarHBondContact O-OG1 2.99Å; T92-T121 HydrophobicContact CG2-CG2 4.32Å; G117-T121 WeakPolarHBondContact O-CB 3.42Å; G117-T121 PolarHBondContact O-N 3.42Å; G117-T121 PolarHBondContact O-OG1 3.27Å; I118-T121 PolarHBondContact O-N 3.37Å; P119-T121 PolarHBondContact O-N 3.19Å; T121-M124 HydrophobicContact CG2-CE 4.41Å; T121-M124 WeakPolarHBondContact O-CB 3.43Å; T121-M124 PolarHBondContact O-N 2.89Å; T121-F125 HydrophobicContact CG2-CD2 3.53Å; T121-F125 HydrophobicContact CG2-CE2 3.29Å; T121-F125 HydrophobicContact CG2-CZ 4.24Å; T121-F125 WeakPolarHBondContact O-CD2 3.32Å; T121-F125 PolarHBondContact O-N 3.31Å
122L91.6Very high94Very high108 Ų10879.6 Ų79.657%0.56541%0.405SS*.Hα-helixtrans-61.6-46.8176.8-73.1174.7000111.8I118 P119 M124 F125 Q126I118-L122 HydrophobicContact CG2-CD1 4.04Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 WeakPolarHBondContact O-CG 3.47Å; I118-L122 PolarHBondContact O-N 2.98Å; P119-L122 PolarHBondContact O-N 3.4Å; L122-M124 VanDerWaalsContact C-N 3.31Å; L122-M124 PolarHBondContact O-N 3.43Å; L122-F125 PolarHBondContact O-N 2.84Å; L122-Q126 WeakPolarHBondContact O-CB 3.32Å; L122-Q126 PolarHBondContact O-N 3.27Å
123V92.3Very high93.7Very high90 Ų9073.5 Ų73.555%0.54538%0.38SS..Hα-helixtrans-62.9-40.4176.5172.50000111.1P119 L120 Q126 S127P119-V123 WeakPolarHBondContact O-CG2 3.46Å; P119-V123 PolarHBondContact O-N 3.31Å; L120-V123 PolarHBondContact O-N 3.39Å; V123-Q126 PolarHBondContact O-N 3.47Å; V123-S127 WeakPolarHBondContact O-CB 3.36Å; V123-S127 PolarHBondContact O-N 3.21Å; V123-S127 PolarHBondContact O-OG 3.36Å
124M93Very high93.4Very high79 Ų7973.7 Ų73.739%0.38939%0.39SS..Hα-helixtrans-60.4-51.5175.8-177.3-167.471.300111.1L120 T121 L122 Q126 S127 L128L120-M124 WeakPolarHBondContact O-CB 3.46Å; L120-M124 PolarHBondContact O-N 3.46Å; T121-M124 HydrophobicContact CG2-CE 4.41Å; T121-M124 WeakPolarHBondContact O-CB 3.43Å; T121-M124 PolarHBondContact O-N 2.89Å; L122-M124 VanDerWaalsContact C-N 3.31Å; L122-M124 PolarHBondContact O-N 3.43Å; M124-Q126 PolarHBondContact O-N 3.12Å; M124-S127 PolarHBondContact O-N 2.94Å; M124-L128 HydrophobicContact CG-CD1 3.94Å; M124-L128 HydrophobicContact CG-CG 4.43Å; M124-L128 WeakPolarHBondContact O-CB 3.38Å; M124-L128 WeakPolarHBondContact O-CG 3.32Å; M124-L128 PolarHBondContact O-N 3.47Å
125F90.8Very high93.1Very high22 Ų2278.4 Ų78.410%0.09641%0.406CS..Hα-helixtrans-66.1-35.5179.9-76.4-46.7000112.9T92 T121 L122 G129 L229 L232 T233T92-F125 HydrophobicContact CG2-CE2 4.2Å; T92-F125 HydrophobicContact CG2-CZ 4.38Å; T121-F125 HydrophobicContact CG2-CD2 3.53Å; T121-F125 HydrophobicContact CG2-CE2 3.29Å; T121-F125 HydrophobicContact CG2-CZ 4.24Å; T121-F125 WeakPolarHBondContact O-CD2 3.32Å; T121-F125 PolarHBondContact O-N 3.31Å; L122-F125 PolarHBondContact O-N 2.84Å; F125-G129 WeakPolarHBondContact O-CA 3.24Å; F125-G129 PolarHBondContact O-N 3.08Å; F125-L229 HydrophobicContact CZ-CD2 4.5Å; F125-L232 HydrophobicContact CE1-CB 3.81Å; F125-L232 HydrophobicContact CE2-CB 4Å; F125-L232 HydrophobicContact CE2-CD1 3.96Å; F125-L232 HydrophobicContact CZ-CB 3.51Å; F125-L232 HydrophobicContact CZ-CD1 3.75Å; F125-L232 HydrophobicContact CZ-CG 4.3Å; F125-T233 WeakPolarHBondContact CE1-OG1 3.1Å
126Q89.3Confident92.8Very high102 Ų10275.2 Ų75.248%0.47739%0.387SS..Hα-helixtrans-63.3-46.8173.9-174.2175.9-39.700111.1L122 V123 M124 G129 E130L122-Q126 WeakPolarHBondContact O-CB 3.32Å; L122-Q126 PolarHBondContact O-N 3.27Å; V123-Q126 PolarHBondContact O-N 3.47Å; M124-Q126 PolarHBondContact O-N 3.12Å; Q126-G129 PolarHBondContact O-N 3.42Å; Q126-E130 PolarHBondContact O-N 3Å
127S91.4Very high92.5Very high62 Ų6274.1 Ų74.143%0.43438%0.377SS..Hα-helixtrans-63.2-45.9178.6-58.30000111.7V123 M124 R131V123-S127 WeakPolarHBondContact O-CB 3.36Å; V123-S127 PolarHBondContact O-N 3.21Å; V123-S127 PolarHBondContact O-OG 3.36Å; M124-S127 PolarHBondContact O-N 2.94Å; S127-R131 VanDerWaalsContact O-CG 3.24Å; S127-R131 WeakPolarHBondContact O-CG 3.25Å; S127-R131 PolarHBondContact O-N 3.27Å
128L93.4Very high92.2Very high80 Ų8080 Ų8042%0.41940%0.397SS..Hα-helixtrans-65.4-40.6176.7-71176.5000111.6M124 R131 M132 T233M124-L128 HydrophobicContact CG-CD1 3.94Å; M124-L128 HydrophobicContact CG-CG 4.43Å; M124-L128 WeakPolarHBondContact O-CB 3.38Å; M124-L128 WeakPolarHBondContact O-CG 3.32Å; M124-L128 PolarHBondContact O-N 3.47Å; L128-R131 PolarHBondContact O-N 3.4Å; L128-M132 WeakPolarHBondContact O-CB 3.45Å; L128-M132 PolarHBondContact O-N 3.11Å; L128-T233 HydrophobicContact CB-CG2 3.71Å; L128-T233 HydrophobicContact CD1-CG2 4.48Å
129G90.6Very high91.9Very high0 Ų080.8 Ų80.80%040%0.401CS..Hα-helixtrans-64.1-41.4178.900000112.9F125 Q126 M132 N133F125-G129 WeakPolarHBondContact O-CA 3.24Å; F125-G129 PolarHBondContact O-N 3.08Å; Q126-G129 PolarHBondContact O-N 3.42Å; G129-M132 PolarHBondContact O-N 3.11Å; G129-N133 WeakPolarHBondContact O-CB 3.45Å; G129-N133 VanDerWaalsContact O-CG 3.3Å; G129-N133 PolarHBondContact O-N 3.13Å; G129-N133 PolarHBondContact O-ND2 3.1Å
130E90.6Very high91.5Very high117 Ų11778.9 Ų78.955%0.54739%0.387SS..Hα-helixtrans-63.2-43.9174.3-172.5-175.3172.500112Q126 M132 N133 T134Q126-E130 PolarHBondContact O-N 3Å; E130-M132 VanDerWaalsContact C-N 3.32Å; E130-M132 PolarHBondContact O-N 3.38Å; E130-N133 PolarHBondContact O-N 3.33Å; E130-T134 WeakPolarHBondContact O-CB 3.35Å; E130-T134 PolarHBondContact O-N 3.06Å; E130-T134 PolarHBondContact O-OG1 3.49Å
131R93.4Very high91.2Very high196 Ų19678.4 Ų78.474%0.7438%0.379SS*.Hα-helixtrans-62.3-41.7175.9-66.2-68.7178.8173.1-0.5111.2S127 L128 T134 F135S127-R131 VanDerWaalsContact O-CG 3.24Å; S127-R131 WeakPolarHBondContact O-CG 3.25Å; S127-R131 PolarHBondContact O-N 3.27Å; L128-R131 PolarHBondContact O-N 3.4Å; R131-T134 PolarHBondContact O-N 2.82Å; R131-F135 WeakPolarHBondContact O-CB 3.38Å; R131-F135 PolarHBondContact O-N 2.9Å
132M91.8Very high91Very high55 Ų5585.1 Ų85.127%0.27140%0.404SS..Hα-helixtrans-65.2-44.8177-170.5148.772.500112L128 G129 E130 T134 F135 V136 T233 V234 A237L128-M132 WeakPolarHBondContact O-CB 3.45Å; L128-M132 PolarHBondContact O-N 3.11Å; G129-M132 PolarHBondContact O-N 3.11Å; E130-M132 VanDerWaalsContact C-N 3.32Å; E130-M132 PolarHBondContact O-N 3.38Å; M132-T134 VanDerWaalsContact C-N 3.31Å; M132-T134 PolarHBondContact O-N 3.06Å; M132-F135 WeakPolarHBondContact O-CB 3.32Å; M132-F135 PolarHBondContact O-N 2.88Å; M132-V136 WeakPolarHBondContact O-CG2 3.28Å; M132-V136 PolarHBondContact O-N 3.23Å; M132-T233 HydrophobicContact CE-CG2 3.86Å; M132-T233 VanDerWaalsContact CE-O 3.31Å; M132-T233 WeakPolarHBondContact CE-O 3.31Å; M132-V234 VanDerWaalsContact CE-CA 3.41Å; M132-V234 HydrophobicContact CE-CB 4.13Å; M132-V234 HydrophobicContact CE-CG2 3.69Å; M132-V234 HydrophobicContact SD-CG2 4.47Å; M132-A237 HydrophobicContact CB-CB 4.45Å; M132-A237 HydrophobicContact CE-CB 3.68Å
133N91.4Very high90.8Very high25 Ų2584.6 Ų84.613%0.13440%0.4CS..Hα-helixtrans-60.1-41.5174.8-74.6-24.4000111.7G129 E130 V136 K137 M159 A237G129-N133 WeakPolarHBondContact O-CB 3.45Å; G129-N133 VanDerWaalsContact O-CG 3.3Å; G129-N133 PolarHBondContact O-N 3.13Å; G129-N133 PolarHBondContact O-ND2 3.1Å; E130-N133 PolarHBondContact O-N 3.33Å; N133-V136 PolarHBondContact O-N 2.91Å; N133-K137 WeakPolarHBondContact O-CB 3.37Å; N133-K137 PolarHBondContact O-N 3.47Å; N133-M159 HydrophobicContact CB-CE 4.16Å; N133-M159 WeakPolarHBondContact O-CE 3.48Å; N133-A237 PolarHBondContact ND2-O 2.94Å
134T91.4Very high90.6Very high85 Ų8581.8 Ų81.852%0.52138%0.381SS..Hα-helixtrans-63.2-42.5175.5-58.30000111.6E130 R131 M132 K137 Y138E130-T134 WeakPolarHBondContact O-CB 3.35Å; E130-T134 PolarHBondContact O-N 3.06Å; E130-T134 PolarHBondContact O-OG1 3.49Å; R131-T134 PolarHBondContact O-N 2.82Å; M132-T134 VanDerWaalsContact C-N 3.31Å; M132-T134 PolarHBondContact O-N 3.06Å; T134-K137 PolarHBondContact O-N 2.93Å; T134-Y138 PolarHBondContact O-N 2.99Å
135F91.8Very high90.2Very high118 Ų11885.8 Ų85.852%0.51840%0.396SS..Hα-helixtrans-63.6-45.8176.3178.8-108.6000112.1R131 M132 K137 Y138 L139R131-F135 WeakPolarHBondContact O-CB 3.38Å; R131-F135 PolarHBondContact O-N 2.9Å; M132-F135 WeakPolarHBondContact O-CB 3.32Å; M132-F135 PolarHBondContact O-N 2.88Å; F135-K137 VanDerWaalsContact C-N 3.34Å; F135-K137 PolarHBondContact O-N 2.9Å; F135-Y138 WeakPolarHBondContact O-CB 3.49Å; F135-Y138 PolarHBondContact O-N 2.89Å; F135-L139 HydrophobicContact CD1-CD1 3.87Å; F135-L139 HydrophobicContact CD1-CG 4.4Å; F135-L139 HydrophobicContact CE1-CD1 3.32Å; F135-L139 HydrophobicContact CE1-CG 4.03Å; F135-L139 HydrophobicContact CE2-CD1 4.4Å; F135-L139 HydrophobicContact CE2-CD2 4.42Å; F135-L139 HydrophobicContact CE2-CG 4.27Å; F135-L139 HydrophobicContact CZ-CD1 3.63Å; F135-L139 HydrophobicContact CZ-CD2 4.14Å; F135-L139 HydrophobicContact CZ-CG 3.96Å; F135-L139 WeakPolarHBondContact O-CG 3.41Å; F135-L139 PolarHBondContact O-N 3Å
136V90.3Very high90Very high36 Ų3689.8 Ų89.822%0.21843%0.426CS..Hα-helixtrans-60-44174.8170.60000110.8M132 N133 Y138 L139 L140 M159 V162M132-V136 WeakPolarHBondContact O-CG2 3.28Å; M132-V136 PolarHBondContact O-N 3.23Å; N133-V136 PolarHBondContact O-N 2.91Å; V136-Y138 VanDerWaalsContact C-N 3.31Å; V136-Y138 PolarHBondContact O-N 3.07Å; V136-L139 PolarHBondContact O-N 3Å; V136-L140 HydrophobicContact CG1-CD1 3.9Å; V136-L140 HydrophobicContact CG1-CG 4.31Å; V136-L140 WeakPolarHBondContact O-CB 3.38Å; V136-L140 WeakPolarHBondContact O-CG 3.35Å; V136-L140 PolarHBondContact O-N 3.05Å; V136-M159 HydrophobicContact CG1-CE 4.47Å; V136-V162 HydrophobicContact CG1-CG1 3.67Å
137K89.3Confident89.9Confident113 Ų11389.2 Ų89.249%0.49143%0.432SS..Hα-helixtrans-59.7-42.3176-170.3174.6-174.5175.40111.7N133 T134 F135 K141 V154 M159N133-K137 WeakPolarHBondContact O-CB 3.37Å; N133-K137 PolarHBondContact O-N 3.47Å; T134-K137 PolarHBondContact O-N 2.93Å; F135-K137 VanDerWaalsContact C-N 3.34Å; F135-K137 PolarHBondContact O-N 2.9Å; K137-K141 WeakPolarHBondContact O-CB 3.17Å; K137-K141 PolarHBondContact O-N 3.26Å; K137-V154 HydrophobicContact CG-CB 4.04Å; K137-V154 HydrophobicContact CG-CG1 4.17Å; K137-V154 HydrophobicContact CG-CG2 4.24Å; K137-M159 HydrophobicContact CB-CE 4.16Å; K137-M159 HydrophobicContact CB-SD 3.81Å; K137-M159 HydrophobicContact CG-SD 4.17Å
138Y90.7Very high89.3Confident134 Ų13489.3 Ų89.353%0.52544%0.443SS..Hα-helixtrans-63.4-46.5175.1172.7-100.5000112T134 F135 V136 K141 R142T134-Y138 PolarHBondContact O-N 2.99Å; F135-Y138 WeakPolarHBondContact O-CB 3.49Å; F135-Y138 PolarHBondContact O-N 2.89Å; V136-Y138 VanDerWaalsContact C-N 3.31Å; V136-Y138 PolarHBondContact O-N 3.07Å; Y138-K141 PolarHBondContact O-N 3.27Å; Y138-R142 PolarHBondContact O-N 2.97Å
139L90.5Very high88.7Confident67 Ų6790.2 Ų90.235%0.35145%0.446SS..Hα-helixtrans-60.5-46.9176.6-74.2180000111.9F135 V136 K141 R142 I143F135-L139 HydrophobicContact CD1-CD1 3.87Å; F135-L139 HydrophobicContact CD1-CG 4.4Å; F135-L139 HydrophobicContact CE1-CD1 3.32Å; F135-L139 HydrophobicContact CE1-CG 4.03Å; F135-L139 HydrophobicContact CE2-CD1 4.4Å; F135-L139 HydrophobicContact CE2-CD2 4.42Å; F135-L139 HydrophobicContact CE2-CG 4.27Å; F135-L139 HydrophobicContact CZ-CD1 3.63Å; F135-L139 HydrophobicContact CZ-CD2 4.14Å; F135-L139 HydrophobicContact CZ-CG 3.96Å; F135-L139 WeakPolarHBondContact O-CG 3.41Å; F135-L139 PolarHBondContact O-N 3Å; V136-L139 PolarHBondContact O-N 3Å; L139-K141 VanDerWaalsContact C-N 3.31Å; L139-K141 PolarHBondContact O-N 3.35Å; L139-R142 WeakPolarHBondContact O-CB 3.39Å; L139-R142 PolarHBondContact O-N 3.48Å; L139-R142 VanDerWaalsContact O-N 3.1Å; L139-I143 VanDerWaalsContact O-CG1 3.31Å; L139-I143 WeakPolarHBondContact O-CG1 3.43Å; L139-I143 PolarHBondContact O-N 3.26Å
140L88.9Confident87.7Confident31 Ų31102.6 Ų102.616%0.16249%0.493CS..Hα-helixtrans-60.6-41.5177.2-73.4171.3000111.8V136 R142 I143 K144 V154 M159 V162V136-L140 HydrophobicContact CG1-CD1 3.9Å; V136-L140 HydrophobicContact CG1-CG 4.31Å; V136-L140 WeakPolarHBondContact O-CB 3.38Å; V136-L140 WeakPolarHBondContact O-CG 3.35Å; V136-L140 PolarHBondContact O-N 3.05Å; L140-R142 VanDerWaalsContact C-N 3.31Å; L140-R142 PolarHBondContact O-N 2.92Å; L140-I143 PolarHBondContact O-N 2.94Å; L140-K144 WeakPolarHBondContact O-CB 3.46Å; L140-K144 WeakPolarHBondContact O-CG 3.24Å; L140-K144 PolarHBondContact O-N 3.28Å; L140-V154 HydrophobicContact CB-CG1 4.48Å; L140-V154 HydrophobicContact CB-CG2 4.19Å; L140-V154 HydrophobicContact CD1-CG1 4.08Å; L140-M159 HydrophobicContact CD1-SD 4.11Å; L140-V162 HydrophobicContact CD1-CB 4.34Å; L140-V162 HydrophobicContact CD1-CG1 4.45Å; L140-V162 HydrophobicContact CD1-CG2 3.91Å; L140-V162 HydrophobicContact CD2-CG2 3.94Å
141K88.6Confident86.7Confident116 Ų116100.4 Ų100.450%0.50449%0.49SS..Hα-helixtrans-61.7-41.2175-172174.5-176.7176.50111.3K137 Y138 L139 K145 V154K137-K141 WeakPolarHBondContact O-CB 3.17Å; K137-K141 PolarHBondContact O-N 3.26Å; Y138-K141 PolarHBondContact O-N 3.27Å; L139-K141 VanDerWaalsContact C-N 3.31Å; L139-K141 PolarHBondContact O-N 3.35Å; K141-K145 WeakPolarHBondContact O-CB 3.43Å; K141-K145 PolarHBondContact O-N 2.62Å; K141-V154 HydrophobicContact CB-CG2 4.27Å
142R88.9Confident85.8Confident151 Ų15193.6 Ų93.657%0.5747%0.471SS*.Hα-helixtrans-66-44.6177-167.3172.8-177.5169.31.4111.6Y138 L139 L140 K145 C146Y138-R142 PolarHBondContact O-N 2.97Å; L139-R142 WeakPolarHBondContact O-CB 3.39Å; L139-R142 PolarHBondContact O-N 3.48Å; L139-R142 VanDerWaalsContact O-N 3.1Å; L140-R142 VanDerWaalsContact C-N 3.31Å; L140-R142 PolarHBondContact O-N 2.92Å; R142-K145 PolarHBondContact O-N 3.42Å; R142-C146 PolarHBondContact O-N 2.96Å; R142-C146 PolarHBondContact O-SG 3.42Å
143I88.1Confident85.1Confident97 Ų9798.4 Ų98.450%0.49749%0.493SS..Hα-helixtrans-61.4-50.3176.6-67.5165.2000110.4L139 L140 K145 C146 C147L139-I143 VanDerWaalsContact O-CG1 3.31Å; L139-I143 WeakPolarHBondContact O-CG1 3.43Å; L139-I143 PolarHBondContact O-N 3.26Å; L140-I143 PolarHBondContact O-N 2.94Å; I143-K145 VanDerWaalsContact C-N 3.26Å; I143-K145 PolarHBondContact O-N 3.43Å; I143-C146 CarbonylContact O-C 3.57Å; I143-C146 WeakPolarHBondContact O-CB 3.39Å; I143-C146 PolarHBondContact O-N 3.01Å; I143-C146 VanDerWaalsContact O-N 3.08Å; I143-C147 PolarHBondContact O-N 3.13Å; I143-C147 PolarHBondContact O-SG 2.95Å
144K87.5Confident84.8Confident31 Ų3198.2 Ų98.214%0.13549%0.492CS..Hα-helixtrans-57.5-39.1177.1-73.6-170.1179.3-169.70112.5L140 C147 G148 M149 E153 N158L140-K144 WeakPolarHBondContact O-CB 3.46Å; L140-K144 WeakPolarHBondContact O-CG 3.24Å; L140-K144 PolarHBondContact O-N 3.28Å; K144-C147 PolarHBondContact O-N 3.34Å; K144-G148 PolarHBondContact O-N 3.48Å; K144-M149 HydrophobicContact CB-SD 4.17Å; K144-M149 HydrophobicContact CD-SD 4.32Å; K144-M149 HydrophobicContact CG-SD 3.84Å; K144-M149 PolarHBondContact O-N 3.29Å; K144-M149 VanDerWaalsContact O-N 3.13Å; K144-E153 PolarHBondContact NZ-O 3.43Å; K144-N158 PolarHBondContact NZ-ND2 2.78Å
145K86Confident84.5Confident164 Ų16496.9 Ų96.971%0.71349%0.486SS*.Hα-helixtrans-66.9-42.3175.7-170.3177.6-178.7-1790111.7K141 R142 I143 C147 G148 T152K141-K145 WeakPolarHBondContact O-CB 3.43Å; K141-K145 PolarHBondContact O-N 2.62Å; R142-K145 PolarHBondContact O-N 3.42Å; I143-K145 VanDerWaalsContact C-N 3.26Å; I143-K145 PolarHBondContact O-N 3.43Å; K145-C147 VanDerWaalsContact C-N 3.33Å; K145-G148 PolarHBondContact O-N 3.27Å; K145-T152 HydrophobicContact CB-CG2 4.48Å
146C87Confident84.2Confident105 Ų10595.6 Ų95.671%0.70948%0.483SS*.Hα-helixtrans-65-35.3174.7-70.90000112.4R142 I143 G148R142-C146 PolarHBondContact O-N 2.96Å; R142-C146 PolarHBondContact O-SG 3.42Å; I143-C146 CarbonylContact O-C 3.57Å; I143-C146 WeakPolarHBondContact O-CB 3.39Å; I143-C146 PolarHBondContact O-N 3.01Å; I143-C146 VanDerWaalsContact O-N 3.08Å; C146-G148 PolarHBondContact O-N 3.42Å
147C85.8Confident84.1Confident90 Ų90100.9 Ų100.961%0.60851%0.505SS*.THydrogen-bonded Turntrans-77.54.4175.4-63.30000113.9I143 K144 K145 M149I143-C147 PolarHBondContact O-N 3.13Å; I143-C147 PolarHBondContact O-SG 2.95Å; K144-C147 PolarHBondContact O-N 3.34Å; K145-C147 VanDerWaalsContact C-N 3.33Å; C147-M149 VanDerWaalsContact C-N 3.29Å; C147-M149 HydrophobicContact CB-CG 4.4Å; C147-M149 PolarHBondContact O-N 2.66Å
148G79.5Confident84.1Confident65 Ų6598.5 Ų98.567%0.6750%0.498SS*.THydrogen-bonded Turntrans69.918.5175.500000115.2K144 K145 C146 R150K144-G148 PolarHBondContact O-N 3.48Å; K145-G148 PolarHBondContact O-N 3.27Å; C146-G148 PolarHBondContact O-N 3.42Å; G148-R150 PolarHBondContact O-N 3.39Å
149M80.9Confident84.1Confident98 Ų9892.9 Ų92.948%0.48348%0.477SS..  trans-71.2129.6-178.4-65.91777400111.4K144 C147 S151K144-M149 HydrophobicContact CB-SD 4.17Å; K144-M149 HydrophobicContact CD-SD 4.32Å; K144-M149 HydrophobicContact CG-SD 3.84Å; K144-M149 PolarHBondContact O-N 3.29Å; K144-M149 VanDerWaalsContact O-N 3.13Å; C147-M149 VanDerWaalsContact C-N 3.29Å; C147-M149 HydrophobicContact CB-CG 4.4Å; C147-M149 PolarHBondContact O-N 2.66Å; M149-S151 VanDerWaalsContact C-N 3.26Å; M149-S151 PolarHBondContact O-N 2.9Å
150R68.3Low84.1Confident261 Ų26192 Ų9299%0.98547%0.474SS*.SBendtrans-62.6-26.5178.3-87.6-179.9170.3174.3-3.1114G148G148-R150 PolarHBondContact O-N 3.39Å
151S71.4Confident84.3Confident70 Ų7093.9 Ų93.949%0.4949%0.487SS..  trans-106.8112173.7-178.20000110.7M149M149-S151 VanDerWaalsContact C-N 3.26Å; M149-S151 PolarHBondContact O-N 2.9Å
152T73.2Confident84.5Confident53 Ų5390.7 Ų90.733%0.32548%0.477SS..  trans-96.57.417761.40000112.8K145K145-T152 HydrophobicContact CB-CG2 4.48Å
153E78.3Confident84.7Confident157 Ų15784.2 Ų84.273%0.73446%0.457SS*.  trans-71.9131.6175.9-64.6-167168.300110.5K144K144-E153 PolarHBondContact NZ-O 3.43Å
154V83.6Confident85Confident21 Ų2184.9 Ų84.913%0.12746%0.457CS..  trans-97.295.9177.5-175.90000107K137 L140 K141 N158 M159K137-V154 HydrophobicContact CG-CB 4.04Å; K137-V154 HydrophobicContact CG-CG1 4.17Å; K137-V154 HydrophobicContact CG-CG2 4.24Å; L140-V154 HydrophobicContact CB-CG1 4.48Å; L140-V154 HydrophobicContact CB-CG2 4.19Å; L140-V154 HydrophobicContact CD1-CG1 4.08Å; K141-V154 HydrophobicContact CB-CG2 4.27Å; V154-N158 HydrophobicContact CG1-CB 4.38Å; V154-M159 HydrophobicContact CG1-CG 3.83Å; V154-M159 HydrophobicContact CG1-SD 3.75Å
155S86.8Confident85.4Confident57 Ų5790 Ų9040%0.39948%0.479SS..  trans-58.4152.7171.4179.60000111.4E157 N158 M159S155-E157 PolarHBondContact O-N 2.93Å; S155-E157 PolarHBondContact OG-N 2.63Å; S155-N158 WeakPolarHBondContact O-CB 3.33Å; S155-N158 PolarHBondContact O-N 3.31Å; S155-M159 PolarHBondContact O-N 3.13Å
156M85.4Confident85.8Confident90 Ų9084.8 Ų84.844%0.44346%0.463SS..Hα-helixtrans-58-37.6174.1-175.6176.7-72.500111.8N158 M159 V160 R245M156-N158 VanDerWaalsContact C-N 3.31Å; M156-N158 PolarHBondContact O-N 3.07Å; M156-M159 WeakPolarHBondContact O-CB 3.46Å; M156-M159 PolarHBondContact O-N 3.43Å; M156-M159 VanDerWaalsContact O-N 3.08Å; M156-V160 HydrophobicContact CG-CG2 4.43Å; M156-V160 WeakPolarHBondContact O-CG2 3.45Å; M156-V160 PolarHBondContact O-N 3.45Å; M156-R245 PolarHBondContact SD-NH1 2.87Å
157E87.3Confident86.3Confident147 Ų14780.4 Ų80.469%0.68743%0.434SS*.Hα-helixtrans-59.1-43176.8-65.7174.1178.800111.5S155 M159 V160 T161S155-E157 PolarHBondContact O-N 2.93Å; S155-E157 PolarHBondContact OG-N 2.63Å; E157-M159 VanDerWaalsContact C-N 3.29Å; E157-M159 PolarHBondContact O-N 2.89Å; E157-V160 PolarHBondContact O-N 2.95Å; E157-T161 WeakPolarHBondContact O-CB 3.33Å; E157-T161 PolarHBondContact O-N 2.8Å; E157-T161 PolarHBondContact O-OG1 3.45Å
158N89.4Confident86.8Confident63 Ų6379 Ų7934%0.33742%0.419SS..Hα-helixtrans-62.4-38.3176.3-63.5-47.6000111.8K144 V154 S155 M156 V162K144-N158 PolarHBondContact NZ-ND2 2.78Å; V154-N158 HydrophobicContact CG1-CB 4.38Å; S155-N158 WeakPolarHBondContact O-CB 3.33Å; S155-N158 PolarHBondContact O-N 3.31Å; M156-N158 VanDerWaalsContact C-N 3.31Å; M156-N158 PolarHBondContact O-N 3.07Å; N158-V162 WeakPolarHBondContact O-CB 3Å; N158-V162 WeakPolarHBondContact O-CG2 3.27Å; N158-V162 PolarHBondContact O-N 2.91Å
159M90.5Very high87.6Confident16 Ų1677.3 Ų77.38%0.07940%0.402CS..Hα-helixtrans-66.1-44.2177.2-69-68.5-60.700111.4N133 V136 K137 L140 V154 S155 M156 E157 V162 G163 L241N133-M159 HydrophobicContact CB-CE 4.16Å; N133-M159 WeakPolarHBondContact O-CE 3.48Å; V136-M159 HydrophobicContact CG1-CE 4.47Å; K137-M159 HydrophobicContact CB-CE 4.16Å; K137-M159 HydrophobicContact CB-SD 3.81Å; K137-M159 HydrophobicContact CG-SD 4.17Å; L140-M159 HydrophobicContact CD1-SD 4.11Å; V154-M159 HydrophobicContact CG1-CG 3.83Å; V154-M159 HydrophobicContact CG1-SD 3.75Å; S155-M159 PolarHBondContact O-N 3.13Å; M156-M159 WeakPolarHBondContact O-CB 3.46Å; M156-M159 PolarHBondContact O-N 3.43Å; M156-M159 VanDerWaalsContact O-N 3.08Å; E157-M159 VanDerWaalsContact C-N 3.29Å; E157-M159 PolarHBondContact O-N 2.89Å; M159-V162 PolarHBondContact O-N 3.49Å; M159-G163 PolarHBondContact O-N 3.36Å; M159-L241 HydrophobicContact CB-CD1 4.33Å; M159-L241 HydrophobicContact CB-CD2 3.81Å
160V91.8Very high88.4Confident50 Ų5073.7 Ų73.730%0.30339%0.385SS..Hα-helixtrans-64-45.5178.1173.30000110.4M156 E157 V162 G163 F164 F238 L241 V242M156-V160 HydrophobicContact CG-CG2 4.43Å; M156-V160 WeakPolarHBondContact O-CG2 3.45Å; M156-V160 PolarHBondContact O-N 3.45Å; E157-V160 PolarHBondContact O-N 2.95Å; V160-V162 PolarHBondContact O-N 3.29Å; V160-G163 PolarHBondContact O-N 2.96Å; V160-F164 WeakPolarHBondContact O-CB 3.28Å; V160-F164 PolarHBondContact O-N 3.49Å; V160-F238 HydrophobicContact CG1-CE2 4.27Å; V160-L241 HydrophobicContact CG2-CD2 3.88Å; V160-L241 HydrophobicContact CG2-CG 4.41Å; V160-V242 HydrophobicContact CG2-CG2 4.45Å
161T91.9Very high89.8Confident70 Ų7061.8 Ų61.843%0.42934%0.341SS..Hα-helixtrans-59.8-47.2177.1-60.70000111.8E157 F164 F165E157-T161 WeakPolarHBondContact O-CB 3.33Å; E157-T161 PolarHBondContact O-N 2.8Å; E157-T161 PolarHBondContact O-OG1 3.45Å; T161-F164 PolarHBondContact O-N 3.36Å; T161-F165 HydrophobicContact CG2-CD2 3.79Å; T161-F165 HydrophobicContact CG2-CE2 3.53Å; T161-F165 WeakPolarHBondContact O-CD2 3.42Å; T161-F165 PolarHBondContact O-N 3.24Å
162V93.5Very high91Very high49 Ų4960.9 Ų60.930%0.29733%0.334SS..Hα-helixtrans-66.1-39.7178.2171.40000111.4V136 L140 N158 M159 V160 F165 S166V136-V162 HydrophobicContact CG1-CG1 3.67Å; L140-V162 HydrophobicContact CD1-CB 4.34Å; L140-V162 HydrophobicContact CD1-CG1 4.45Å; L140-V162 HydrophobicContact CD1-CG2 3.91Å; L140-V162 HydrophobicContact CD2-CG2 3.94Å; N158-V162 WeakPolarHBondContact O-CB 3Å; N158-V162 WeakPolarHBondContact O-CG2 3.27Å; N158-V162 PolarHBondContact O-N 2.91Å; M159-V162 PolarHBondContact O-N 3.49Å; V160-V162 PolarHBondContact O-N 3.29Å; V162-F165 PolarHBondContact O-N 3.04Å; V162-S166 VanDerWaalsContact O-CB 3.31Å; V162-S166 WeakPolarHBondContact O-CB 3.41Å; V162-S166 PolarHBondContact O-N 3.39Å
163G93.4Very high92.2Very high15 Ų1563.8 Ų63.816%0.15535%0.346CS..Hα-helixtrans-60.8-43.1174.200000112.5M159 V160 S166 C167M159-G163 PolarHBondContact O-N 3.36Å; V160-G163 PolarHBondContact O-N 2.96Å; G163-S166 WeakPolarHBondContact O-CB 3.25Å; G163-S166 PolarHBondContact O-N 3.5Å; G163-C167 PolarHBondContact O-N 3.39Å; G163-C167 PolarHBondContact O-SG 2.82Å
164F94Very high93.1Very high111 Ų11156.3 Ų56.349%0.48731%0.311SS..Hα-helixtrans-61.5-49.4176.4179.8-98.5000111.9V160 T161 S166 C167 M168 F238V160-F164 WeakPolarHBondContact O-CB 3.28Å; V160-F164 PolarHBondContact O-N 3.49Å; T161-F164 PolarHBondContact O-N 3.36Å; F164-S166 VanDerWaalsContact C-N 3.29Å; F164-S166 PolarHBondContact O-N 2.88Å; F164-C167 PolarHBondContact O-N 3.46Å; F164-M168 HydrophobicContact CD1-CG 4.47Å; F164-M168 HydrophobicContact CE1-CG 4.07Å; F164-M168 HydrophobicContact CZ-CG 4.12Å; F164-M168 PolarHBondContact O-N 3.46Å; F164-F238 HydrophobicContact CB-CE2 4.36Å
165F95.4Very high93.7Very high138 Ų13855.3 Ų55.361%0.60531%0.305SS*.Hα-helixtrans-63.8-34.3175.7-75.2-63.2000112.7T161 V162 G169T161-F165 HydrophobicContact CG2-CD2 3.79Å; T161-F165 HydrophobicContact CG2-CE2 3.53Å; T161-F165 WeakPolarHBondContact O-CD2 3.42Å; T161-F165 PolarHBondContact O-N 3.24Å; V162-F165 PolarHBondContact O-N 3.04Å; F165-G169 PolarHBondContact O-N 2.57Å
166S95.4Very high94.2Very high54 Ų5454.8 Ų54.838%0.37830%0.304SS..Hα-helixtrans-64.4-46174.4-1710000111.5V162 G163 F164 G169 T170V162-S166 VanDerWaalsContact O-CB 3.31Å; V162-S166 WeakPolarHBondContact O-CB 3.41Å; V162-S166 PolarHBondContact O-N 3.39Å; G163-S166 WeakPolarHBondContact O-CB 3.25Å; G163-S166 PolarHBondContact O-N 3.5Å; F164-S166 VanDerWaalsContact C-N 3.29Å; F164-S166 PolarHBondContact O-N 2.88Å; S166-G169 PolarHBondContact O-N 2.78Å; S166-T170 PolarHBondContact O-N 2.63Å; S166-T170 PolarHBondContact O-OG1 3.48Å; S166-T170 VanDerWaalsContact O-OG1 3.05Å
167C95.9Very high94.7Very high13 Ų1351.5 Ų51.59%0.08829%0.291CS..Hα-helixtrans-60.9-47.6177-64.70000110.7G163 F164 G169 T170 L171 I235G163-C167 PolarHBondContact O-N 3.39Å; G163-C167 PolarHBondContact O-SG 2.82Å; F164-C167 PolarHBondContact O-N 3.46Å; C167-G169 VanDerWaalsContact C-N 3.35Å; C167-G169 PolarHBondContact O-N 3.02Å; C167-T170 PolarHBondContact O-N 3.03Å; C167-L171 WeakPolarHBondContact O-CG 3.36Å; C167-L171 PolarHBondContact O-N 3.41Å; C167-I235 HydrophobicContact CB-CD1 3.77Å
168M96.5Very high95.1Very high62 Ų6244.5 Ų44.531%0.30526%0.259SS..Hα-helixtrans-58.5-45.1175.8-79.3-55.9-34.900112.5F164 T170 L171 C172 Y190F164-M168 HydrophobicContact CD1-CG 4.47Å; F164-M168 HydrophobicContact CE1-CG 4.07Å; F164-M168 HydrophobicContact CZ-CG 4.12Å; F164-M168 PolarHBondContact O-N 3.46Å; M168-T170 PolarHBondContact O-N 3.45Å; M168-L171 PolarHBondContact O-N 2.95Å; M168-C172 PolarHBondContact O-N 3.1Å; M168-C172 PolarHBondContact O-SG 2.94Å; M168-C172 VanDerWaalsContact O-SG 3.33Å; M168-Y190 HydrophobicContact CE-CE2 4.02Å; M168-Y190 WeakPolarHBondContact CE-OH 3.5Å; M168-Y190 PolarHBondContact SD-OH 2.97Å; M168-Y190 VanDerWaalsContact SD-OH 3.38Å
169G96.9Very high95.4Very high29 Ų2942.3 Ų42.330%0.29925%0.248SC..Hα-helixtrans-60.5-44.2176.600000112.4F165 S166 C167 L171 C172 I173F165-G169 PolarHBondContact O-N 2.57Å; S166-G169 PolarHBondContact O-N 2.78Å; C167-G169 VanDerWaalsContact C-N 3.35Å; C167-G169 PolarHBondContact O-N 3.02Å; G169-L171 VanDerWaalsContact C-N 3.35Å; G169-L171 PolarHBondContact O-N 3.48Å; G169-C172 PolarHBondContact O-N 3.27Å; G169-I173 WeakPolarHBondContact O-CB 3.47Å; G169-I173 WeakPolarHBondContact O-CD1 3.29Å; G169-I173 VanDerWaalsContact O-CG1 3.22Å; G169-I173 WeakPolarHBondContact O-CG1 3.49Å; G169-I173 PolarHBondContact O-N 3.26Å
170T96.8Very high95.4Very high22 Ų2249 Ų4914%0.13528%0.279CS..Hα-helixtrans-61.5-40.7176.5-61.30000112.4S166 C167 M168 G174 L197 Y227S166-T170 PolarHBondContact O-N 2.63Å; S166-T170 PolarHBondContact O-OG1 3.48Å; S166-T170 VanDerWaalsContact O-OG1 3.05Å; C167-T170 PolarHBondContact O-N 3.03Å; M168-T170 PolarHBondContact O-N 3.45Å; T170-G174 PolarHBondContact O-N 3.1Å; T170-L197 HydrophobicContact CG2-CD1 3.85Å; T170-Y227 HydrophobicContact CG2-CE2 4.21Å; T170-Y227 WeakPolarHBondContact O-CE2 3.31Å; T170-Y227 PolarHBondContact O-OH 2.85Å
171L97.8Very high95.4Very high10 Ų1052.2 Ų52.25%0.05229%0.287CS..Hα-helixtrans-66-45.8175.9-66.8172.6000111.4C167 M168 G169 G174 A175 Y190 C193 F194 L197C167-L171 WeakPolarHBondContact O-CG 3.36Å; C167-L171 PolarHBondContact O-N 3.41Å; M168-L171 PolarHBondContact O-N 2.95Å; G169-L171 VanDerWaalsContact C-N 3.35Å; G169-L171 PolarHBondContact O-N 3.48Å; L171-G174 PolarHBondContact O-N 3.11Å; L171-A175 VanDerWaalsContact O-CB 3.3Å; L171-A175 WeakPolarHBondContact O-CB 3.42Å; L171-A175 PolarHBondContact O-N 3.41Å; L171-Y190 HydrophobicContact CB-CD2 4.19Å; L171-Y190 HydrophobicContact CB-CE2 3.51Å; L171-Y190 HydrophobicContact CD1-CE1 4.41Å; L171-Y190 HydrophobicContact CD1-CE2 4.49Å; L171-Y190 VanDerWaalsContact CD1-OH 3.29Å; L171-Y190 WeakPolarHBondContact CD1-OH 3.45Å; L171-C193 HydrophobicContact CD2-CB 3.91Å; L171-F194 HydrophobicContact CD1-CD2 3.99Å; L171-F194 HydrophobicContact CD2-CB 4.24Å; L171-L197 HydrophobicContact CD2-CD1 4.04Å
172C97.8Very high95.3Very high51 Ų5149.4 Ų49.435%0.34527%0.269SS..Hα-helixtrans-63.8-42178.3-69.20000113.1M168 G169 A175 A176M168-C172 PolarHBondContact O-N 3.1Å; M168-C172 PolarHBondContact O-SG 2.94Å; M168-C172 VanDerWaalsContact O-SG 3.33Å; G169-C172 PolarHBondContact O-N 3.27Å; C172-A175 PolarHBondContact O-N 2.91Å; C172-A176 WeakPolarHBondContact O-CB 3.47Å; C172-A176 PolarHBondContact O-N 3.31Å
173I97.1Very high95.3Very high115 Ų11555.7 Ų55.759%0.5930%0.295SS*.Hα-helixtrans-63.7-43.9177.2-69.5165.2000110.3G169 A177G169-I173 WeakPolarHBondContact O-CB 3.47Å; G169-I173 WeakPolarHBondContact O-CD1 3.29Å; G169-I173 VanDerWaalsContact O-CG1 3.22Å; G169-I173 WeakPolarHBondContact O-CG1 3.49Å; G169-I173 PolarHBondContact O-N 3.26Å; I173-A177 PolarHBondContact O-N 2.74Å; I173-A177 VanDerWaalsContact O-N 3.09Å
174G96.9Very high95.3Very high0 Ų057.5 Ų57.50%030%0.297CS..Hα-helixtrans-61-50.5174.700000112T170 L171 A176 A177 F178T170-G174 PolarHBondContact O-N 3.1Å; L171-G174 PolarHBondContact O-N 3.11Å; G174-A176 VanDerWaalsContact C-N 3.31Å; G174-A176 PolarHBondContact O-N 2.84Å; G174-A177 PolarHBondContact O-N 2.96Å; G174-A177 VanDerWaalsContact O-N 3.09Å; G174-F178 WeakPolarHBondContact O-CD2 3.15Å; G174-F178 PolarHBondContact O-N 3.49Å
175A97.4Very high95.5Very high0 Ų054.9 Ų54.90%029%0.293CS..Hα-helixtrans-56.1-45.3179.300000111.9L171 C172 A177 S179 F186 A189 Y190 C193L171-A175 VanDerWaalsContact O-CB 3.3Å; L171-A175 WeakPolarHBondContact O-CB 3.42Å; L171-A175 PolarHBondContact O-N 3.41Å; C172-A175 PolarHBondContact O-N 2.91Å; A175-A177 PolarHBondContact O-N 3.3Å; A175-S179 WeakPolarHBondContact O-CB 3.45Å; A175-S179 PolarHBondContact O-N 2.97Å; A175-S179 PolarHBondContact O-OG 3.14Å; A175-F186 HydrophobicContact CB-CD2 4.02Å; A175-F186 HydrophobicContact CB-CE1 4.28Å; A175-F186 HydrophobicContact CB-CE2 3.58Å; A175-F186 HydrophobicContact CB-CZ 3.73Å; A175-A189 HydrophobicContact CB-CB 4.33Å; A175-A189 VanDerWaalsContact O-CB 3.31Å; A175-A189 WeakPolarHBondContact O-CB 3.19Å; A175-Y190 HydrophobicContact CB-CD2 3.99Å; A175-Y190 HydrophobicContact CB-CG 4.35Å; A175-C193 PolarHBondContact N-SG 3.48Å
176A97.1Very high95.5Very high46 Ų4653.4 Ų53.438%0.3829%0.286SS..Hα-helixtrans-60.9-4617600000111.7C172 G174 S179 Q180 F186C172-A176 WeakPolarHBondContact O-CB 3.47Å; C172-A176 PolarHBondContact O-N 3.31Å; G174-A176 VanDerWaalsContact C-N 3.31Å; G174-A176 PolarHBondContact O-N 2.84Å; A176-S179 PolarHBondContact O-OG 3.44Å; A176-Q180 WeakPolarHBondContact O-CG 3.42Å; A176-F186 HydrophobicContact CB-CE2 4.34Å
177A95.5Very high95.6Very high20 Ų2057.7 Ų57.717%0.16530%0.298CS..Hα-helixtrans-65.6-51.1178.700000112.8I173 G174 A175 S179 Q180 Y181 F223I173-A177 PolarHBondContact O-N 2.74Å; I173-A177 VanDerWaalsContact O-N 3.09Å; G174-A177 PolarHBondContact O-N 2.96Å; G174-A177 VanDerWaalsContact O-N 3.09Å; A175-A177 PolarHBondContact O-N 3.3Å; A177-S179 PolarHBondContact O-N 3.08Å; A177-Q180 PolarHBondContact O-N 2.96Å; A177-Y181 WeakPolarHBondContact O-CD2 3.24Å; A177-Y181 PolarHBondContact O-N 3.26Å; A177-F223 HydrophobicContact CB-CE1 3.73Å; A177-F223 HydrophobicContact CB-CE2 4.49Å; A177-F223 HydrophobicContact CB-CZ 3.43Å; A177-F223 VanDerWaalsContact CB-CZ 3.43Å
178F95.3Very high95.7Very high0 Ų060.5 Ų60.50%031%0.31CS..Hα-helixtrans-69.5-32.2-176.5-69.6-64.8000112.8G174 Q180 Y181 E182 A189 Y192 C193 A207 Y220 F223 Y227G174-F178 WeakPolarHBondContact O-CD2 3.15Å; G174-F178 PolarHBondContact O-N 3.49Å; F178-Q180 PolarHBondContact O-N 3.18Å; F178-Y181 PolarHBondContact O-N 2.93Å; F178-E182 WeakPolarHBondContact O-CB 3.36Å; F178-E182 PolarHBondContact O-N 3.28Å; F178-A189 HydrophobicContact CB-CB 4.18Å; F178-Y192 HydrophobicContact CB-CD1 4.47Å; F178-Y192 HydrophobicContact CD1-CE1 4.08Å; F178-Y192 AromaticContact CD2-CD1 3.98Å; F178-Y192 HydrophobicContact CD2-CD1 3.98Å; F178-Y192 AromaticContact CD2-CE1 3.7Å; F178-Y192 HydrophobicContact CD2-CE1 3.7Å; F178-Y192 HydrophobicContact CE1-CE1 4.12Å; F178-Y192 HydrophobicContact CE2-CD1 4.43Å; F178-Y192 AromaticContact CE2-CE1 3.76Å; F178-Y192 HydrophobicContact CE2-CE1 3.76Å; F178-Y192 HydrophobicContact CG-CD1 4.14Å; F178-Y192 AromaticContact CG-CE1 3.89Å; F178-Y192 HydrophobicContact CG-CE1 3.89Å; F178-Y192 AromaticContact CZ-CE1 3.97Å; F178-Y192 HydrophobicContact CZ-CE1 3.97Å; F178-C193 VanDerWaalsContact CD2-SG 3.59Å; F178-A207 HydrophobicContact CD1-CB 3.99Å; F178-A207 HydrophobicContact CE1-CB 3.78Å; F178-Y220 HydrophobicContact CD1-CE2 4.19Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.39Å; F178-Y220 HydrophobicContact CE1-CE2 4.02Å; F178-F223 HydrophobicContact CE1-CE1 4.32Å; F178-F223 HydrophobicContact CZ-CE1 4.13Å; F178-Y227 AromaticContact CE2-CD1 3.53Å; F178-Y227 HydrophobicContact CE2-CD1 3.53Å; F178-Y227 AromaticContact CE2-CE1 3.73Å; F178-Y227 HydrophobicContact CE2-CE1 3.73Å; F178-Y227 HydrophobicContact CE2-CG 4Å; F178-Y227 AromaticContact CZ-CD1 3.94Å; F178-Y227 HydrophobicContact CZ-CD1 3.94Å; F178-Y227 HydrophobicContact CZ-CG 4.29Å
179S95.8Very high95.8Very high17 Ų1757.5 Ų57.512%0.11930%0.295CS..Hα-helixtrans-58.4-36.7172.368.30000112.5A175 A176 A177 E183 W184A175-S179 WeakPolarHBondContact O-CB 3.45Å; A175-S179 PolarHBondContact O-N 2.97Å; A175-S179 PolarHBondContact O-OG 3.14Å; A176-S179 PolarHBondContact O-OG 3.44Å; A177-S179 PolarHBondContact O-N 3.08Å; S179-E183 WeakPolarHBondContact O-CA 3.47Å; S179-E183 PolarHBondContact O-N 3.09Å; S179-W184 WeakPolarHBondContact CA-O 3.4Å; S179-W184 WeakPolarHBondContact CB-O 3.07Å; S179-W184 PolarHBondContact O-N 2.74Å
180Q91.9Very high95.8Very high157 Ų15758.6 Ų58.673%0.73429%0.291SS*.Hα-helixtrans-79.7-38.9179.1-63.7-68.2-39.400112.5A176 A177 F178A176-Q180 WeakPolarHBondContact O-CG 3.42Å; A177-Q180 PolarHBondContact O-N 2.96Å; F178-Q180 PolarHBondContact O-N 3.18Å
181Y91Very high95.9Very high117 Ų11760.7 Ų60.746%0.45930%0.297SS..Hα-helixtrans-79.7-36.3-176.8-77.1-63000114.3A177 F178 Y220A177-Y181 WeakPolarHBondContact O-CD2 3.24Å; A177-Y181 PolarHBondContact O-N 3.26Å; F178-Y181 PolarHBondContact O-N 2.93Å; Y181-Y220 HydrophobicContact CD1-CD2 4.01Å; Y181-Y220 HydrophobicContact CD1-CE2 4.34Å; Y181-Y220 HydrophobicContact CD1-CG 4.31Å; Y181-Y220 AromaticContact CD2-CD2 3.8Å; Y181-Y220 HydrophobicContact CD2-CD2 3.8Å; Y181-Y220 AromaticContact CD2-CE2 3.72Å; Y181-Y220 HydrophobicContact CD2-CE2 3.72Å; Y181-Y220 HydrophobicContact CE1-CD2 4.39Å; Y181-Y220 HydrophobicContact CE2-CD2 4.2Å; Y181-Y220 AromaticContact CG-CD2 3.71Å; Y181-Y220 HydrophobicContact CG-CD2 3.71Å; Y181-Y220 AromaticContact CG-CE2 3.63Å; Y181-Y220 HydrophobicContact CG-CE2 3.63Å; Y181-Y220 HydrophobicContact CG-CG 4.39Å
182E90.4Very high95.9Very high11 Ų1160.4 Ų60.45%0.05130%0.295CS..SBendtrans-103.92.7-177.2-61.4-66.9168.600113.1F178 W184 A207 L208 T210 Y220F178-E182 WeakPolarHBondContact O-CB 3.36Å; F178-E182 PolarHBondContact O-N 3.28Å; E182-W184 HydrophobicContact CB-CD2 3.55Å; E182-W184 VanDerWaalsContact CB-CE2 3.45Å; E182-W184 HydrophobicContact CB-CE3 3.93Å; E182-W184 HydrophobicContact CB-CG 3.97Å; E182-W184 HydrophobicContact CB-CH2 4.17Å; E182-W184 HydrophobicContact CB-CZ2 3.79Å; E182-W184 HydrophobicContact CB-CZ3 4.22Å; E182-W184 HydrophobicContact CG-CD2 4.35Å; E182-W184 HydrophobicContact CG-CE3 4.34Å; E182-W184 HydrophobicContact CG-CH2 3.95Å; E182-W184 HydrophobicContact CG-CZ2 3.94Å; E182-W184 HydrophobicContact CG-CZ3 4.15Å; E182-W184 VanDerWaalsContact O-CD1 3.23Å; E182-W184 PolarHBondContact O-N 3.16Å; E182-W184 PolarHBondContact O-NE1 3.32Å; E182-A207 WeakPolarHBondContact OE1-CA 3.32Å; E182-L208 PolarHBondContact OE1-N 3.36Å; E182-T210 WeakPolarHBondContact OE2-CB 3.33Å; E182-T210 PolarHBondContact OE2-OG1 2.89Å; E182-Y220 VanDerWaalsContact CD-OH 3.31Å; E182-Y220 VanDerWaalsContact CG-OH 3.28Å; E182-Y220 WeakPolarHBondContact CG-OH 3.31Å; E182-Y220 VanDerWaalsContact OE1-CE1 3.25Å; E182-Y220 WeakPolarHBondContact OE1-CE1 3.46Å; E182-Y220 VanDerWaalsContact OE1-CZ 3.31Å; E182-Y220 PolarHBondContact OE1-OH 3.42Å
183E91.8Very high95.9Very high182 Ų18258 Ų5885%0.8528%0.278SS*.  trans58.629.6-179.6-57.2176.6-170.500113.2S179S179-E183 WeakPolarHBondContact O-CA 3.47Å; S179-E183 PolarHBondContact O-N 3.09Å
184W94.9Very high95.9Very high52 Ų5257 Ų5720%0.19727%0.27CS..  trans-86.9157.9176.4-61.9-20.5000112S179 E182 H188 A189 Y192 Y205S179-W184 WeakPolarHBondContact CA-O 3.4Å; S179-W184 WeakPolarHBondContact CB-O 3.07Å; S179-W184 PolarHBondContact O-N 2.74Å; E182-W184 HydrophobicContact CB-CD2 3.55Å; E182-W184 VanDerWaalsContact CB-CE2 3.45Å; E182-W184 HydrophobicContact CB-CE3 3.93Å; E182-W184 HydrophobicContact CB-CG 3.97Å; E182-W184 HydrophobicContact CB-CH2 4.17Å; E182-W184 HydrophobicContact CB-CZ2 3.79Å; E182-W184 HydrophobicContact CB-CZ3 4.22Å; E182-W184 HydrophobicContact CG-CD2 4.35Å; E182-W184 HydrophobicContact CG-CE3 4.34Å; E182-W184 HydrophobicContact CG-CH2 3.95Å; E182-W184 HydrophobicContact CG-CZ2 3.94Å; E182-W184 HydrophobicContact CG-CZ3 4.15Å; E182-W184 VanDerWaalsContact O-CD1 3.23Å; E182-W184 PolarHBondContact O-N 3.16Å; E182-W184 PolarHBondContact O-NE1 3.32Å; W184-H188 HydrophobicContact CB-CB 4.3Å; W184-A189 HydrophobicContact CE3-CB 4.43Å; W184-Y192 HydrophobicContact CH2-CD2 4.5Å; W184-Y192 HydrophobicContact CH2-CG 4.44Å; W184-Y192 AromaticContact CZ3-CD1 3.88Å; W184-Y192 HydrophobicContact CZ3-CD1 3.88Å; W184-Y192 HydrophobicContact CZ3-CD2 4.26Å; W184-Y192 HydrophobicContact CZ3-CE1 4.45Å; W184-Y192 AromaticContact CZ3-CG 3.77Å; W184-Y192 HydrophobicContact CZ3-CG 3.77Å; W184-Y205 AromaticContact CD2-CD1 3.78Å; W184-Y205 HydrophobicContact CD2-CD1 3.78Å; W184-Y205 HydrophobicContact CD2-CE1 4.26Å; W184-Y205 AromaticContact CE2-CD1 3.67Å; W184-Y205 HydrophobicContact CE3-CD1 4.08Å; W184-Y205 HydrophobicContact CG-CD1 4.32Å; W184-Y205 HydrophobicContact CG-CE1 4.32Å; W184-Y205 HydrophobicContact CH2-CD1 4.17Å; W184-Y205 AromaticContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ3-CD1 4.26Å
185S96.9Very high96Very high56 Ų5657.5 Ų57.539%0.39227%0.273SS..  trans-62.7151.6166.681.90000110.1F187 H188 A189S185-F187 PolarHBondContact O-N 3.41Å; S185-H188 PolarHBondContact O-N 3.33Å; S185-H188 VanDerWaalsContact O-N 3.15Å; S185-H188 PolarHBondContact OG-CD2 3.41Å; S185-H188 PolarHBondContact OG-N 3.17Å; S185-A189 PolarHBondContact O-N 2.85Å
186F97.1Very high96Very high107 Ų10757.5 Ų57.547%0.46927%0.273SS..Hα-helixtrans-55.6-37.3177.3-177.2-91000111.8A175 A176 A189 Y190A175-F186 HydrophobicContact CB-CD2 4.02Å; A175-F186 HydrophobicContact CB-CE1 4.28Å; A175-F186 HydrophobicContact CB-CE2 3.58Å; A175-F186 HydrophobicContact CB-CZ 3.73Å; A176-F186 HydrophobicContact CB-CE2 4.34Å; F186-A189 PolarHBondContact O-N 3.4Å; F186-Y190 HydrophobicContact CE1-CD2 4.23Å; F186-Y190 HydrophobicContact CZ-CD2 4.46Å; F186-Y190 VanDerWaalsContact O-CB 3.24Å; F186-Y190 WeakPolarHBondContact O-CB 3.39Å; F186-Y190 PolarHBondContact O-N 3.23Å
187F97.7Very high96Very high145 Ų14555.4 Ų55.464%0.63626%0.255SS*.Hα-helixtrans-63.8-48.1177.4179.2-99.7000112.2S185 A189 Y190 Y191S185-F187 PolarHBondContact O-N 3.41Å; F187-A189 VanDerWaalsContact C-N 3.34Å; F187-A189 PolarHBondContact O-N 2.98Å; F187-Y190 PolarHBondContact O-N 3.36Å; F187-Y191 WeakPolarHBondContact O-CB 3.5Å; F187-Y191 PolarHBondContact O-N 3.18Å
188H97Very high96Very high71 Ų7156.8 Ų56.833%0.32926%0.262SS..Hα-helixtrans-64.5-39.5177.4-68-51.8000111.9W184 S185 Y190 Y191 Y192 Y205W184-H188 HydrophobicContact CB-CB 4.3Å; S185-H188 PolarHBondContact O-N 3.33Å; S185-H188 VanDerWaalsContact O-N 3.15Å; S185-H188 PolarHBondContact OG-CD2 3.41Å; S185-H188 PolarHBondContact OG-N 3.17Å; H188-Y190 VanDerWaalsContact C-N 3.34Å; H188-Y190 PolarHBondContact O-N 3.46Å; H188-Y191 PolarHBondContact O-N 3.15Å; H188-Y192 WeakPolarHBondContact O-CB 3.28Å; H188-Y192 PolarHBondContact O-N 3.15Å; H188-Y205 HydrophobicContact CB-CD1 4.39Å; H188-Y205 HydrophobicContact CB-CE1 3.78Å; H188-Y205 PolarHBondContact CE1-OH 3.31Å; H188-Y205 VanDerWaalsContact CE1-OH 3.31Å; H188-Y205 AromaticContact CG-CZ 3.68Å; H188-Y205 VanDerWaalsContact CG-OH 3.32Å; H188-Y205 AromaticContact ND1-CE2 3.98Å; H188-Y205 AromaticContact ND1-CZ 3.61Å; H188-Y205 PolarHBondContact ND1-OH 2.78Å; H188-Y205 VanDerWaalsContact ND1-OH 3.13Å
189A97.6Very high96Very high0 Ų059.3 Ų59.30%028%0.277CS..Hα-helixtrans-65.1-37.9175.100000112.2A175 F178 W184 S185 F186 F187 C193A175-A189 HydrophobicContact CB-CB 4.33Å; A175-A189 VanDerWaalsContact O-CB 3.31Å; A175-A189 WeakPolarHBondContact O-CB 3.19Å; F178-A189 HydrophobicContact CB-CB 4.18Å; W184-A189 HydrophobicContact CE3-CB 4.43Å; S185-A189 PolarHBondContact O-N 2.85Å; F186-A189 PolarHBondContact O-N 3.4Å; F187-A189 VanDerWaalsContact C-N 3.34Å; F187-A189 PolarHBondContact O-N 2.98Å; A189-C193 PolarHBondContact O-N 2.77Å; A189-C193 PolarHBondContact O-SG 3.49Å
190Y98.1Very high96.1Very high52 Ų5262.4 Ų62.420%0.20429%0.291CS..Hα-helixtrans-66.3-46.1174.7-172-80.5000111.7M168 L171 A175 F186 F187 H188 C193 F194M168-Y190 HydrophobicContact CE-CE2 4.02Å; M168-Y190 WeakPolarHBondContact CE-OH 3.5Å; M168-Y190 PolarHBondContact SD-OH 2.97Å; M168-Y190 VanDerWaalsContact SD-OH 3.38Å; L171-Y190 HydrophobicContact CB-CD2 4.19Å; L171-Y190 HydrophobicContact CB-CE2 3.51Å; L171-Y190 HydrophobicContact CD1-CE1 4.41Å; L171-Y190 HydrophobicContact CD1-CE2 4.49Å; L171-Y190 VanDerWaalsContact CD1-OH 3.29Å; L171-Y190 WeakPolarHBondContact CD1-OH 3.45Å; A175-Y190 HydrophobicContact CB-CD2 3.99Å; A175-Y190 HydrophobicContact CB-CG 4.35Å; F186-Y190 HydrophobicContact CE1-CD2 4.23Å; F186-Y190 HydrophobicContact CZ-CD2 4.46Å; F186-Y190 VanDerWaalsContact O-CB 3.24Å; F186-Y190 WeakPolarHBondContact O-CB 3.39Å; F186-Y190 PolarHBondContact O-N 3.23Å; F187-Y190 PolarHBondContact O-N 3.36Å; H188-Y190 VanDerWaalsContact C-N 3.34Å; H188-Y190 PolarHBondContact O-N 3.46Å; Y190-C193 PolarHBondContact O-N 2.89Å; Y190-F194 WeakPolarHBondContact O-CB 3.31Å; Y190-F194 PolarHBondContact O-N 3.22Å
191Y98.1Very high96.3Very high66 Ų6655.1 Ų55.126%0.25926%0.259SS..Hα-helixtrans-57.4-47.6173.8166.7-94.1000111.3F187 H188 C193 F194 I195 F202 D204 Y205F187-Y191 WeakPolarHBondContact O-CB 3.5Å; F187-Y191 PolarHBondContact O-N 3.18Å; H188-Y191 PolarHBondContact O-N 3.15Å; Y191-C193 PolarHBondContact O-N 2.82Å; Y191-F194 PolarHBondContact O-N 3.48Å; Y191-I195 HydrophobicContact CD1-CG1 4.45Å; Y191-I195 HydrophobicContact CD2-CG1 3.96Å; Y191-I195 HydrophobicContact CE1-CG1 4.1Å; Y191-I195 HydrophobicContact CE2-CD1 4.02Å; Y191-I195 HydrophobicContact CE2-CG1 3.59Å; Y191-I195 HydrophobicContact CG-CG1 4.39Å; Y191-I195 WeakPolarHBondContact O-CB 3.34Å; Y191-I195 WeakPolarHBondContact O-CG1 3.45Å; Y191-I195 PolarHBondContact O-N 2.84Å; Y191-F202 VanDerWaalsContact OH-CD2 3.31Å; Y191-F202 WeakPolarHBondContact OH-CD2 3.36Å; Y191-D204 WeakPolarHBondContact CE1-OD2 3.42Å; Y191-D204 VanDerWaalsContact CZ-OD2 3.31Å; Y191-D204 PolarHBondContact OH-OD2 3.48Å; Y191-Y205 HydrophobicContact CD1-CD2 4.1Å; Y191-Y205 HydrophobicContact CE1-CD2 4.01Å
192Y97.8Very high96.5Very high3 Ų355.8 Ų55.81%0.01226%0.264CS..Hα-helixtrans-54-51.4173.2163.4-105.9000111.5Y96 F178 W184 H188 F194 I195 T196 Y205 A207Y96-Y192 HydrophobicContact CE1-CE2 4.14Å; Y96-Y192 AromaticContact CZ-CE2 3.98Å; Y96-Y192 WeakPolarHBondContact OH-CE2 3.49Å; Y96-Y192 PolarHBondContact OH-OH 3.49Å; F178-Y192 HydrophobicContact CB-CD1 4.47Å; F178-Y192 HydrophobicContact CD1-CE1 4.08Å; F178-Y192 AromaticContact CD2-CD1 3.98Å; F178-Y192 HydrophobicContact CD2-CD1 3.98Å; F178-Y192 AromaticContact CD2-CE1 3.7Å; F178-Y192 HydrophobicContact CD2-CE1 3.7Å; F178-Y192 HydrophobicContact CE1-CE1 4.12Å; F178-Y192 HydrophobicContact CE2-CD1 4.43Å; F178-Y192 AromaticContact CE2-CE1 3.76Å; F178-Y192 HydrophobicContact CE2-CE1 3.76Å; F178-Y192 HydrophobicContact CG-CD1 4.14Å; F178-Y192 AromaticContact CG-CE1 3.89Å; F178-Y192 HydrophobicContact CG-CE1 3.89Å; F178-Y192 AromaticContact CZ-CE1 3.97Å; F178-Y192 HydrophobicContact CZ-CE1 3.97Å; W184-Y192 HydrophobicContact CH2-CD2 4.5Å; W184-Y192 HydrophobicContact CH2-CG 4.44Å; W184-Y192 AromaticContact CZ3-CD1 3.88Å; W184-Y192 HydrophobicContact CZ3-CD1 3.88Å; W184-Y192 HydrophobicContact CZ3-CD2 4.26Å; W184-Y192 HydrophobicContact CZ3-CE1 4.45Å; W184-Y192 AromaticContact CZ3-CG 3.77Å; W184-Y192 HydrophobicContact CZ3-CG 3.77Å; H188-Y192 WeakPolarHBondContact O-CB 3.28Å; H188-Y192 PolarHBondContact O-N 3.15Å; Y192-F194 VanDerWaalsContact C-N 3.3Å; Y192-F194 PolarHBondContact O-N 3.4Å; Y192-I195 PolarHBondContact O-N 2.95Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.28Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.47Å; Y192-T196 WeakPolarHBondContact O-CB 3.48Å; Y192-T196 PolarHBondContact O-N 3.46Å; Y192-T196 PolarHBondContact O-OG1 2.87Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.29Å; Y192-A207 HydrophobicContact CE1-CB 4.13Å; Y192-A207 HydrophobicContact CE2-CB 4.49Å; Y192-A207 VanDerWaalsContact OH-CB 3.27Å; Y192-A207 WeakPolarHBondContact OH-CB 3.4Å
193C98Very high96.6Very high0 Ų056.4 Ų56.40%027%0.274CS..Hα-helixtrans-60-41.6179.2-66.90000111.9L171 A175 F178 A189 Y190 Y191 T196 L197 Y227L171-C193 HydrophobicContact CD2-CB 3.91Å; A175-C193 PolarHBondContact N-SG 3.48Å; F178-C193 VanDerWaalsContact CD2-SG 3.59Å; A189-C193 PolarHBondContact O-N 2.77Å; A189-C193 PolarHBondContact O-SG 3.49Å; Y190-C193 PolarHBondContact O-N 2.89Å; Y191-C193 PolarHBondContact O-N 2.82Å; C193-T196 PolarHBondContact O-N 3.35Å; C193-L197 WeakPolarHBondContact O-CB 3.29Å; C193-L197 VanDerWaalsContact O-CG 3.28Å; C193-L197 WeakPolarHBondContact O-CG 3.49Å; C193-L197 PolarHBondContact O-N 3.2Å; C193-Y227 HydrophobicContact CB-CE1 4.47Å; C193-Y227 WeakPolarHBondContact CB-OH 3.46Å; C193-Y227 PolarHBondContact SG-OH 3.13Å
194F98Very high96.7Very high94 Ų9452 Ų5241%0.41226%0.256SS..Hα-helixtrans-63.9-52.9178.9-178.1-93.6000111.7L171 Y190 Y191 Y192 T196 L197 T198L171-F194 HydrophobicContact CD1-CD2 3.99Å; L171-F194 HydrophobicContact CD2-CB 4.24Å; Y190-F194 WeakPolarHBondContact O-CB 3.31Å; Y190-F194 PolarHBondContact O-N 3.22Å; Y191-F194 PolarHBondContact O-N 3.48Å; Y192-F194 VanDerWaalsContact C-N 3.3Å; Y192-F194 PolarHBondContact O-N 3.4Å; F194-T196 VanDerWaalsContact C-N 3.25Å; F194-T196 PolarHBondContact O-N 3Å; F194-L197 PolarHBondContact O-N 2.85Å; F194-T198 HydrophobicContact CD1-CG2 4.44Å; F194-T198 HydrophobicContact CD2-CG2 4.37Å; F194-T198 HydrophobicContact CE1-CG2 4.15Å; F194-T198 HydrophobicContact CE2-CG2 4.07Å; F194-T198 HydrophobicContact CZ-CG2 3.95Å; F194-T198 WeakPolarHBondContact O-CB 3.38Å; F194-T198 VanDerWaalsContact O-CG2 3.31Å; F194-T198 WeakPolarHBondContact O-CG2 3.14Å; F194-T198 PolarHBondContact O-N 3.49Å; F194-T198 PolarHBondContact O-OG1 2.98Å
195I97.8Very high96.7Very high11 Ų1152.4 Ų52.46%0.05626%0.258CS..Hα-helixtrans-62.2-33.8178.9-66.9-56.7000111.9Y191 Y192 T198 I200 G201 F202Y191-I195 HydrophobicContact CD1-CG1 4.45Å; Y191-I195 HydrophobicContact CD2-CG1 3.96Å; Y191-I195 HydrophobicContact CE1-CG1 4.1Å; Y191-I195 HydrophobicContact CE2-CD1 4.02Å; Y191-I195 HydrophobicContact CE2-CG1 3.59Å; Y191-I195 HydrophobicContact CG-CG1 4.39Å; Y191-I195 WeakPolarHBondContact O-CB 3.34Å; Y191-I195 WeakPolarHBondContact O-CG1 3.45Å; Y191-I195 PolarHBondContact O-N 2.84Å; Y192-I195 PolarHBondContact O-N 2.95Å; I195-T198 PolarHBondContact O-OG1 3.46Å; I195-I200 HydrophobicContact CD1-CB 4.33Å; I195-I200 HydrophobicContact CD1-CD1 3.89Å; I195-I200 HydrophobicContact CD1-CG2 4.29Å; I195-I200 HydrophobicContact CG2-CB 4.07Å; I195-I200 HydrophobicContact CG2-CG2 4.21Å; I195-I200 PolarHBondContact O-N 3.1Å; I195-G201 PolarHBondContact O-N 2.89Å; I195-G201 VanDerWaalsContact O-N 3.09Å; I195-F202 HydrophobicContact CD1-CD2 3.93Å; I195-F202 HydrophobicContact CD1-CE2 3.64Å; I195-F202 HydrophobicContact CG1-CD2 4.15Å; I195-F202 HydrophobicContact CG1-CE2 4.36Å; I195-F202 HydrophobicContact CG2-CB 4.44Å; I195-F202 HydrophobicContact CG2-CD2 3.84Å; I195-F202 HydrophobicContact CG2-CG 4.34Å
196T97.6Very high96.5Very high0 Ų050.3 Ų50.30%024%0.242CC..Hα-helixtrans-67.3-54.9175.3-61.10000112I94 Y96 Y192 C193 F194 T198 T199 I228I94-T196 HydrophobicContact CD1-CG2 4.14Å; Y96-T196 WeakPolarHBondContact OH-CB 3.24Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.33Å; Y96-T196 PolarHBondContact OH-OG1 2.8Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.28Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.47Å; Y192-T196 WeakPolarHBondContact O-CB 3.48Å; Y192-T196 PolarHBondContact O-N 3.46Å; Y192-T196 PolarHBondContact O-OG1 2.87Å; C193-T196 PolarHBondContact O-N 3.35Å; F194-T196 VanDerWaalsContact C-N 3.25Å; F194-T196 PolarHBondContact O-N 3Å; T196-T198 VanDerWaalsContact C-N 3.3Å; T196-T198 PolarHBondContact O-N 3.29Å; T196-T199 PolarHBondContact O-N 3.34Å; T196-I228 HydrophobicContact CG2-CD1 4.46Å; T196-I228 HydrophobicContact CG2-CG1 4Å
197L96.8Very high96.2Very high3 Ų345.2 Ų45.22%0.01622%0.22CC..Hα-helixtrans-78-16.5-172.4-62.2-173.7000113.3T170 L171 C193 F194 T199 Y227 L232 I235T170-L197 HydrophobicContact CG2-CD1 3.85Å; L171-L197 HydrophobicContact CD2-CD1 4.04Å; C193-L197 WeakPolarHBondContact O-CB 3.29Å; C193-L197 VanDerWaalsContact O-CG 3.28Å; C193-L197 WeakPolarHBondContact O-CG 3.49Å; C193-L197 PolarHBondContact O-N 3.2Å; F194-L197 PolarHBondContact O-N 2.85Å; L197-T199 VanDerWaalsContact C-N 3.26Å; L197-Y227 HydrophobicContact CD1-CE1 4.26Å; L197-Y227 HydrophobicContact CD2-CE1 4.29Å; L197-Y227 HydrophobicContact CG-CE1 4.38Å; L197-L232 HydrophobicContact CD2-CG 4.26Å; L197-L232 WeakPolarHBondContact O-CD2 3.33Å; L197-I235 HydrophobicContact CB-CG1 3.86Å; L197-I235 HydrophobicContact CD1-CG1 4.38Å
198T95.8Very high95.7Very high49 Ų4938.3 Ų38.330%0.30119%0.19SC..THydrogen-bonded Turntrans-86.63.2168.154.90000112.9F194 I195 T196 I200F194-T198 HydrophobicContact CD1-CG2 4.44Å; F194-T198 HydrophobicContact CD2-CG2 4.37Å; F194-T198 HydrophobicContact CE1-CG2 4.15Å; F194-T198 HydrophobicContact CE2-CG2 4.07Å; F194-T198 HydrophobicContact CZ-CG2 3.95Å; F194-T198 WeakPolarHBondContact O-CB 3.38Å; F194-T198 VanDerWaalsContact O-CG2 3.31Å; F194-T198 WeakPolarHBondContact O-CG2 3.14Å; F194-T198 PolarHBondContact O-N 3.49Å; F194-T198 PolarHBondContact O-OG1 2.98Å; I195-T198 PolarHBondContact O-OG1 3.46Å; T196-T198 VanDerWaalsContact C-N 3.3Å; T196-T198 PolarHBondContact O-N 3.29Å; T198-I200 PolarHBondContact O-N 3.13Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.44Å
199T96.4Very high95.1Very high52 Ų5236.5 Ų36.532%0.31918%0.182SC..THydrogen-bonded Turntrans55.429.4-179.7680000113.7T92 I94 T196 L197 L232T92-T199 VanDerWaalsContact O-CG2 3.22Å; T92-T199 WeakPolarHBondContact O-CG2 3.39Å; I94-T199 HydrophobicContact CG1-CG2 4.1Å; T196-T199 PolarHBondContact O-N 3.34Å; L197-T199 VanDerWaalsContact C-N 3.26Å; T199-L232 HydrophobicContact CG2-CD2 3.55Å
200I97.5Very high94.1Very high82 Ų8239.9 Ų39.942%0.42120%0.202SC..  trans-79.5-49.6172.9-64.6171.6000109.2I195 T198 F202I195-I200 HydrophobicContact CD1-CB 4.33Å; I195-I200 HydrophobicContact CD1-CD1 3.89Å; I195-I200 HydrophobicContact CD1-CG2 4.29Å; I195-I200 HydrophobicContact CG2-CB 4.07Å; I195-I200 HydrophobicContact CG2-CG2 4.21Å; I195-I200 PolarHBondContact O-N 3.1Å; T198-I200 PolarHBondContact O-N 3.13Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.44Å; I200-F202 HydrophobicContact CG2-CD1 3.89Å; I200-F202 HydrophobicContact CG2-CD2 3.98Å; I200-F202 HydrophobicContact CG2-CE1 3.55Å; I200-F202 HydrophobicContact CG2-CE2 3.68Å; I200-F202 HydrophobicContact CG2-CG 4.09Å; I200-F202 HydrophobicContact CG2-CZ 3.45Å; I200-F202 VanDerWaalsContact CG2-CZ 3.45Å
201G96.3Very high92.6Very high5 Ų546 Ų465%0.05223%0.23CC..  trans53.656.1171.100000115.8I94 Y96 I195 G203I94-G201 WeakPolarHBondContact O-CA 3.41Å; Y96-G201 VanDerWaalsContact CA-O 3.31Å; Y96-G201 WeakPolarHBondContact CA-O 3.4Å; I195-G201 PolarHBondContact O-N 2.89Å; I195-G201 VanDerWaalsContact O-N 3.09Å; G201-G203 PolarHBondContact O-N 3.07Å
202F94.9Very high91.2Very high131 Ų13143.5 Ų43.558%0.57522%0.224SC*.  trans-56.7-34.3178.8-67.1-53.7000114.3Y191 I195 I200Y191-F202 VanDerWaalsContact OH-CD2 3.31Å; Y191-F202 WeakPolarHBondContact OH-CD2 3.36Å; I195-F202 HydrophobicContact CD1-CD2 3.93Å; I195-F202 HydrophobicContact CD1-CE2 3.64Å; I195-F202 HydrophobicContact CG1-CD2 4.15Å; I195-F202 HydrophobicContact CG1-CE2 4.36Å; I195-F202 HydrophobicContact CG2-CB 4.44Å; I195-F202 HydrophobicContact CG2-CD2 3.84Å; I195-F202 HydrophobicContact CG2-CG 4.34Å; I200-F202 HydrophobicContact CG2-CD1 3.89Å; I200-F202 HydrophobicContact CG2-CD2 3.98Å; I200-F202 HydrophobicContact CG2-CE1 3.55Å; I200-F202 HydrophobicContact CG2-CE2 3.68Å; I200-F202 HydrophobicContact CG2-CG 4.09Å; I200-F202 HydrophobicContact CG2-CZ 3.45Å; I200-F202 VanDerWaalsContact CG2-CZ 3.45Å
203G93Very high90.3Very high24 Ų2443.7 Ų43.725%0.24723%0.226CC..SBendtrans86.44.6178.300000115.3Y96 G201 Y205 V206Y96-G203 VanDerWaalsContact O-CA 3.25Å; Y96-G203 WeakPolarHBondContact O-CA 3.43Å; G201-G203 PolarHBondContact O-N 3.07Å; G203-Y205 VanDerWaalsContact C-N 3.35Å; G203-V206 WeakPolarHBondContact O-CG2 3.33Å
204D93Very high89.4Confident89 Ų8944.1 Ų44.148%0.47623%0.229SC..SBendtrans-63.2-39.5168.755.3-15.1000112.1Y191Y191-D204 WeakPolarHBondContact CE1-OD2 3.42Å; Y191-D204 VanDerWaalsContact CZ-OD2 3.31Å; Y191-D204 PolarHBondContact OH-OD2 3.48Å
205Y94.2Very high88.4Confident60 Ų6044.4 Ų44.424%0.23523%0.231CC..SBendtrans-117.7124.2168.3-71.8-92.9000110.1W184 H188 Y191 Y192 G203W184-Y205 AromaticContact CD2-CD1 3.78Å; W184-Y205 HydrophobicContact CD2-CD1 3.78Å; W184-Y205 HydrophobicContact CD2-CE1 4.26Å; W184-Y205 AromaticContact CE2-CD1 3.67Å; W184-Y205 HydrophobicContact CE3-CD1 4.08Å; W184-Y205 HydrophobicContact CG-CD1 4.32Å; W184-Y205 HydrophobicContact CG-CE1 4.32Å; W184-Y205 HydrophobicContact CH2-CD1 4.17Å; W184-Y205 AromaticContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ3-CD1 4.26Å; H188-Y205 HydrophobicContact CB-CD1 4.39Å; H188-Y205 HydrophobicContact CB-CE1 3.78Å; H188-Y205 PolarHBondContact CE1-OH 3.31Å; H188-Y205 VanDerWaalsContact CE1-OH 3.31Å; H188-Y205 AromaticContact CG-CZ 3.68Å; H188-Y205 VanDerWaalsContact CG-OH 3.32Å; H188-Y205 AromaticContact ND1-CE2 3.98Å; H188-Y205 AromaticContact ND1-CZ 3.61Å; H188-Y205 PolarHBondContact ND1-OH 2.78Å; H188-Y205 VanDerWaalsContact ND1-OH 3.13Å; Y191-Y205 HydrophobicContact CD1-CD2 4.1Å; Y191-Y205 HydrophobicContact CE1-CD2 4.01Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.29Å; G203-Y205 VanDerWaalsContact C-N 3.35Å
206V93.1Very high87.6Confident12 Ų1251.5 Ų51.57%0.07326%0.262CS..  trans-138.5119.2178.5-173.60000109.8Y85 Y96 H98 G203 Q209Y85-V206 HydrophobicContact CE1-CG1 4.05Å; Y96-V206 HydrophobicContact CD1-CG2 4.14Å; Y96-V206 HydrophobicContact CD2-CG1 4.17Å; Y96-V206 HydrophobicContact CG-CG1 4.37Å; Y96-V206 HydrophobicContact CG-CG2 4.03Å; H98-V206 HydrophobicContact CB-CG1 4.4Å; H98-V206 HydrophobicContact CB-CG2 4.2Å; G203-V206 WeakPolarHBondContact O-CG2 3.33Å; V206-Q209 HydrophobicContact CB-CG 3.78Å; V206-Q209 HydrophobicContact CG1-CG 3.72Å
207A91.6Very high87.2Confident0 Ų056.6 Ų56.60%028%0.284CS..THydrogen-bonded Turntrans-64.8159.4174.800000111.3F178 E182 Y192 Q209F178-A207 HydrophobicContact CD1-CB 3.99Å; F178-A207 HydrophobicContact CE1-CB 3.78Å; E182-A207 WeakPolarHBondContact OE1-CA 3.32Å; Y192-A207 HydrophobicContact CE1-CB 4.13Å; Y192-A207 HydrophobicContact CE2-CB 4.49Å; Y192-A207 VanDerWaalsContact OH-CB 3.27Å; Y192-A207 WeakPolarHBondContact OH-CB 3.4Å; A207-Q209 PolarHBondContact O-N 2.91Å
208L87.1Confident86.7Confident1 Ų161 Ų611%0.00531%0.313CS..THydrogen-bonded Turntrans69.76.4177.3-47.4167.3000115.3E182 L214 Y220 V221 F225E182-L208 PolarHBondContact OE1-N 3.36Å; L208-L214 HydrophobicContact CB-CD1 3.44Å; L208-L214 VanDerWaalsContact CB-CD1 3.44Å; L208-L214 HydrophobicContact CD1-CD1 3.86Å; L208-L214 HydrophobicContact CG-CD1 4.21Å; L208-Y220 HydrophobicContact CD2-CD1 3.39Å; L208-Y220 HydrophobicContact CD2-CE1 3.35Å; L208-Y220 HydrophobicContact CD2-CE2 4.48Å; L208-Y220 HydrophobicContact CD2-CG 4.01Å; L208-Y220 HydrophobicContact CG-CE1 4.29Å; L208-V221 HydrophobicContact CD1-CG2 4.48Å; L208-V221 HydrophobicContact CD2-CB 4.4Å; L208-V221 HydrophobicContact CD2-CG2 3.88Å; L208-F225 HydrophobicContact CD1-CE1 3.91Å
209Q83.4Confident86.4Confident33 Ų3366 Ų6615%0.15434%0.337CS..  trans-85.7-15.7177-63.2-55.5-58.900113.5A74 H98 V206 A207 K211A74-Q209 WeakPolarHBondContact CA-O 3.38Å; A74-Q209 HydrophobicContact CB-CB 4.12Å; A74-Q209 WeakPolarHBondContact CB-O 3.38Å; H98-Q209 PolarHBondContact CD2-NE2 3.09Å; V206-Q209 HydrophobicContact CB-CG 3.78Å; V206-Q209 HydrophobicContact CG1-CG 3.72Å; A207-Q209 PolarHBondContact O-N 2.91Å; Q209-K211 PolarHBondContact O-N 3.35Å
210T76.9Confident86.2Confident70 Ų7063.9 Ų63.943%0.42932%0.323SS..G310 helixtrans-73.7114.9-175-55.80000112.7E182 G212 A213E182-T210 WeakPolarHBondContact OE2-CB 3.33Å; E182-T210 PolarHBondContact OE2-OG1 2.89Å; T210-G212 VanDerWaalsContact C-N 3.29Å; T210-G212 PolarHBondContact O-N 3.26Å; T210-A213 VanDerWaalsContact O-CB 3.29Å; T210-A213 WeakPolarHBondContact O-CB 3.17Å; T210-A213 PolarHBondContact O-N 2.76Å
211K67.6Low85.9Confident180 Ų18060.4 Ų60.478%0.78331%0.306SS*.G310 helixtrans49.436.4166.1-62.6177.9-178.9168.70115.9Q209 K216Q209-K211 PolarHBondContact O-N 3.35Å; K211-K216 PolarHBondContact O-NZ 3.4Å
212G68.3Low85.8Confident14 Ų1462.6 Ų62.614%0.14432%0.323CS..G310 helixtrans76.627.7-179.400000114.3A74 T210 L214 Q215 K216A74-G212 PolarHBondContact O-N 3.22Å; T210-G212 VanDerWaalsContact C-N 3.29Å; T210-G212 PolarHBondContact O-N 3.26Å; G212-L214 PolarHBondContact O-N 3.07Å; G212-L214 VanDerWaalsContact O-N 3.17Å; G212-Q215 PolarHBondContact O-N 2.8Å; G212-K216 PolarHBondContact O-N 3.44Å; G212-K216 VanDerWaalsContact O-N 3.08Å
213A78.5Confident85.8Confident7 Ų759.7 Ų59.76%0.05831%0.31CS..Hα-helixtrans-49.6-37174.500000112.5T210 Q215 K216 K217 Y220T210-A213 VanDerWaalsContact O-CB 3.29Å; T210-A213 WeakPolarHBondContact O-CB 3.17Å; T210-A213 PolarHBondContact O-N 2.76Å; A213-Q215 PolarHBondContact O-N 3.22Å; A213-Q215 VanDerWaalsContact O-N 3.1Å; A213-K216 PolarHBondContact O-N 2.91Å; A213-K217 PolarHBondContact O-N 3.33Å; A213-Y220 HydrophobicContact CB-CD1 4.49Å
214L79Confident85.8Confident9 Ų958.5 Ų58.55%0.04730%0.299CS..Hα-helixtrans-51.2-32.2175.6-137.668.8000114.3A81 L208 G212A81-L214 HydrophobicContact CB-CG 4.44Å; L208-L214 HydrophobicContact CB-CD1 3.44Å; L208-L214 VanDerWaalsContact CB-CD1 3.44Å; L208-L214 HydrophobicContact CD1-CD1 3.86Å; L208-L214 HydrophobicContact CG-CD1 4.21Å; G212-L214 PolarHBondContact O-N 3.07Å; G212-L214 VanDerWaalsContact O-N 3.17Å
215Q77.4Confident85.9Confident100 Ų10055 Ų5547%0.46728%0.279SS..Hα-helixtrans-103.8-32.2179.7-56.9-55.2-51.300112.7G212 A213G212-Q215 PolarHBondContact O-N 2.8Å; A213-Q215 PolarHBondContact O-N 3.22Å; A213-Q215 VanDerWaalsContact O-N 3.1Å
216K81.9Confident85.9Confident160 Ų16057.3 Ų57.370%0.69629%0.293SS*.Hα-helixtrans-89.6-23.4-171-67.4176.9-178.61670114K211 G212 A213K211-K216 PolarHBondContact O-NZ 3.4Å; G212-K216 PolarHBondContact O-N 3.44Å; G212-K216 VanDerWaalsContact O-N 3.08Å; A213-K216 PolarHBondContact O-N 2.91Å
217K87.5Confident86.1Confident108 Ų10857.7 Ų57.747%0.4729%0.294SS..  trans-127.771.3-172.1-62.8-174.7178.7179.50111.7A213 L219 Y220 V221A213-K217 PolarHBondContact O-N 3.33Å; K217-L219 VanDerWaalsContact C-N 3.3Å; K217-L219 PolarHBondContact O-N 2.97Å; K217-Y220 PolarHBondContact O-N 2.92Å; K217-Y220 VanDerWaalsContact O-N 3.1Å; K217-V221 WeakPolarHBondContact O-CG2 3.39Å; K217-V221 PolarHBondContact O-N 3.27Å; K217-V221 VanDerWaalsContact O-N 3.11Å
218P87.9Confident86.3Confident96 Ų9657.7 Ų57.762%0.62329%0.294SS*.Hα-helixtrans-61.8-33-17524.4-34.4000113.9Y220 V221 A222P218-Y220 VanDerWaalsContact C-N 3.35Å; P218-V221 PolarHBondContact O-N 3.03Å; P218-A222 WeakPolarHBondContact O-CB 3.33Å; P218-A222 PolarHBondContact O-N 3.18Å
219L89.7Confident86.7Confident152 Ų15259.9 Ų59.980%0.79631%0.305SS*.Hα-helixtrans-65.2-38.6175.7-67.1177.6000112.2K217 A222 F223K217-L219 VanDerWaalsContact C-N 3.3Å; K217-L219 PolarHBondContact O-N 2.97Å; L219-A222 PolarHBondContact O-N 3.47Å; L219-F223 WeakPolarHBondContact O-CB 3.15Å; L219-F223 PolarHBondContact O-N 2.84Å
220Y91.6Very high87.2Confident8 Ų862.6 Ų62.63%0.03132%0.324CS..Hα-helixtrans-70.3-38.3177.6175.7-133.4000111.7F178 Y181 E182 L208 A213 K217 P218 F223 S224F178-Y220 HydrophobicContact CD1-CE2 4.19Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.39Å; F178-Y220 HydrophobicContact CE1-CE2 4.02Å; Y181-Y220 HydrophobicContact CD1-CD2 4.01Å; Y181-Y220 HydrophobicContact CD1-CE2 4.34Å; Y181-Y220 HydrophobicContact CD1-CG 4.31Å; Y181-Y220 AromaticContact CD2-CD2 3.8Å; Y181-Y220 HydrophobicContact CD2-CD2 3.8Å; Y181-Y220 AromaticContact CD2-CE2 3.72Å; Y181-Y220 HydrophobicContact CD2-CE2 3.72Å; Y181-Y220 HydrophobicContact CE1-CD2 4.39Å; Y181-Y220 HydrophobicContact CE2-CD2 4.2Å; Y181-Y220 AromaticContact CG-CD2 3.71Å; Y181-Y220 HydrophobicContact CG-CD2 3.71Å; Y181-Y220 AromaticContact CG-CE2 3.63Å; Y181-Y220 HydrophobicContact CG-CE2 3.63Å; Y181-Y220 HydrophobicContact CG-CG 4.39Å; E182-Y220 VanDerWaalsContact CD-OH 3.31Å; E182-Y220 VanDerWaalsContact CG-OH 3.28Å; E182-Y220 WeakPolarHBondContact CG-OH 3.31Å; E182-Y220 VanDerWaalsContact OE1-CE1 3.25Å; E182-Y220 WeakPolarHBondContact OE1-CE1 3.46Å; E182-Y220 VanDerWaalsContact OE1-CZ 3.31Å; E182-Y220 PolarHBondContact OE1-OH 3.42Å; L208-Y220 HydrophobicContact CD2-CD1 3.39Å; L208-Y220 HydrophobicContact CD2-CE1 3.35Å; L208-Y220 HydrophobicContact CD2-CE2 4.48Å; L208-Y220 HydrophobicContact CD2-CG 4.01Å; L208-Y220 HydrophobicContact CG-CE1 4.29Å; A213-Y220 HydrophobicContact CB-CD1 4.49Å; K217-Y220 PolarHBondContact O-N 2.92Å; K217-Y220 VanDerWaalsContact O-N 3.1Å; P218-Y220 VanDerWaalsContact C-N 3.35Å; Y220-F223 HydrophobicContact CD2-CD1 4.19Å; Y220-F223 HydrophobicContact CE2-CD1 4.33Å; Y220-F223 PolarHBondContact O-N 3.45Å; Y220-S224 WeakPolarHBondContact CE2-OG 3.29Å; Y220-S224 WeakPolarHBondContact O-CB 3.46Å; Y220-S224 PolarHBondContact O-N 3.2Å; Y220-S224 PolarHBondContact O-OG 3.29Å
221V91.7Very high88.2Confident9 Ų959.3 Ų59.36%0.05530%0.304CS..Hα-helixtrans-58.4-50.8171.7174.40000110.5A81 L208 K217 P218 F223 S224 F225A81-V221 HydrophobicContact CB-CG1 4.42Å; L208-V221 HydrophobicContact CD1-CG2 4.48Å; L208-V221 HydrophobicContact CD2-CB 4.4Å; L208-V221 HydrophobicContact CD2-CG2 3.88Å; K217-V221 WeakPolarHBondContact O-CG2 3.39Å; K217-V221 PolarHBondContact O-N 3.27Å; K217-V221 VanDerWaalsContact O-N 3.11Å; P218-V221 PolarHBondContact O-N 3.03Å; V221-F223 PolarHBondContact O-N 3.02Å; V221-S224 PolarHBondContact O-N 3.38Å; V221-F225 HydrophobicContact CG1-CD2 4.01Å; V221-F225 HydrophobicContact CG1-CE1 4.04Å; V221-F225 HydrophobicContact CG1-CE2 3.31Å; V221-F225 HydrophobicContact CG1-CZ 3.33Å; V221-F225 WeakPolarHBondContact O-CG 2.92Å; V221-F225 PolarHBondContact O-N 2.95Å
222A92.8Very high89.5Confident51 Ų5151.3 Ų51.342%0.42127%0.269SS..Hα-helixtrans-61.5-44.5178.800000112.2P218 L219 S224 F225 M226P218-A222 WeakPolarHBondContact O-CB 3.33Å; P218-A222 PolarHBondContact O-N 3.18Å; L219-A222 PolarHBondContact O-N 3.47Å; A222-S224 VanDerWaalsContact C-N 3.33Å; A222-S224 PolarHBondContact O-N 2.89Å; A222-F225 PolarHBondContact O-N 3.16Å; A222-M226 WeakPolarHBondContact O-CB 3.25Å; A222-M226 WeakPolarHBondContact O-CG 3.48Å; A222-M226 PolarHBondContact O-N 3.33Å
223F94.6Very high90.7Very high70 Ų7051.6 Ų51.631%0.30727%0.268SS..Hα-helixtrans-56-47.4173.8167.9-97.4000111.7A177 F178 L219 Y220 V221 F225 M226 Y227A177-F223 HydrophobicContact CB-CE1 3.73Å; A177-F223 HydrophobicContact CB-CE2 4.49Å; A177-F223 HydrophobicContact CB-CZ 3.43Å; A177-F223 VanDerWaalsContact CB-CZ 3.43Å; F178-F223 HydrophobicContact CE1-CE1 4.32Å; F178-F223 HydrophobicContact CZ-CE1 4.13Å; L219-F223 WeakPolarHBondContact O-CB 3.15Å; L219-F223 PolarHBondContact O-N 2.84Å; Y220-F223 HydrophobicContact CD2-CD1 4.19Å; Y220-F223 HydrophobicContact CE2-CD1 4.33Å; Y220-F223 PolarHBondContact O-N 3.45Å; V221-F223 PolarHBondContact O-N 3.02Å; F223-F225 PolarHBondContact O-N 3.26Å; F223-M226 PolarHBondContact O-N 3.38Å; F223-Y227 WeakPolarHBondContact O-CB 3.39Å; F223-Y227 PolarHBondContact O-N 3.35Å
224S94.4Very high91.5Very high0 Ų051.8 Ų51.80%027%0.269CS..Hα-helixtrans-63.5-42.7-178.4-590000112Y220 V221 A222 Y227 I228Y220-S224 WeakPolarHBondContact CE2-OG 3.29Å; Y220-S224 WeakPolarHBondContact O-CB 3.46Å; Y220-S224 PolarHBondContact O-N 3.2Å; Y220-S224 PolarHBondContact O-OG 3.29Å; V221-S224 PolarHBondContact O-N 3.38Å; A222-S224 VanDerWaalsContact C-N 3.33Å; A222-S224 PolarHBondContact O-N 2.89Å; S224-Y227 PolarHBondContact O-N 3.09Å; S224-I228 WeakPolarHBondContact O-CG1 3.48Å; S224-I228 PolarHBondContact O-N 2.84Å
225F94.7Very high92.2Very high16 Ų1652.6 Ų52.67%0.0727%0.273CS..Hα-helixtrans-65.4-44.3176.4-62-14.6000111.9A81 F84 Y85 I88 L208 V221 A222 F223 Y227 I228 L229A81-F225 WeakPolarHBondContact O-CZ 3.24Å; F84-F225 AromaticContact CD1-CD2 3.58Å; F84-F225 HydrophobicContact CD1-CD2 3.58Å; F84-F225 AromaticContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CE2 3.41Å; F84-F225 VanDerWaalsContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CG 4.38Å; F84-F225 HydrophobicContact CD1-CZ 4.09Å; F84-F225 AromaticContact CE1-CD2 3.69Å; F84-F225 HydrophobicContact CE1-CD2 3.69Å; F84-F225 HydrophobicContact CE1-CE2 4.03Å; F84-F225 HydrophobicContact CE1-CG 4.35Å; F84-F225 HydrophobicContact CG-CE2 4.42Å; Y85-F225 AromaticContact CD2-CD1 4Å; Y85-F225 HydrophobicContact CD2-CD1 4Å; Y85-F225 AromaticContact CD2-CE1 3.45Å; Y85-F225 HydrophobicContact CD2-CE1 3.45Å; Y85-F225 VanDerWaalsContact CD2-CE1 3.45Å; Y85-F225 HydrophobicContact CD2-CZ 4.45Å; Y85-F225 HydrophobicContact CE2-CE1 4.34Å; Y85-F225 AromaticContact CG-CE1 3.74Å; Y85-F225 HydrophobicContact CG-CE1 3.74Å; Y85-F225 HydrophobicContact CG-CZ 4.39Å; I88-F225 HydrophobicContact CD1-CB 4Å; I88-F225 HydrophobicContact CD1-CD1 3.85Å; I88-F225 HydrophobicContact CD1-CD2 4.28Å; I88-F225 HydrophobicContact CD1-CE1 4.43Å; I88-F225 HydrophobicContact CD1-CG 3.78Å; L208-F225 HydrophobicContact CD1-CE1 3.91Å; V221-F225 HydrophobicContact CG1-CD2 4.01Å; V221-F225 HydrophobicContact CG1-CE1 4.04Å; V221-F225 HydrophobicContact CG1-CE2 3.31Å; V221-F225 HydrophobicContact CG1-CZ 3.33Å; V221-F225 WeakPolarHBondContact O-CG 2.92Å; V221-F225 PolarHBondContact O-N 2.95Å; A222-F225 PolarHBondContact O-N 3.16Å; F223-F225 PolarHBondContact O-N 3.26Å; F225-Y227 VanDerWaalsContact C-N 3.33Å; F225-Y227 PolarHBondContact O-N 3.44Å; F225-I228 PolarHBondContact O-N 3.04Å; F225-L229 WeakPolarHBondContact O-CG 3.46Å; F225-L229 PolarHBondContact O-N 2.96Å
226M94.9Very high92.9Very high108 Ų10848.7 Ų48.753%0.53226%0.26SS..Hα-helixtrans-63.5-41176.4-71.5-61104.200111.6A222 F223 L229 V230A222-M226 WeakPolarHBondContact O-CB 3.25Å; A222-M226 WeakPolarHBondContact O-CG 3.48Å; A222-M226 PolarHBondContact O-N 3.33Å; F223-M226 PolarHBondContact O-N 3.38Å; M226-L229 HydrophobicContact CE-CD1 3.87Å; M226-L229 PolarHBondContact O-N 3.3Å; M226-V230 WeakPolarHBondContact O-CB 3.4Å; M226-V230 VanDerWaalsContact O-CG2 3.29Å; M226-V230 WeakPolarHBondContact O-CG2 3.3Å; M226-V230 PolarHBondContact O-N 3.46Å
227Y97Very high93.4Very high19 Ų1941.3 Ų41.38%0.07523%0.228CC..Hα-helixtrans-59-48.4176.2177.2-94.4000111.5T170 F178 C193 L197 F223 S224 F225 G231T170-Y227 HydrophobicContact CG2-CE2 4.21Å; T170-Y227 WeakPolarHBondContact O-CE2 3.31Å; T170-Y227 PolarHBondContact O-OH 2.85Å; F178-Y227 AromaticContact CE2-CD1 3.53Å; F178-Y227 HydrophobicContact CE2-CD1 3.53Å; F178-Y227 AromaticContact CE2-CE1 3.73Å; F178-Y227 HydrophobicContact CE2-CE1 3.73Å; F178-Y227 HydrophobicContact CE2-CG 4Å; F178-Y227 AromaticContact CZ-CD1 3.94Å; F178-Y227 HydrophobicContact CZ-CD1 3.94Å; F178-Y227 HydrophobicContact CZ-CG 4.29Å; C193-Y227 HydrophobicContact CB-CE1 4.47Å; C193-Y227 WeakPolarHBondContact CB-OH 3.46Å; C193-Y227 PolarHBondContact SG-OH 3.13Å; L197-Y227 HydrophobicContact CD1-CE1 4.26Å; L197-Y227 HydrophobicContact CD2-CE1 4.29Å; L197-Y227 HydrophobicContact CG-CE1 4.38Å; F223-Y227 WeakPolarHBondContact O-CB 3.39Å; F223-Y227 PolarHBondContact O-N 3.35Å; S224-Y227 PolarHBondContact O-N 3.09Å; F225-Y227 VanDerWaalsContact C-N 3.33Å; F225-Y227 PolarHBondContact O-N 3.44Å; Y227-G231 WeakPolarHBondContact O-CA 3.15Å; Y227-G231 PolarHBondContact O-N 3.48Å
228I96.3Very high93.7Very high0 Ų038.4 Ų38.40%022%0.216CC..Hα-helixtrans-61.2-48.8178.9-68.2167.8000110.5Y85 I88 I94 T196 S224 F225 G231 L232Y85-I228 HydrophobicContact CE2-CD1 3.87Å; I88-I228 HydrophobicContact CG2-CG2 4.11Å; I94-I228 HydrophobicContact CD1-CG2 3.73Å; T196-I228 HydrophobicContact CG2-CD1 4.46Å; T196-I228 HydrophobicContact CG2-CG1 4Å; S224-I228 WeakPolarHBondContact O-CG1 3.48Å; S224-I228 PolarHBondContact O-N 2.84Å; F225-I228 PolarHBondContact O-N 3.04Å; I228-G231 PolarHBondContact O-N 3.35Å; I228-L232 HydrophobicContact CG2-CD1 3.82Å; I228-L232 HydrophobicContact CG2-CG 4.38Å; I228-L232 VanDerWaalsContact O-CB 3.29Å; I228-L232 WeakPolarHBondContact O-CB 3.44Å; I228-L232 VanDerWaalsContact O-CG 3.24Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.33Å
229L94.3Very high93.8Very high48 Ų4838 Ų3825%0.25121%0.208SC..Hα-helixtrans-65.6-45.2-177.5-67.7173.9000112.7F125 F225 M226 T233F125-L229 HydrophobicContact CZ-CD2 4.5Å; F225-L229 WeakPolarHBondContact O-CG 3.46Å; F225-L229 PolarHBondContact O-N 2.96Å; M226-L229 HydrophobicContact CE-CD1 3.87Å; M226-L229 PolarHBondContact O-N 3.3Å; L229-T233 PolarHBondContact O-N 2.93Å; L229-T233 VanDerWaalsContact O-N 3.13Å; L229-T233 PolarHBondContact O-OG1 2.89Å
230V95.1Very high93.7Very high89 Ų8932.1 Ų32.154%0.53918%0.177SC..Hα-helixtrans-68.9-43.4177.8173.60000110.4M226 T233 V234M226-V230 WeakPolarHBondContact O-CB 3.4Å; M226-V230 VanDerWaalsContact O-CG2 3.29Å; M226-V230 WeakPolarHBondContact O-CG2 3.3Å; M226-V230 PolarHBondContact O-N 3.46Å; V230-T233 WeakPolarHBondContact O-CA 3.45Å; V230-T233 WeakPolarHBondContact O-CB 3.46Å; V230-T233 PolarHBondContact O-N 3.38Å; V230-T233 VanDerWaalsContact O-N 3.1Å; V230-V234 WeakPolarHBondContact O-CG2 3.37Å; V230-V234 PolarHBondContact O-N 2.94Å
231G96.2Very high93.5Very high1 Ų133.5 Ų33.51%0.0119%0.185CC..Hα-helixtrans-62-45.2179.500000112.4Y227 I228 T233 V234 I235Y227-G231 WeakPolarHBondContact O-CA 3.15Å; Y227-G231 PolarHBondContact O-N 3.48Å; I228-G231 PolarHBondContact O-N 3.35Å; G231-T233 PolarHBondContact O-N 2.91Å; G231-V234 WeakPolarHBondContact O-CB 3.34Å; G231-V234 PolarHBondContact O-N 2.86Å; G231-I235 WeakPolarHBondContact O-CG1 3.46Å; G231-I235 PolarHBondContact O-N 2.91Å
232L95.1Very high93.3Very high12 Ų1235.2 Ų35.26%0.06320%0.195CC..Hα-helixtrans-62.1-33.8173.6-75.2173.4000111.8T92 I94 F125 L197 T199 I228 G236T92-L232 HydrophobicContact CG2-CD1 3.56Å; I94-L232 HydrophobicContact CD1-CD1 4.27Å; F125-L232 HydrophobicContact CE1-CB 3.81Å; F125-L232 HydrophobicContact CE2-CB 4Å; F125-L232 HydrophobicContact CE2-CD1 3.96Å; F125-L232 HydrophobicContact CZ-CB 3.51Å; F125-L232 HydrophobicContact CZ-CD1 3.75Å; F125-L232 HydrophobicContact CZ-CG 4.3Å; L197-L232 HydrophobicContact CD2-CG 4.26Å; L197-L232 WeakPolarHBondContact O-CD2 3.33Å; T199-L232 HydrophobicContact CG2-CD2 3.55Å; I228-L232 HydrophobicContact CG2-CD1 3.82Å; I228-L232 HydrophobicContact CG2-CG 4.38Å; I228-L232 VanDerWaalsContact O-CB 3.29Å; I228-L232 WeakPolarHBondContact O-CB 3.44Å; I228-L232 VanDerWaalsContact O-CG 3.24Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.33Å; L232-G236 WeakPolarHBondContact O-CA 3.49Å; L232-G236 PolarHBondContact O-N 3.5Å
233T94.3Very high92.8Very high20 Ų2035.7 Ų35.712%0.12319%0.193CC..Hα-helixtrans-66.8-37.9173.8-54.10000111.5F125 L128 M132 L229 V230 G231 A237F125-T233 WeakPolarHBondContact CE1-OG1 3.1Å; L128-T233 HydrophobicContact CB-CG2 3.71Å; L128-T233 HydrophobicContact CD1-CG2 4.48Å; M132-T233 HydrophobicContact CE-CG2 3.86Å; M132-T233 VanDerWaalsContact CE-O 3.31Å; M132-T233 WeakPolarHBondContact CE-O 3.31Å; L229-T233 PolarHBondContact O-N 2.93Å; L229-T233 VanDerWaalsContact O-N 3.13Å; L229-T233 PolarHBondContact O-OG1 2.89Å; V230-T233 WeakPolarHBondContact O-CA 3.45Å; V230-T233 WeakPolarHBondContact O-CB 3.46Å; V230-T233 PolarHBondContact O-N 3.38Å; V230-T233 VanDerWaalsContact O-N 3.1Å; G231-T233 PolarHBondContact O-N 2.91Å; T233-A237 VanDerWaalsContact O-CB 3.25Å; T233-A237 WeakPolarHBondContact O-CB 3.22Å; T233-A237 PolarHBondContact O-N 3.09Å
234V95.4Very high91.8Very high12 Ų1235.4 Ų35.47%0.07319%0.194CC..Hα-helixtrans-66.1-50.81761740000111.3M132 V230 G231 G236 A237 F238M132-V234 VanDerWaalsContact CE-CA 3.41Å; M132-V234 HydrophobicContact CE-CB 4.13Å; M132-V234 HydrophobicContact CE-CG2 3.69Å; M132-V234 HydrophobicContact SD-CG2 4.47Å; V230-V234 WeakPolarHBondContact O-CG2 3.37Å; V230-V234 PolarHBondContact O-N 2.94Å; G231-V234 WeakPolarHBondContact O-CB 3.34Å; G231-V234 PolarHBondContact O-N 2.86Å; V234-G236 VanDerWaalsContact C-N 3.33Å; V234-G236 PolarHBondContact O-N 3.09Å; V234-A237 PolarHBondContact O-N 3.34Å; V234-F238 PolarHBondContact O-N 2.95Å; V234-F238 VanDerWaalsContact O-N 3.09Å
235I94.1Very high90.6Very high26 Ų2642.8 Ų42.813%0.13322%0.222CC..Hα-helixtrans-62.5-44.5176.8-59.4-49.4000110.1C167 L197 G231 A237 F238 L239C167-I235 HydrophobicContact CB-CD1 3.77Å; L197-I235 HydrophobicContact CB-CG1 3.86Å; L197-I235 HydrophobicContact CD1-CG1 4.38Å; G231-I235 WeakPolarHBondContact O-CG1 3.46Å; G231-I235 PolarHBondContact O-N 2.91Å; I235-A237 VanDerWaalsContact C-N 3.34Å; I235-A237 PolarHBondContact O-N 3.06Å; I235-F238 WeakPolarHBondContact O-CB 3.35Å; I235-F238 PolarHBondContact O-N 2.84Å; I235-F238 VanDerWaalsContact O-N 3.15Å; I235-L239 HydrophobicContact CG2-CD1 4.02Å; I235-L239 HydrophobicContact CG2-CG 4.23Å; I235-L239 WeakPolarHBondContact O-CG 3.43Å; I235-L239 PolarHBondContact O-N 2.93Å
236G92.5Very high89.6Confident18 Ų1848.3 Ų48.319%0.18625%0.246CC..Hα-helixtrans-59.8-39.8176.200000113.2L232 V234 L239 N240L232-G236 WeakPolarHBondContact O-CA 3.49Å; L232-G236 PolarHBondContact O-N 3.5Å; V234-G236 VanDerWaalsContact C-N 3.33Å; V234-G236 PolarHBondContact O-N 3.09Å; G236-L239 PolarHBondContact O-N 3.43Å; G236-N240 WeakPolarHBondContact O-CB 3.43Å; G236-N240 PolarHBondContact O-N 3.47Å
237A92.4Very high88.7Confident4 Ų448.6 Ų48.63%0.03325%0.249CC..Hα-helixtrans-63.8-40.9174.600000112.1M132 N133 T233 V234 I235 N240 L241M132-A237 HydrophobicContact CB-CB 4.45Å; M132-A237 HydrophobicContact CE-CB 3.68Å; N133-A237 PolarHBondContact ND2-O 2.94Å; T233-A237 VanDerWaalsContact O-CB 3.25Å; T233-A237 WeakPolarHBondContact O-CB 3.22Å; T233-A237 PolarHBondContact O-N 3.09Å; V234-A237 PolarHBondContact O-N 3.34Å; I235-A237 VanDerWaalsContact C-N 3.34Å; I235-A237 PolarHBondContact O-N 3.06Å; A237-N240 PolarHBondContact O-N 3.26Å; A237-L241 PolarHBondContact O-N 3.48Å
238F92.9Very high87.7Confident48 Ų4850.6 Ų50.621%0.21126%0.264CS..Hα-helixtrans-67.5-45.5176.4-177.6-107.5000112V160 F164 V234 I235 N240 L241 V242V160-F238 HydrophobicContact CG1-CE2 4.27Å; F164-F238 HydrophobicContact CB-CE2 4.36Å; V234-F238 PolarHBondContact O-N 2.95Å; V234-F238 VanDerWaalsContact O-N 3.09Å; I235-F238 WeakPolarHBondContact O-CB 3.35Å; I235-F238 PolarHBondContact O-N 2.84Å; I235-F238 VanDerWaalsContact O-N 3.15Å; F238-N240 VanDerWaalsContact C-N 3.32Å; F238-N240 PolarHBondContact O-N 3.04Å; F238-L241 WeakPolarHBondContact O-CB 3.41Å; F238-L241 PolarHBondContact O-N 3.29Å; F238-V242 HydrophobicContact CD2-CG2 4.42Å; F238-V242 HydrophobicContact CE1-CG2 4.34Å; F238-V242 HydrophobicContact CE2-CG2 4.04Å; F238-V242 HydrophobicContact CZ-CG2 3.99Å; F238-V242 PolarHBondContact O-N 2.86Å
239L90.3Very high86.5Confident88 Ų8854.5 Ų54.546%0.46128%0.283SS..Hα-helixtrans-61.1-41.4174.1-68.2177.7000111.3I235 G236 L241 V242 V243I235-L239 HydrophobicContact CG2-CD1 4.02Å; I235-L239 HydrophobicContact CG2-CG 4.23Å; I235-L239 WeakPolarHBondContact O-CG 3.43Å; I235-L239 PolarHBondContact O-N 2.93Å; G236-L239 PolarHBondContact O-N 3.43Å; L239-L241 VanDerWaalsContact C-N 3.31Å; L239-L241 PolarHBondContact O-N 3.2Å; L239-V242 PolarHBondContact O-N 2.85Å; L239-V243 HydrophobicContact CB-CG2 4.49Å; L239-V243 HydrophobicContact CD2-CG2 4.01Å; L239-V243 WeakPolarHBondContact O-CA 3.38Å; L239-V243 VanDerWaalsContact O-CB 3.24Å; L239-V243 WeakPolarHBondContact O-CB 3.45Å; L239-V243 PolarHBondContact O-N 3.27Å
240N87.9Confident85.5Confident28 Ų2854.5 Ų54.515%0.1528%0.283CS..Hα-helixtrans-60.9-40.4175.5-171.225.2000111.6G236 A237 F238 L244G236-N240 WeakPolarHBondContact O-CB 3.43Å; G236-N240 PolarHBondContact O-N 3.47Å; A237-N240 PolarHBondContact O-N 3.26Å; F238-N240 VanDerWaalsContact C-N 3.32Å; F238-N240 PolarHBondContact O-N 3.04Å; N240-L244 WeakPolarHBondContact O-CB 3.44Å; N240-L244 WeakPolarHBondContact OD1-CD2 3.22Å
241L86.7Confident84.6Confident36 Ų3653.2 Ų53.219%0.18828%0.278CS..Hα-helixtrans-65.5-43.1177.3-178.768.9000112.5M159 V160 A237 F238 L239M159-L241 HydrophobicContact CB-CD1 4.33Å; M159-L241 HydrophobicContact CB-CD2 3.81Å; V160-L241 HydrophobicContact CG2-CD2 3.88Å; V160-L241 HydrophobicContact CG2-CG 4.41Å; A237-L241 PolarHBondContact O-N 3.48Å; F238-L241 WeakPolarHBondContact O-CB 3.41Å; F238-L241 PolarHBondContact O-N 3.29Å; L239-L241 VanDerWaalsContact C-N 3.31Å; L239-L241 PolarHBondContact O-N 3.2Å
242V87.3Confident83.7Confident45 Ų4557.3 Ų57.327%0.27330%0.297SS..Hα-helixtrans-91.1-53.2-171.5178.60000112.1V160 F238 L239 F246V160-V242 HydrophobicContact CG2-CG2 4.45Å; F238-V242 HydrophobicContact CD2-CG2 4.42Å; F238-V242 HydrophobicContact CE1-CG2 4.34Å; F238-V242 HydrophobicContact CE2-CG2 4.04Å; F238-V242 HydrophobicContact CZ-CG2 3.99Å; F238-V242 PolarHBondContact O-N 2.86Å; L239-V242 PolarHBondContact O-N 2.85Å; V242-F246 HydrophobicContact CG1-CE2 4.27Å; V242-F246 WeakPolarHBondContact O-CD2 3.41Å
243V82.2Confident82.9Confident62 Ų6257.9 Ų57.938%0.37630%0.3SS..Hα-helixtrans-80-40.8-169.2-178.40000112L239 R245 F246 L247L239-V243 HydrophobicContact CB-CG2 4.49Å; L239-V243 HydrophobicContact CD2-CG2 4.01Å; L239-V243 WeakPolarHBondContact O-CA 3.38Å; L239-V243 VanDerWaalsContact O-CB 3.24Å; L239-V243 WeakPolarHBondContact O-CB 3.45Å; L239-V243 PolarHBondContact O-N 3.27Å; V243-R245 PolarHBondContact O-N 2.93Å; V243-R245 VanDerWaalsContact O-N 3.16Å; V243-F246 PolarHBondContact O-N 3.05Å; V243-L247 HydrophobicContact CG1-CD1 4.06Å; V243-L247 HydrophobicContact CG1-CG 4.19Å; V243-L247 PolarHBondContact O-N 3.32Å; V243-L247 VanDerWaalsContact O-N 3.08Å
244L73.3Confident82Confident64 Ų6461.6 Ų61.634%0.33532%0.316SS..Hα-helixtrans-59.3-34.6-177.6-169.665.3000111.4N240 F246 L247 T248N240-L244 WeakPolarHBondContact O-CB 3.44Å; N240-L244 WeakPolarHBondContact OD1-CD2 3.22Å; L244-F246 VanDerWaalsContact C-N 3.34Å; L244-F246 PolarHBondContact O-N 3.45Å; L244-L247 PolarHBondContact O-N 2.98Å; L244-T248 HydrophobicContact CD1-CG2 4.44Å; L244-T248 HydrophobicContact CG-CG2 4.31Å; L244-T248 WeakPolarHBondContact O-CG2 3.15Å; L244-T248 PolarHBondContact O-N 2.91Å; L244-T248 PolarHBondContact O-OG1 3.27Å; L244-T248 VanDerWaalsContact O-OG1 3.09Å
245R70.4Confident81.4Confident154 Ų15467.9 Ų67.958%0.58134%0.338SS*.Hα-helixtrans-61.5-39.1175.1-172.2-176.6-177.5-153.4-0.6112.9M156 V243 T248 M249M156-R245 PolarHBondContact SD-NH1 2.87Å; V243-R245 PolarHBondContact O-N 2.93Å; V243-R245 VanDerWaalsContact O-N 3.16Å; R245-T248 PolarHBondContact O-OG1 3.46Å; R245-M249 WeakPolarHBondContact O-CB 3.42Å; R245-M249 PolarHBondContact O-N 2.85Å
246F73.5Confident80.7Confident132 Ų13273.5 Ų73.558%0.57936%0.358SS*.Hα-helixtrans-72.8-35.8177.7-72.2-70.2000111.9V242 V243 L244 M249V242-F246 HydrophobicContact CG1-CE2 4.27Å; V242-F246 WeakPolarHBondContact O-CD2 3.41Å; V243-F246 PolarHBondContact O-N 3.05Å; L244-F246 VanDerWaalsContact C-N 3.34Å; L244-F246 PolarHBondContact O-N 3.45Å; F246-M249 HydrophobicContact CD1-CE 4.13Å; F246-M249 PolarHBondContact O-N 2.94Å
247L75.8Confident80.2Confident114 Ų11475 Ų7560%0.59736%0.362SS*.Hα-helixtrans-67.4-45177-65.1176.6000111.7V243 L244 M249 N250V243-L247 HydrophobicContact CG1-CD1 4.06Å; V243-L247 HydrophobicContact CG1-CG 4.19Å; V243-L247 PolarHBondContact O-N 3.32Å; V243-L247 VanDerWaalsContact O-N 3.08Å; L244-L247 PolarHBondContact O-N 2.98Å; L247-M249 VanDerWaalsContact C-N 3.29Å; L247-M249 PolarHBondContact O-N 3.27Å; L247-N250 PolarHBondContact O-N 3.39Å
248T76.3Confident79.7Confident61 Ų6177 Ų7737%0.37438%0.378SS..Hα-helixtrans-71-23.8178.557.10000113L244 R245 N250 S251 E252L244-T248 HydrophobicContact CD1-CG2 4.44Å; L244-T248 HydrophobicContact CG-CG2 4.31Å; L244-T248 WeakPolarHBondContact O-CG2 3.15Å; L244-T248 PolarHBondContact O-N 2.91Å; L244-T248 PolarHBondContact O-OG1 3.27Å; L244-T248 VanDerWaalsContact O-OG1 3.09Å; R245-T248 PolarHBondContact O-OG1 3.46Å; T248-N250 PolarHBondContact O-N 3.49Å; T248-S251 PolarHBondContact O-N 3.33Å; T248-S251 PolarHBondContact O-OG 2.91Å; T248-E252 PolarHBondContact O-N 3.17Å
249M71.3Confident79.3Confident83 Ų8379.5 Ų79.541%0.40939%0.39SS..Hα-helixtrans-61.1-32.7174-170.2172.865.700111.9R245 F246 L247 D253R245-M249 WeakPolarHBondContact O-CB 3.42Å; R245-M249 PolarHBondContact O-N 2.85Å; F246-M249 HydrophobicContact CD1-CE 4.13Å; F246-M249 PolarHBondContact O-N 2.94Å; L247-M249 VanDerWaalsContact C-N 3.29Å; L247-M249 PolarHBondContact O-N 3.27Å; M249-D253 PolarHBondContact O-N 3.39Å; M249-D253 VanDerWaalsContact O-N 3.14Å; M249-D253 VanDerWaalsContact O-OD2 3.12Å
250N73.3Confident79Confident47 Ų4781.1 Ų81.125%0.25140%0.396SS..Hα-helixtrans-69.2-42.1176.7-174.173000112.8R7 L247 T248 D253 E254R7-N250 VanDerWaalsContact CZ-OD1 3.25Å; R7-N250 PolarHBondContact NE-OD1 2.84Å; R7-N250 VanDerWaalsContact NH2-CA 3.28Å; R7-N250 PolarHBondContact NH2-OD1 3.05Å; L247-N250 PolarHBondContact O-N 3.39Å; T248-N250 PolarHBondContact O-N 3.49Å; N250-D253 PolarHBondContact O-N 3.31Å; N250-E254 PolarHBondContact ND2-OE1 3.37Å; N250-E254 PolarHBondContact O-N 2.9Å; N250-E254 VanDerWaalsContact O-N 3.13Å
251S76.2Confident78.7Confident62 Ų6286.4 Ų86.443%0.43441%0.414SS..Hα-helixtrans-71.5-32.8178.159.50000112.6T248 E254 R255T248-S251 PolarHBondContact O-N 3.33Å; T248-S251 PolarHBondContact O-OG 2.91Å; S251-E254 PolarHBondContact O-N 3.43Å; S251-R255 PolarHBondContact O-N 3.08Å
252E77Confident78.5Confident87 Ų8787.8 Ų87.841%0.40743%0.431SS..Hα-helixtrans-65.3-41.6172.4-75-156.8166.700112.6T248 E254 R255 R256T248-E252 PolarHBondContact O-N 3.17Å; E252-E254 VanDerWaalsContact C-N 3.33Å; E252-R255 PolarHBondContact O-N 3.36Å; E252-R256 VanDerWaalsContact O-CG 3.29Å; E252-R256 WeakPolarHBondContact O-CG 3.47Å; E252-R256 PolarHBondContact O-N 3.38Å; E252-R256 IonicContact OE2-NH2 3.88Å; E252-R256 PolarHBondContact OE2-NH2 3.3Å
253D77.4Confident78.3Confident25 Ų2589.2 Ų89.213%0.13444%0.443CS..Hα-helixtrans-61.7-42.2175.2-68.5-33.5000110.9R7 M249 N250 R255 R256 D257R7-D253 IonicContact CZ-OD2 3.03Å; R7-D253 IonicContact NH1-OD2 3.53Å; R7-D253 PolarHBondContact NH1-OD2 2.84Å; R7-D253 IonicContact NH2-OD2 3.27Å; R7-D253 PolarHBondContact NH2-OD2 3.06Å; M249-D253 PolarHBondContact O-N 3.39Å; M249-D253 VanDerWaalsContact O-N 3.14Å; M249-D253 VanDerWaalsContact O-OD2 3.12Å; N250-D253 PolarHBondContact O-N 3.31Å; D253-R255 PolarHBondContact O-N 2.9Å; D253-R256 PolarHBondContact O-N 3.42Å; D253-D257 WeakPolarHBondContact O-CB 3.35Å; D253-D257 PolarHBondContact O-N 3.18Å
254E76.8Confident78.2Confident97 Ų9791.8 Ų91.845%0.45345%0.453SS..Hα-helixtrans-61.1-42.1175.6-75.6176.5-17200112.6Q4 N250 S251 E252 D257 A258Q4-E254 VanDerWaalsContact NE2-CG 3.3Å; N250-E254 PolarHBondContact ND2-OE1 3.37Å; N250-E254 PolarHBondContact O-N 2.9Å; N250-E254 VanDerWaalsContact O-N 3.13Å; S251-E254 PolarHBondContact O-N 3.43Å; E252-E254 VanDerWaalsContact C-N 3.33Å; E254-D257 PolarHBondContact O-N 3.01Å; E254-A258 WeakPolarHBondContact O-CB 3.46Å; E254-A258 PolarHBondContact O-N 2.9Å
255R80.9Confident78.4Confident144 Ų14491.8 Ų91.854%0.54346%0.463SS..Hα-helixtrans-64.3-44.1177.1-167.8175.371102-9.1111.3S251 E252 D253 A258 E259S251-R255 PolarHBondContact O-N 3.08Å; E252-R255 PolarHBondContact O-N 3.36Å; D253-R255 PolarHBondContact O-N 2.9Å; R255-A258 PolarHBondContact O-N 3.37Å; R255-E259 WeakPolarHBondContact CG-OE1 3.31Å; R255-E259 IonicContact CZ-OE1 2.74Å; R255-E259 IonicContact NE-OE1 3.27Å; R255-E259 IonicContact NH1-OE1 3.9Å; R255-E259 PolarHBondContact NH1-OE1 2.95Å; R255-E259 WeakPolarHBondContact O-CG 3.43Å; R255-E259 PolarHBondContact O-N 3.23Å
256R80.8Confident78.1Confident145 Ų14587 Ų8755%0.54746%0.461SS..Hα-helixtrans-62.3-45.7176.5-69.6174-164.6-155.67.9111.8E252 D253 A258 E259 E260E252-R256 VanDerWaalsContact O-CG 3.29Å; E252-R256 WeakPolarHBondContact O-CG 3.47Å; E252-R256 PolarHBondContact O-N 3.38Å; E252-R256 IonicContact OE2-NH2 3.88Å; E252-R256 PolarHBondContact OE2-NH2 3.3Å; D253-R256 PolarHBondContact O-N 3.42Å; R256-A258 VanDerWaalsContact C-N 3.27Å; R256-A258 PolarHBondContact O-N 2.87Å; R256-E259 PolarHBondContact O-N 3.19Å; R256-E260 WeakPolarHBondContact O-CB 3.46Å; R256-E260 PolarHBondContact O-N 3.4Å
257D81.5Confident77.4Confident48 Ų4886.4 Ų86.426%0.25746%0.464SS..Hα-helixtrans-65.2-30.3177.7-73.4-7.7000112.4Q4 D253 E254 R261Q4-D257 PolarHBondContact NE2-OD2 2.98Å; Q4-D257 VanDerWaalsContact NE2-OD2 3.1Å; D253-D257 WeakPolarHBondContact O-CB 3.35Å; D253-D257 PolarHBondContact O-N 3.18Å; E254-D257 PolarHBondContact O-N 3.01Å; D257-R261 WeakPolarHBondContact O-CB 3.36Å; D257-R261 WeakPolarHBondContact O-CG 3.44Å; D257-R261 PolarHBondContact O-N 3.38Å; D257-R261 PolarHBondContact O-NE 3.27Å
258A82.3Confident76.2Confident46 Ų4691.4 Ų91.438%0.3848%0.475SS..Hα-helixtrans-74.3-42175.300000111.7E254 R255 R256 R261 A262E254-A258 WeakPolarHBondContact O-CB 3.46Å; E254-A258 PolarHBondContact O-N 2.9Å; R255-A258 PolarHBondContact O-N 3.37Å; R256-A258 VanDerWaalsContact C-N 3.27Å; R256-A258 PolarHBondContact O-N 2.87Å; A258-R261 PolarHBondContact O-N 2.85Å; A258-A262 PolarHBondContact O-N 2.97Å
259E84.8Confident74.9Confident101 Ų10195.3 Ų95.347%0.47249%0.494SS..Hα-helixtrans-63-42.7174.8-73169.7-171.400111.5R255 R256 A262 S263R255-E259 WeakPolarHBondContact CG-OE1 3.31Å; R255-E259 IonicContact CZ-OE1 2.74Å; R255-E259 IonicContact NE-OE1 3.27Å; R255-E259 IonicContact NH1-OE1 3.9Å; R255-E259 PolarHBondContact NH1-OE1 2.95Å; R255-E259 WeakPolarHBondContact O-CG 3.43Å; R255-E259 PolarHBondContact O-N 3.23Å; R256-E259 PolarHBondContact O-N 3.19Å; E259-A262 PolarHBondContact O-N 3.45Å; E259-S263 PolarHBondContact O-N 2.96Å
260E83.8Confident74Confident122 Ų12296.1 Ų96.157%0.5751%0.508SS*.Hα-helixtrans-65.8-37.3176.2-169176.8-17500112.4R256 S263 L264R256-E260 WeakPolarHBondContact O-CB 3.46Å; R256-E260 PolarHBondContact O-N 3.4Å; E260-S263 PolarHBondContact O-N 3.02Å; E260-S263 PolarHBondContact O-OG 3.45Å; E260-L264 HydrophobicContact CG-CD1 4.4Å; E260-L264 VanDerWaalsContact O-CG 3.32Å; E260-L264 WeakPolarHBondContact O-CG 3.36Å; E260-L264 PolarHBondContact O-N 3.1Å; E260-L264 VanDerWaalsContact O-N 3.11Å
261R81.1Confident72.6Confident139 Ų139101.4 Ų101.453%0.52553%0.533SS..Hα-helixtrans-66.5-38.2173.3-82178.7-84.3140.2-7.7112.5D257 A258 A265D257-R261 WeakPolarHBondContact O-CB 3.36Å; D257-R261 WeakPolarHBondContact O-CG 3.44Å; D257-R261 PolarHBondContact O-N 3.38Å; D257-R261 PolarHBondContact O-NE 3.27Å; A258-R261 PolarHBondContact O-N 2.85Å; R261-A265 WeakPolarHBondContact O-CB 3.49Å; R261-A265 PolarHBondContact O-N 3.3Å; R261-A265 VanDerWaalsContact O-N 3.11Å
262A83.1Confident71.2Confident66 Ų66105 Ų10555%0.54555%0.546SS..Hα-helixtrans-67-39.3176.900000112A258 E259 A265 G266A258-A262 PolarHBondContact O-N 2.97Å; E259-A262 PolarHBondContact O-N 3.45Å; A262-A265 PolarHBondContact O-N 3.4Å; A262-G266 PolarHBondContact O-N 3.37Å
263S82.1Confident69.6Low75 Ų75107.3 Ų107.352%0.52456%0.559SS.*Hα-helixtrans-68.6-39.3177.768.70000112.7E259 E260 A265 G266 N267E259-S263 PolarHBondContact O-N 2.96Å; E260-S263 PolarHBondContact O-N 3.02Å; E260-S263 PolarHBondContact O-OG 3.45Å; S263-A265 VanDerWaalsContact C-N 3.34Å; S263-A265 PolarHBondContact O-N 2.87Å; S263-G266 PolarHBondContact O-N 2.82Å; S263-N267 PolarHBondContact O-N 2.9Å; S263-N267 VanDerWaalsContact O-N 3.13Å
264L81.2Confident67.6Low115 Ų115114.4 Ų114.460%0.60259%0.591SS**Hα-helixtrans-65.5-35.2174.3-71.5169.5000112.7E260E260-L264 HydrophobicContact CG-CD1 4.4Å; E260-L264 VanDerWaalsContact O-CG 3.32Å; E260-L264 WeakPolarHBondContact O-CG 3.36Å; E260-L264 PolarHBondContact O-N 3.1Å; E260-L264 VanDerWaalsContact O-N 3.11Å
265A76.5Confident65.8Low65 Ų65117 Ų11754%0.53761%0.607SS.*Hα-helixtrans-69.4-38.5174.800000112.3R261 A262 S263R261-A265 WeakPolarHBondContact O-CB 3.49Å; R261-A265 PolarHBondContact O-N 3.3Å; R261-A265 VanDerWaalsContact O-N 3.11Å; A262-A265 PolarHBondContact O-N 3.4Å; S263-A265 VanDerWaalsContact C-N 3.34Å; S263-A265 PolarHBondContact O-N 2.87Å
266G64.7Low63.6Low53 Ų53117.5 Ų117.555%0.54662%0.615SS.*Hα-helixtrans-67.7-34177.200000114.1A262 S263 R268A262-G266 PolarHBondContact O-N 3.37Å; S263-G266 PolarHBondContact O-N 2.82Å; G266-R268 VanDerWaalsContact C-N 3.31Å; G266-R268 PolarHBondContact O-N 3.04Å
267N57.7Low61.3Low119 Ų119119.7 Ų119.764%0.63663%0.632SS**Hα-helixtrans-75.5-18.7-177.4-15231.8000113.7S263 N269 S270S263-N267 PolarHBondContact O-N 2.9Å; S263-N267 VanDerWaalsContact O-N 3.13Å; N267-N269 VanDerWaalsContact C-N 3.27Å; N267-N269 PolarHBondContact O-N 3.08Å; N267-S270 PolarHBondContact O-N 3.3Å
268R52Low58.8Low219 Ų219123.5 Ų123.583%0.82665%0.652SS**G310 helixtrans-75.6-14.8-178.1-152.8167.9165.7176.9-5.8113.4G266 S270G266-R268 VanDerWaalsContact C-N 3.31Å; G266-R268 PolarHBondContact O-N 3.04Å; R268-S270 VanDerWaalsContact C-N 3.35Å
269N49.5Very low56.4Low143 Ų143126.5 Ų126.577%0.76567%0.67SS**G310 helixtrans-84.8-2173.1-75.9-2.6000113.9N267N267-N269 VanDerWaalsContact C-N 3.27Å; N267-N269 PolarHBondContact O-N 3.08Å
270S50.4Low53.8Low101 Ų101130.3 Ų130.371%0.70669%0.688SS**G310 helixtrans-102.7-1.6-178.3-157.50000114.2N267 R268N267-S270 PolarHBondContact O-N 3.3Å; R268-S270 VanDerWaalsContact C-N 3.35Å
271M44.3Very low51.6Low158 Ų158134.1 Ų134.178%0.77871%0.705SS**  trans-108.167.9-179.1-164.2178.1-7000111
272I47.3Very low49.2Very low137 Ų137131.2 Ų131.270%0.70372%0.719SS**  trans-92.6103.8162.7-61.8-178.9000106.8H274I272-H274 PolarHBondContact O-N 3.27Å
273I44.2Very low46.7Very low136 Ų136139.8 Ų139.870%0.69774%0.737SS**  trans-69.7106.9169.7-62.7172.6000106.8I275I273-I275 PolarHBondContact O-N 3.35Å
274H34.8Very low44.9Very low173 Ų173141.9 Ų141.980%0.80175%0.749SS**  trans-70.7105.7170.2-94.7-83.6000109.1I272I272-H274 PolarHBondContact O-N 3.27Å
275I38.1Very low42.5Very low152 Ų152148.3 Ų148.378%0.77977%0.765SS**  trans-79.8122.8160.7-63.6176.6000106.7I273I273-I275 PolarHBondContact O-N 3.35Å
276Q35.3Very low40.3Very low155 Ų155155.8 Ų155.872%0.72478%0.781SS**  trans-88.9117-179.1-178.8157.9-21.100110.1
277E32.2Very low38.6Very low191 Ų191162.5 Ų162.589%0.89380%0.795SS**  trans-125.5118.2154.4-88-170.2148.600108.6
278D29.5Very low37.2Very low128 Ų128161.7 Ų161.768%0.68481%0.805SS**  trans-71.9135.3174.9-80.4-48.3000110.8
279S31.4Very low36.1Very low108 Ų108160.2 Ų160.276%0.75581%0.807SS**  161143.3107-68.10000113.7
280Q30Very low35.1Very low181 Ų181160.3 Ų160.385%0.84681%0.813SS**  trans96.682.2157.6-53.6-160.2-8.200119.5
281H37.5Very low34.1Very low202 Ų202161.1 Ų161.194%0.93581%0.813SS**  19.2108.9124.6-72.579000119.5
282G31.8Very low33.4Very low78 Ų78162 Ų16280%0.80482%0.821SS**  trans176.9105.315600000112.1
283R30.9Very low32.7Very low247 Ų247163 Ų16393%0.93283%0.827SS**  trans-57.6171.7167.5-82-179.1172.9-176.9-1.3111.2
284P44.7Very low32.1Very low119 Ų119165.3 Ų165.377%0.77384%0.835SS**  cis-135.1173.5-3.537.1-18.8000114.4
285R29.2Very low31.9Very low249 Ų249161.7 Ų161.794%0.9483%0.83SS**  trans-172.1131141.4-122.9168.6167.7157-4.8114.9
286Y30.1Very low31.7Very low222 Ų222161 Ų16187%0.87183%0.832SS**  trans-91.7148.5164.9-131.3-102.5000109.9
287K29.7Very low31.4Very low194 Ų194159.6 Ų159.684%0.84384%0.838SS**  trans-41.3138.1-165.4-69.4168.2172.51790117.9
288A28.5Very low31.2Very low102 Ų102155.2 Ų155.284%0.84383%0.828SS**  trans-121.7134154.500000108.8
289E29.2Very low31.3Very low189 Ų189154.4 Ų154.488%0.88383%0.832SS**  trans-65.4143.5175-72.7168.3124.500112.3
290V29.1Very low31.3Very low144 Ų144158.2 Ų158.287%0.87384%0.84SS**  trans-139.1123.2143.1-1790000108.2
291T29Very low31.3Very low118 Ų118155.9 Ų155.972%0.72484%0.842SS**  trans-61.6137.8171.534.80000113.3
292D29Very low30.7Very low176 Ų176156.4 Ų156.494%0.94184%0.837SS**  trans-121.1131.4151.8-108.3-23.1000109.6
293L32.8Very low30.5Very low159 Ų159163 Ų16383%0.83284%0.838SS**  trans-125.9106.2-167.9-164.8133.4000108.3
294Q31.4Very low30.2Very low184 Ų184156.3 Ų156.386%0.8683%0.829SS**  trans-167.1100.1157.4-114.3178.8-13.100108.3
295S31.6Very low29.4Very low98 Ų98158.9 Ų158.969%0.68583%0.83SS**  94.4110.271.686.80000113.9
296V32.7Very low29.2Very low138 Ų138155.8 Ų155.884%0.83683%0.826SS**  trans79.780.4147-143.60000120.7
297C28.9Very low29Very low124 Ų124155.9 Ų155.984%0.83883%0.827SS**  20.4126.8123-133.30000121.9
298S29.4Very low28.7Very low100 Ų100152.7 Ų152.770%0.69982%0.823SS**  trans-83.2163.8157.7-48.70000112.3
299C29.8Very low28.5Very low111 Ų111153.2 Ų153.275%0.7582%0.821SS**  trans94.7109.5149.2-530000119.8
300M32.3Very low28.3Very low187 Ų187155.5 Ų155.592%0.92182%0.822SS**  28.6107.3114.1-64.4-75.4-74.800116.8
301C29.1Very low28.1Very low133 Ų133154.8 Ų154.890%0.89982%0.817SS**  trans-126.5121.7159.2-790000111.7
302Y26.4Very low27.9Very low213 Ų213155 Ų15584%0.83582%0.818SS**  trans-84.8120.6164.1-149.4-101.3000108.1
303R26.8Very low27.6Very low217 Ų217151 Ų15182%0.81980%0.804SS**  trans62.9117.1143-154.3177.8-165.21734.8120.4
304S24.6Very low27.3Very low105 Ų105152.2 Ų152.273%0.73481%0.805SS**  -170.3134.6124.7-162.70000113.6
305H28Very low27Very low173 Ų173151.8 Ų151.880%0.80180%0.803SS**  trans41.7114.6152.2-97.8-91.3000122.2
306E25.2Very low26.7Very low185 Ų185154.8 Ų154.886%0.86481%0.811SS**  trans-61.1127.4154.4-72.3173.5138.200111.1
307Y24.7Very low26.4Very low223 Ų223153.3 Ų153.388%0.87581%0.807SS**  trans-146.2129.8143.6-124.5-91.3000109
308T23.6Very low26.2Very low127 Ų127157.7 Ų157.778%0.77981%0.812SS**  trans-64.7136.9-177.720.50000113
309S25.3Very low26Very low114 Ų114158 Ų15880%0.79781%0.814SS**  trans177.9111.8131.5-81.30000113.7
310R23.9Very low25.9Very low237 Ų237157.9 Ų157.989%0.89482%0.815SS**  31.7131.5126.7-87.6-176.5-171.7-177.53.6121
311V24.8Very low25.6Very low129 Ų129158.1 Ų158.178%0.78281%0.811SS**  120.1116.8126.7162.70000118.7
312V24.9Very low25.5Very low123 Ų123159.8 Ų159.875%0.74581%0.81SS**  trans96.2124.3139.8171.90000122
313S24.3Very low25.5Very low90 Ų90156.8 Ų156.863%0.62981%0.808SS**  trans-55.1151.5168.545.90000116.6
314H25.4Very low25.7Very low186 Ų186151 Ų15186%0.86180%0.799SS**  -158.9128.3127.2-112.7-76.2000111.9
315Q26.4Very low25.8Very low174 Ų174155.2 Ų155.281%0.81381%0.807SS**  trans-68.4150.6163.2-75.7168.1-45.600110.1
316N24.6Very low25.7Very low162 Ų162157.3 Ų157.387%0.86681%0.81SS**  -160.5130.1129.4-97.2-16.3000111.7
317S26.1Very low25.8Very low107 Ų107158.1 Ų158.175%0.74881%0.81SS**  trans-86.9148.5172.543.40000110.4
318F24.8Very low25.9Very low216 Ų216156.6 Ų156.695%0.94781%0.811SS**  trans-153.6138.1147.2-133.8-94.7000111.2
319S25.1Very low26Very low106 Ų106155.4 Ų155.474%0.74181%0.808SS**  trans-118.2138.8-173-172.20000109.4
320S26.9Very low26.2Very low109 Ų109156.7 Ų156.776%0.76280%0.804SS**  trans-171.7107.5155.746.10000107.9
321K26.6Very low26.3Very low192 Ų192150.1 Ų150.184%0.83580%0.795SS**  70.811180.2-83-169.6177.81800115.7
322L26.1Very low26.6Very low167 Ų167153.1 Ų153.187%0.87479%0.793SS**  trans141.694137.2-82.8145.2000111.3
323N27.2Very low26.6Very low150 Ų150154.9 Ų154.980%0.80279%0.791SS**  84.4152.490.3-125.120.2000114.5
324P30.4Very low26.9Very low97 Ų97158 Ų15863%0.6380%0.799SS**  -124.6157.1-112.532.4-11.5000113.2
325Q26.6Very low27.1Very low193 Ų193155.8 Ų155.890%0.90279%0.789SS**  trans-119.8132.7167-85.3-174.9-25.400111.4
326Y25.9Very low27.4Very low217 Ų217156.5 Ų156.585%0.85179%0.792SS**  trans-56.3128.8-169.1-81.8-109.7000113.7
327F28.2Very low28Very low201 Ų201155.5 Ų155.588%0.88279%0.786SS**  trans-125.7123.2151.7-90.9-86.5000108.8S329F327-S329 PolarHBondContact O-N 3.43Å
328H26.4Very low28.1Very low192 Ų192153.9 Ų153.989%0.88977%0.774SS**  trans-59.3114175.3-100.9-73000110.3
329S26.5Very low28.6Very low102 Ų102150.1 Ų150.171%0.71377%0.771SS**  trans-89.2124.6166.649.30000109.6F327 S331F327-S329 PolarHBondContact O-N 3.43Å; S329-S331 PolarHBondContact O-N 3.29Å
330I30.1Very low29.3Very low141 Ų141149.7 Ų149.772%0.72377%0.768SS**  trans-82.299.8160-64.3175.5000105.5Y332I330-Y332 HydrophobicContact CG2-CD1 4.36Å; I330-Y332 HydrophobicContact CG2-CE1 3.75Å
331S25.7Very low30Very low99 Ų99150 Ų15069%0.69277%0.765SS**  trans-91.8117.6174.4-175.20000108.7S329 K333S329-S331 PolarHBondContact O-N 3.29Å; S331-K333 PolarHBondContact O-N 3.3Å
332Y29.7Very low30.5Very low191 Ų191148.4 Ų148.475%0.74977%0.765SS**  trans-82.2111164.7-35.9-81.9000107.1I330 I334I330-Y332 HydrophobicContact CG2-CD1 4.36Å; I330-Y332 HydrophobicContact CG2-CE1 3.75Å; Y332-I334 PolarHBondContact O-N 3.29Å
333K25.3Very low31Very low161 Ų161149.3 Ų149.370%0.776%0.762SS**  trans-75.3107.5174.8-161-172.5-179.7-146.80107.6S331 E335S331-K333 PolarHBondContact O-N 3.3Å; K333-E335 IonicContact NZ-OE1 2.87Å; K333-E335 PolarHBondContact NZ-OE1 2.84Å; K333-E335 PolarHBondContact O-N 3.48Å
334I31.4Very low31.5Very low154 Ų154150 Ų15079%0.7977%0.766SS**  trans-81.3106.1166.9-64173.3000106Y332 E336Y332-I334 PolarHBondContact O-N 3.29Å; I334-E336 PolarHBondContact O-N 3.13Å
335E30.3Very low31.5Very low140 Ų140150.4 Ų150.465%0.65477%0.771SS**  trans-77.2110.5165.7-92170.4-174.800108.6K333 I337K333-E335 IonicContact NZ-OE1 2.87Å; K333-E335 PolarHBondContact NZ-OE1 2.84Å; K333-E335 PolarHBondContact O-N 3.48Å; E335-I337 PolarHBondContact O-N 3.31Å
336E31.5Very low31.7Very low190 Ų190148.7 Ų148.789%0.88877%0.767SS**  trans-66.9112.1169.1-77.6-176.715400109.4I334I334-E336 PolarHBondContact O-N 3.13Å
337I36.3Very low32Very low141 Ų141148.2 Ų148.272%0.72377%0.77SS**  trans-85.7116.3169.9-61.9169000107.7E335E335-I337 PolarHBondContact O-N 3.31Å
338S29.3Very low32.2Very low73 Ų73144.6 Ų144.651%0.5177%0.766SS.*  trans-63146.4174.7172.60000111.8S340S338-S340 PolarHBondContact O-N 3.22Å; S338-S340 PolarHBondContact OG-OG 3.29Å
339P36Very low32.5Very low136 Ų136140.8 Ų140.888%0.88376%0.762SS**THydrogen-bonded Turntrans-71.622.6-171.8-12.928.8000115.9
340S39.1Very low33.2Very low97 Ų97141.7 Ų141.768%0.67877%0.765SS**THydrogen-bonded Turntrans-113.3-1.2-175.8500000114.7S338S338-S340 PolarHBondContact O-N 3.22Å; S338-S340 PolarHBondContact OG-OG 3.29Å
341T41.2Very low33.3Very low115 Ų115141.3 Ų141.371%0.70677%0.769SS**SBendtrans-107.85.7-177.3-26.90000114.5
342L37.6Very low33.4Very low159 Ų159141.9 Ų141.983%0.83277%0.773SS**  trans-113.236.2-179.4-126152.6000112.9
343K36.2Very low33.4Very low187 Ų187137.5 Ų137.581%0.81377%0.77SS**SBendtrans-128.381.4163.2-83.7-174.7174.6-179.90107.3
344N37.7Very low33.6Very low164 Ų164137.2 Ų137.288%0.87778%0.775SS**SBendtrans16376153.7-82.5-15.9000110.2
345S30.3Very low33.6Very low105 Ų105135.3 Ų135.373%0.73478%0.775SS**  trans-172.4123151.652.40000109.1
346L31.1Very low34.2Very low158 Ų158134.8 Ų134.883%0.82778%0.784SS**SBendtrans117.761.2169.3-61.6163.3000114.7
347F32.7Very low34Very low207 Ų207129.1 Ų129.191%0.90878%0.776SS**  trans-151.3123.1133.2-87.2-70.7000108.1
348P32Very low33.7Very low124 Ų124129.7 Ų129.781%0.80578%0.78SS**  trans-91.5125.9164.430.9-24.1000110.1
349S32.3Very low33.6Very low113 Ų113134 Ų13479%0.7979%0.792SS**  trans-119.5142.6154.2-53.90000107.2
350P42.6Very low33.2Very low121 Ų121131.9 Ų131.979%0.78678%0.78SS**  -146.3171.5108.734.6-17.7000112.1
351V31.8Very low32.7Very low133 Ų133135.8 Ų135.881%0.80679%0.785SS**  cis-176137.1-15.3145.10000103.6
352S27.9Very low32.2Very low111 Ų111135.5 Ų135.578%0.77678%0.784SS**  trans159.8131.3144.959.90000107.7
353S29.1Very low31.9Very low98 Ų98134.6 Ų134.669%0.68578%0.78SS**  cis-174.8142.623.2430000110.1
354I28.6Very low31.5Very low155 Ų155132.1 Ų132.180%0.79578%0.775SS**  trans75.8108.6137.8-60.4165.7000121.2
355S31.4Very low31.2Very low114 Ų114130.9 Ų130.980%0.79776%0.764SS**  trans78.5154.4133-82.30000125.1
356P43.7Very low31.1Very low130 Ų130135.3 Ų135.384%0.84477%0.765SS**  trans-122.8167.3-139.642.8-29.4000116
357G27.3Very low31.1Very low70 Ų70134.6 Ų134.672%0.72276%0.761SS**  trans171.9107.6160.400000110.8
358L28.8Very low30.9Very low154 Ų154132.3 Ų132.381%0.80676%0.755SS**  84.613584.4-137.484.8000114.4
359H29.1Very low30.9Very low162 Ų162134.6 Ų134.675%0.7575%0.752SS**  trans83.3119.1174.2-64.1-82.6000117.1
360S27.4Very low31Very low93 Ų93140 Ų14065%0.6576%0.755SS**  cis84141.243.3-160.30000115.2
361F28.5Very low30.5Very low178 Ų178145.5 Ų145.578%0.78176%0.76SS**  trans84.2105.4173.9-73.6-98000117
362T30Very low30.5Very low110 Ų110148 Ų14868%0.67576%0.76SS**  65.5129.280.160.50000116.7
363D30.7Very low30.7Very low139 Ų139147.2 Ų147.274%0.74376%0.755SS**  trans50.5120.6147-66.7-23.1000120.1
364N28.9Very low31.3Very low135 Ų135154.2 Ų154.272%0.72278%0.782SS**  168.5143.196.1-102.9-43.3000115.3
365H30Very low31.4Very low139 Ų139154.2 Ų154.264%0.64478%0.782SS**  trans56.9120.2137-87.1-26.9000125.2
366R29.3Very low31.4Very low198 Ų198156.3 Ų156.375%0.74778%0.781SS**  63.2127.9116-84.6178175.8-169.91.5121.1
367L30.7Very low30.7Very low143 Ų143157.8 Ų157.875%0.74978%0.777SS**  trans69.3119.7130.6-72.8162000119.8
368M28.8Very low30.9Very low158 Ų158162.9 Ų162.978%0.77878%0.781SS**  158.1122.2115-88.7-172123.700109.9
369K31.2Very low31Very low172 Ų172163.5 Ų163.575%0.74878%0.779SS**  81.597.481.1-154.2-178.3-169.21790114.1
370R34.8Very low31.2Very low228 Ų228163.6 Ų163.686%0.8678%0.781SS**  44.5122125.9-159.8-175-163.1-173.26.1119.7
371R32.2Very low31.4Very low235 Ų235168.6 Ų168.689%0.88779%0.79SS**  trans-179.2121130.6-100.3174-174.4-170.52.3108.9
372K32.6Very low31.7Very low185 Ų185167.9 Ų167.980%0.80479%0.791SS**  71.8113.382.9-99.6-163.5178.9-169.10114.9
373S30.6Very low31.8Very low96 Ų96172.8 Ų172.867%0.67180%0.801SS**  trans35.2122.4134.762.60000119.5
374I41.8Very low31.9Very low245 Ų245175.8 Ų175.8100%1.25681%0.806SS**  -127.20121.2-66.4-177.2000106.7

Retrieved 374 of 374 residues in 337.3 ms (Link to these results)

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