A0A087YQG1_POEFO Loading...

Sodium/myo-inositol cotransporter

AlphaFold DB , UniProt , Accession A0A087YQG1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 706 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
1M35.8Very low73.1Confident232 Ų23295.2 Ų95.2100%1.14351%0.507SS*.  0100.90-166178-172.300107.1A3M1-A3 PolarHBondContact O-N 3.24Å
2H48Very low74.4Confident130 Ų13091 Ų9160%0.60249%0.487SS*.  trans-65.2119.7-179-69.1-77.6000109.2R4H2-R4 PolarHBondContact O-N 3.42Å
3A55.3Low75.3Confident44 Ų4485.4 Ų85.436%0.36446%0.458SS..  trans-65104.9172.900000107.8M1 M356M1-A3 PolarHBondContact O-N 3.24Å; A3-M356 WeakPolarHBondContact O-CE 3.21Å
4R66.9Low76.1Confident216 Ų21683.1 Ų83.182%0.81546%0.457SS*.PPolyproline II helixtrans-71.9150.3178.5-68.7-176.6177178.9-1.2110.1H2 R364H2-R4 PolarHBondContact O-N 3.42Å; R4-R364 PolarHBondContact O-NH1 2.97Å; R4-R364 VanDerWaalsContact O-NH1 3.15Å; R4-R364 PolarHBondContact O-NH2 3.48Å
5M77.4Confident76.9Confident32 Ų3286.1 Ų86.116%0.15847%0.471CS..PPolyproline II helixtrans-59.6137.2171-79.8-140.4-77.300110.9D9 I10 L154 M356 M368M5-D9 HydrophobicContact CB-CB 4.38Å; M5-D9 HydrophobicContact CG-CB 4.41Å; M5-D9 HydrophobicContact SD-CB 3.81Å; M5-I10 HydrophobicContact CB-CG1 4.22Å; M5-I10 HydrophobicContact CE-CG1 3.95Å; M5-I10 HydrophobicContact SD-CG1 4.41Å; M5-L154 HydrophobicContact CB-CD2 4.38Å; M5-L154 HydrophobicContact CE-CD1 4.09Å; M5-L154 HydrophobicContact CE-CD2 3.16Å; M5-L154 HydrophobicContact CE-CG 3.74Å; M5-L154 HydrophobicContact CG-CD2 4.22Å; M5-M356 HydrophobicContact CG-CE 4.43Å; M5-M368 HydrophobicContact CE-CE 3.43Å; M5-M368 VanDerWaalsContact CE-CE 3.43Å; M5-M368 HydrophobicContact CE-SD 4.22Å; M5-M368 HydrophobicContact CG-CE 4.09Å; M5-M368 HydrophobicContact CG-SD 3.83Å; M5-M368 HydrophobicContact SD-CE 3.32Å; M5-M368 WeakPolarHBondContact SD-CE 3.22Å; M5-M368 HydrophobicContact SD-SD 3.25Å
6E84.8Confident77.5Confident105 Ų10581.3 Ų81.349%0.49144%0.444SS..PPolyproline II helixtrans-88.8162.5173.7-68.1-173.1-163.300110.4A8 D9 I10 V361E6-A8 PolarHBondContact O-N 2.61Å; E6-A8 VanDerWaalsContact O-N 3.16Å; E6-D9 PolarHBondContact N-OD2 2.73Å; E6-D9 WeakPolarHBondContact O-CB 3.29Å; E6-D9 PolarHBondContact O-N 3.12Å; E6-I10 PolarHBondContact O-N 3.07Å; E6-V361 HydrophobicContact CB-CG1 3.97Å; E6-V361 VanDerWaalsContact CD-CG2 3.42Å; E6-V361 HydrophobicContact CG-CG1 4.47Å; E6-V361 HydrophobicContact CG-CG2 4.32Å; E6-V361 WeakPolarHBondContact OE1-CG2 3.43Å; E6-V361 WeakPolarHBondContact OE2-CG1 3.45Å; E6-V361 WeakPolarHBondContact OE2-CG2 3.35Å
7A86.5Confident77.7Confident75 Ų7578.4 Ų78.462%0.6243%0.426SS*.Hα-helixtrans-57.5-33.4-178.800000112.9I10 S11A7-I10 PolarHBondContact O-N 3.35Å; A7-S11 WeakPolarHBondContact O-CB 3.43Å; A7-S11 PolarHBondContact O-N 2.75Å; A7-S11 PolarHBondContact O-OG 3.14Å
8A87.8Confident78.1Confident48 Ų4879.8 Ų79.840%0.39744%0.437SS..Hα-helixtrans-65-39.3175.200000112.4E6 S11 V12 V361E6-A8 PolarHBondContact O-N 2.61Å; E6-A8 VanDerWaalsContact O-N 3.16Å; A8-S11 PolarHBondContact O-N 3.46Å; A8-V12 WeakPolarHBondContact O-CG2 3.35Å; A8-V12 PolarHBondContact O-N 2.8Å; A8-V12 VanDerWaalsContact O-N 3.08Å; A8-V361 HydrophobicContact CB-CG1 3.77Å
9D86.9Confident78.5Confident0 Ų079.7 Ų79.70%044%0.436CS..Hα-helixtrans-63.3-46.8176.3-65.4-53.1000111.1M5 E6 S11 V12 V13 G362 R364 G365M5-D9 HydrophobicContact CB-CB 4.38Å; M5-D9 HydrophobicContact CG-CB 4.41Å; M5-D9 HydrophobicContact SD-CB 3.81Å; E6-D9 PolarHBondContact N-OD2 2.73Å; E6-D9 WeakPolarHBondContact O-CB 3.29Å; E6-D9 PolarHBondContact O-N 3.12Å; D9-S11 VanDerWaalsContact C-N 3.29Å; D9-S11 PolarHBondContact O-N 3.44Å; D9-V12 PolarHBondContact O-N 3.49Å; D9-V13 WeakPolarHBondContact O-CG2 3.43Å; D9-V13 PolarHBondContact O-N 2.7Å; D9-G362 WeakPolarHBondContact OD1-CA 3.32Å; D9-G362 PolarHBondContact OD1-N 3.39Å; D9-R364 IonicContact OD1-NE 3.56Å; D9-R364 IonicContact OD2-CZ 2.64Å; D9-R364 VanDerWaalsContact OD2-CZ 3.22Å; D9-R364 IonicContact OD2-NE 3.88Å; D9-R364 PolarHBondContact OD2-NE 3.31Å; D9-R364 IonicContact OD2-NH2 3.63Å; D9-R364 PolarHBondContact OD2-NH2 3.4Å; D9-G365 PolarHBondContact OD1-N 2.91Å
10I86.3Confident78.5Confident89 Ų8976.4 Ų76.446%0.45642%0.418SS..Hα-helixtrans-62.1-39.9179.1-61.4171.2000110.7M5 E6 A7 V12 V13 A14M5-I10 HydrophobicContact CB-CG1 4.22Å; M5-I10 HydrophobicContact CE-CG1 3.95Å; M5-I10 HydrophobicContact SD-CG1 4.41Å; E6-I10 PolarHBondContact O-N 3.07Å; A7-I10 PolarHBondContact O-N 3.35Å; I10-V12 PolarHBondContact O-N 3.49Å; I10-V13 PolarHBondContact O-N 3.22Å; I10-A14 PolarHBondContact O-N 2.96Å
11S88.2Confident78.5Confident76 Ų7675.9 Ų75.953%0.53142%0.415SS..Hα-helixtrans-63.2-41.4178-58.80000111.8A7 A8 D9 A14 L15A7-S11 WeakPolarHBondContact O-CB 3.43Å; A7-S11 PolarHBondContact O-N 2.75Å; A7-S11 PolarHBondContact O-OG 3.14Å; A8-S11 PolarHBondContact O-N 3.46Å; D9-S11 VanDerWaalsContact C-N 3.29Å; D9-S11 PolarHBondContact O-N 3.44Å; S11-A14 PolarHBondContact O-N 3.49Å; S11-L15 WeakPolarHBondContact O-CB 3.11Å; S11-L15 PolarHBondContact O-N 3.45Å
12V88.8Confident80.7Confident45 Ų4566.7 Ų66.727%0.27338%0.376SS..Hα-helixtrans-64.5-43175.6172.50000111.1A8 D9 I10 L15 Y16 L366A8-V12 WeakPolarHBondContact O-CG2 3.35Å; A8-V12 PolarHBondContact O-N 2.8Å; A8-V12 VanDerWaalsContact O-N 3.08Å; D9-V12 PolarHBondContact O-N 3.49Å; I10-V12 PolarHBondContact O-N 3.49Å; V12-L15 PolarHBondContact O-N 3.37Å; V12-Y16 WeakPolarHBondContact O-CB 3.33Å; V12-Y16 PolarHBondContact O-N 2.94Å; V12-L366 HydrophobicContact CG1-CB 3.81Å; V12-L366 HydrophobicContact CG1-CD1 4.12Å
13V86.1Confident82.2Confident18 Ų1862.8 Ų62.811%0.10936%0.359CS..Hα-helixtrans-59.5-47.8175.8175.20000111D9 I10 L15 Y16 F17 G365 M368 A369D9-V13 WeakPolarHBondContact O-CG2 3.43Å; D9-V13 PolarHBondContact O-N 2.7Å; I10-V13 PolarHBondContact O-N 3.22Å; V13-L15 PolarHBondContact O-N 3.08Å; V13-Y16 WeakPolarHBondContact O-CB 3.49Å; V13-Y16 PolarHBondContact O-N 3Å; V13-F17 HydrophobicContact CG1-CD2 3.77Å; V13-F17 HydrophobicContact CG1-CE2 3.56Å; V13-F17 WeakPolarHBondContact O-CD2 3.26Å; V13-F17 PolarHBondContact O-N 3.02Å; V13-F17 VanDerWaalsContact O-N 3.07Å; V13-G365 WeakPolarHBondContact CG2-O 3.39Å; V13-M368 HydrophobicContact CG2-CB 4.39Å; V13-A369 HydrophobicContact CB-CB 4.28Å; V13-A369 HydrophobicContact CG1-CB 4.34Å; V13-A369 HydrophobicContact CG2-CB 4.02Å
14A86.4Confident83Confident54 Ų5461.1 Ų61.145%0.44635%0.346SS..Hα-helixtrans-61.4-45.3178.800000112.1I10 S11 Y16 F17 V18I10-A14 PolarHBondContact O-N 2.96Å; S11-A14 PolarHBondContact O-N 3.49Å; A14-Y16 VanDerWaalsContact C-N 3.32Å; A14-Y16 PolarHBondContact O-N 2.91Å; A14-F17 PolarHBondContact O-N 3.03Å; A14-V18 WeakPolarHBondContact O-CG2 3.31Å; A14-V18 PolarHBondContact O-N 3.4Å
15L88.6Confident83.4Confident127 Ų12754.7 Ų54.767%0.66533%0.327SS*.Hα-helixtrans-63.5-38.5179-173.8135.5000112S11 V12 V13 V18 L19S11-L15 WeakPolarHBondContact O-CB 3.11Å; S11-L15 PolarHBondContact O-N 3.45Å; V12-L15 PolarHBondContact O-N 3.37Å; V13-L15 PolarHBondContact O-N 3.08Å; L15-V18 PolarHBondContact O-N 3.5Å; L15-L19 PolarHBondContact O-N 3.29Å
16Y85.8Confident83.4Confident9 Ų958.7 Ų58.74%0.03535%0.349CS..Hα-helixtrans-61-47.2173.9174.4-91.9000111.9V12 V13 A14 V18 L19 V20 L191 A369 A373V12-Y16 WeakPolarHBondContact O-CB 3.33Å; V12-Y16 PolarHBondContact O-N 2.94Å; V13-Y16 WeakPolarHBondContact O-CB 3.49Å; V13-Y16 PolarHBondContact O-N 3Å; A14-Y16 VanDerWaalsContact C-N 3.32Å; A14-Y16 PolarHBondContact O-N 2.91Å; Y16-V18 VanDerWaalsContact C-N 3.31Å; Y16-V18 PolarHBondContact O-N 2.65Å; Y16-L19 WeakPolarHBondContact O-CB 3.48Å; Y16-L19 PolarHBondContact O-N 3.24Å; Y16-L19 VanDerWaalsContact O-N 3.12Å; Y16-V20 HydrophobicContact CD1-CG2 4.14Å; Y16-V20 HydrophobicContact CD2-CG2 4.49Å; Y16-V20 HydrophobicContact CE1-CG2 3.48Å; Y16-V20 VanDerWaalsContact CE1-CG2 3.48Å; Y16-V20 HydrophobicContact CE2-CG2 3.89Å; Y16-V20 WeakPolarHBondContact O-CG2 3.32Å; Y16-V20 PolarHBondContact O-N 3.47Å; Y16-V20 WeakPolarHBondContact OH-CG2 3.49Å; Y16-L191 HydrophobicContact CD2-CD1 4.06Å; Y16-L191 HydrophobicContact CE2-CD1 3.47Å; Y16-L191 VanDerWaalsContact CE2-CD1 3.47Å; Y16-A369 HydrophobicContact CD1-CB 3.62Å; Y16-A369 HydrophobicContact CD2-CB 4.44Å; Y16-A369 HydrophobicContact CE1-CB 4.43Å; Y16-A369 HydrophobicContact CG-CB 3.63Å; Y16-A373 HydrophobicContact CE1-CB 3.41Å; Y16-A373 VanDerWaalsContact CE1-CB 3.41Å; Y16-A373 WeakPolarHBondContact OH-CB 3.38Å
17F82.3Confident82.7Confident33 Ų3354.4 Ų54.415%0.14533%0.331CS..Hα-helixtrans-62.4-39178-82.9-63.1000112.8V13 A14 L19 V20 L21 M168 I372 M376V13-F17 HydrophobicContact CG1-CD2 3.77Å; V13-F17 HydrophobicContact CG1-CE2 3.56Å; V13-F17 WeakPolarHBondContact O-CD2 3.26Å; V13-F17 PolarHBondContact O-N 3.02Å; V13-F17 VanDerWaalsContact O-N 3.07Å; A14-F17 PolarHBondContact O-N 3.03Å; F17-L19 VanDerWaalsContact C-N 3.32Å; F17-L19 PolarHBondContact O-N 2.89Å; F17-V20 PolarHBondContact O-N 3.45Å; F17-L21 VanDerWaalsContact O-CB 3.28Å; F17-L21 WeakPolarHBondContact O-CB 3.32Å; F17-L21 PolarHBondContact O-N 3.27Å; F17-M168 HydrophobicContact CD1-CE 3.57Å; F17-M168 HydrophobicContact CD2-CE 3.83Å; F17-M168 HydrophobicContact CE1-CE 3.52Å; F17-M168 HydrophobicContact CE2-CE 3.75Å; F17-M168 HydrophobicContact CG-CE 3.75Å; F17-M168 HydrophobicContact CZ-CE 3.61Å; F17-M168 HydrophobicContact CZ-SD 4.4Å; F17-I372 HydrophobicContact CZ-CB 4.04Å; F17-I372 HydrophobicContact CZ-CG2 3.68Å; F17-M376 HydrophobicContact CD1-CE 4.33Å; F17-M376 HydrophobicContact CE1-CE 3.28Å; F17-M376 HydrophobicContact CE1-SD 3.78Å; F17-M376 HydrophobicContact CZ-CE 3.59Å
18V85Confident81.6Confident103 Ų10352.3 Ų52.362%0.62431%0.309SS*.Hα-helixtrans-61.1-42.6173.7172.70000110.9A14 L15 Y16 L21 A22A14-V18 WeakPolarHBondContact O-CG2 3.31Å; A14-V18 PolarHBondContact O-N 3.4Å; L15-V18 PolarHBondContact O-N 3.5Å; Y16-V18 VanDerWaalsContact C-N 3.31Å; Y16-V18 PolarHBondContact O-N 2.65Å; V18-L21 PolarHBondContact O-N 3.35Å; V18-A22 VanDerWaalsContact O-CB 3.28Å; V18-A22 WeakPolarHBondContact O-CB 3.27Å; V18-A22 PolarHBondContact O-N 2.86Å
19L84.5Confident80.7Confident78 Ų7861.1 Ų61.141%0.40833%0.332SS..Hα-helixtrans-62.6-47.7177.317967.8000112L15 Y16 F17 A22 I23 L187L15-L19 PolarHBondContact O-N 3.29Å; Y16-L19 WeakPolarHBondContact O-CB 3.48Å; Y16-L19 PolarHBondContact O-N 3.24Å; Y16-L19 VanDerWaalsContact O-N 3.12Å; F17-L19 VanDerWaalsContact C-N 3.32Å; F17-L19 PolarHBondContact O-N 2.89Å; L19-A22 PolarHBondContact O-N 3.22Å; L19-I23 HydrophobicContact CD1-CD1 3.98Å; L19-I23 HydrophobicContact CD1-CG1 4.44Å; L19-I23 HydrophobicContact CG-CD1 3.94Å; L19-I23 WeakPolarHBondContact O-CG1 3.29Å; L19-I23 PolarHBondContact O-N 2.89Å; L19-L187 HydrophobicContact CD2-CD2 4.02Å; L19-L187 HydrophobicContact CG-CD2 4.35Å
20V79.5Confident79.6Confident13 Ų1370.4 Ų70.48%0.07937%0.373CS..Hα-helixtrans-61.8-45.7178.8171.80000110.8Y16 F17 A22 I23 G24 L172 T184Y16-V20 HydrophobicContact CD1-CG2 4.14Å; Y16-V20 HydrophobicContact CD2-CG2 4.49Å; Y16-V20 HydrophobicContact CE1-CG2 3.48Å; Y16-V20 VanDerWaalsContact CE1-CG2 3.48Å; Y16-V20 HydrophobicContact CE2-CG2 3.89Å; Y16-V20 WeakPolarHBondContact O-CG2 3.32Å; Y16-V20 PolarHBondContact O-N 3.47Å; Y16-V20 WeakPolarHBondContact OH-CG2 3.49Å; F17-V20 PolarHBondContact O-N 3.45Å; V20-A22 VanDerWaalsContact C-N 3.35Å; V20-A22 PolarHBondContact O-N 3.12Å; V20-I23 PolarHBondContact O-N 3.37Å; V20-G24 PolarHBondContact O-N 3.27Å; V20-L172 HydrophobicContact CG1-CD1 4.39Å; V20-T184 HydrophobicContact CG1-CG2 3.98Å
21L77.9Confident78.3Confident66 Ų6667.7 Ų67.735%0.34636%0.363SS..Hα-helixtrans-63.6-41.9178.3-168145000110.9F17 V18 G24 L25 L171 L172F17-L21 VanDerWaalsContact O-CB 3.28Å; F17-L21 WeakPolarHBondContact O-CB 3.32Å; F17-L21 PolarHBondContact O-N 3.27Å; V18-L21 PolarHBondContact O-N 3.35Å; L21-G24 PolarHBondContact O-N 3.47Å; L21-L25 HydrophobicContact CD2-CD1 3.54Å; L21-L25 HydrophobicContact CD2-CG 4.04Å; L21-L25 WeakPolarHBondContact O-CB 3.48Å; L21-L25 VanDerWaalsContact O-CG 3.26Å; L21-L25 WeakPolarHBondContact O-CG 3.43Å; L21-L25 PolarHBondContact O-N 2.91Å; L21-L171 HydrophobicContact CD1-CD2 4.27Å; L21-L172 HydrophobicContact CB-CD2 4.44Å; L21-L172 HydrophobicContact CD1-CD2 4.36Å; L21-L172 HydrophobicContact CG-CD2 4.4Å
22A81.9Confident76.6Confident40 Ų4070.5 Ų70.533%0.33137%0.372SS..Hα-helixtrans-61.3-45.7175.500000112.2V18 L19 V20 L25 L26V18-A22 VanDerWaalsContact O-CB 3.28Å; V18-A22 WeakPolarHBondContact O-CB 3.27Å; V18-A22 PolarHBondContact O-N 2.86Å; L19-A22 PolarHBondContact O-N 3.22Å; V20-A22 VanDerWaalsContact C-N 3.35Å; V20-A22 PolarHBondContact O-N 3.12Å; A22-L25 PolarHBondContact O-N 3.06Å; A22-L26 WeakPolarHBondContact O-CB 3.07Å; A22-L26 VanDerWaalsContact O-CG 3.24Å; A22-L26 WeakPolarHBondContact O-CG 3.32Å; A22-L26 PolarHBondContact O-N 2.72Å
23I79.1Confident74.9Confident48 Ų4874.4 Ų74.425%0.24638%0.382CS..Hα-helixtrans-64.1-42.8177.3-68.8167.8000110.8L19 V20 L25 L26 A27 T184 L187L19-I23 HydrophobicContact CD1-CD1 3.98Å; L19-I23 HydrophobicContact CD1-CG1 4.44Å; L19-I23 HydrophobicContact CG-CD1 3.94Å; L19-I23 WeakPolarHBondContact O-CG1 3.29Å; L19-I23 PolarHBondContact O-N 2.89Å; V20-I23 PolarHBondContact O-N 3.37Å; I23-L25 PolarHBondContact O-N 3.04Å; I23-L26 PolarHBondContact O-N 3.37Å; I23-A27 WeakPolarHBondContact O-CB 3.3Å; I23-A27 PolarHBondContact O-N 3.46Å; I23-T184 HydrophobicContact CG2-CG2 4.44Å; I23-L187 HydrophobicContact CD1-CD2 3.51Å
24G73.3Confident73.4Confident9 Ų976.9 Ų76.99%0.09340%0.4CS..Hα-helixtrans-57.1-49.4174.900000111.6V20 L21 L26 A27 M28V20-G24 PolarHBondContact O-N 3.27Å; L21-G24 PolarHBondContact O-N 3.47Å; G24-L26 PolarHBondContact O-N 2.93Å; G24-A27 PolarHBondContact O-N 2.84Å; G24-M28 WeakPolarHBondContact O-CG 3.47Å; G24-M28 PolarHBondContact O-N 2.94Å
25L74.4Confident72.1Confident80 Ų8077.7 Ų77.742%0.41940%0.4SS..Hα-helixtrans-63-40.5177.9-68.7-179.8000112.8L21 A22 I23 M28 W29L21-L25 HydrophobicContact CD2-CD1 3.54Å; L21-L25 HydrophobicContact CD2-CG 4.04Å; L21-L25 WeakPolarHBondContact O-CB 3.48Å; L21-L25 VanDerWaalsContact O-CG 3.26Å; L21-L25 WeakPolarHBondContact O-CG 3.43Å; L21-L25 PolarHBondContact O-N 2.91Å; A22-L25 PolarHBondContact O-N 3.06Å; I23-L25 PolarHBondContact O-N 3.04Å; L25-M28 HydrophobicContact CB-CE 4.47Å; L25-M28 HydrophobicContact CD2-CE 3.31Å; L25-M28 HydrophobicContact CD2-SD 3.98Å; L25-M28 HydrophobicContact CG-CE 4.44Å; L25-M28 WeakPolarHBondContact O-CB 3.41Å; L25-M28 PolarHBondContact O-N 2.87Å; L25-W29 PolarHBondContact O-N 3.32Å
26L76.8Confident70.7Confident117 Ų11773.9 Ų73.961%0.61338%0.382SS*.Hα-helixtrans-66.5-42177.5-72.3172000112A22 I23 G24 M28 W29A22-L26 WeakPolarHBondContact O-CB 3.07Å; A22-L26 VanDerWaalsContact O-CG 3.24Å; A22-L26 WeakPolarHBondContact O-CG 3.32Å; A22-L26 PolarHBondContact O-N 2.72Å; I23-L26 PolarHBondContact O-N 3.37Å; G24-L26 PolarHBondContact O-N 2.93Å; L26-M28 VanDerWaalsContact C-N 3.3Å; L26-M28 PolarHBondContact O-N 3.43Å; L26-W29 PolarHBondContact O-N 2.8Å
27A69.9Low69.4Low14 Ų1475.5 Ų75.512%0.11639%0.394CS..Hα-helixtrans-63.2-38.9176.800000111.4I23 G24 W29 K30 A31 A180 Y183I23-A27 WeakPolarHBondContact O-CB 3.3Å; I23-A27 PolarHBondContact O-N 3.46Å; G24-A27 PolarHBondContact O-N 2.84Å; A27-W29 PolarHBondContact O-N 3.07Å; A27-K30 PolarHBondContact O-N 3.43Å; A27-A31 PolarHBondContact O-N 3.43Å; A27-A180 HydrophobicContact CB-CB 4.14Å; A27-Y183 HydrophobicContact CB-CD2 4.29Å
28M65.1Low68.2Low32 Ų3274.7 Ų74.716%0.15840%0.395CS..Hα-helixtrans-61.5-42.2175.7-70.9160.818.700112.8G24 L25 L26 K30 A31 T175 A180G24-M28 WeakPolarHBondContact O-CG 3.47Å; G24-M28 PolarHBondContact O-N 2.94Å; L25-M28 HydrophobicContact CB-CE 4.47Å; L25-M28 HydrophobicContact CD2-CE 3.31Å; L25-M28 HydrophobicContact CD2-SD 3.98Å; L25-M28 HydrophobicContact CG-CE 4.44Å; L25-M28 WeakPolarHBondContact O-CB 3.41Å; L25-M28 PolarHBondContact O-N 2.87Å; L26-M28 VanDerWaalsContact C-N 3.3Å; L26-M28 PolarHBondContact O-N 3.43Å; M28-K30 PolarHBondContact O-N 3.4Å; M28-A31 PolarHBondContact O-N 3.28Å; M28-A31 VanDerWaalsContact O-N 3.15Å; M28-T175 VanDerWaalsContact CG-O 3.27Å; M28-T175 WeakPolarHBondContact CG-O 3.46Å; M28-T175 VanDerWaalsContact SD-CB 3.53Å; M28-A180 HydrophobicContact CG-CB 4.49Å
29W67.3Low67.1Low233 Ų23372.6 Ų72.688%0.88338%0.376SS*.Hα-helixtrans-64.5-25.3-177.7-158.7-1000112.1L25 L26 A27L25-W29 PolarHBondContact O-N 3.32Å; L26-W29 PolarHBondContact O-N 2.8Å; A27-W29 PolarHBondContact O-N 3.07Å
30K63.7Low65.9Low195 Ų19569.4 Ų69.485%0.84836%0.359SS*.Hα-helixtrans-90.3-14.2179-157.3173.3-179.4179.80113.6A27 M28A27-K30 PolarHBondContact O-N 3.43Å; M28-K30 PolarHBondContact O-N 3.4Å
31A59.2Low64.9Low31 Ų3169 Ų6926%0.25636%0.356SS..SBendtrans-89.9131.4-173.400000112.5A27 M28 R33 V179A27-A31 PolarHBondContact O-N 3.43Å; M28-A31 PolarHBondContact O-N 3.28Å; M28-A31 VanDerWaalsContact O-N 3.15Å; A31-R33 PolarHBondContact O-N 2.82Å; A31-V179 HydrophobicContact CB-CB 4.42Å; A31-V179 HydrophobicContact CB-CG1 4.48Å; A31-V179 HydrophobicContact CB-CG2 4.43Å
32N52.8Low64Low136 Ų13666.1 Ų66.173%0.72734%0.342SS*.  trans-80.8105.7-179.8-145.22.2000110.5
33R54.1Low63Low127 Ų12766.3 Ų66.348%0.47935%0.348SS..  trans-83.2-5.2-169.4-87.1-178.5171169.6-2.9116A31 T35 T175A31-R33 PolarHBondContact O-N 2.82Å; R33-T35 VanDerWaalsContact C-N 3.32Å; R33-T35 PolarHBondContact O-N 3.22Å; R33-T175 PolarHBondContact NH2-O 3.41Å
34S53.9Low62.4Low69 Ų6966.1 Ų66.148%0.48334%0.344SS..SBendtrans-78.3-5.9-16555.30000115.7
35T58.8Low62.6Low72 Ų7269.3 Ų69.344%0.44237%0.365SS..SBendtrans-131.5145.9-175.2680000113.9R33 S37 G38 Y39R33-T35 VanDerWaalsContact C-N 3.32Å; R33-T35 PolarHBondContact O-N 3.22Å; T35-S37 VanDerWaalsContact C-N 3.26Å; T35-S37 PolarHBondContact O-N 2.96Å; T35-G38 WeakPolarHBondContact O-CA 3.33Å; T35-G38 PolarHBondContact O-N 3.32Å; T35-G38 PolarHBondContact OG1-N 3.46Å; T35-G38 VanDerWaalsContact OG1-N 3.13Å; T35-Y39 PolarHBondContact O-N 3.25Å
36V59.1Low63Low47 Ų4765.9 Ų65.929%0.28535%0.347SS..Hα-helixtrans-55-40.1174.11720000111.6Y39 F40 Q404V36-Y39 PolarHBondContact O-N 3.42Å; V36-F40 HydrophobicContact CG1-CD2 3.51Å; V36-F40 HydrophobicContact CG1-CE2 3.76Å; V36-F40 VanDerWaalsContact O-CD2 3.29Å; V36-F40 WeakPolarHBondContact O-CD2 3.42Å; V36-F40 PolarHBondContact O-N 3Å; V36-Q404 HydrophobicContact CG2-CG 4.01Å
37S59Low63.7Low43 Ų4363.7 Ų63.730%0.30134%0.336SS..Hα-helixtrans-65.4-37.4174.5-174.30000112.4T35 L41 A42 G43T35-S37 VanDerWaalsContact C-N 3.26Å; T35-S37 PolarHBondContact O-N 2.96Å; S37-L41 CarbonylContact O-C 3.56Å; S37-L41 WeakPolarHBondContact O-CA 3.24Å; S37-L41 WeakPolarHBondContact O-CB 3.26Å; S37-L41 PolarHBondContact O-N 3.23Å; S37-A42 PolarHBondContact O-N 2.95Å; S37-G43 PolarHBondContact O-N 3.3Å
38G57.6Low64.8Low15 Ų1567.1 Ų67.116%0.15535%0.346CS..Hα-helixtrans-62.9-42.1173.200000112.7T35 A42T35-G38 WeakPolarHBondContact O-CA 3.33Å; T35-G38 PolarHBondContact O-N 3.32Å; T35-G38 PolarHBondContact OG1-N 3.46Å; T35-G38 VanDerWaalsContact OG1-N 3.13Å; G38-A42 WeakPolarHBondContact O-CA 3.29Å; G38-A42 PolarHBondContact O-N 3.04Å
39Y60.6Low66.1Low59 Ų5968.3 Ų68.323%0.23136%0.355CS..Hα-helixtrans-72-45.3179.6-171.3-102000113T35 V36 L178 L408T35-Y39 PolarHBondContact O-N 3.25Å; V36-Y39 PolarHBondContact O-N 3.42Å; Y39-L178 WeakPolarHBondContact O-CB 3.39Å; Y39-L408 HydrophobicContact CD1-CD2 4.16Å; Y39-L408 HydrophobicContact CE1-CD2 4.18Å
40F59.6Low67.3Low11 Ų1158 Ų585%0.04832%0.317CS..Hα-helixtrans-93.5-20.2-173.4-67.7-60.9000115.6V36 L178 Q284 T388V36-F40 HydrophobicContact CG1-CD2 3.51Å; V36-F40 HydrophobicContact CG1-CE2 3.76Å; V36-F40 VanDerWaalsContact O-CD2 3.29Å; V36-F40 WeakPolarHBondContact O-CD2 3.42Å; V36-F40 PolarHBondContact O-N 3Å; F40-L178 WeakPolarHBondContact O-CD2 3.41Å; F40-Q284 PolarHBondContact O-NE2 3.22Å; F40-T388 HydrophobicContact CD1-CG2 4.01Å; F40-T388 WeakPolarHBondContact CD1-OG1 3.34Å; F40-T388 HydrophobicContact CE1-CG2 4.16Å; F40-T388 WeakPolarHBondContact CE1-OG1 3.45Å; F40-T388 HydrophobicContact CG-CG2 4.36Å
41L58.5Low68.6Low4 Ų448.7 Ų48.72%0.02128%0.277CS..Hα-helixtrans-128.59.6-175.6-69.5155.8000113.5S37 G43 R44 Y107 L287 A288S37-L41 CarbonylContact O-C 3.56Å; S37-L41 WeakPolarHBondContact O-CA 3.24Å; S37-L41 WeakPolarHBondContact O-CB 3.26Å; S37-L41 PolarHBondContact O-N 3.23Å; L41-G43 PolarHBondContact O-N 2.81Å; L41-R44 PolarHBondContact O-N 3.42Å; L41-Y107 HydrophobicContact CD1-CD1 3.1Å; L41-Y107 HydrophobicContact CD1-CE1 3.36Å; L41-Y107 HydrophobicContact CD1-CG 3.95Å; L41-Y107 HydrophobicContact CG-CD1 4.35Å; L41-L287 HydrophobicContact CD2-CB 4.14Å; L41-A288 WeakPolarHBondContact O-CB 3.27Å
42A59.4Low70.3Confident6 Ų647.2 Ų47.25%0.0527%0.265CS..G310 helixtrans53.927.9-178.900000112.8S37 G38 R44 S45 M46 L178 V179 L182S37-A42 PolarHBondContact O-N 2.95Å; G38-A42 WeakPolarHBondContact O-CA 3.29Å; G38-A42 PolarHBondContact O-N 3.04Å; A42-R44 VanDerWaalsContact C-N 3.26Å; A42-R44 PolarHBondContact O-N 2.9Å; A42-S45 PolarHBondContact O-OG 3.04Å; A42-M46 HydrophobicContact CB-CE 3.88Å; A42-M46 HydrophobicContact CB-CG 3.99Å; A42-M46 HydrophobicContact CB-SD 4.25Å; A42-L178 HydrophobicContact CB-CD2 4.42Å; A42-V179 HydrophobicContact CB-CG2 3.5Å; A42-V179 VanDerWaalsContact CB-CG2 3.5Å; A42-L182 HydrophobicContact CB-CD1 4Å
43G59.8Low72.2Confident44 Ų4441 Ų4145%0.45423%0.233SC..G310 helixtrans63.420.1-178.600000115.7S37 L41 S45S37-G43 PolarHBondContact O-N 3.3Å; L41-G43 PolarHBondContact O-N 2.81Å; G43-S45 VanDerWaalsContact C-N 3.29Å; G43-S45 PolarHBondContact O-N 2.87Å
44R67.5Low73.9Confident44 Ų4435 Ų3517%0.16621%0.21CC..G310 helixtrans52.641.5177.9-68.2173.1160-177.93.4113.9L41 A42 A288 K290 M675L41-R44 PolarHBondContact O-N 3.42Å; A42-R44 VanDerWaalsContact C-N 3.26Å; A42-R44 PolarHBondContact O-N 2.9Å; R44-A288 CarbonylContact C-O 3.59Å; R44-A288 WeakPolarHBondContact CA-O 3.32Å; R44-K290 VanDerWaalsContact O-CA 3.26Å; R44-K290 WeakPolarHBondContact O-CA 3.34Å; R44-M675 HydrophobicContact CB-CE 4.06Å; R44-M675 HydrophobicContact CG-CE 4Å
45S76.8Confident75.7Confident76 Ų7631.8 Ų31.853%0.53119%0.187SC..  trans-119.17.6-176.361.30000113.2A42 G43 A288A42-S45 PolarHBondContact O-OG 3.04Å; G43-S45 VanDerWaalsContact C-N 3.29Å; G43-S45 PolarHBondContact O-N 2.87Å; S45-A288 PolarHBondContact N-O 3.25Å
46M83.6Confident77.3Confident9 Ų928.6 Ų28.64%0.04417%0.167CC..BIsolated β-bridgetrans-79.4141.5-167.9-61.8-68.5119.700112.3A42 I51 V179 L182 A288 K290A42-M46 HydrophobicContact CB-CE 3.88Å; A42-M46 HydrophobicContact CB-CG 3.99Å; A42-M46 HydrophobicContact CB-SD 4.25Å; M46-I51 HydrophobicContact CB-CD1 3.81Å; M46-I51 HydrophobicContact CB-CG1 3.78Å; M46-V179 HydrophobicContact CE-CG1 4.45Å; M46-V179 HydrophobicContact CE-CG2 4.43Å; M46-L182 HydrophobicContact CG-CD1 3.78Å; M46-L182 HydrophobicContact SD-CD1 3.8Å; M46-A288 WeakPolarHBondContact CB-O 3.5Å; M46-A288 HydrophobicContact CG-CB 4.17Å; M46-A288 PolarHBondContact N-O 3.18Å; M46-K290 PolarHBondContact O-N 3.44Å
47N90.7Very high78.8Confident70 Ų7026.4 Ų26.437%0.37415%0.154SC..  trans-80.7154.9177.2-165.19000111.1V49 V50 I51 H294N47-V49 VanDerWaalsContact C-N 3.29Å; N47-V49 PolarHBondContact O-N 3.44Å; N47-V50 PolarHBondContact O-N 2.92Å; N47-I51 WeakPolarHBondContact O-CG1 3.43Å; N47-I51 PolarHBondContact O-N 3.42Å; N47-I51 VanDerWaalsContact O-N 3.14Å; N47-H294 PolarHBondContact OD1-CE1 3.34Å; N47-H294 PolarHBondContact OD1-ND1 3.41Å
48W92.8Very high80.1Confident87 Ų8724.7 Ų24.733%0.3314%0.142SC..Hα-helixtrans-63.6-33-17465.2-95.8000112.9G52 H294 C297 S298 M301W48-G52 PolarHBondContact O-N 3.32Å; W48-H294 HydrophobicContact CB-CB 4.17Å; W48-H294 VanDerWaalsContact CB-O 3.27Å; W48-H294 WeakPolarHBondContact CB-O 3.3Å; W48-H294 AromaticContact CD1-CE1 3.61Å; W48-H294 AromaticContact CD1-ND1 3.61Å; W48-H294 PolarHBondContact N-ND1 3.31Å; W48-C297 HydrophobicContact CB-CB 3.84Å; W48-C297 HydrophobicContact CD2-CB 4.23Å; W48-C297 HydrophobicContact CE3-CB 4.44Å; W48-C297 HydrophobicContact CG-CB 3.98Å; W48-S298 WeakPolarHBondContact O-CB 3.47Å; W48-M301 HydrophobicContact CE3-CB 4.17Å; W48-M301 HydrophobicContact CE3-SD 3.88Å; W48-M301 HydrophobicContact CH2-SD 4.38Å; W48-M301 HydrophobicContact CZ3-CB 3.99Å; W48-M301 HydrophobicContact CZ3-CG 4.01Å; W48-M301 HydrophobicContact CZ3-SD 3.41Å; W48-M301 WeakPolarHBondContact CZ3-SD 3.38Å
49V93.8Very high81.6Confident56 Ų5624.3 Ų24.334%0.33914%0.136SC..Hα-helixtrans-63.7-48.2176.8-178.50000110.8N47 I51 G52 A53 M301N47-V49 VanDerWaalsContact C-N 3.29Å; N47-V49 PolarHBondContact O-N 3.44Å; V49-I51 VanDerWaalsContact C-N 3.34Å; V49-I51 PolarHBondContact O-N 3.28Å; V49-G52 PolarHBondContact O-N 3.46Å; V49-A53 VanDerWaalsContact O-CB 3.23Å; V49-A53 WeakPolarHBondContact O-CB 3.23Å; V49-A53 PolarHBondContact O-N 3.47Å; V49-M301 HydrophobicContact CG1-CE 4.43Å; V49-M301 HydrophobicContact CG1-SD 4.36Å; V49-M301 WeakPolarHBondContact O-CE 3.41Å
50V91.6Very high83Confident17 Ų1721.6 Ų21.610%0.10313%0.126CC..Hα-helixtrans-62.9-44.7-179.4175.60000110N47 S54 L182 Y183N47-V50 PolarHBondContact O-N 2.92Å; V50-S54 WeakPolarHBondContact O-CB 3.48Å; V50-S54 PolarHBondContact O-N 3.06Å; V50-L182 HydrophobicContact CG1-CB 3.82Å; V50-Y183 HydrophobicContact CG2-CE1 4.4Å
51I91.9Very high84.2Confident0 Ų021.1 Ų21.10%012%0.124CC..Hα-helixtrans-66.3-48.2179.3-61169.5000110.8M46 N47 V49 A53 S54 L55 A289 S298M46-I51 HydrophobicContact CB-CD1 3.81Å; M46-I51 HydrophobicContact CB-CG1 3.78Å; N47-I51 WeakPolarHBondContact O-CG1 3.43Å; N47-I51 PolarHBondContact O-N 3.42Å; N47-I51 VanDerWaalsContact O-N 3.14Å; V49-I51 VanDerWaalsContact C-N 3.34Å; V49-I51 PolarHBondContact O-N 3.28Å; I51-A53 VanDerWaalsContact C-N 3.34Å; I51-A53 PolarHBondContact O-N 3.42Å; I51-S54 CarbonylContact O-C 3.53Å; I51-S54 PolarHBondContact O-N 3.34Å; I51-L55 HydrophobicContact CG2-CD1 4.28Å; I51-L55 HydrophobicContact CG2-CG 4.24Å; I51-L55 VanDerWaalsContact O-CG 3.31Å; I51-L55 WeakPolarHBondContact O-CG 3.4Å; I51-L55 PolarHBondContact O-N 2.9Å; I51-A289 HydrophobicContact CD1-CB 3.51Å; I51-S298 WeakPolarHBondContact CG2-OG 3.28Å
52G94.3Very high85.4Confident0 Ų021.1 Ų21.10%012%0.124CC..Hα-helixtrans-68.1-34.6-176.900000112.6W48 V49 S54 L55 F56 S298W48-G52 PolarHBondContact O-N 3.32Å; V49-G52 PolarHBondContact O-N 3.46Å; G52-S54 VanDerWaalsContact C-N 3.33Å; G52-L55 PolarHBondContact O-N 3.48Å; G52-F56 PolarHBondContact O-N 3.47Å; G52-F56 VanDerWaalsContact O-N 3.08Å; G52-S298 WeakPolarHBondContact CA-O 3.26Å
53A92.9Very high86.8Confident6 Ų622.3 Ų22.35%0.0513%0.129CC..Hα-helixtrans-66.3-42.7174.600000109.9V49 I51 F56 V57 T186 A189 M301V49-A53 VanDerWaalsContact O-CB 3.23Å; V49-A53 WeakPolarHBondContact O-CB 3.23Å; V49-A53 PolarHBondContact O-N 3.47Å; I51-A53 VanDerWaalsContact C-N 3.34Å; I51-A53 PolarHBondContact O-N 3.42Å; A53-F56 WeakPolarHBondContact O-CB 3.46Å; A53-F56 PolarHBondContact O-N 3.2Å; A53-V57 WeakPolarHBondContact O-CG2 3.32Å; A53-V57 PolarHBondContact O-N 2.92Å; A53-T186 HydrophobicContact CB-CG2 4.26Å; A53-A189 HydrophobicContact CB-CB 3.92Å; A53-M301 HydrophobicContact CB-CE 4.1Å
54S90.3Very high88.4Confident0 Ų020.2 Ų20.20%011%0.107CC..Hα-helixtrans-67.5-39.2176.3179.20000113.6V50 I51 G52 F56 V57 S58 L182 D185 R285V50-S54 WeakPolarHBondContact O-CB 3.48Å; V50-S54 PolarHBondContact O-N 3.06Å; I51-S54 CarbonylContact O-C 3.53Å; I51-S54 PolarHBondContact O-N 3.34Å; G52-S54 VanDerWaalsContact C-N 3.33Å; S54-F56 VanDerWaalsContact C-N 3.25Å; S54-F56 PolarHBondContact O-N 3.45Å; S54-V57 PolarHBondContact O-N 2.72Å; S54-S58 VanDerWaalsContact O-CB 3.3Å; S54-S58 WeakPolarHBondContact O-CB 3.37Å; S54-S58 PolarHBondContact O-N 3.35Å; S54-S58 PolarHBondContact O-OG 2.84Å; S54-L182 WeakPolarHBondContact OG-CD2 3.24Å; S54-D185 PolarHBondContact OG-OD2 3.43Å; S54-R285 WeakPolarHBondContact OG-CD 3.47Å; S54-R285 PolarHBondContact OG-NE 3.07Å; S54-R285 PolarHBondContact OG-NH1 3.31Å
55L91.8Very high89.6Confident1 Ų118.3 Ų18.31%0.00510%0.1CC..Hα-helixtrans-58.7-39.9171.6-75177.9000111.9I51 G52 I282 R285 V286 T299 A302I51-L55 HydrophobicContact CG2-CD1 4.28Å; I51-L55 HydrophobicContact CG2-CG 4.24Å; I51-L55 VanDerWaalsContact O-CG 3.31Å; I51-L55 WeakPolarHBondContact O-CG 3.4Å; I51-L55 PolarHBondContact O-N 2.9Å; G52-L55 PolarHBondContact O-N 3.48Å; L55-I282 HydrophobicContact CD2-CG2 3.94Å; L55-R285 HydrophobicContact CD2-CB 4.15Å; L55-V286 HydrophobicContact CD1-CG2 3.77Å; L55-V286 HydrophobicContact CD2-CG2 3.75Å; L55-V286 HydrophobicContact CG-CG2 4.22Å; L55-T299 HydrophobicContact CD1-CG2 4.5Å; L55-A302 HydrophobicContact CB-CB 3.91Å; L55-A302 HydrophobicContact CD1-CB 4.03Å
56F92.6Very high90.3Very high6 Ų614.7 Ų14.73%0.0268%0.075CC..Hα-helixtrans-68.1-48.3176.2177-106.6000111G52 A53 S54 N59 I60 M192 I193 L305 P309G52-F56 PolarHBondContact O-N 3.47Å; G52-F56 VanDerWaalsContact O-N 3.08Å; A53-F56 WeakPolarHBondContact O-CB 3.46Å; A53-F56 PolarHBondContact O-N 3.2Å; S54-F56 VanDerWaalsContact C-N 3.25Å; S54-F56 PolarHBondContact O-N 3.45Å; F56-N59 PolarHBondContact O-N 3.43Å; F56-I60 HydrophobicContact CD2-CG1 3.75Å; F56-I60 HydrophobicContact CE1-CG1 4.29Å; F56-I60 HydrophobicContact CE2-CB 4.47Å; F56-I60 HydrophobicContact CE2-CD1 4.34Å; F56-I60 HydrophobicContact CE2-CG1 3.45Å; F56-I60 VanDerWaalsContact CE2-CG1 3.45Å; F56-I60 HydrophobicContact CG-CG1 4.31Å; F56-I60 HydrophobicContact CZ-CB 4.34Å; F56-I60 HydrophobicContact CZ-CG1 3.75Å; F56-I60 HydrophobicContact CZ-CG2 4.5Å; F56-I60 WeakPolarHBondContact O-CB 3.44Å; F56-I60 WeakPolarHBondContact O-CG1 3.04Å; F56-I60 PolarHBondContact O-N 3.07Å; F56-M192 HydrophobicContact CD1-CE 3.79Å; F56-M192 HydrophobicContact CE1-CE 3.29Å; F56-M192 HydrophobicContact CZ-CE 4.1Å; F56-I193 HydrophobicContact CD1-CD1 4.44Å; F56-I193 HydrophobicContact CE1-CD1 3.92Å; F56-I193 HydrophobicContact CE1-CG1 3.83Å; F56-I193 HydrophobicContact CZ-CG1 4.34Å; F56-L305 HydrophobicContact CB-CB 4.37Å; F56-L305 HydrophobicContact CB-CD1 3.9Å; F56-L305 HydrophobicContact CD1-CB 4.49Å; F56-L305 HydrophobicContact CD1-CD1 4.17Å; F56-L305 HydrophobicContact CD2-CB 3.54Å; F56-L305 HydrophobicContact CD2-CD1 4.46Å; F56-L305 HydrophobicContact CE2-CB 3.84Å; F56-L305 WeakPolarHBondContact CE2-O 3.48Å; F56-L305 HydrophobicContact CG-CB 3.9Å; F56-L305 HydrophobicContact CG-CD1 3.94Å; F56-L305 HydrophobicContact CZ-CB 4.43Å; F56-P309 HydrophobicContact CE2-CG 4.13Å
57V89.9Confident90.8Very high0 Ų014.3 Ų14.30%07%0.073CC..Hα-helixtrans-64.5-47.5-179.5166.10000112.5A53 S54 N59 I60 D185 A189 M192 S377A53-V57 WeakPolarHBondContact O-CG2 3.32Å; A53-V57 PolarHBondContact O-N 2.92Å; S54-V57 PolarHBondContact O-N 2.72Å; V57-N59 PolarHBondContact O-N 3.49Å; V57-I60 CarbonylContact O-C 3.57Å; V57-I60 PolarHBondContact O-N 3.47Å; V57-I60 VanDerWaalsContact O-N 3.17Å; V57-D185 HydrophobicContact CB-CB 4.34Å; V57-D185 HydrophobicContact CG1-CB 4.26Å; V57-D185 WeakPolarHBondContact CG2-O 3.37Å; V57-A189 HydrophobicContact CG2-CB 3.53Å; V57-M192 HydrophobicContact CG2-CE 4.17Å; V57-S377 WeakPolarHBondContact CG1-OG 3.49Å
58S86.6Confident91Very high8 Ų811 Ų116%0.0566%0.055CC..THydrogen-bonded Turntrans-66.3-3.4-179.9-60.20000114.8S54 R285 D378S54-S58 VanDerWaalsContact O-CB 3.3Å; S54-S58 WeakPolarHBondContact O-CB 3.37Å; S54-S58 PolarHBondContact O-N 3.35Å; S54-S58 PolarHBondContact O-OG 2.84Å; S58-R285 PolarHBondContact OG-NE 3.44Å; S58-R285 PolarHBondContact OG-NH2 2.92Å; S58-D378 WeakPolarHBondContact CA-OD1 3.32Å
59N89.4Confident91.2Very high7 Ų76.9 Ų6.94%0.0374%0.04CC..THydrogen-bonded Turntrans-112.2-43.5168.7169.3-105.4000110.9F56 V57 G61 H64 Y275 W276 K306F56-N59 PolarHBondContact O-N 3.43Å; V57-N59 PolarHBondContact O-N 3.49Å; N59-G61 PolarHBondContact O-N 2.97Å; N59-H64 PolarHBondContact ND2-CE1 3.46Å; N59-H64 PolarHBondContact O-CE1 2.91Å; N59-H64 PolarHBondContact O-ND1 3.43Å; N59-Y275 WeakPolarHBondContact CB-OH 3.41Å; N59-Y275 VanDerWaalsContact ND2-CZ 3.32Å; N59-Y275 PolarHBondContact ND2-OH 2.93Å; N59-W276 HydrophobicContact CB-CH2 3.99Å; N59-K306 WeakPolarHBondContact OD1-CE 3.15Å; N59-K306 PolarHBondContact OD1-NZ 3.41Å
60I89.6Confident91.2Very high2 Ų24.2 Ų4.21%0.012%0.024CC..SBendtrans-79.381.1177-55.4-54.2000110F56 V57 H64 F65 M192 P309 I313F56-I60 HydrophobicContact CD2-CG1 3.75Å; F56-I60 HydrophobicContact CE1-CG1 4.29Å; F56-I60 HydrophobicContact CE2-CB 4.47Å; F56-I60 HydrophobicContact CE2-CD1 4.34Å; F56-I60 HydrophobicContact CE2-CG1 3.45Å; F56-I60 VanDerWaalsContact CE2-CG1 3.45Å; F56-I60 HydrophobicContact CG-CG1 4.31Å; F56-I60 HydrophobicContact CZ-CB 4.34Å; F56-I60 HydrophobicContact CZ-CG1 3.75Å; F56-I60 HydrophobicContact CZ-CG2 4.5Å; F56-I60 WeakPolarHBondContact O-CB 3.44Å; F56-I60 WeakPolarHBondContact O-CG1 3.04Å; F56-I60 PolarHBondContact O-N 3.07Å; V57-I60 CarbonylContact O-C 3.57Å; V57-I60 PolarHBondContact O-N 3.47Å; V57-I60 VanDerWaalsContact O-N 3.17Å; I60-H64 HydrophobicContact CG2-CB 4.45Å; I60-F65 HydrophobicContact CG2-CE2 4.21Å; I60-M192 HydrophobicContact CB-CE 3.74Å; I60-M192 HydrophobicContact CB-SD 4.45Å; I60-M192 HydrophobicContact CG2-CE 3.59Å; I60-M192 HydrophobicContact CG2-SD 3.88Å; I60-P309 HydrophobicContact CD1-CB 4.3Å; I60-P309 HydrophobicContact CD1-CG 3.61Å; I60-P309 HydrophobicContact CG1-CG 4.2Å; I60-I313 HydrophobicContact CG2-CD1 3.8Å
61G85.1Confident91.4Very high0 Ų03.4 Ų3.40%02%0.019CC..SBendtrans-107.3-163.3-18000000115.3N59 E63 H64 F65 D378N59-G61 PolarHBondContact O-N 2.97Å; G61-E63 PolarHBondContact O-N 2.82Å; G61-H64 PolarHBondContact O-N 3.32Å; G61-H64 VanDerWaalsContact O-N 3.09Å; G61-F65 WeakPolarHBondContact O-CD2 3.45Å; G61-F65 PolarHBondContact O-N 2.86Å; G61-F65 VanDerWaalsContact O-N 3.16Å; G61-D378 WeakPolarHBondContact CA-OD2 3.31Å
62S83.4Confident91.6Very high5 Ų53.4 Ų3.44%0.0352%0.019CC..Hα-helixtrans-63.1-32.2174.977.50000112.9H64 F65 I66 D142 A145 L375S62-H64 PolarHBondContact O-N 2.97Å; S62-F65 PolarHBondContact O-N 3.06Å; S62-I66 VanDerWaalsContact O-CB 3.26Å; S62-I66 WeakPolarHBondContact O-CB 3.45Å; S62-I66 WeakPolarHBondContact O-CG1 3.38Å; S62-I66 PolarHBondContact O-N 2.87Å; S62-D142 WeakPolarHBondContact CB-OD1 3.2Å; S62-D142 PolarHBondContact OG-O 3.27Å; S62-D142 PolarHBondContact OG-OD1 3.5Å; S62-A145 VanDerWaalsContact OG-CB 3.31Å; S62-A145 WeakPolarHBondContact OG-CB 3.45Å; S62-L375 VanDerWaalsContact OG-CD2 3.22Å; S62-L375 WeakPolarHBondContact OG-CD2 3.08Å
63E88.9Confident91.7Very high30 Ų303.4 Ų3.414%0.142%0.019CC..Iπ-helixtrans-59.7-30.317572.3-179-171.300111.9G61 G67 L68 I441G61-E63 PolarHBondContact O-N 2.82Å; E63-G67 CarbonylContact O-C 3.57Å; E63-G67 WeakPolarHBondContact O-CA 3.45Å; E63-G67 PolarHBondContact O-N 3.2Å; E63-L68 PolarHBondContact O-N 3.26Å; E63-I441 HydrophobicContact CB-CD1 4.04Å
64H93.6Very high91.7Very high1 Ų14.4 Ų4.41%0.0053%0.027CC..Iπ-helixtrans-82.1-48.2176.7-68.469.3000110.4N59 I60 G61 S62 I66 L68 A69 E83 I313N59-H64 PolarHBondContact ND2-CE1 3.46Å; N59-H64 PolarHBondContact O-CE1 2.91Å; N59-H64 PolarHBondContact O-ND1 3.43Å; I60-H64 HydrophobicContact CG2-CB 4.45Å; G61-H64 PolarHBondContact O-N 3.32Å; G61-H64 VanDerWaalsContact O-N 3.09Å; S62-H64 PolarHBondContact O-N 2.97Å; H64-I66 VanDerWaalsContact C-N 3.32Å; H64-I66 PolarHBondContact O-N 3.47Å; H64-L68 HydrophobicContact CB-CB 4.24Å; H64-L68 HydrophobicContact CB-CD2 4.48Å; H64-L68 WeakPolarHBondContact O-CA 3.39Å; H64-L68 WeakPolarHBondContact O-CB 3.37Å; H64-L68 PolarHBondContact O-N 3.23Å; H64-L68 VanDerWaalsContact O-N 3.13Å; H64-A69 PolarHBondContact O-N 2.84Å; H64-E83 IonicContact CD2-OE1 2.91Å; H64-E83 IonicContact NE2-OE1 2.68Å; H64-E83 PolarHBondContact NE2-OE1 3.37Å; H64-I313 HydrophobicContact CB-CD1 3.97Å; H64-I313 WeakPolarHBondContact O-CG2 3.42Å
65F92Very high91.7Very high3 Ų34.5 Ų4.51%0.0133%0.028CC..Iπ-helixtrans-64.5-35179.4-76.4-68.5000113.8I60 G61 S62 A69 M192 A196 I313 Y351 M367 M371I60-F65 HydrophobicContact CG2-CE2 4.21Å; G61-F65 WeakPolarHBondContact O-CD2 3.45Å; G61-F65 PolarHBondContact O-N 2.86Å; G61-F65 VanDerWaalsContact O-N 3.16Å; S62-F65 PolarHBondContact O-N 3.06Å; F65-A69 WeakPolarHBondContact O-CB 3.09Å; F65-M192 HydrophobicContact CE2-CG 3.86Å; F65-M192 HydrophobicContact CE2-SD 3.61Å; F65-M192 HydrophobicContact CZ-CG 3.6Å; F65-M192 HydrophobicContact CZ-SD 3.94Å; F65-A196 HydrophobicContact CE1-CB 4.39Å; F65-I313 HydrophobicContact CD1-CD1 4.33Å; F65-I313 HydrophobicContact CD1-CG1 4.35Å; F65-I313 HydrophobicContact CE1-CD1 4.15Å; F65-I313 HydrophobicContact CE1-CG1 4.13Å; F65-I313 HydrophobicContact CZ-CD1 4.37Å; F65-Y351 HydrophobicContact CB-CD1 4.36Å; F65-Y351 AromaticContact CD1-CD1 3.83Å; F65-Y351 HydrophobicContact CD1-CD1 3.83Å; F65-Y351 HydrophobicContact CD1-CD2 4.35Å; F65-Y351 AromaticContact CD1-CE1 3.35Å; F65-Y351 HydrophobicContact CD1-CE1 3.35Å; F65-Y351 AromaticContact CD1-CE2 3.93Å; F65-Y351 HydrophobicContact CD1-CE2 3.93Å; F65-Y351 HydrophobicContact CD1-CG 4.31Å; F65-Y351 AromaticContact CD1-CZ 3.4Å; F65-Y351 VanDerWaalsContact CD1-CZ 3.4Å; F65-Y351 AromaticContact CE1-CE1 3.82Å; F65-Y351 HydrophobicContact CE1-CE1 3.82Å; F65-Y351 HydrophobicContact CE1-CE2 4.27Å; F65-Y351 AromaticContact CE1-CZ 3.56Å; F65-Y351 WeakPolarHBondContact CE1-OH 3.4Å; F65-Y351 HydrophobicContact CG-CE1 4.34Å; F65-Y351 WeakPolarHBondContact O-CB 3.28Å; F65-M367 HydrophobicContact CD1-CE 4.49Å; F65-M367 HydrophobicContact CE1-CE 3.86Å; F65-M367 HydrophobicContact CZ-CE 4.25Å; F65-M371 HydrophobicContact CB-CE 3.47Å; F65-M371 VanDerWaalsContact CB-CE 3.47Å; F65-M371 HydrophobicContact CD1-CE 4.3Å; F65-M371 HydrophobicContact CD2-CE 4.26Å; F65-M371 HydrophobicContact CD2-CG 4.45Å; F65-M371 HydrophobicContact CG-CE 3.77Å; F65-M371 HydrophobicContact CG-SD 4.43Å
66I92.3Very high91.9Very high1 Ų14.4 Ų4.41%0.0053%0.027CC..Iπ-helixtrans-93.7-56.7-179.9-59.7-56000110.1S62 H64 G70 A145 L148 F149 N348 P352S62-I66 VanDerWaalsContact O-CB 3.26Å; S62-I66 WeakPolarHBondContact O-CB 3.45Å; S62-I66 WeakPolarHBondContact O-CG1 3.38Å; S62-I66 PolarHBondContact O-N 2.87Å; H64-I66 VanDerWaalsContact C-N 3.32Å; H64-I66 PolarHBondContact O-N 3.47Å; I66-G70 WeakPolarHBondContact O-CA 3.23Å; I66-G70 PolarHBondContact O-N 2.91Å; I66-A145 HydrophobicContact CB-CB 3.92Å; I66-A145 HydrophobicContact CG1-CB 3.95Å; I66-A145 HydrophobicContact CG2-CB 4.1Å; I66-L148 HydrophobicContact CG2-CD1 4.04Å; I66-F149 HydrophobicContact CD1-CB 4.18Å; I66-F149 HydrophobicContact CD1-CD2 4.17Å; I66-N348 HydrophobicContact CG2-CB 3.77Å; I66-N348 WeakPolarHBondContact CG2-O 3.48Å; I66-P352 HydrophobicContact CD1-CG 3.5Å
67G93.3Very high91.9Very high1 Ų15 Ų51%0.013%0.03CC..Iπ-helixtrans-75.9-53-173.600000113.4E63 G70 S71 Y438E63-G67 CarbonylContact O-C 3.57Å; E63-G67 WeakPolarHBondContact O-CA 3.45Å; E63-G67 PolarHBondContact O-N 3.2Å; G67-G70 PolarHBondContact O-N 3.4Å; G67-S71 WeakPolarHBondContact O-CB 3.47Å; G67-S71 PolarHBondContact O-N 2.95Å; G67-S71 PolarHBondContact O-OG 2.88Å; G67-Y438 VanDerWaalsContact C-CB 3.43Å; G67-Y438 WeakPolarHBondContact O-CB 3.48Å
68L95.3Very high92.1Very high0 Ų05 Ų50%03%0.03CC..Iπ-helixtrans-66.7-44.9-177.4-178.671.4000110.6E63 H64 S71 G72 V79 E83 P309 I313 V314 Y438E63-L68 PolarHBondContact O-N 3.26Å; H64-L68 HydrophobicContact CB-CB 4.24Å; H64-L68 HydrophobicContact CB-CD2 4.48Å; H64-L68 WeakPolarHBondContact O-CA 3.39Å; H64-L68 WeakPolarHBondContact O-CB 3.37Å; H64-L68 PolarHBondContact O-N 3.23Å; H64-L68 VanDerWaalsContact O-N 3.13Å; L68-S71 PolarHBondContact O-N 3.3Å; L68-G72 PolarHBondContact O-N 3.31Å; L68-V79 HydrophobicContact CD1-CB 3.65Å; L68-V79 HydrophobicContact CD1-CG2 3.7Å; L68-V79 HydrophobicContact CG-CG2 4.46Å; L68-E83 HydrophobicContact CD2-CG 3.92Å; L68-P309 HydrophobicContact CD2-CB 4.45Å; L68-I313 HydrophobicContact CB-CG2 4.29Å; L68-I313 HydrophobicContact CD2-CG2 4.19Å; L68-I313 HydrophobicContact CG-CG2 4.35Å; L68-V314 HydrophobicContact CD1-CG2 4.26Å; L68-V314 HydrophobicContact CD2-CG2 4.04Å; L68-V314 HydrophobicContact CG-CG2 3.91Å; L68-Y438 HydrophobicContact CB-CD2 3.9Å; L68-Y438 HydrophobicContact CB-CE2 4Å; L68-Y438 HydrophobicContact CB-CG 4.35Å; L68-Y438 HydrophobicContact CD1-CD1 4.16Å; L68-Y438 HydrophobicContact CD1-CD2 4.45Å; L68-Y438 HydrophobicContact CD1-CE1 3.84Å; L68-Y438 HydrophobicContact CD1-CE2 4.14Å; L68-Y438 HydrophobicContact CD1-CG 4.45Å
69A96.3Very high92.4Very high0 Ų04.7 Ų4.70%03%0.028CC..Hα-helixtrans-63.6-41.9174.500000112.1H64 F65 S71 G72 A73 I313 G317 Y351H64-A69 PolarHBondContact O-N 2.84Å; F65-A69 WeakPolarHBondContact O-CB 3.09Å; A69-S71 VanDerWaalsContact C-N 3.33Å; A69-S71 PolarHBondContact O-N 3.38Å; A69-G72 CarbonylContact O-C 3.5Å; A69-G72 WeakPolarHBondContact O-CA 3.35Å; A69-G72 PolarHBondContact O-N 3.09Å; A69-G72 VanDerWaalsContact O-N 3.12Å; A69-A73 PolarHBondContact O-N 3.44Å; A69-I313 HydrophobicContact CB-CG2 3.72Å; A69-G317 WeakPolarHBondContact O-CA 3.33Å; A69-Y351 HydrophobicContact CB-CD2 3.74Å; A69-Y351 HydrophobicContact CB-CG 4.11Å
70G95Very high92.6Very high0 Ų04.3 Ų4.30%03%0.026CC..Hα-helixtrans-64-39.517700000112.6I66 G67 G72 A73 A74 S347I66-G70 WeakPolarHBondContact O-CA 3.23Å; I66-G70 PolarHBondContact O-N 2.91Å; G67-G70 PolarHBondContact O-N 3.4Å; G70-G72 VanDerWaalsContact C-N 3.3Å; G70-G72 PolarHBondContact O-N 2.97Å; G70-A73 WeakPolarHBondContact O-CB 3.41Å; G70-A73 PolarHBondContact O-N 3.49Å; G70-A73 VanDerWaalsContact O-N 3.16Å; G70-A74 PolarHBondContact O-N 3.49Å; G70-S347 WeakPolarHBondContact CA-O 3.41Å; G70-S347 WeakPolarHBondContact O-CB 3.44Å
71S95Very high92.8Very high0 Ų04.2 Ų4.20%03%0.025CC..Hα-helixtrans-69.3-30.4172.6-570000112.1G67 L68 A69 A74 S75 Q436G67-S71 WeakPolarHBondContact O-CB 3.47Å; G67-S71 PolarHBondContact O-N 2.95Å; G67-S71 PolarHBondContact O-OG 2.88Å; L68-S71 PolarHBondContact O-N 3.3Å; A69-S71 VanDerWaalsContact C-N 3.33Å; A69-S71 PolarHBondContact O-N 3.38Å; S71-A74 PolarHBondContact O-N 2.79Å; S71-S75 WeakPolarHBondContact O-CA 3.45Å; S71-S75 WeakPolarHBondContact O-CB 3.48Å; S71-S75 PolarHBondContact O-N 3.36Å; S71-S75 PolarHBondContact O-OG 3.33Å; S71-Q436 PolarHBondContact OG-NE2 3.28Å
72G95.8Very high93.3Very high0 Ų04.8 Ų4.80%03%0.027CC..Hα-helixtrans-63.9-39.116800000112.4L68 A69 G70 G76 M318L68-G72 PolarHBondContact O-N 3.31Å; A69-G72 CarbonylContact O-C 3.5Å; A69-G72 WeakPolarHBondContact O-CA 3.35Å; A69-G72 PolarHBondContact O-N 3.09Å; A69-G72 VanDerWaalsContact O-N 3.12Å; G70-G72 VanDerWaalsContact C-N 3.3Å; G70-G72 PolarHBondContact O-N 2.97Å; G72-G76 WeakPolarHBondContact O-CA 3.38Å; G72-G76 PolarHBondContact O-N 3.01Å; G72-M318 WeakPolarHBondContact O-CG 3.27Å
73A95.9Very high93.8Very high0 Ų04.6 Ų4.60%03%0.026CC..Hα-helixtrans-62.6-46.9172.600000111.1A69 G70 Y217 G317 R321 I328 A350A69-A73 PolarHBondContact O-N 3.44Å; G70-A73 WeakPolarHBondContact O-CB 3.41Å; G70-A73 PolarHBondContact O-N 3.49Å; G70-A73 VanDerWaalsContact O-N 3.16Å; A73-Y217 PolarHBondContact O-OH 3.08Å; A73-G317 VanDerWaalsContact CB-O 3.25Å; A73-G317 WeakPolarHBondContact CB-O 3.36Å; A73-R321 HydrophobicContact CB-CB 4.26Å; A73-R321 WeakPolarHBondContact O-CD 3.43Å; A73-R321 PolarHBondContact O-NH1 3.2Å; A73-I328 HydrophobicContact CB-CG2 4.17Å; A73-A350 HydrophobicContact CB-CB 3.7Å
74A93Very high94.1Very high28 Ų283.3 Ų3.323%0.2312%0.02CC..Hα-helixtrans-71.4-45.9-178.200000113.9G70 S71 Y217 R321 Q436G70-A74 PolarHBondContact O-N 3.49Å; S71-A74 PolarHBondContact O-N 2.79Å; A74-Y217 PolarHBondContact O-OH 2.85Å; A74-R321 PolarHBondContact O-NH1 3.43Å; A74-R321 VanDerWaalsContact O-NH1 3.1Å; A74-Q436 HydrophobicContact CB-CG 4.02Å
75S91.9Very high94.1Very high1 Ų13.7 Ų3.71%0.0072%0.022CC..Hα-helixtrans-119-2.7-166.673.20000114.8S71 R252S71-S75 WeakPolarHBondContact O-CA 3.45Å; S71-S75 WeakPolarHBondContact O-CB 3.48Å; S71-S75 PolarHBondContact O-N 3.36Å; S71-S75 PolarHBondContact O-OG 3.33Å; S75-R252 PolarHBondContact O-NH2 3.43Å
76G94.2Very high94.3Very high0 Ų03.6 Ų3.60%02%0.022CC..G310 helixtrans74.8-138.1177.500000113.3G72 A78 Y217 S247 V314G72-G76 WeakPolarHBondContact O-CA 3.38Å; G72-G76 PolarHBondContact O-N 3.01Å; G76-A78 PolarHBondContact O-N 3.09Å; G76-Y217 PolarHBondContact N-OH 3.22Å; G76-Y217 VanDerWaalsContact N-OH 3.12Å; G76-S247 CarbonylContact C-O 3.6Å; G76-S247 WeakPolarHBondContact CA-O 3.34Å; G76-V314 WeakPolarHBondContact O-CG1 3.4Å
77F94.3Very high94.5Very high18 Ų183.6 Ų3.68%0.0792%0.022CC..G310 helixtrans-69.1-20.1-173.3-70.6-18.8000114.4V79 G80 S247 L248 I250 M310 I315 M318 F704F77-V79 VanDerWaalsContact C-N 3.25Å; F77-V79 PolarHBondContact O-N 2.91Å; F77-V79 VanDerWaalsContact O-N 3.1Å; F77-G80 PolarHBondContact O-N 2.92Å; F77-S247 PolarHBondContact N-O 3.42Å; F77-L248 HydrophobicContact CD2-CB 4.39Å; F77-L248 HydrophobicContact CD2-CD2 4.41Å; F77-L248 WeakPolarHBondContact CD2-O 3.38Å; F77-L248 HydrophobicContact CE2-CD2 4.13Å; F77-L248 HydrophobicContact CZ-CD2 4.49Å; F77-I250 HydrophobicContact CB-CG1 4.23Å; F77-I250 WeakPolarHBondContact O-CG1 3.49Å; F77-M310 HydrophobicContact CB-CE 3.73Å; F77-M310 HydrophobicContact CD1-CE 3.29Å; F77-M310 HydrophobicContact CD2-CE 4.23Å; F77-M310 HydrophobicContact CE1-CE 3.91Å; F77-M310 HydrophobicContact CG-CE 3.49Å; F77-M310 VanDerWaalsContact CG-CE 3.49Å; F77-I315 HydrophobicContact CE1-CD1 4.36Å; F77-I315 HydrophobicContact CE1-CG1 3.8Å; F77-M318 HydrophobicContact CD1-CE 3.98Å; F77-M318 HydrophobicContact CD1-SD 3.28Å; F77-M318 WeakPolarHBondContact CD1-SD 3.37Å; F77-M318 HydrophobicContact CE1-CE 3.82Å; F77-M318 HydrophobicContact CE1-SD 3.29Å; F77-M318 WeakPolarHBondContact CE1-SD 3.03Å; F77-M318 HydrophobicContact CG-SD 4.33Å; F77-M318 HydrophobicContact CZ-CE 4.35Å; F77-M318 HydrophobicContact CZ-SD 4.34Å; F77-F704 AromaticContact CD2-CD1 3.84Å; F77-F704 HydrophobicContact CD2-CD1 3.84Å; F77-F704 HydrophobicContact CD2-CE1 4.2Å; F77-F704 HydrophobicContact CE2-CD1 4.02Å; F77-F704 AromaticContact CE2-CE1 3.98Å; F77-F704 HydrophobicContact CE2-CE1 3.98Å; F77-F704 HydrophobicContact CG-CD1 4.37Å; F77-F704 HydrophobicContact CZ-CE1 4.24Å
78A92.3Very high94.6Very high0 Ų06.7 Ų6.70%04%0.038CC..G310 helixtrans-43.2-51.3-17500000112.2G76 G80 A81 I259G76-A78 PolarHBondContact O-N 3.09Å; A78-G80 PolarHBondContact O-N 3.45Å; A78-G80 VanDerWaalsContact O-N 3.1Å; A78-A81 WeakPolarHBondContact O-CB 2.95Å; A78-A81 PolarHBondContact O-N 3.28Å; A78-I259 HydrophobicContact CB-CD1 3.32Å; A78-I259 HydrophobicContact CB-CG1 4.03Å; A78-I259 WeakPolarHBondContact O-CD1 3.43Å
79V93.6Very high94.6Very high1 Ų17.2 Ų7.21%0.0064%0.041CC..G310 helixtrans-66.8-13.4-176.5-63.60000115.5L68 F77 A81 W82 V314L68-V79 HydrophobicContact CD1-CB 3.65Å; L68-V79 HydrophobicContact CD1-CG2 3.7Å; L68-V79 HydrophobicContact CG-CG2 4.46Å; F77-V79 VanDerWaalsContact C-N 3.25Å; F77-V79 PolarHBondContact O-N 2.91Å; F77-V79 VanDerWaalsContact O-N 3.1Å; V79-A81 PolarHBondContact O-N 3.44Å; V79-A81 VanDerWaalsContact O-N 3.15Å; V79-W82 HydrophobicContact CB-CE3 4.27Å; V79-W82 HydrophobicContact CB-CZ3 4.24Å; V79-W82 HydrophobicContact CG1-CZ3 4.04Å; V79-W82 PolarHBondContact O-N 3.42Å; V79-V314 HydrophobicContact CG2-CG1 4.05Å; V79-V314 HydrophobicContact CG2-CG2 3.99Å
80G94.4Very high94.6Very high0 Ų07.2 Ų7.20%04%0.041CC..Hα-helixtrans-61.9-16.1169.200000113.5F77 A78 W82 E83 F84F77-G80 PolarHBondContact O-N 2.92Å; A78-G80 PolarHBondContact O-N 3.45Å; A78-G80 VanDerWaalsContact O-N 3.1Å; G80-W82 VanDerWaalsContact C-N 3.28Å; G80-W82 PolarHBondContact O-N 2.94Å; G80-E83 PolarHBondContact O-N 2.79Å; G80-F84 PolarHBondContact O-N 2.79Å
81A94.1Very high94.7Very high0 Ų07.5 Ų7.50%04%0.042CC..Hα-helixtrans-54.2-42.9177.100000112.5A78 V79 E83 N85 I250 F264 F701A78-A81 WeakPolarHBondContact O-CB 2.95Å; A78-A81 PolarHBondContact O-N 3.28Å; V79-A81 PolarHBondContact O-N 3.44Å; V79-A81 VanDerWaalsContact O-N 3.15Å; A81-E83 VanDerWaalsContact C-N 3.34Å; A81-E83 PolarHBondContact O-N 2.86Å; A81-N85 VanDerWaalsContact O-CB 3.23Å; A81-N85 WeakPolarHBondContact O-CB 3.48Å; A81-N85 PolarHBondContact O-N 2.78Å; A81-I250 HydrophobicContact CB-CG2 3.44Å; A81-I250 VanDerWaalsContact CB-CG2 3.44Å; A81-F264 HydrophobicContact CB-CD1 4.36Å; A81-F264 HydrophobicContact CB-CD2 4.07Å; A81-F264 HydrophobicContact CB-CE1 3.79Å; A81-F264 HydrophobicContact CB-CE2 3.46Å; A81-F264 VanDerWaalsContact CB-CE2 3.46Å; A81-F264 HydrophobicContact CB-CG 4.5Å; A81-F264 HydrophobicContact CB-CZ 3.32Å; A81-F264 WeakPolarHBondContact O-CZ 3.15Å; A81-F701 HydrophobicContact CB-CE2 4.36Å
82W94.1Very high94.8Very high11 Ų119.6 Ų9.64%0.0425%0.053CC..Hα-helixtrans-63.5-40.2-178.8-80.1-90.9000112.3V79 G80 N85 A86 I259 F264 Q268 Y438 Q442 Y511 M512V79-W82 HydrophobicContact CB-CE3 4.27Å; V79-W82 HydrophobicContact CB-CZ3 4.24Å; V79-W82 HydrophobicContact CG1-CZ3 4.04Å; V79-W82 PolarHBondContact O-N 3.42Å; G80-W82 VanDerWaalsContact C-N 3.28Å; G80-W82 PolarHBondContact O-N 2.94Å; W82-N85 PolarHBondContact O-N 2.95Å; W82-A86 WeakPolarHBondContact O-CB 3.13Å; W82-A86 PolarHBondContact O-N 2.53Å; W82-I259 HydrophobicContact CE3-CD1 4.33Å; W82-I259 HydrophobicContact CH2-CD1 3.99Å; W82-I259 HydrophobicContact CH2-CG1 4.16Å; W82-I259 HydrophobicContact CZ3-CD1 3.42Å; W82-I259 VanDerWaalsContact CZ3-CD1 3.42Å; W82-I259 HydrophobicContact CZ3-CG1 4.1Å; W82-F264 AromaticContact CD2-CE2 3.84Å; W82-F264 HydrophobicContact CD2-CE2 3.84Å; W82-F264 AromaticContact CE2-CE2 3.88Å; W82-F264 HydrophobicContact CE3-CE2 4.21Å; W82-F264 HydrophobicContact CG-CE2 4.18Å; W82-F264 HydrophobicContact CG-CZ 4.48Å; W82-F264 HydrophobicContact CZ2-CE2 4.27Å; W82-Q268 HydrophobicContact CZ2-CG 4.39Å; W82-Y438 HydrophobicContact CB-CE1 4.41Å; W82-Y438 WeakPolarHBondContact CB-OH 3.47Å; W82-Y438 AromaticContact CD2-CE1 3.84Å; W82-Y438 HydrophobicContact CD2-CE1 3.84Å; W82-Y438 AromaticContact CE3-CE1 3.93Å; W82-Y438 HydrophobicContact CE3-CE1 3.93Å; W82-Y438 HydrophobicContact CG-CE1 4.05Å; W82-Y438 HydrophobicContact CZ3-CE1 4.47Å; W82-Q442 HydrophobicContact CZ2-CB 4.04Å; W82-Q442 HydrophobicContact CZ2-CG 3.87Å; W82-Q442 VanDerWaalsContact NE1-CD 3.27Å; W82-Q442 VanDerWaalsContact NE1-OE1 3.12Å; W82-Y511 WeakPolarHBondContact CZ2-OH 3.47Å; W82-M512 HydrophobicContact CH2-CE 3.52Å; W82-M512 HydrophobicContact CZ2-CE 3.43Å; W82-M512 VanDerWaalsContact CZ2-CE 3.43Å
83E94.8Very high94.8Very high2 Ų29.6 Ų9.61%0.0095%0.053CC..Hα-helixtrans-66.8-45.7-178.3-61.4-58.5116.900111.3H64 L68 G80 A81 A86 I87 K306 P309H64-E83 IonicContact CD2-OE1 2.91Å; H64-E83 IonicContact NE2-OE1 2.68Å; H64-E83 PolarHBondContact NE2-OE1 3.37Å; L68-E83 HydrophobicContact CD2-CG 3.92Å; G80-E83 PolarHBondContact O-N 2.79Å; A81-E83 VanDerWaalsContact C-N 3.34Å; A81-E83 PolarHBondContact O-N 2.86Å; E83-A86 WeakPolarHBondContact O-CB 3.45Å; E83-A86 PolarHBondContact O-N 3.15Å; E83-I87 PolarHBondContact O-N 3.48Å; E83-K306 IonicContact OE1-NZ 3.59Å; E83-K306 PolarHBondContact OE1-NZ 3.38Å; E83-K306 WeakPolarHBondContact OE2-CD 3.42Å; E83-K306 WeakPolarHBondContact OE2-CE 3.24Å; E83-K306 IonicContact OE2-NZ 3.3Å; E83-K306 PolarHBondContact OE2-NZ 3.5Å; E83-P309 HydrophobicContact CG-CB 3.94Å; E83-P309 VanDerWaalsContact OE2-CB 3.23Å; E83-P309 WeakPolarHBondContact OE2-CB 3.23Å; E83-P309 VanDerWaalsContact OE2-CG 3.23Å; E83-P309 WeakPolarHBondContact OE2-CG 3.38Å
84F94.5Very high94.8Very high2 Ų29.6 Ų9.61%0.0095%0.053CC..Hα-helixtrans-72.4-32177.4-66.3-17.6000112.9G80 A86 I87 I250 M310 M700 F701 F704G80-F84 PolarHBondContact O-N 2.79Å; F84-A86 VanDerWaalsContact C-N 3.34Å; F84-I87 HydrophobicContact CD1-CD1 3.91Å; F84-I87 WeakPolarHBondContact O-CB 3.46Å; F84-I87 PolarHBondContact O-N 3.14Å; F84-I250 HydrophobicContact CD2-CD1 3.72Å; F84-I250 HydrophobicContact CE2-CD1 3.59Å; F84-M310 HydrophobicContact CE1-CB 4.01Å; F84-M310 HydrophobicContact CE1-CG 4.43Å; F84-M310 HydrophobicContact CE2-CG 4.48Å; F84-M310 HydrophobicContact CZ-CB 3.89Å; F84-M310 HydrophobicContact CZ-CG 3.81Å; F84-M700 HydrophobicContact CD1-CB 4.3Å; F84-M700 HydrophobicContact CD2-CB 4.04Å; F84-M700 HydrophobicContact CE1-CB 3.98Å; F84-M700 HydrophobicContact CE1-CG 4.49Å; F84-M700 HydrophobicContact CE2-CB 3.7Å; F84-M700 HydrophobicContact CG-CB 4.33Å; F84-M700 HydrophobicContact CZ-CB 3.67Å; F84-M700 HydrophobicContact CZ-CG 4.33Å; F84-F701 HydrophobicContact CB-CB 4.43Å; F84-F701 HydrophobicContact CB-CD2 3.74Å; F84-F701 HydrophobicContact CD2-CB 4.47Å; F84-F701 HydrophobicContact CD2-CD2 4.32Å; F84-F704 AromaticContact CE2-CD2 3.7Å; F84-F704 HydrophobicContact CE2-CD2 3.7Å; F84-F704 HydrophobicContact CE2-CE2 4.28Å; F84-F704 HydrophobicContact CE2-CG 4.38Å; F84-F704 HydrophobicContact CZ-CD2 4.02Å; F84-F704 HydrophobicContact CZ-CE2 4.14Å
85N94.9Very high94.9Very high9 Ų910.8 Ų10.85%0.0485%0.052CC..Hα-helixtrans-61.9-43.6171.8-168.4-27000111.2A81 W82 I87 L88 L89 F264 T269A81-N85 VanDerWaalsContact O-CB 3.23Å; A81-N85 WeakPolarHBondContact O-CB 3.48Å; A81-N85 PolarHBondContact O-N 2.78Å; W82-N85 PolarHBondContact O-N 2.95Å; N85-I87 PolarHBondContact O-N 3.2Å; N85-L88 PolarHBondContact O-N 3.12Å; N85-L88 VanDerWaalsContact O-N 3.15Å; N85-L89 PolarHBondContact O-N 3.21Å; N85-L89 WeakPolarHBondContact OD1-CD1 3.14Å; N85-F264 HydrophobicContact CB-CE1 4.03Å; N85-F264 HydrophobicContact CB-CZ 4.02Å; N85-F264 VanDerWaalsContact ND2-CE1 3.3Å; N85-F264 WeakPolarHBondContact ND2-CE1 3.46Å; N85-T269 PolarHBondContact ND2-OG1 3.41Å
86A95.1Very high95.1Very high2 Ų212.2 Ų12.22%0.0176%0.06CC..Hα-helixtrans-56.7-34.2177.300000113.8W82 E83 F84 L88 L89 L90 W276 K306W82-A86 WeakPolarHBondContact O-CB 3.13Å; W82-A86 PolarHBondContact O-N 2.53Å; E83-A86 WeakPolarHBondContact O-CB 3.45Å; E83-A86 PolarHBondContact O-N 3.15Å; F84-A86 VanDerWaalsContact C-N 3.34Å; A86-L88 VanDerWaalsContact C-N 3.26Å; A86-L88 PolarHBondContact O-N 3.09Å; A86-L89 PolarHBondContact O-N 3.39Å; A86-L90 WeakPolarHBondContact O-CB 3.18Å; A86-L90 WeakPolarHBondContact O-CG 3.4Å; A86-L90 PolarHBondContact O-N 3.29Å; A86-W276 VanDerWaalsContact CB-CE2 3.44Å; A86-W276 HydrophobicContact CB-CH2 4.34Å; A86-W276 HydrophobicContact CB-CZ2 3.33Å; A86-K306 HydrophobicContact CB-CD 4.13Å; A86-K306 HydrophobicContact CB-CG 4.44Å
87I96.1Very high95.1Very high0 Ų012.2 Ų12.20%06%0.06CC..Hα-helixtrans-54.9-44.2178.4-59.8176000110.8E83 F84 N85 Q91 K306 I307 V693E83-I87 PolarHBondContact O-N 3.48Å; F84-I87 HydrophobicContact CD1-CD1 3.91Å; F84-I87 WeakPolarHBondContact O-CB 3.46Å; F84-I87 PolarHBondContact O-N 3.14Å; N85-I87 PolarHBondContact O-N 3.2Å; I87-Q91 WeakPolarHBondContact O-CG 3.43Å; I87-Q91 PolarHBondContact O-NE2 2.83Å; I87-K306 HydrophobicContact CG1-CB 3.88Å; I87-I307 HydrophobicContact CD1-CG1 3.61Å; I87-V693 HydrophobicContact CG2-CG1 3.61Å
88L95.6Very high95.1Very high67 Ų6711.3 Ų11.335%0.3516%0.056SC..Hα-helixtrans-75.2-40.4-178.5-58.9179.9000111.7N85 A86 Q91 L92 C694 I698N85-L88 PolarHBondContact O-N 3.12Å; N85-L88 VanDerWaalsContact O-N 3.15Å; A86-L88 VanDerWaalsContact C-N 3.26Å; A86-L88 PolarHBondContact O-N 3.09Å; L88-Q91 PolarHBondContact O-N 3.45Å; L88-Q91 VanDerWaalsContact O-N 3.12Å; L88-L92 PolarHBondContact O-N 3.26Å; L88-L92 VanDerWaalsContact O-N 3.07Å; L88-C694 HydrophobicContact CD2-CB 4.11Å; L88-I698 HydrophobicContact CD1-CG1 4.43Å; L88-I698 HydrophobicContact CD2-CG1 4.26Å
89L96.4Very high95.2Very high10 Ų1011.8 Ų11.85%0.0526%0.059CC..Hα-helixtrans-72.1-29.6-177-64-179.1000113.3N85 A86 Q91 L92 L93 T269 I273 W276N85-L89 PolarHBondContact O-N 3.21Å; N85-L89 WeakPolarHBondContact OD1-CD1 3.14Å; A86-L89 PolarHBondContact O-N 3.39Å; L89-Q91 PolarHBondContact O-N 3.06Å; L89-L92 HydrophobicContact CD2-CD2 4.02Å; L89-L92 WeakPolarHBondContact O-CB 3.48Å; L89-L92 PolarHBondContact O-N 3.39Å; L89-L93 PolarHBondContact O-N 3.09Å; L89-T269 HydrophobicContact CD2-CG2 4.4Å; L89-I273 HydrophobicContact CD1-CG1 4.5Å; L89-I273 HydrophobicContact CD2-CG1 3.66Å; L89-W276 HydrophobicContact CB-CB 4Å; L89-W276 HydrophobicContact CB-CG 3.93Å
90L96.3Very high95.1Very high0 Ų011.7 Ų11.70%06%0.059CC..Hα-helixtrans-60.4-36.4168.3-84.1166.2000111.8A86 L93 G94 W276 T299 A302 K306A86-L90 WeakPolarHBondContact O-CB 3.18Å; A86-L90 WeakPolarHBondContact O-CG 3.4Å; A86-L90 PolarHBondContact O-N 3.29Å; L90-L93 WeakPolarHBondContact O-CB 3.08Å; L90-L93 PolarHBondContact O-N 3.3Å; L90-G94 PolarHBondContact O-N 2.85Å; L90-G94 VanDerWaalsContact O-N 3.08Å; L90-W276 HydrophobicContact CD1-CE3 4.3Å; L90-W276 HydrophobicContact CD1-CH2 4.23Å; L90-W276 HydrophobicContact CD1-CZ3 3.99Å; L90-W276 HydrophobicContact CD2-CD2 4.25Å; L90-W276 HydrophobicContact CD2-CE3 3.35Å; L90-W276 HydrophobicContact CD2-CZ3 3.52Å; L90-W276 HydrophobicContact CG-CD2 4.06Å; L90-W276 HydrophobicContact CG-CE3 3.6Å; L90-W276 HydrophobicContact CG-CH2 4.4Å; L90-W276 HydrophobicContact CG-CZ3 3.8Å; L90-T299 WeakPolarHBondContact O-CB 3.03Å; L90-A302 HydrophobicContact CD1-CB 3.97Å; L90-A302 HydrophobicContact CD2-CB 4.32Å; L90-K306 HydrophobicContact CD1-CG 4.09Å
91Q96.8Very high95Very high7 Ų711.7 Ų11.73%0.0336%0.059CC..Hα-helixtrans-75.1-33.6176.1-48.8-40.1-31.800112.3I87 L88 L89 L93 G94 W95 T299 L690I87-Q91 WeakPolarHBondContact O-CG 3.43Å; I87-Q91 PolarHBondContact O-NE2 2.83Å; L88-Q91 PolarHBondContact O-N 3.45Å; L88-Q91 VanDerWaalsContact O-N 3.12Å; L89-Q91 PolarHBondContact O-N 3.06Å; Q91-L93 VanDerWaalsContact C-N 3.29Å; Q91-L93 PolarHBondContact O-N 2.8Å; Q91-G94 PolarHBondContact O-N 3.29Å; Q91-W95 HydrophobicContact CB-CE3 4.38Å; Q91-W95 PolarHBondContact O-N 3.35Å; Q91-W95 VanDerWaalsContact OE1-CZ3 3.28Å; Q91-T299 PolarHBondContact NE2-O 3.18Å; Q91-T299 PolarHBondContact OE1-OG1 2.93Å; Q91-L690 HydrophobicContact CB-CD1 3.48Å; Q91-L690 VanDerWaalsContact CB-CD1 3.48Å; Q91-L690 HydrophobicContact CG-CD1 3.61Å
92L96.8Very high94.8Very high43 Ų4312 Ų1223%0.2256%0.06CC..Hα-helixtrans-58.2-43.8169.5-177.665.8000111L88 L89 V96 F97 I273L88-L92 PolarHBondContact O-N 3.26Å; L88-L92 VanDerWaalsContact O-N 3.07Å; L89-L92 HydrophobicContact CD2-CD2 4.02Å; L89-L92 WeakPolarHBondContact O-CB 3.48Å; L89-L92 PolarHBondContact O-N 3.39Å; L92-V96 HydrophobicContact CD1-CB 4.07Å; L92-V96 HydrophobicContact CD1-CG2 3.75Å; L92-V96 WeakPolarHBondContact O-CB 3.21Å; L92-V96 PolarHBondContact O-N 3.22Å; L92-F97 HydrophobicContact CD1-CE2 4.3Å; L92-F97 HydrophobicContact CD2-CE2 3.97Å; L92-F97 HydrophobicContact CG-CD2 4.05Å; L92-F97 HydrophobicContact CG-CE2 3.81Å; L92-F97 PolarHBondContact O-N 3.02Å; L92-I273 HydrophobicContact CD2-CD1 4.28Å; L92-I273 HydrophobicContact CD2-CG1 4.07Å; L92-I273 HydrophobicContact CD2-CG2 4.42Å
93L96.6Very high94.5Very high0 Ų013 Ų130%06%0.064CC..Iπ-helixtrans-56.2-54.6172.8171.668.2000111.2L89 L90 Q91 W95 F97 I98 W276 I282 V283 V286 T299L89-L93 PolarHBondContact O-N 3.09Å; L90-L93 WeakPolarHBondContact O-CB 3.08Å; L90-L93 PolarHBondContact O-N 3.3Å; Q91-L93 VanDerWaalsContact C-N 3.29Å; Q91-L93 PolarHBondContact O-N 2.8Å; L93-W95 PolarHBondContact O-N 3.24Å; L93-F97 HydrophobicContact CD1-CB 4.21Å; L93-F97 PolarHBondContact O-N 3.36Å; L93-I98 HydrophobicContact CD1-CD1 3.79Å; L93-I98 HydrophobicContact CD1-CG1 3.61Å; L93-I98 HydrophobicContact CG-CD1 4.32Å; L93-I98 HydrophobicContact CG-CG1 3.8Å; L93-I98 WeakPolarHBondContact O-CB 3.41Å; L93-I98 WeakPolarHBondContact O-CG1 3.43Å; L93-I98 PolarHBondContact O-N 3.46Å; L93-W276 WeakPolarHBondContact CD1-O 3.29Å; L93-W276 WeakPolarHBondContact CD2-O 3.43Å; L93-I282 HydrophobicContact CD2-CG2 3.92Å; L93-V283 HydrophobicContact CD1-CG2 4.02Å; L93-V286 HydrophobicContact CD2-CG2 3.85Å; L93-T299 HydrophobicContact CD2-CG2 4.15Å; L93-T299 HydrophobicContact CG-CG2 4.4Å
94G95.4Very high94.1Very high0 Ų013 Ų130%06%0.064CC..Iπ-helixtrans-65.2-39.2-173.800000115L90 Q91 P99L90-G94 PolarHBondContact O-N 2.85Å; L90-G94 VanDerWaalsContact O-N 3.08Å; Q91-G94 PolarHBondContact O-N 3.29Å; G94-P99 WeakPolarHBondContact O-CD 3.39Å
95W95.1Very high93.4Very high54 Ų5414.4 Ų14.421%0.2058%0.08CC..Iπ-helixtrans-95.1-24.2-173.9-88.4-108.4000114.6Q91 L93 K296 L300 L686 N687 L690Q91-W95 HydrophobicContact CB-CE3 4.38Å; Q91-W95 PolarHBondContact O-N 3.35Å; Q91-W95 VanDerWaalsContact OE1-CZ3 3.28Å; L93-W95 PolarHBondContact O-N 3.24Å; W95-K296 HydrophobicContact CD2-CD 4.41Å; W95-K296 HydrophobicContact CD2-CG 4.44Å; W95-K296 HydrophobicContact CE3-CG 4.35Å; W95-K296 HydrophobicContact CH2-CB 3.95Å; W95-K296 HydrophobicContact CH2-CG 4.39Å; W95-K296 HydrophobicContact CZ2-CB 4.38Å; W95-K296 HydrophobicContact CZ2-CD 4.19Å; W95-K296 HydrophobicContact CZ3-CB 4.08Å; W95-K296 HydrophobicContact CZ3-CG 4.31Å; W95-L300 HydrophobicContact CH2-CD1 3.76Å; W95-L300 HydrophobicContact CH2-CD2 3.79Å; W95-L300 HydrophobicContact CH2-CG 3.65Å; W95-L300 HydrophobicContact CZ3-CD2 4.19Å; W95-L300 HydrophobicContact CZ3-CG 4.07Å; W95-L686 HydrophobicContact CZ2-CB 4.15Å; W95-N687 PolarHBondContact NE1-OD1 3.06Å; W95-L690 HydrophobicContact CD2-CD1 4.34Å; W95-L690 HydrophobicContact CD2-CD2 4.01Å; W95-L690 HydrophobicContact CE3-CD1 4.18Å; W95-L690 HydrophobicContact CG-CD2 4.26Å; W95-L690 HydrophobicContact CH2-CB 4Å; W95-L690 HydrophobicContact CH2-CD1 4.24Å; W95-L690 HydrophobicContact CZ2-CB 3.73Å; W95-L690 HydrophobicContact CZ2-CD1 4.36Å; W95-L690 HydrophobicContact CZ2-CD2 4.02Å; W95-L690 HydrophobicContact CZ2-CG 4.25Å; W95-L690 HydrophobicContact CZ3-CD1 4.15Å
96V95.2Very high92.9Very high30 Ų3014.4 Ų14.418%0.1828%0.08CC..Iπ-helixtrans-112.1-58.8-175.2179.40000111.1L92 V100 V460 F461 V546L92-V96 HydrophobicContact CD1-CB 4.07Å; L92-V96 HydrophobicContact CD1-CG2 3.75Å; L92-V96 WeakPolarHBondContact O-CB 3.21Å; L92-V96 PolarHBondContact O-N 3.22Å; V96-V100 WeakPolarHBondContact O-CG2 3.37Å; V96-V460 HydrophobicContact CG1-CG1 3.88Å; V96-F461 HydrophobicContact CB-CZ 4.48Å; V96-F461 HydrophobicContact CG1-CE1 3.95Å; V96-F461 HydrophobicContact CG1-CE2 4.02Å; V96-F461 HydrophobicContact CG1-CZ 3.41Å; V96-F461 VanDerWaalsContact CG1-CZ 3.41Å; V96-F461 HydrophobicContact CG2-CZ 4.37Å; V96-V546 HydrophobicContact CG1-CG2 3.93Å
97F95.6Very high92.1Very high0 Ų018.9 Ų18.90%010%0.097CC..Iπ-helixtrans-77.7-46.7-168.2-76.5-91.5000112.7L92 L93 V100 Y101 I273 C277 F456 L457 V460L92-F97 HydrophobicContact CD1-CE2 4.3Å; L92-F97 HydrophobicContact CD2-CE2 3.97Å; L92-F97 HydrophobicContact CG-CD2 4.05Å; L92-F97 HydrophobicContact CG-CE2 3.81Å; L92-F97 PolarHBondContact O-N 3.02Å; L93-F97 HydrophobicContact CD1-CB 4.21Å; L93-F97 PolarHBondContact O-N 3.36Å; F97-V100 WeakPolarHBondContact O-CB 3.42Å; F97-V100 PolarHBondContact O-N 3.15Å; F97-V100 VanDerWaalsContact O-N 3.1Å; F97-Y101 HydrophobicContact CB-CD2 4.3Å; F97-Y101 HydrophobicContact CB-CE2 3.78Å; F97-Y101 HydrophobicContact CD1-CE1 4.27Å; F97-Y101 HydrophobicContact CD1-CE2 4.22Å; F97-Y101 AromaticContact CD1-CZ 3.66Å; F97-Y101 WeakPolarHBondContact CD1-OH 3.5Å; F97-Y101 HydrophobicContact CG-CE2 4.48Å; F97-Y101 WeakPolarHBondContact O-CD2 3.35Å; F97-Y101 VanDerWaalsContact O-CG 3.26Å; F97-Y101 PolarHBondContact O-N 3.45Å; F97-I273 HydrophobicContact CZ-CG2 4.25Å; F97-C277 HydrophobicContact CB-CB 4.46Å; F97-C277 HydrophobicContact CD1-CB 3.95Å; F97-C277 HydrophobicContact CD2-CB 3.6Å; F97-C277 VanDerWaalsContact CD2-SG 3.59Å; F97-C277 HydrophobicContact CE1-CB 3.96Å; F97-C277 HydrophobicContact CE2-CB 3.65Å; F97-C277 HydrophobicContact CG-CB 3.74Å; F97-C277 HydrophobicContact CZ-CB 3.81Å; F97-F456 HydrophobicContact CE1-CB 4.25Å; F97-L457 HydrophobicContact CE2-CD2 4.45Å; F97-L457 HydrophobicContact CZ-CD2 4Å; F97-V460 HydrophobicContact CD1-CG2 3.84Å; F97-V460 HydrophobicContact CE1-CB 4.41Å; F97-V460 HydrophobicContact CE1-CG2 3.69Å
98I94.3Very high91.7Very high0 Ų019.1 Ų19.10%010%0.098CC..Hα-helixtrans-61-45.8-177.3-68.8-68.7000113.4L93 V100 Y101 I102 V283 V286 L287 I292 A295L93-I98 HydrophobicContact CD1-CD1 3.79Å; L93-I98 HydrophobicContact CD1-CG1 3.61Å; L93-I98 HydrophobicContact CG-CD1 4.32Å; L93-I98 HydrophobicContact CG-CG1 3.8Å; L93-I98 WeakPolarHBondContact O-CB 3.41Å; L93-I98 WeakPolarHBondContact O-CG1 3.43Å; L93-I98 PolarHBondContact O-N 3.46Å; I98-V100 PolarHBondContact O-N 3.32Å; I98-Y101 HydrophobicContact CD1-CD2 4.3Å; I98-Y101 PolarHBondContact O-N 3.49Å; I98-I102 HydrophobicContact CG2-CD1 3.57Å; I98-I102 HydrophobicContact CG2-CG1 4.16Å; I98-I102 WeakPolarHBondContact O-CB 3.5Å; I98-I102 WeakPolarHBondContact O-CG1 3.25Å; I98-I102 PolarHBondContact O-N 3.48Å; I98-V283 HydrophobicContact CD1-CG1 4.18Å; I98-V286 HydrophobicContact CD1-CB 3.6Å; I98-V286 HydrophobicContact CD1-CG1 3.54Å; I98-V286 HydrophobicContact CG1-CB 4.24Å; I98-V286 HydrophobicContact CG1-CG1 3.69Å; I98-V286 HydrophobicContact CG2-CG1 4.22Å; I98-L287 HydrophobicContact CD1-CD2 4.29Å; I98-L287 HydrophobicContact CD1-CG 4.43Å; I98-I292 HydrophobicContact CG2-CD1 3.81Å; I98-A295 HydrophobicContact CG2-CB 3.94Å
99P92.6Very high91.5Very high9 Ų915.9 Ų15.96%0.0588%0.082CC..Hα-helixtrans-56-38.5174.4-25.733.3000112.9G94 Y103 I292 L549G94-P99 WeakPolarHBondContact O-CD 3.39Å; P99-Y103 VanDerWaalsContact O-CB 3.28Å; P99-Y103 WeakPolarHBondContact O-CB 3.48Å; P99-Y103 PolarHBondContact O-N 2.79Å; P99-I292 HydrophobicContact CB-CD1 4.43Å; P99-I292 HydrophobicContact CG-CD1 3.86Å; P99-L549 HydrophobicContact CB-CD2 3.51Å
100V93.1Very high91.2Very high0 Ų015.4 Ų15.40%08%0.079CC..Hα-helixtrans-70.1-43.7177.71730000111.2V96 F97 I98 Y103 S104 Y112 V460 T544 V546V96-V100 WeakPolarHBondContact O-CG2 3.37Å; F97-V100 WeakPolarHBondContact O-CB 3.42Å; F97-V100 PolarHBondContact O-N 3.15Å; F97-V100 VanDerWaalsContact O-N 3.1Å; I98-V100 PolarHBondContact O-N 3.32Å; V100-Y103 PolarHBondContact O-N 3Å; V100-S104 WeakPolarHBondContact O-CB 3.44Å; V100-S104 PolarHBondContact O-N 3.27Å; V100-S104 PolarHBondContact O-OG 3.21Å; V100-Y112 HydrophobicContact CG1-CE2 3.96Å; V100-V460 HydrophobicContact CG2-CG1 4.38Å; V100-T544 VanDerWaalsContact CG1-C 3.42Å; V100-T544 WeakPolarHBondContact CG1-O 3.2Å; V100-V546 HydrophobicContact CG2-CG2 3.92Å
101Y92.6Very high90.9Very high0 Ų016.8 Ų16.80%09%0.09CC..Hα-helixtrans-64.8-44178.5-62.6-24.9000112.3F97 I98 S104 G105 M109 Y112 C277 V283 F456F97-Y101 HydrophobicContact CB-CD2 4.3Å; F97-Y101 HydrophobicContact CB-CE2 3.78Å; F97-Y101 HydrophobicContact CD1-CE1 4.27Å; F97-Y101 HydrophobicContact CD1-CE2 4.22Å; F97-Y101 AromaticContact CD1-CZ 3.66Å; F97-Y101 WeakPolarHBondContact CD1-OH 3.5Å; F97-Y101 HydrophobicContact CG-CE2 4.48Å; F97-Y101 WeakPolarHBondContact O-CD2 3.35Å; F97-Y101 VanDerWaalsContact O-CG 3.26Å; F97-Y101 PolarHBondContact O-N 3.45Å; I98-Y101 HydrophobicContact CD1-CD2 4.3Å; I98-Y101 PolarHBondContact O-N 3.49Å; Y101-S104 WeakPolarHBondContact CA-OG 3.49Å; Y101-S104 PolarHBondContact O-N 2.7Å; Y101-S104 PolarHBondContact O-OG 3.05Å; Y101-G105 PolarHBondContact O-N 2.89Å; Y101-G105 VanDerWaalsContact O-N 3.15Å; Y101-M109 HydrophobicContact CD2-CE 4.05Å; Y101-M109 HydrophobicContact CD2-SD 4.17Å; Y101-M109 HydrophobicContact CE1-SD 4.19Å; Y101-M109 HydrophobicContact CE2-CE 4.09Å; Y101-M109 HydrophobicContact CE2-SD 3.58Å; Y101-M109 VanDerWaalsContact CE2-SD 3.58Å; Y101-M109 HydrophobicContact CG-CE 4.3Å; Y101-M109 VanDerWaalsContact CZ-SD 3.58Å; Y101-Y112 AromaticContact CD1-CD2 3.7Å; Y101-Y112 HydrophobicContact CD1-CD2 3.7Å; Y101-Y112 HydrophobicContact CD1-CE2 4Å; Y101-Y112 HydrophobicContact CD1-CG 4.03Å; Y101-Y112 AromaticContact CE1-CD1 3.91Å; Y101-Y112 HydrophobicContact CE1-CD1 3.91Å; Y101-Y112 AromaticContact CE1-CD2 3.81Å; Y101-Y112 HydrophobicContact CE1-CD2 3.81Å; Y101-Y112 HydrophobicContact CE1-CE1 4.08Å; Y101-Y112 AromaticContact CE1-CE2 3.99Å; Y101-Y112 HydrophobicContact CE1-CE2 3.99Å; Y101-Y112 AromaticContact CE1-CG 3.78Å; Y101-Y112 HydrophobicContact CE1-CG 3.78Å; Y101-C277 WeakPolarHBondContact CE2-O 3.3Å; Y101-C277 PolarHBondContact OH-O 3.21Å; Y101-V283 HydrophobicContact CD2-CG1 3.54Å; Y101-V283 HydrophobicContact CE2-CG1 3.68Å; Y101-V283 HydrophobicContact CE2-CG2 4.13Å; Y101-F456 VanDerWaalsContact OH-CD1 3.28Å; Y101-F456 WeakPolarHBondContact OH-CD1 3.01Å; Y101-F456 WeakPolarHBondContact OH-CE1 3.45Å
102I88.4Confident90.7Very high5 Ų516.4 Ų16.43%0.0269%0.089CC..Hα-helixtrans-59.2-49.1173.6-69.1171.1000110I98 S104 G105 L287 I292 T672 M675 L676I98-I102 HydrophobicContact CG2-CD1 3.57Å; I98-I102 HydrophobicContact CG2-CG1 4.16Å; I98-I102 WeakPolarHBondContact O-CB 3.5Å; I98-I102 WeakPolarHBondContact O-CG1 3.25Å; I98-I102 PolarHBondContact O-N 3.48Å; I102-S104 VanDerWaalsContact C-N 3.26Å; I102-S104 PolarHBondContact O-N 3.21Å; I102-G105 PolarHBondContact O-N 3.21Å; I102-L287 HydrophobicContact CG1-CD2 3.85Å; I102-I292 HydrophobicContact CD1-CD1 3.95Å; I102-T672 HydrophobicContact CG2-CG2 4.3Å; I102-T672 VanDerWaalsContact O-CG2 3.31Å; I102-T672 WeakPolarHBondContact O-CG2 3.25Å; I102-M675 HydrophobicContact CB-SD 4.24Å; I102-M675 HydrophobicContact CD1-CG 4.19Å; I102-M675 HydrophobicContact CD1-SD 3.83Å; I102-M675 HydrophobicContact CG1-SD 3.81Å; I102-M675 HydrophobicContact CG2-CB 4.12Å; I102-M675 HydrophobicContact CG2-CG 3.85Å; I102-M675 HydrophobicContact CG2-SD 3.45Å; I102-M675 WeakPolarHBondContact CG2-SD 3.21Å; I102-L676 HydrophobicContact CB-CD2 4.03Å; I102-L676 HydrophobicContact CG2-CD1 4.45Å; I102-L676 HydrophobicContact CG2-CD2 3.69Å; I102-L676 HydrophobicContact CG2-CG 3.76Å
103Y87.5Confident90.5Very high33 Ų3314.5 Ų14.513%0.1298%0.078CC..Hα-helixtrans-62.9-34-179.7-174.1-138.1000113.1P99 V100 G105 R542 T543 L549 L552 T672 L676P99-Y103 VanDerWaalsContact O-CB 3.28Å; P99-Y103 WeakPolarHBondContact O-CB 3.48Å; P99-Y103 PolarHBondContact O-N 2.79Å; V100-Y103 PolarHBondContact O-N 3Å; Y103-G105 PolarHBondContact O-N 3.43Å; Y103-R542 WeakPolarHBondContact CE1-O 3.25Å; Y103-T543 WeakPolarHBondContact CD1-O 3.2Å; Y103-T543 HydrophobicContact CE1-CG2 4.34Å; Y103-L549 HydrophobicContact CD1-CD1 4.38Å; Y103-L549 HydrophobicContact CG-CD1 4.29Å; Y103-L552 HydrophobicContact CD2-CD2 4.08Å; Y103-L552 HydrophobicContact CE2-CD2 3.74Å; Y103-T672 HydrophobicContact CD2-CG2 4.41Å; Y103-L676 HydrophobicContact CD2-CD1 3.94Å; Y103-L676 HydrophobicContact CG-CD1 4.26Å
104S86.5Confident90.2Very high1 Ų116.1 Ų16.11%0.0079%0.09CC..Hα-helixtrans-74.2-12.7175.473.20000113.5V100 Y101 I102 V106 K115 T543V100-S104 WeakPolarHBondContact O-CB 3.44Å; V100-S104 PolarHBondContact O-N 3.27Å; V100-S104 PolarHBondContact O-OG 3.21Å; Y101-S104 WeakPolarHBondContact CA-OG 3.49Å; Y101-S104 PolarHBondContact O-N 2.7Å; Y101-S104 PolarHBondContact O-OG 3.05Å; I102-S104 VanDerWaalsContact C-N 3.26Å; I102-S104 PolarHBondContact O-N 3.21Å; S104-V106 PolarHBondContact O-N 3.44Å; S104-V106 WeakPolarHBondContact OG-CG1 3.31Å; S104-V106 WeakPolarHBondContact OG-CG2 3.38Å; S104-K115 WeakPolarHBondContact O-CD 3.16Å; S104-K115 WeakPolarHBondContact O-CE 3.43Å; S104-K115 PolarHBondContact O-NZ 2.95Å; S104-T543 WeakPolarHBondContact CA-O 3.39Å; S104-T543 WeakPolarHBondContact CB-O 3.43Å; S104-T543 PolarHBondContact N-O 3.44Å
105G81.6Confident90Very high33 Ų3320.5 Ų20.534%0.3411%0.109SC..THydrogen-bonded Turntrans65.623178.600000114.2Y101 I102 Y103Y101-G105 PolarHBondContact O-N 2.89Å; Y101-G105 VanDerWaalsContact O-N 3.15Å; I102-G105 PolarHBondContact O-N 3.21Å; Y103-G105 PolarHBondContact O-N 3.43Å
106V83.8Confident89.9Confident9 Ų918 Ų186%0.05510%0.099CC..  trans-90.3152.3-176.5-60.90000112.1S104 Y112 K115S104-V106 PolarHBondContact O-N 3.44Å; S104-V106 WeakPolarHBondContact OG-CG1 3.31Å; S104-V106 WeakPolarHBondContact OG-CG2 3.38Å; V106-Y112 HydrophobicContact CG2-CD2 4.46Å; V106-K115 HydrophobicContact CG1-CB 4.48Å; V106-K115 HydrophobicContact CG1-CD 4.11Å
107Y77.6Confident89.7Confident96 Ų9616.8 Ų16.838%0.3769%0.092SC..SBendtrans-110.4-25.2178.7-54.7-58000112.9L41 Q280L41-Y107 HydrophobicContact CD1-CD1 3.1Å; L41-Y107 HydrophobicContact CD1-CE1 3.36Å; L41-Y107 HydrophobicContact CD1-CG 3.95Å; L41-Y107 HydrophobicContact CG-CD1 4.35Å; Y107-Q280 PolarHBondContact O-NE2 3.46Å; Y107-Q280 VanDerWaalsContact O-NE2 3.11Å
108T87.7Confident89.1Confident4 Ų417.6 Ų17.63%0.02510%0.1CC..SBendtrans-124.5148.6178.474.40000111A111 Y112 Q280 T388 L392 D393T108-A111 WeakPolarHBondContact O-CB 2.82Å; T108-A111 PolarHBondContact O-N 3.44Å; T108-A111 VanDerWaalsContact O-N 3.17Å; T108-A111 WeakPolarHBondContact OG1-CB 3.47Å; T108-A111 PolarHBondContact OG1-N 3.47Å; T108-A111 VanDerWaalsContact OG1-N 3.15Å; T108-Y112 PolarHBondContact O-N 2.97Å; T108-Q280 VanDerWaalsContact CA-OE1 3.29Å; T108-T388 HydrophobicContact CG2-CG2 3.91Å; T108-L392 HydrophobicContact CG2-CD1 4.12Å; T108-D393 VanDerWaalsContact CB-OD2 3.31Å; T108-D393 WeakPolarHBondContact CB-OD2 3.13Å; T108-D393 PolarHBondContact OG1-OD1 2.82Å; T108-D393 PolarHBondContact OG1-OD2 3.49Å
109M91.8Very high88.6Confident0 Ų020.1 Ų20.10%013%0.126CC..Hα-helixtrans-65.4-36.4177.1-63.2-58.398.900112.9Y101 A111 Y112 L113 F126 A278 V283 L287 F456Y101-M109 HydrophobicContact CD2-CE 4.05Å; Y101-M109 HydrophobicContact CD2-SD 4.17Å; Y101-M109 HydrophobicContact CE1-SD 4.19Å; Y101-M109 HydrophobicContact CE2-CE 4.09Å; Y101-M109 HydrophobicContact CE2-SD 3.58Å; Y101-M109 VanDerWaalsContact CE2-SD 3.58Å; Y101-M109 HydrophobicContact CG-CE 4.3Å; Y101-M109 VanDerWaalsContact CZ-SD 3.58Å; M109-A111 VanDerWaalsContact C-N 3.34Å; M109-A111 PolarHBondContact O-N 2.87Å; M109-Y112 WeakPolarHBondContact O-CB 3.3Å; M109-Y112 PolarHBondContact O-N 3.29Å; M109-L113 PolarHBondContact O-N 3.47Å; M109-F126 HydrophobicContact CB-CE1 3.65Å; M109-F126 HydrophobicContact CB-CZ 4.28Å; M109-A278 VanDerWaalsContact CG-O 3.32Å; M109-A278 WeakPolarHBondContact CG-O 3.35Å; M109-V283 HydrophobicContact CE-CB 4.11Å; M109-V283 HydrophobicContact CE-CG1 3.38Å; M109-V283 HydrophobicContact CG-CB 4.41Å; M109-V283 HydrophobicContact SD-CB 4.01Å; M109-V283 HydrophobicContact SD-CG1 3.71Å; M109-V283 HydrophobicContact SD-CG2 4.01Å; M109-L287 HydrophobicContact CE-CD1 4.27Å; M109-F456 HydrophobicContact CB-CE1 4.43Å; M109-F456 HydrophobicContact CB-CZ 4.07Å; M109-F456 HydrophobicContact SD-CE1 4.31Å
110P91.1Very high88.2Confident0 Ų023 Ų230%014%0.141CC..Hα-helixtrans-60.9-38.7166.9-18.528.5000113.5Y112 L113 S114 K123 F126 A127 I389 D393P110-Y112 VanDerWaalsContact C-N 3.33Å; P110-Y112 PolarHBondContact O-N 2.89Å; P110-L113 PolarHBondContact O-N 3Å; P110-S114 PolarHBondContact O-N 2.89Å; P110-K123 HydrophobicContact CB-CG 3.78Å; P110-F126 HydrophobicContact CB-CD1 4.01Å; P110-F126 HydrophobicContact CG-CD1 3.58Å; P110-F126 HydrophobicContact CG-CE1 3.96Å; P110-A127 HydrophobicContact CB-CB 4.36Å; P110-A127 HydrophobicContact CG-CB 4.11Å; P110-I389 HydrophobicContact CG-CG2 4.47Å; P110-D393 HydrophobicContact CB-CB 4.03Å; P110-D393 HydrophobicContact CG-CB 4.22Å; P110-D393 WeakPolarHBondContact CG-OD2 3.4Å
111A88.6Confident88.1Confident28 Ų2830.5 Ų30.523%0.23117%0.169CC..Hα-helixtrans-65.4-35.5175.900000112.3T108 M109 S114 K115T108-A111 WeakPolarHBondContact O-CB 2.82Å; T108-A111 PolarHBondContact O-N 3.44Å; T108-A111 VanDerWaalsContact O-N 3.17Å; T108-A111 WeakPolarHBondContact OG1-CB 3.47Å; T108-A111 PolarHBondContact OG1-N 3.47Å; T108-A111 VanDerWaalsContact OG1-N 3.15Å; M109-A111 VanDerWaalsContact C-N 3.34Å; M109-A111 PolarHBondContact O-N 2.87Å; A111-S114 PolarHBondContact O-N 3.31Å; A111-K115 WeakPolarHBondContact O-CB 3.32Å; A111-K115 PolarHBondContact O-N 3.42Å
112Y92.9Very high87.9Confident0 Ų030.6 Ų30.60%017%0.17CC..Hα-helixtrans-55.8-49.6169.3173.5-102.6000111.8V100 Y101 V106 T108 M109 P110 S114 K115 R116 F456 V460 T544V100-Y112 HydrophobicContact CG1-CE2 3.96Å; Y101-Y112 AromaticContact CD1-CD2 3.7Å; Y101-Y112 HydrophobicContact CD1-CD2 3.7Å; Y101-Y112 HydrophobicContact CD1-CE2 4Å; Y101-Y112 HydrophobicContact CD1-CG 4.03Å; Y101-Y112 AromaticContact CE1-CD1 3.91Å; Y101-Y112 HydrophobicContact CE1-CD1 3.91Å; Y101-Y112 AromaticContact CE1-CD2 3.81Å; Y101-Y112 HydrophobicContact CE1-CD2 3.81Å; Y101-Y112 HydrophobicContact CE1-CE1 4.08Å; Y101-Y112 AromaticContact CE1-CE2 3.99Å; Y101-Y112 HydrophobicContact CE1-CE2 3.99Å; Y101-Y112 AromaticContact CE1-CG 3.78Å; Y101-Y112 HydrophobicContact CE1-CG 3.78Å; V106-Y112 HydrophobicContact CG2-CD2 4.46Å; T108-Y112 PolarHBondContact O-N 2.97Å; M109-Y112 WeakPolarHBondContact O-CB 3.3Å; M109-Y112 PolarHBondContact O-N 3.29Å; P110-Y112 VanDerWaalsContact C-N 3.33Å; P110-Y112 PolarHBondContact O-N 2.89Å; Y112-S114 VanDerWaalsContact C-N 3.33Å; Y112-S114 PolarHBondContact O-N 2.94Å; Y112-K115 PolarHBondContact O-N 3.44Å; Y112-R116 HydrophobicContact CE1-CB 4.49Å; Y112-R116 WeakPolarHBondContact O-CB 3.39Å; Y112-R116 PolarHBondContact O-N 2.98Å; Y112-F456 HydrophobicContact CD1-CD1 4.05Å; Y112-F456 AromaticContact CD1-CE1 3.62Å; Y112-F456 HydrophobicContact CD1-CE1 3.62Å; Y112-F456 HydrophobicContact CD1-CZ 4.38Å; Y112-F456 HydrophobicContact CE1-CD1 4.05Å; Y112-F456 HydrophobicContact CE1-CE1 4.11Å; Y112-V460 HydrophobicContact CE1-CG2 4.35Å; Y112-V460 WeakPolarHBondContact OH-CG2 2.97Å; Y112-T544 HydrophobicContact CE2-CG2 4.44Å; Y112-T544 PolarHBondContact OH-O 3.02Å
113L92.1Very high88Confident2 Ų231.7 Ų31.71%0.0118%0.175CC..Hα-helixtrans-61.6-41.7178.2-67.7177.7000112M109 P110 K115 R116 F117 L122 F126 F456M109-L113 PolarHBondContact O-N 3.47Å; P110-L113 PolarHBondContact O-N 3Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 3.48Å; L113-R116 PolarHBondContact O-N 2.89Å; L113-F117 HydrophobicContact CB-CD2 4.47Å; L113-F117 HydrophobicContact CD2-CD2 4.03Å; L113-F117 HydrophobicContact CD2-CE2 3.72Å; L113-F117 WeakPolarHBondContact O-CB 3.48Å; L113-F117 WeakPolarHBondContact O-CD2 3.38Å; L113-F117 PolarHBondContact O-N 2.74Å; L113-L122 HydrophobicContact CB-CD2 4.09Å; L113-L122 HydrophobicContact CB-CG 4.36Å; L113-L122 HydrophobicContact CD1-CD2 4.39Å; L113-L122 HydrophobicContact CD1-CG 4.22Å; L113-L122 HydrophobicContact CD2-CD2 4.21Å; L113-L122 HydrophobicContact CG-CD2 4.48Å; L113-F126 HydrophobicContact CD1-CB 3.62Å; L113-F126 HydrophobicContact CD1-CD1 3.84Å; L113-F126 HydrophobicContact CD1-CD2 4.34Å; L113-F126 HydrophobicContact CD1-CG 3.64Å; L113-F456 HydrophobicContact CD1-CE2 3.8Å; L113-F456 HydrophobicContact CD1-CZ 4.04Å; L113-F456 HydrophobicContact CD2-CD2 4.21Å; L113-F456 HydrophobicContact CD2-CE1 4.46Å; L113-F456 HydrophobicContact CD2-CE2 3.86Å; L113-F456 HydrophobicContact CD2-CZ 3.99Å; L113-F456 HydrophobicContact CG-CE2 3.97Å; L113-F456 HydrophobicContact CG-CZ 3.85Å
114S90.8Very high88.1Confident34 Ų3432.5 Ų32.524%0.23818%0.182CC..Hα-helixtrans-61.3-41.2175.5-169.70000112.1P110 A111 Y112 G118 G119P110-S114 PolarHBondContact O-N 2.89Å; A111-S114 PolarHBondContact O-N 3.31Å; Y112-S114 VanDerWaalsContact C-N 3.33Å; Y112-S114 PolarHBondContact O-N 2.94Å; S114-G118 WeakPolarHBondContact O-CA 3.45Å; S114-G118 PolarHBondContact O-N 3.21Å; S114-G119 PolarHBondContact OG-O 2.86Å
115K90.7Very high88.3Confident93 Ų9333.9 Ų33.940%0.40419%0.188SC..Hα-helixtrans-71.9-37177.9-167.5166-178.5165.80112.5S104 V106 A111 Y112 L113 T543 T544S104-K115 WeakPolarHBondContact O-CD 3.16Å; S104-K115 WeakPolarHBondContact O-CE 3.43Å; S104-K115 PolarHBondContact O-NZ 2.95Å; V106-K115 HydrophobicContact CG1-CB 4.48Å; V106-K115 HydrophobicContact CG1-CD 4.11Å; A111-K115 WeakPolarHBondContact O-CB 3.32Å; A111-K115 PolarHBondContact O-N 3.42Å; Y112-K115 PolarHBondContact O-N 3.44Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 3.48Å; K115-T543 WeakPolarHBondContact CE-OG1 3.45Å; K115-T544 HydrophobicContact CB-CG2 4.28Å; K115-T544 HydrophobicContact CD-CG2 4.42Å; K115-T544 HydrophobicContact CG-CG2 3.9Å
116R93.2Very high88.8Confident0 Ų032.5 Ų32.50%017%0.172CC..Hα-helixtrans-72.6-44-179.5173.559.9-171.383.1-0.2112.8Y112 L113 G459 W462 K463 C465 T544Y112-R116 HydrophobicContact CE1-CB 4.49Å; Y112-R116 WeakPolarHBondContact O-CB 3.39Å; Y112-R116 PolarHBondContact O-N 2.98Å; L113-R116 PolarHBondContact O-N 2.89Å; R116-G459 WeakPolarHBondContact CD-O 3.24Å; R116-G459 PolarHBondContact NE-O 2.96Å; R116-W462 PolarHBondContact NH2-O 2.85Å; R116-K463 PolarHBondContact NH2-O 3.27Å; R116-C465 PolarHBondContact NH1-O 3.16Å; R116-C465 PolarHBondContact NH2-O 3.3Å; R116-T544 HydrophobicContact CB-CG2 4.31Å; R116-T544 WeakPolarHBondContact CD-OG1 3.33Å
117F90.4Very high89.2Confident6 Ų632 Ų323%0.02617%0.17CC..Hα-helixtrans-104.3-22.3-172.2-64.9-69.4000112.5L113 L122 C465 E467 A470 Q540L113-F117 HydrophobicContact CB-CD2 4.47Å; L113-F117 HydrophobicContact CD2-CD2 4.03Å; L113-F117 HydrophobicContact CD2-CE2 3.72Å; L113-F117 WeakPolarHBondContact O-CB 3.48Å; L113-F117 WeakPolarHBondContact O-CD2 3.38Å; L113-F117 PolarHBondContact O-N 2.74Å; F117-L122 HydrophobicContact CB-CD2 4.17Å; F117-L122 HydrophobicContact CD2-CD2 3.34Å; F117-L122 HydrophobicContact CE2-CD2 3.91Å; F117-L122 HydrophobicContact CG-CD2 3.88Å; F117-C465 HydrophobicContact CE1-CB 3.97Å; F117-E467 HydrophobicContact CB-CB 4.11Å; F117-E467 HydrophobicContact CB-CG 4.27Å; F117-E467 WeakPolarHBondContact O-CB 3.25Å; F117-A470 HydrophobicContact CD1-CB 3.82Å; F117-A470 HydrophobicContact CD2-CB 4.36Å; F117-A470 HydrophobicContact CE1-CB 3.65Å; F117-A470 HydrophobicContact CE2-CB 4.19Å; F117-A470 HydrophobicContact CG-CB 4.17Å; F117-A470 HydrophobicContact CZ-CB 3.83Å; F117-Q540 PolarHBondContact O-NE2 2.96Å
118G84.8Confident89.8Confident16 Ų1630.5 Ų30.517%0.16517%0.172CC..  trans83.3167.4-171.600000112.1S114 Q540S114-G118 WeakPolarHBondContact O-CA 3.45Å; S114-G118 PolarHBondContact O-N 3.21Å; G118-Q540 VanDerWaalsContact CA-NE2 3.29Å
119G83.3Confident90Very high54 Ų5430.5 Ų30.556%0.55717%0.172SC*.SBendtrans69.1-176178.200000114.5S114S114-G119 PolarHBondContact OG-O 2.86Å
120N84.9Confident90Very high70 Ų7030.7 Ų30.737%0.37417%0.174SC..SBendtrans-113.3-10.1-174.8-148.438.2000113.6K123 V124 S397N120-K123 WeakPolarHBondContact OD1-CD 3.4Å; N120-V124 WeakPolarHBondContact O-CG2 3.24Å; N120-V124 PolarHBondContact O-N 3.13Å; N120-V124 VanDerWaalsContact O-N 3.07Å; N120-S397 WeakPolarHBondContact ND2-CB 3.46Å; N120-S397 PolarHBondContact ND2-OG 3.37Å
121R89.7Confident90Very high156 Ų15631.4 Ų31.459%0.58918%0.178SC*.Hα-helixtrans-66.5-52.5-172.7-55.5-179.994.4-178.16.6111.3K123 V124 Y125 F471R121-K123 VanDerWaalsContact C-N 3.33Å; R121-K123 PolarHBondContact O-N 3.44Å; R121-V124 PolarHBondContact O-N 3Å; R121-Y125 VanDerWaalsContact O-CB 3.32Å; R121-Y125 WeakPolarHBondContact O-CB 3.15Å; R121-Y125 PolarHBondContact O-N 3.16Å; R121-F471 HydrophobicContact CB-CD2 4.25Å; R121-F471 HydrophobicContact CB-CE2 4.27Å
122L89.5Confident90.1Very high3 Ų333.1 Ų33.12%0.01618%0.183CC..Hα-helixtrans-68.2-34.3-178.5-163.567.5000112.3L113 F117 Y125 F126 L455 A470L113-L122 HydrophobicContact CB-CD2 4.09Å; L113-L122 HydrophobicContact CB-CG 4.36Å; L113-L122 HydrophobicContact CD1-CD2 4.39Å; L113-L122 HydrophobicContact CD1-CG 4.22Å; L113-L122 HydrophobicContact CD2-CD2 4.21Å; L113-L122 HydrophobicContact CG-CD2 4.48Å; F117-L122 HydrophobicContact CB-CD2 4.17Å; F117-L122 HydrophobicContact CD2-CD2 3.34Å; F117-L122 HydrophobicContact CE2-CD2 3.91Å; F117-L122 HydrophobicContact CG-CD2 3.88Å; L122-Y125 HydrophobicContact CD1-CD1 3.97Å; L122-F126 WeakPolarHBondContact O-CB 3.5Å; L122-F126 PolarHBondContact O-N 3.36Å; L122-L455 HydrophobicContact CD1-CD1 4.15Å; L122-A470 HydrophobicContact CD2-CB 4Å
123K89.9Confident90Very high28 Ų2833.1 Ų33.112%0.12218%0.183CC..Hα-helixtrans-57.9-55.5173.1-174.1-173.4178.4-160.10111P110 N120 R121 F126 A127 L392 D393 S397P110-K123 HydrophobicContact CB-CG 3.78Å; N120-K123 WeakPolarHBondContact OD1-CD 3.4Å; R121-K123 VanDerWaalsContact C-N 3.33Å; R121-K123 PolarHBondContact O-N 3.44Å; K123-F126 PolarHBondContact O-N 3.25Å; K123-A127 VanDerWaalsContact O-CB 3.3Å; K123-A127 WeakPolarHBondContact O-CB 3.33Å; K123-A127 PolarHBondContact O-N 3.21Å; K123-L392 PolarHBondContact NZ-O 2.57Å; K123-D393 WeakPolarHBondContact CE-OD1 3.37Å; K123-D393 HydrophobicContact CG-CB 4.38Å; K123-D393 IonicContact NZ-OD1 2.8Å; K123-S397 PolarHBondContact NZ-OG 3.17Å
124V89.9Confident90Very high49 Ų4933.1 Ų33.130%0.29718%0.183SC..Hα-helixtrans-65.2-43.6-179.4174.10000111N120 R121 F126 A127 C128N120-V124 WeakPolarHBondContact O-CG2 3.24Å; N120-V124 PolarHBondContact O-N 3.13Å; N120-V124 VanDerWaalsContact O-N 3.07Å; R121-V124 PolarHBondContact O-N 3Å; V124-F126 PolarHBondContact O-N 3.28Å; V124-A127 PolarHBondContact O-N 3.21Å; V124-C128 WeakPolarHBondContact O-CB 3.43Å; V124-C128 PolarHBondContact O-N 3.48Å; V124-C128 PolarHBondContact O-SG 3.17Å; V124-C128 VanDerWaalsContact O-SG 3.32Å
125Y90.6Very high89.9Confident31 Ų3132.2 Ų32.212%0.12218%0.175CC..Hα-helixtrans-53.4-52.6175.7162.8-100.6000111.9R121 L122 C128 L129 G474 M475 F478R121-Y125 VanDerWaalsContact O-CB 3.32Å; R121-Y125 WeakPolarHBondContact O-CB 3.15Å; R121-Y125 PolarHBondContact O-N 3.16Å; L122-Y125 HydrophobicContact CD1-CD1 3.97Å; Y125-C128 PolarHBondContact O-N 3.3Å; Y125-L129 HydrophobicContact CE1-CD2 4.43Å; Y125-L129 HydrophobicContact CE2-CD2 4.47Å; Y125-L129 WeakPolarHBondContact O-CB 3.28Å; Y125-L129 PolarHBondContact O-N 3.48Å; Y125-G474 PolarHBondContact OH-O 3.11Å; Y125-M475 HydrophobicContact CD2-CE 4.34Å; Y125-F478 HydrophobicContact CE2-CB 4.09Å; Y125-F478 HydrophobicContact CE2-CD2 4.38Å; Y125-F478 HydrophobicContact CE2-CG 4.1Å; Y125-F478 WeakPolarHBondContact OH-CB 3.21Å
126F91.7Very high89.8Confident3 Ų330.3 Ų30.31%0.01317%0.167CC..Hα-helixtrans-69.7-37-178.3179.3-110000112.3M109 P110 L113 L122 K123 V124 L129 S130 I452 F456M109-F126 HydrophobicContact CB-CE1 3.65Å; M109-F126 HydrophobicContact CB-CZ 4.28Å; P110-F126 HydrophobicContact CB-CD1 4.01Å; P110-F126 HydrophobicContact CG-CD1 3.58Å; P110-F126 HydrophobicContact CG-CE1 3.96Å; L113-F126 HydrophobicContact CD1-CB 3.62Å; L113-F126 HydrophobicContact CD1-CD1 3.84Å; L113-F126 HydrophobicContact CD1-CD2 4.34Å; L113-F126 HydrophobicContact CD1-CG 3.64Å; L122-F126 WeakPolarHBondContact O-CB 3.5Å; L122-F126 PolarHBondContact O-N 3.36Å; K123-F126 PolarHBondContact O-N 3.25Å; V124-F126 PolarHBondContact O-N 3.28Å; F126-L129 PolarHBondContact O-N 3.49Å; F126-S130 WeakPolarHBondContact CE2-OG 3.47Å; F126-S130 WeakPolarHBondContact CZ-OG 3.17Å; F126-S130 VanDerWaalsContact O-CB 3.31Å; F126-S130 WeakPolarHBondContact O-CB 3.44Å; F126-S130 PolarHBondContact O-N 3.12Å; F126-S130 PolarHBondContact O-OG 2.9Å; F126-I452 HydrophobicContact CD2-CD1 4.16Å; F126-I452 HydrophobicContact CD2-CG1 4.48Å; F126-I452 HydrophobicContact CD2-CG2 3.76Å; F126-I452 HydrophobicContact CE2-CD1 3.95Å; F126-I452 HydrophobicContact CE2-CG2 3.41Å; F126-I452 VanDerWaalsContact CE2-CG2 3.41Å; F126-I452 HydrophobicContact CZ-CG2 4.37Å; F126-F456 HydrophobicContact CD2-CE2 4.48Å; F126-F456 HydrophobicContact CE1-CE2 4.39Å; F126-F456 HydrophobicContact CE1-CZ 4.21Å; F126-F456 HydrophobicContact CE2-CE2 4.18Å; F126-F456 HydrophobicContact CZ-CE2 4.11Å; F126-F456 HydrophobicContact CZ-CZ 4.24Å
127A91.8Very high89.4Confident0 Ų030.5 Ų30.50%017%0.168CC..Hα-helixtrans-61.4-48174.900000111.9P110 K123 V124 S130 V131 I389 D393 I394P110-A127 HydrophobicContact CB-CB 4.36Å; P110-A127 HydrophobicContact CG-CB 4.11Å; K123-A127 VanDerWaalsContact O-CB 3.3Å; K123-A127 WeakPolarHBondContact O-CB 3.33Å; K123-A127 PolarHBondContact O-N 3.21Å; V124-A127 PolarHBondContact O-N 3.21Å; A127-S130 PolarHBondContact O-N 3.29Å; A127-V131 WeakPolarHBondContact O-CG2 3.39Å; A127-V131 PolarHBondContact O-N 3.01Å; A127-I389 HydrophobicContact CB-CG2 3.63Å; A127-D393 HydrophobicContact CB-CB 3.91Å; A127-I394 HydrophobicContact CB-CD1 4.05Å; A127-I394 HydrophobicContact CB-CG1 3.82Å
128C91.1Very high89.4Confident63 Ų6331.1 Ų31.143%0.42617%0.171SC..Hα-helixtrans-62.3-45177-70.30000112V124 Y125 S130 V131 L132V124-C128 WeakPolarHBondContact O-CB 3.43Å; V124-C128 PolarHBondContact O-N 3.48Å; V124-C128 PolarHBondContact O-SG 3.17Å; V124-C128 VanDerWaalsContact O-SG 3.32Å; Y125-C128 PolarHBondContact O-N 3.3Å; C128-S130 PolarHBondContact O-N 3.01Å; C128-V131 PolarHBondContact O-N 3.48Å; C128-L132 WeakPolarHBondContact O-CB 3.4Å; C128-L132 PolarHBondContact O-N 3.15Å
129L91.1Very high89.7Confident5 Ų530.4 Ų30.43%0.02616%0.163CC..Hα-helixtrans-63.5-40.8178.1-177.356.1000111.9Y125 F126 L132 L133 I452 F478Y125-L129 HydrophobicContact CE1-CD2 4.43Å; Y125-L129 HydrophobicContact CE2-CD2 4.47Å; Y125-L129 WeakPolarHBondContact O-CB 3.28Å; Y125-L129 PolarHBondContact O-N 3.48Å; F126-L129 PolarHBondContact O-N 3.49Å; L129-L132 PolarHBondContact O-N 2.81Å; L129-L133 HydrophobicContact CG-CD1 4.32Å; L129-L133 WeakPolarHBondContact O-CG 3.36Å; L129-L133 PolarHBondContact O-N 3.3Å; L129-I452 HydrophobicContact CD2-CD1 3.51Å; L129-I452 HydrophobicContact CD2-CG1 3.94Å; L129-I452 HydrophobicContact CG-CD1 4.14Å; L129-F478 HydrophobicContact CD1-CD2 4.02Å; L129-F478 HydrophobicContact CD1-CE2 3.8Å; L129-F478 HydrophobicContact CD2-CD2 4.36Å
130S91.3Very high90.1Very high4 Ų427.8 Ų27.83%0.02814%0.136CC..Hα-helixtrans-65.3-43.8178.6-59.20000111.9F126 A127 C128 L132 L133 Y134F126-S130 WeakPolarHBondContact CE2-OG 3.47Å; F126-S130 WeakPolarHBondContact CZ-OG 3.17Å; F126-S130 VanDerWaalsContact O-CB 3.31Å; F126-S130 WeakPolarHBondContact O-CB 3.44Å; F126-S130 PolarHBondContact O-N 3.12Å; F126-S130 PolarHBondContact O-OG 2.9Å; A127-S130 PolarHBondContact O-N 3.29Å; C128-S130 PolarHBondContact O-N 3.01Å; S130-L132 VanDerWaalsContact C-N 3.33Å; S130-L132 PolarHBondContact O-N 3.46Å; S130-L133 PolarHBondContact O-N 3.04Å; S130-Y134 WeakPolarHBondContact O-CD1 3.4Å; S130-Y134 PolarHBondContact O-N 3.48Å
131V91.6Very high90.4Very high15 Ų1524.5 Ų24.59%0.09112%0.119CC..Hα-helixtrans-59.4-45.1173.9161.60000111.2A127 C128 L133 Y134 I135 I389 F414A127-V131 WeakPolarHBondContact O-CG2 3.39Å; A127-V131 PolarHBondContact O-N 3.01Å; C128-V131 PolarHBondContact O-N 3.48Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 3.12Å; V131-Y134 PolarHBondContact O-N 2.99Å; V131-I135 HydrophobicContact CG1-CD1 4.04Å; V131-I135 WeakPolarHBondContact O-CG1 3.44Å; V131-I135 PolarHBondContact O-N 3.19Å; V131-I389 HydrophobicContact CG2-CG2 4.14Å; V131-F414 HydrophobicContact CB-CZ 4.48Å; V131-F414 HydrophobicContact CG1-CE2 4.37Å; V131-F414 HydrophobicContact CG1-CZ 3.62Å; V131-F414 HydrophobicContact CG2-CE1 4.42Å; V131-F414 HydrophobicContact CG2-CZ 4.01Å
132L90.4Very high90.5Very high64 Ų6417.3 Ų17.334%0.3359%0.092SC..Hα-helixtrans-60.1-45.5178.4-176.8150.3000111.4C128 L129 S130 I135 F136 L448C128-L132 WeakPolarHBondContact O-CB 3.4Å; C128-L132 PolarHBondContact O-N 3.15Å; L129-L132 PolarHBondContact O-N 2.81Å; S130-L132 VanDerWaalsContact C-N 3.33Å; S130-L132 PolarHBondContact O-N 3.46Å; L132-I135 PolarHBondContact O-N 3.39Å; L132-F136 HydrophobicContact CD1-CE2 4.16Å; L132-F136 HydrophobicContact CD2-CD2 3.62Å; L132-F136 HydrophobicContact CD2-CE2 4.01Å; L132-F136 HydrophobicContact CG-CD2 3.68Å; L132-F136 HydrophobicContact CG-CE2 3.63Å; L132-F136 VanDerWaalsContact O-CD2 3.29Å; L132-F136 WeakPolarHBondContact O-CD2 3.36Å; L132-F136 PolarHBondContact O-N 3.3Å; L132-F136 VanDerWaalsContact O-N 3.07Å; L132-L448 HydrophobicContact CD2-CD1 4.21Å
133L90.5Very high90.6Very high0 Ų017.1 Ų17.10%09%0.091CC..Hα-helixtrans-61.7-45.4175-72.4170.9000111.3L129 S130 V131 I135 F136 T137 W274 L448 T449L129-L133 HydrophobicContact CG-CD1 4.32Å; L129-L133 WeakPolarHBondContact O-CG 3.36Å; L129-L133 PolarHBondContact O-N 3.3Å; S130-L133 PolarHBondContact O-N 3.04Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 3.12Å; L133-I135 VanDerWaalsContact C-N 3.29Å; L133-I135 PolarHBondContact O-N 3.31Å; L133-F136 PolarHBondContact O-N 2.71Å; L133-T137 HydrophobicContact CD2-CG2 4.11Å; L133-T137 PolarHBondContact O-N 3.23Å; L133-T137 PolarHBondContact O-OG1 3.03Å; L133-W274 HydrophobicContact CD1-CH2 4.19Å; L133-W274 HydrophobicContact CD1-CZ2 3.75Å; L133-L448 HydrophobicContact CD2-CB 3.97Å; L133-L448 HydrophobicContact CD2-CD1 3.64Å; L133-L448 HydrophobicContact CD2-CG 4.45Å; L133-T449 HydrophobicContact CD1-CG2 3.95Å
134Y91.9Very high90.7Very high2 Ų216.3 Ų16.31%0.0089%0.087CC..Iπ-helixtrans-59.4-39.1178.4-73.2-2.2000112.9S130 V131 K138 L139 D279 Q280 V281 I382 A386 I389S130-Y134 WeakPolarHBondContact O-CD1 3.4Å; S130-Y134 PolarHBondContact O-N 3.48Å; V131-Y134 PolarHBondContact O-N 2.99Å; Y134-K138 HydrophobicContact CD1-CD 3.92Å; Y134-K138 HydrophobicContact CD1-CG 4.4Å; Y134-K138 HydrophobicContact CE1-CD 4.1Å; Y134-K138 PolarHBondContact O-N 2.82Å; Y134-L139 VanDerWaalsContact O-CB 3.28Å; Y134-L139 WeakPolarHBondContact O-CB 3.34Å; Y134-L139 PolarHBondContact O-N 3.05Å; Y134-D279 PolarHBondContact OH-OD1 2.8Å; Y134-Q280 WeakPolarHBondContact OH-CB 3.41Å; Y134-Q280 PolarHBondContact OH-N 3.23Å; Y134-V281 HydrophobicContact CE2-CG2 4.46Å; Y134-V281 PolarHBondContact OH-N 3.14Å; Y134-I382 HydrophobicContact CD2-CG2 4.45Å; Y134-I382 HydrophobicContact CG-CG2 4.46Å; Y134-A386 HydrophobicContact CD2-CB 3.97Å; Y134-I389 HydrophobicContact CE2-CD1 3.83Å
135I90.6Very high90.8Very high15 Ų1514 Ų148%0.0777%0.074CC..Iπ-helixtrans-65-55.7175.3-68.6167000110.4V131 L132 L133 S140 M418 I421 S422V131-I135 HydrophobicContact CG1-CD1 4.04Å; V131-I135 WeakPolarHBondContact O-CG1 3.44Å; V131-I135 PolarHBondContact O-N 3.19Å; L132-I135 PolarHBondContact O-N 3.39Å; L133-I135 VanDerWaalsContact C-N 3.29Å; L133-I135 PolarHBondContact O-N 3.31Å; I135-S140 WeakPolarHBondContact O-CB 3.42Å; I135-S140 PolarHBondContact O-N 2.76Å; I135-S140 PolarHBondContact O-OG 3.3Å; I135-M418 HydrophobicContact CD1-CG 4.06Å; I135-M418 HydrophobicContact CG1-CG 3.45Å; I135-M418 VanDerWaalsContact CG1-CG 3.45Å; I135-M418 HydrophobicContact CG1-SD 4.34Å; I135-I421 HydrophobicContact CG2-CB 4.36Å; I135-I421 HydrophobicContact CG2-CG2 3.66Å; I135-S422 PolarHBondContact O-OG 3.32Å
136F86.9Confident90.7Very high52 Ų5212.6 Ų12.623%0.2287%0.068CC..Iπ-helixtrans-85.7-28.7-165.8-63.5-48000114.9L132 L133 W425L132-F136 HydrophobicContact CD1-CE2 4.16Å; L132-F136 HydrophobicContact CD2-CD2 3.62Å; L132-F136 HydrophobicContact CD2-CE2 4.01Å; L132-F136 HydrophobicContact CG-CD2 3.68Å; L132-F136 HydrophobicContact CG-CE2 3.63Å; L132-F136 VanDerWaalsContact O-CD2 3.29Å; L132-F136 WeakPolarHBondContact O-CD2 3.36Å; L132-F136 PolarHBondContact O-N 3.3Å; L132-F136 VanDerWaalsContact O-N 3.07Å; L133-F136 PolarHBondContact O-N 2.71Å; F136-W425 HydrophobicContact CD1-CB 4.46Å; F136-W425 AromaticContact CD1-CD1 3.77Å; F136-W425 AromaticContact CD1-CD2 3.43Å; F136-W425 HydrophobicContact CD1-CD2 3.43Å; F136-W425 VanDerWaalsContact CD1-CD2 3.43Å; F136-W425 AromaticContact CD1-CE2 3.45Å; F136-W425 VanDerWaalsContact CD1-CE2 3.45Å; F136-W425 AromaticContact CD1-CE3 3.96Å; F136-W425 HydrophobicContact CD1-CE3 3.96Å; F136-W425 AromaticContact CD1-CG 3.65Å; F136-W425 HydrophobicContact CD1-CG 3.65Å; F136-W425 HydrophobicContact CD1-CH2 4.43Å; F136-W425 AromaticContact CD1-CZ2 3.98Å; F136-W425 HydrophobicContact CD1-CZ2 3.98Å; F136-W425 HydrophobicContact CD1-CZ3 4.42Å; F136-W425 AromaticContact CD1-NE1 3.65Å; F136-W425 AromaticContact CE1-CD2 3.53Å; F136-W425 HydrophobicContact CE1-CD2 3.53Å; F136-W425 AromaticContact CE1-CE2 3.87Å; F136-W425 AromaticContact CE1-CE3 3.53Å; F136-W425 HydrophobicContact CE1-CE3 3.53Å; F136-W425 HydrophobicContact CE1-CG 4.04Å; F136-W425 HydrophobicContact CE1-CH2 4.19Å; F136-W425 HydrophobicContact CE1-CZ2 4.2Å; F136-W425 AromaticContact CE1-CZ3 3.87Å; F136-W425 HydrophobicContact CE1-CZ3 3.87Å; F136-W425 HydrophobicContact CZ-CE3 4.48Å; F136-W425 HydrophobicContact CZ-CZ3 4.45Å
137T85.9Confident90.6Very high5 Ų512.4 Ų12.43%0.0317%0.067CC..Iπ-helixtrans-109.7-28-174.5710000114L133 V141 V444L133-T137 HydrophobicContact CD2-CG2 4.11Å; L133-T137 PolarHBondContact O-N 3.23Å; L133-T137 PolarHBondContact O-OG1 3.03Å; T137-V141 WeakPolarHBondContact O-CG2 3.45Å; T137-V444 HydrophobicContact CG2-CB 3.98Å; T137-V444 HydrophobicContact CG2-CG1 3.45Å; T137-V444 VanDerWaalsContact CG2-CG1 3.45Å
138K89.6Confident90.5Very high19 Ų1912.9 Ų12.98%0.0837%0.07CC..Iπ-helixtrans-102-69.8179.9-62.5-160.2176.8-168.40112.3Y134 S140 V141 D142 D279 I382Y134-K138 HydrophobicContact CD1-CD 3.92Å; Y134-K138 HydrophobicContact CD1-CG 4.4Å; Y134-K138 HydrophobicContact CE1-CD 4.1Å; Y134-K138 PolarHBondContact O-N 2.82Å; K138-S140 PolarHBondContact O-N 3.33Å; K138-V141 PolarHBondContact O-N 2.95Å; K138-D142 WeakPolarHBondContact O-CB 3.43Å; K138-D142 PolarHBondContact O-N 2.99Å; K138-D279 VanDerWaalsContact CE-OD2 3.3Å; K138-D279 WeakPolarHBondContact CE-OD2 3.37Å; K138-D279 IonicContact NZ-OD1 3.47Å; K138-D279 IonicContact NZ-OD2 2.89Å; K138-D279 PolarHBondContact NZ-OD2 3.46Å; K138-I382 HydrophobicContact CB-CD1 3.78Å; K138-I382 HydrophobicContact CB-CG1 4.37Å; K138-I382 HydrophobicContact CD-CG1 4.43Å
139L92Very high90.3Very high0 Ų010.1 Ų10.10%05%0.05CC..Iπ-helixtrans-61.2-49.9-169.8179.656.5000112.6Y134 V141 D142 L143 L379 I382 F383 M418 V419 S422Y134-L139 VanDerWaalsContact O-CB 3.28Å; Y134-L139 WeakPolarHBondContact O-CB 3.34Å; Y134-L139 PolarHBondContact O-N 3.05Å; L139-V141 VanDerWaalsContact C-N 3.26Å; L139-V141 PolarHBondContact O-N 3.35Å; L139-D142 PolarHBondContact O-N 2.88Å; L139-L143 HydrophobicContact CD1-CD1 4.1Å; L139-L143 HydrophobicContact CD1-CG 4.11Å; L139-L143 HydrophobicContact CG-CD1 4.21Å; L139-L143 WeakPolarHBondContact O-CB 3.38Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.24Å; L139-L143 PolarHBondContact O-N 3.32Å; L139-L379 HydrophobicContact CD1-CD2 3.22Å; L139-I382 HydrophobicContact CB-CG2 4.37Å; L139-F383 HydrophobicContact CD1-CE1 3.59Å; L139-F383 HydrophobicContact CD1-CZ 4.17Å; L139-F383 HydrophobicContact CD2-CE1 3.91Å; L139-F383 HydrophobicContact CG-CE1 4.45Å; L139-M418 HydrophobicContact CD2-CE 3.52Å; L139-M418 HydrophobicContact CD2-CG 3.88Å; L139-M418 HydrophobicContact CD2-SD 4.18Å; L139-V419 HydrophobicContact CD2-CG2 4.25Å; L139-S422 VanDerWaalsContact CD2-OG 3.26Å; L139-S422 WeakPolarHBondContact CD2-OG 3.26Å; L139-S422 WeakPolarHBondContact CG-OG 3.19Å
140S92.1Very high90.2Very high0 Ų09.9 Ų9.90%05%0.049CC..Hα-helixtrans-64.1-34.4-178.7-53.60000112.3I135 K138 Y144 S422 I429I135-S140 WeakPolarHBondContact O-CB 3.42Å; I135-S140 PolarHBondContact O-N 2.76Å; I135-S140 PolarHBondContact O-OG 3.3Å; K138-S140 PolarHBondContact O-N 3.33Å; S140-Y144 WeakPolarHBondContact O-CB 3.03Å; S140-Y144 PolarHBondContact O-N 3.27Å; S140-Y144 VanDerWaalsContact O-N 3.11Å; S140-S422 WeakPolarHBondContact OG-CA 3.33Å; S140-S422 VanDerWaalsContact OG-CB 3.23Å; S140-S422 WeakPolarHBondContact OG-CB 3.34Å; S140-S422 PolarHBondContact OG-O 2.9Å; S140-S422 PolarHBondContact OG-OG 3.11Å; S140-I429 VanDerWaalsContact C-CD1 3.48Å
141V91.3Very high89.9Confident0 Ų012.5 Ų12.50%06%0.061CC..Hα-helixtrans-76.3-41.1-179.5177.80000111.2T137 K138 L139 Y144 A145 I429 T437 Y440 I441T137-V141 WeakPolarHBondContact O-CG2 3.45Å; K138-V141 PolarHBondContact O-N 2.95Å; L139-V141 VanDerWaalsContact C-N 3.26Å; L139-V141 PolarHBondContact O-N 3.35Å; V141-Y144 PolarHBondContact O-N 2.88Å; V141-A145 WeakPolarHBondContact O-CB 3.28Å; V141-A145 PolarHBondContact O-N 3.02Å; V141-I429 HydrophobicContact CB-CD1 4.44Å; V141-I429 HydrophobicContact CG2-CD1 3.64Å; V141-I429 HydrophobicContact CG2-CG1 4.42Å; V141-T437 HydrophobicContact CG1-CG2 3.62Å; V141-Y440 HydrophobicContact CG2-CE1 4.44Å; V141-I441 HydrophobicContact CB-CD1 4.38Å; V141-I441 HydrophobicContact CB-CG1 4.36Å; V141-I441 HydrophobicContact CG1-CD1 3.46Å; V141-I441 VanDerWaalsContact CG1-CD1 3.46Å; V141-I441 HydrophobicContact CG1-CG1 3.79Å; V141-I441 HydrophobicContact CG2-CG1 4.03Å
142D91.4Very high89.6Confident5 Ų512.7 Ų12.73%0.0276%0.061CC..Hα-helixtrans-64.9-41.9177-16755.7000111.4S62 K138 L139 Y144 A145 G146 L375 L379S62-D142 WeakPolarHBondContact CB-OD1 3.2Å; S62-D142 PolarHBondContact OG-O 3.27Å; S62-D142 PolarHBondContact OG-OD1 3.5Å; K138-D142 WeakPolarHBondContact O-CB 3.43Å; K138-D142 PolarHBondContact O-N 2.99Å; L139-D142 PolarHBondContact O-N 2.88Å; D142-Y144 PolarHBondContact O-N 3.39Å; D142-A145 PolarHBondContact O-N 3.05Å; D142-G146 PolarHBondContact O-N 2.85Å; D142-L375 WeakPolarHBondContact O-CD2 3.32Å; D142-L379 HydrophobicContact CB-CD2 4.46Å; D142-L379 WeakPolarHBondContact OD2-CD2 3.33Å; D142-L379 WeakPolarHBondContact OD2-CG 3.35Å
143L92.1Very high89.3Confident0 Ų09.9 Ų9.90%05%0.047CC..Hα-helixtrans-60.4-43.4171.6-70.4176.1000112.1L139 A147 I162 I166 L379 I423L139-L143 HydrophobicContact CD1-CD1 4.1Å; L139-L143 HydrophobicContact CD1-CG 4.11Å; L139-L143 HydrophobicContact CG-CD1 4.21Å; L139-L143 WeakPolarHBondContact O-CB 3.38Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.24Å; L139-L143 PolarHBondContact O-N 3.32Å; L143-A147 WeakPolarHBondContact O-CB 3.41Å; L143-A147 PolarHBondContact O-N 3.49Å; L143-I162 HydrophobicContact CD2-CG2 4.44Å; L143-I166 HydrophobicContact CD1-CD1 4.23Å; L143-I166 HydrophobicContact CD2-CD1 4.02Å; L143-I166 HydrophobicContact CD2-CG1 3.68Å; L143-L379 HydrophobicContact CD2-CD1 4.03Å; L143-L379 HydrophobicContact CD2-CD2 3.94Å; L143-L379 HydrophobicContact CG-CD2 4.21Å; L143-I423 HydrophobicContact CD1-CG1 4.32Å
144Y91.4Very high89Confident10 Ų1012.6 Ų12.64%0.0396%0.061CC..Hα-helixtrans-65-50.4178171.6-112.1000112.2S140 V141 D142 G146 A147 L148 L158 V426 I429 I430 Q433 T437S140-Y144 WeakPolarHBondContact O-CB 3.03Å; S140-Y144 PolarHBondContact O-N 3.27Å; S140-Y144 VanDerWaalsContact O-N 3.11Å; V141-Y144 PolarHBondContact O-N 2.88Å; D142-Y144 PolarHBondContact O-N 3.39Å; Y144-G146 VanDerWaalsContact C-N 3.34Å; Y144-G146 PolarHBondContact O-N 3.02Å; Y144-A147 PolarHBondContact O-N 3.44Å; Y144-L148 HydrophobicContact CD1-CD1 4.17Å; Y144-L148 HydrophobicContact CD2-CG 4.31Å; Y144-L148 HydrophobicContact CE1-CD1 3.45Å; Y144-L148 VanDerWaalsContact CE1-CD1 3.45Å; Y144-L148 HydrophobicContact CE1-CG 4.16Å; Y144-L148 HydrophobicContact CE2-CD1 3.96Å; Y144-L148 HydrophobicContact CE2-CD2 4.04Å; Y144-L148 HydrophobicContact CE2-CG 3.76Å; Y144-L148 PolarHBondContact O-N 3.33Å; Y144-L148 WeakPolarHBondContact OH-CD1 3.44Å; Y144-L158 HydrophobicContact CD2-CD1 4.43Å; Y144-L158 HydrophobicContact CD2-CD2 4.4Å; Y144-L158 HydrophobicContact CE2-CD1 4.45Å; Y144-L158 HydrophobicContact CE2-CD2 4.5Å; Y144-V426 HydrophobicContact CD2-CG1 4.08Å; Y144-I429 HydrophobicContact CD1-CG2 3.95Å; Y144-I429 HydrophobicContact CE1-CG2 4.4Å; Y144-I429 HydrophobicContact CG-CG2 4.32Å; Y144-I430 HydrophobicContact CD2-CD1 4.36Å; Y144-I430 HydrophobicContact CD2-CG1 3.93Å; Y144-I430 HydrophobicContact CE2-CD1 4.03Å; Y144-I430 HydrophobicContact CE2-CG1 3.47Å; Y144-I430 VanDerWaalsContact CE2-CG1 3.47Å; Y144-Q433 VanDerWaalsContact CE1-OE1 3.29Å; Y144-Q433 PolarHBondContact OH-NE2 3.45Å; Y144-T437 HydrophobicContact CD1-CG2 4.38Å
145A90.8Very high88.6Confident2 Ų215.7 Ų15.72%0.0179%0.093CC..Hα-helixtrans-62.2-41.6179.600000111.4S62 I66 V141 D142 L148 F149S62-A145 VanDerWaalsContact OG-CB 3.31Å; S62-A145 WeakPolarHBondContact OG-CB 3.45Å; I66-A145 HydrophobicContact CB-CB 3.92Å; I66-A145 HydrophobicContact CG1-CB 3.95Å; I66-A145 HydrophobicContact CG2-CB 4.1Å; V141-A145 WeakPolarHBondContact O-CB 3.28Å; V141-A145 PolarHBondContact O-N 3.02Å; D142-A145 PolarHBondContact O-N 3.05Å; A145-L148 PolarHBondContact O-N 2.83Å; A145-F149 PolarHBondContact O-N 3.36Å
146G89.9Confident88.5Confident0 Ų020 Ų200%011%0.109CC..Hα-helixtrans-65.1-40.5174.800000113.7D142 Y144 F149 I150 L375D142-G146 PolarHBondContact O-N 2.85Å; Y144-G146 VanDerWaalsContact C-N 3.34Å; Y144-G146 PolarHBondContact O-N 3.02Å; G146-F149 WeakPolarHBondContact O-CB 3.29Å; G146-F149 PolarHBondContact O-N 3.33Å; G146-I150 WeakPolarHBondContact O-CG1 3.32Å; G146-I150 PolarHBondContact O-N 3.17Å; G146-I150 VanDerWaalsContact O-N 3.11Å; G146-L375 VanDerWaalsContact CA-CD2 3.43Å
147A89.9Confident88.6Confident0 Ų022.3 Ų22.30%012%0.124CC..Hα-helixtrans-66.1-40.1176.600000112.6L143 Y144 F149 I150 Q151 L158 I162L143-A147 WeakPolarHBondContact O-CB 3.41Å; L143-A147 PolarHBondContact O-N 3.49Å; Y144-A147 PolarHBondContact O-N 3.44Å; A147-F149 VanDerWaalsContact C-N 3.31Å; A147-F149 PolarHBondContact O-N 2.8Å; A147-I150 PolarHBondContact O-N 3.05Å; A147-Q151 VanDerWaalsContact O-CB 3.32Å; A147-Q151 WeakPolarHBondContact O-CB 3.36Å; A147-Q151 PolarHBondContact O-N 3.21Å; A147-L158 HydrophobicContact CB-CD1 3.5Å; A147-L158 VanDerWaalsContact CB-CD1 3.5Å; A147-L158 HydrophobicContact CB-CG 3.91Å; A147-I162 HydrophobicContact CB-CD1 4.23Å; A147-I162 HydrophobicContact CB-CG1 3.5Å
148L88.3Confident88.7Confident10 Ų1023 Ų235%0.05213%0.127CC..Hα-helixtrans-58-44.2171.9-80.9-178.3000111.6I66 Y144 A145 I150 Q151 E152 L158 N348I66-L148 HydrophobicContact CG2-CD1 4.04Å; Y144-L148 HydrophobicContact CD1-CD1 4.17Å; Y144-L148 HydrophobicContact CD2-CG 4.31Å; Y144-L148 HydrophobicContact CE1-CD1 3.45Å; Y144-L148 VanDerWaalsContact CE1-CD1 3.45Å; Y144-L148 HydrophobicContact CE1-CG 4.16Å; Y144-L148 HydrophobicContact CE2-CD1 3.96Å; Y144-L148 HydrophobicContact CE2-CD2 4.04Å; Y144-L148 HydrophobicContact CE2-CG 3.76Å; Y144-L148 PolarHBondContact O-N 3.33Å; Y144-L148 WeakPolarHBondContact OH-CD1 3.44Å; A145-L148 PolarHBondContact O-N 2.83Å; L148-I150 PolarHBondContact O-N 3.12Å; L148-Q151 PolarHBondContact O-N 2.66Å; L148-E152 WeakPolarHBondContact O-CG 3.3Å; L148-E152 PolarHBondContact O-N 3.07Å; L148-L158 HydrophobicContact CD2-CD1 4.23Å; L148-L158 HydrophobicContact CG-CD1 4.41Å; L148-N348 HydrophobicContact CD1-CB 4.19Å
149F87.6Confident88.8Confident4 Ų427.6 Ų27.62%0.01815%0.145CC..Hα-helixtrans-61.2-44.7179.1-174.9-99.9000112.3I66 A145 G146 A147 E152 S153 P352 M368 M371 I372I66-F149 HydrophobicContact CD1-CB 4.18Å; I66-F149 HydrophobicContact CD1-CD2 4.17Å; A145-F149 PolarHBondContact O-N 3.36Å; G146-F149 WeakPolarHBondContact O-CB 3.29Å; G146-F149 PolarHBondContact O-N 3.33Å; A147-F149 VanDerWaalsContact C-N 3.31Å; A147-F149 PolarHBondContact O-N 2.8Å; F149-E152 PolarHBondContact O-N 3.38Å; F149-S153 WeakPolarHBondContact O-CB 3.22Å; F149-S153 PolarHBondContact O-N 3.35Å; F149-S153 VanDerWaalsContact O-N 3.13Å; F149-S153 PolarHBondContact O-OG 3.47Å; F149-P352 HydrophobicContact CD2-CB 3.86Å; F149-P352 HydrophobicContact CD2-CG 3.9Å; F149-P352 HydrophobicContact CE2-CB 4.07Å; F149-P352 HydrophobicContact CE2-CG 4.48Å; F149-M368 HydrophobicContact CE1-CB 4.1Å; F149-M368 HydrophobicContact CE1-CG 3.89Å; F149-M368 HydrophobicContact CZ-CB 4.33Å; F149-M368 HydrophobicContact CZ-CG 3.78Å; F149-M371 HydrophobicContact CD1-CB 4.42Å; F149-M371 HydrophobicContact CD1-CE 4.49Å; F149-M371 HydrophobicContact CD2-CE 3.29Å; F149-M371 HydrophobicContact CD2-SD 4.02Å; F149-M371 HydrophobicContact CE1-CB 3.95Å; F149-M371 HydrophobicContact CE1-CE 4.4Å; F149-M371 HydrophobicContact CE1-SD 4.25Å; F149-M371 HydrophobicContact CE2-CE 3.19Å; F149-M371 HydrophobicContact CE2-SD 3.25Å; F149-M371 WeakPolarHBondContact CE2-SD 2.86Å; F149-M371 HydrophobicContact CG-CE 3.98Å; F149-M371 HydrophobicContact CZ-CB 4.02Å; F149-M371 HydrophobicContact CZ-CE 3.78Å; F149-M371 HydrophobicContact CZ-CG 4.25Å; F149-M371 HydrophobicContact CZ-SD 3.37Å; F149-M371 WeakPolarHBondContact CZ-SD 3.19Å; F149-I372 HydrophobicContact CD1-CG1 4.46Å; F149-I372 HydrophobicContact CE1-CG1 4.5Å
150I87.9Confident88.8Confident1 Ų132 Ų321%0.00517%0.167CC..Hα-helixtrans-66.1-40.3176.6-65.2174.7000110.5G146 A147 L148 S153 L154 W156 S161 L165G146-I150 WeakPolarHBondContact O-CG1 3.32Å; G146-I150 PolarHBondContact O-N 3.17Å; G146-I150 VanDerWaalsContact O-N 3.11Å; A147-I150 PolarHBondContact O-N 3.05Å; L148-I150 PolarHBondContact O-N 3.12Å; I150-S153 WeakPolarHBondContact CA-OG 3.36Å; I150-S153 PolarHBondContact O-N 3.18Å; I150-S153 PolarHBondContact O-OG 3.13Å; I150-L154 HydrophobicContact CG2-CB 4.46Å; I150-L154 HydrophobicContact CG2-CD1 4.13Å; I150-L154 WeakPolarHBondContact O-CB 3.49Å; I150-L154 PolarHBondContact O-N 3.4Å; I150-W156 HydrophobicContact CG2-CB 4.43Å; I150-W156 HydrophobicContact CG2-CE3 3.92Å; I150-S161 WeakPolarHBondContact CG2-OG 3.48Å; I150-L165 HydrophobicContact CD1-CD1 3.82Å; I150-L165 HydrophobicContact CD1-CD2 3.91Å; I150-L165 HydrophobicContact CD1-CG 3.62Å
151Q86.7Confident88.7Confident58 Ų5832 Ų3227%0.27117%0.167SC..Hα-helixtrans-60.7-46.3176.7177.1175.5-15.900111.8A147 L148 S153 G155 W156A147-Q151 VanDerWaalsContact O-CB 3.32Å; A147-Q151 WeakPolarHBondContact O-CB 3.36Å; A147-Q151 PolarHBondContact O-N 3.21Å; L148-Q151 PolarHBondContact O-N 2.66Å; Q151-S153 VanDerWaalsContact C-N 3.33Å; Q151-S153 PolarHBondContact O-N 2.53Å; Q151-G155 WeakPolarHBondContact O-CA 3.32Å; Q151-G155 PolarHBondContact O-N 2.97Å; Q151-W156 WeakPolarHBondContact CG-O 3.4Å
152E84.5Confident88.7Confident20 Ų2032.1 Ų32.19%0.09317%0.168CC..Hα-helixtrans-67.4-32.7179.7-75-54.6130.600113.4L148 F149 I349 P352L148-E152 WeakPolarHBondContact O-CG 3.3Å; L148-E152 PolarHBondContact O-N 3.07Å; F149-E152 PolarHBondContact O-N 3.38Å; E152-I349 HydrophobicContact CG-CB 4.06Å; E152-I349 HydrophobicContact CG-CG2 3.73Å; E152-P352 HydrophobicContact CB-CB 3.8Å; E152-P352 HydrophobicContact CB-CG 4.45Å; E152-P352 HydrophobicContact CG-CB 4.22Å; E152-P352 HydrophobicContact CG-CG 4.42Å
153S83.8Confident88.7Confident5 Ų537.5 Ų37.54%0.03520%0.196CC..Hα-helixtrans-89.3-38.1-175.5580000114F149 I150 Q151 M368F149-S153 WeakPolarHBondContact O-CB 3.22Å; F149-S153 PolarHBondContact O-N 3.35Å; F149-S153 VanDerWaalsContact O-N 3.13Å; F149-S153 PolarHBondContact O-OG 3.47Å; I150-S153 WeakPolarHBondContact CA-OG 3.36Å; I150-S153 PolarHBondContact O-N 3.18Å; I150-S153 PolarHBondContact O-OG 3.13Å; Q151-S153 VanDerWaalsContact C-N 3.33Å; Q151-S153 PolarHBondContact O-N 2.53Å; S153-M368 WeakPolarHBondContact OG-CE 3.19Å
154L84.3Confident88.5Confident56 Ų5640.2 Ų40.229%0.29321%0.21SC..Hα-helixtrans-108.5-14.7-176.6-75.4177.3000114.2M5 I150 W156M5-L154 HydrophobicContact CB-CD2 4.38Å; M5-L154 HydrophobicContact CE-CD1 4.09Å; M5-L154 HydrophobicContact CE-CD2 3.16Å; M5-L154 HydrophobicContact CE-CG 3.74Å; M5-L154 HydrophobicContact CG-CD2 4.22Å; I150-L154 HydrophobicContact CG2-CB 4.46Å; I150-L154 HydrophobicContact CG2-CD1 4.13Å; I150-L154 WeakPolarHBondContact O-CB 3.49Å; I150-L154 PolarHBondContact O-N 3.4Å; L154-W156 HydrophobicContact CB-CB 4.49Å; L154-W156 HydrophobicContact CB-CD2 3.99Å; L154-W156 HydrophobicContact CB-CG 3.9Å; L154-W156 HydrophobicContact CD1-CD2 3.95Å; L154-W156 HydrophobicContact CD1-CE3 3.84Å; L154-W156 HydrophobicContact CD1-CH2 3.83Å; L154-W156 HydrophobicContact CD1-CZ2 3.95Å; L154-W156 HydrophobicContact CD1-CZ3 3.73Å; L154-W156 PolarHBondContact O-N 3.48Å
155G84.4Confident88.3Confident67 Ų6739.7 Ų39.769%0.69121%0.209SC*.  trans7020.7-173.900000113.4Q151Q151-G155 WeakPolarHBondContact O-CA 3.32Å; Q151-G155 PolarHBondContact O-N 2.97Å
156W87.4Confident88.2Confident105 Ų10541 Ų4140%0.39822%0.215SC..  trans-82155.7-179.1-710.8000112.1I150 Q151 L154 L164I150-W156 HydrophobicContact CG2-CB 4.43Å; I150-W156 HydrophobicContact CG2-CE3 3.92Å; Q151-W156 WeakPolarHBondContact CG-O 3.4Å; L154-W156 HydrophobicContact CB-CB 4.49Å; L154-W156 HydrophobicContact CB-CD2 3.99Å; L154-W156 HydrophobicContact CB-CG 3.9Å; L154-W156 HydrophobicContact CD1-CD2 3.95Å; L154-W156 HydrophobicContact CD1-CE3 3.84Å; L154-W156 HydrophobicContact CD1-CH2 3.83Å; L154-W156 HydrophobicContact CD1-CZ2 3.95Å; L154-W156 HydrophobicContact CD1-CZ3 3.73Å; L154-W156 PolarHBondContact O-N 3.48Å; W156-L164 HydrophobicContact CE3-CD1 4.45Å; W156-L164 HydrophobicContact CH2-CD1 4.28Å; W156-L164 HydrophobicContact CZ3-CD1 3.56Å
157N89.8Confident87.9Confident102 Ų10244.7 Ų44.755%0.54524%0.241SC..  trans-62.3137175.4-178.1-80.9000110.9Y159 L160 S161N157-Y159 VanDerWaalsContact C-N 3.32Å; N157-Y159 PolarHBondContact O-N 3.24Å; N157-Y159 PolarHBondContact OD1-N 3.33Å; N157-L160 HydrophobicContact CB-CB 4.19Å; N157-L160 WeakPolarHBondContact O-CB 3.45Å; N157-L160 PolarHBondContact O-N 2.9Å; N157-S161 PolarHBondContact O-N 2.93Å; N157-S161 PolarHBondContact O-OG 2.96Å
158L88.1Confident87.4Confident19 Ų1947.4 Ų47.410%0.09925%0.254CS..Hα-helixtrans-48-48.6180-168.881.4000113Y144 A147 L148 L160 S161 I162 V426 I430Y144-L158 HydrophobicContact CD2-CD1 4.43Å; Y144-L158 HydrophobicContact CD2-CD2 4.4Å; Y144-L158 HydrophobicContact CE2-CD1 4.45Å; Y144-L158 HydrophobicContact CE2-CD2 4.5Å; A147-L158 HydrophobicContact CB-CD1 3.5Å; A147-L158 VanDerWaalsContact CB-CD1 3.5Å; A147-L158 HydrophobicContact CB-CG 3.91Å; L148-L158 HydrophobicContact CD2-CD1 4.23Å; L148-L158 HydrophobicContact CG-CD1 4.41Å; L158-L160 PolarHBondContact O-N 3.46Å; L158-S161 WeakPolarHBondContact O-CB 3.44Å; L158-S161 PolarHBondContact O-N 3.02Å; L158-I162 HydrophobicContact CG-CD1 4.48Å; L158-I162 WeakPolarHBondContact O-CG1 3.43Å; L158-I162 PolarHBondContact O-N 3.43Å; L158-V426 HydrophobicContact CD2-CG1 4.32Å; L158-I430 HydrophobicContact CD2-CD1 3.8Å
159Y91.6Very high87.2Confident116 Ų11647 Ų4746%0.45525%0.252SS..Hα-helixtrans-71.6-31.7-177.6-68.1-78.8000113.2N157 S161 I162 L163N157-Y159 VanDerWaalsContact C-N 3.32Å; N157-Y159 PolarHBondContact O-N 3.24Å; N157-Y159 PolarHBondContact OD1-N 3.33Å; Y159-S161 VanDerWaalsContact C-N 3.33Å; Y159-I162 HydrophobicContact CD1-CD1 4.29Å; Y159-I162 PolarHBondContact O-N 2.91Å; Y159-L163 PolarHBondContact O-N 3.47Å
160L91.1Very high86.8Confident91 Ų9148.4 Ų48.448%0.47627%0.265SS..Hα-helixtrans-64.5-42.4172.5179.764.4000110.5N157 L158 L163 L164N157-L160 HydrophobicContact CB-CB 4.19Å; N157-L160 WeakPolarHBondContact O-CB 3.45Å; N157-L160 PolarHBondContact O-N 2.9Å; L158-L160 PolarHBondContact O-N 3.46Å; L160-L163 PolarHBondContact O-N 3.32Å; L160-L164 WeakPolarHBondContact O-CB 3.49Å; L160-L164 PolarHBondContact O-N 2.91Å
161S91.1Very high86.1Confident0 Ų053.3 Ų53.30%029%0.29CS..Hα-helixtrans-60.9-43.3175-55.90000112I150 N157 L158 Y159 L164 L165I150-S161 WeakPolarHBondContact CG2-OG 3.48Å; N157-S161 PolarHBondContact O-N 2.93Å; N157-S161 PolarHBondContact O-OG 2.96Å; L158-S161 WeakPolarHBondContact O-CB 3.44Å; L158-S161 PolarHBondContact O-N 3.02Å; Y159-S161 VanDerWaalsContact C-N 3.33Å; S161-L164 PolarHBondContact O-N 3.33Å; S161-L165 WeakPolarHBondContact O-CG 3.35Å; S161-L165 PolarHBondContact O-N 3.03Å
162I91.6Very high85.2Confident3 Ų351.9 Ų51.92%0.01528%0.284CS..Hα-helixtrans-59.4-48.9175.1-67.6171.6000111L143 A147 L158 Y159 L164 L165 I166 I423 V426L143-I162 HydrophobicContact CD2-CG2 4.44Å; A147-I162 HydrophobicContact CB-CD1 4.23Å; A147-I162 HydrophobicContact CB-CG1 3.5Å; L158-I162 HydrophobicContact CG-CD1 4.48Å; L158-I162 WeakPolarHBondContact O-CG1 3.43Å; L158-I162 PolarHBondContact O-N 3.43Å; Y159-I162 HydrophobicContact CD1-CD1 4.29Å; Y159-I162 PolarHBondContact O-N 2.91Å; I162-L164 VanDerWaalsContact C-N 3.3Å; I162-L164 PolarHBondContact O-N 2.95Å; I162-L165 PolarHBondContact O-N 2.89Å; I162-I166 HydrophobicContact CG2-CD1 3.61Å; I162-I166 HydrophobicContact CG2-CG1 4.46Å; I162-I166 WeakPolarHBondContact O-CG1 3.36Å; I162-I166 PolarHBondContact O-N 3.46Å; I162-I423 HydrophobicContact CG2-CD1 4.4Å; I162-I423 HydrophobicContact CG2-CG1 4.05Å; I162-V426 HydrophobicContact CD1-CG1 4.22Å; I162-V426 HydrophobicContact CD1-CG2 4.19Å
163L91.1Very high84.5Confident118 Ų11852.5 Ų52.562%0.61829%0.289SS*.Hα-helixtrans-61.3-41.3-178.7-177.266.2000111.7Y159 L160 S167Y159-L163 PolarHBondContact O-N 3.47Å; L160-L163 PolarHBondContact O-N 3.32Å; L163-S167 VanDerWaalsContact O-CB 3.31Å; L163-S167 WeakPolarHBondContact O-CB 3.16Å; L163-S167 PolarHBondContact O-N 3.22Å
164L86.9Confident83.5Confident57 Ų5755.2 Ų55.230%0.29830%0.303SS..Hα-helixtrans-65.6-45.8177.6-177.5147.9000111.8W156 L160 S161 I162 I166 S167 M168W156-L164 HydrophobicContact CE3-CD1 4.45Å; W156-L164 HydrophobicContact CH2-CD1 4.28Å; W156-L164 HydrophobicContact CZ3-CD1 3.56Å; L160-L164 WeakPolarHBondContact O-CB 3.49Å; L160-L164 PolarHBondContact O-N 2.91Å; S161-L164 PolarHBondContact O-N 3.33Å; I162-L164 VanDerWaalsContact C-N 3.3Å; I162-L164 PolarHBondContact O-N 2.95Å; L164-I166 PolarHBondContact O-N 3.38Å; L164-S167 PolarHBondContact O-N 3.1Å; L164-M168 HydrophobicContact CD2-CG 4.28Å; L164-M168 HydrophobicContact CD2-SD 3.5Å; L164-M168 WeakPolarHBondContact CD2-SD 3.29Å; L164-M168 HydrophobicContact CG-SD 4.25Å; L164-M168 WeakPolarHBondContact O-CG 3.34Å; L164-M168 PolarHBondContact O-N 3.06Å
165L86.6Confident82.3Confident0 Ų054.6 Ų54.60%030%0.302CS..Hα-helixtrans-56.1-51.9176.1-78.5168000110.9I150 S161 I162 S167 M168 T169 I372 L375I150-L165 HydrophobicContact CD1-CD1 3.82Å; I150-L165 HydrophobicContact CD1-CD2 3.91Å; I150-L165 HydrophobicContact CD1-CG 3.62Å; S161-L165 WeakPolarHBondContact O-CG 3.35Å; S161-L165 PolarHBondContact O-N 3.03Å; I162-L165 PolarHBondContact O-N 2.89Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-S167 PolarHBondContact O-N 2.53Å; L165-M168 PolarHBondContact O-N 3.47Å; L165-T169 WeakPolarHBondContact O-CB 3.43Å; L165-T169 PolarHBondContact O-N 3.41Å; L165-T169 PolarHBondContact O-OG1 2.81Å; L165-I372 HydrophobicContact CD2-CG2 3.77Å; L165-L375 HydrophobicContact CD1-CD1 4.48Å; L165-L375 HydrophobicContact CD2-CB 4.17Å; L165-L375 HydrophobicContact CD2-CD1 4.09Å
166I88.7Confident81.1Confident28 Ų2852 Ų5214%0.14427%0.274CS..Hα-helixtrans-61.4-42.5179.8-67.1164.9000111.2L143 I162 L164 M168 T169 A170 V419 I423L143-I166 HydrophobicContact CD1-CD1 4.23Å; L143-I166 HydrophobicContact CD2-CD1 4.02Å; L143-I166 HydrophobicContact CD2-CG1 3.68Å; I162-I166 HydrophobicContact CG2-CD1 3.61Å; I162-I166 HydrophobicContact CG2-CG1 4.46Å; I162-I166 WeakPolarHBondContact O-CG1 3.36Å; I162-I166 PolarHBondContact O-N 3.46Å; L164-I166 PolarHBondContact O-N 3.38Å; I166-M168 VanDerWaalsContact C-N 3.32Å; I166-M168 PolarHBondContact O-N 3.09Å; I166-T169 PolarHBondContact O-N 2.96Å; I166-A170 WeakPolarHBondContact O-CB 3.43Å; I166-A170 PolarHBondContact O-N 2.68Å; I166-V419 HydrophobicContact CD1-CG1 3.62Å; I166-V419 HydrophobicContact CG1-CG1 4.25Å; I166-V419 HydrophobicContact CG2-CG1 4.1Å; I166-I423 HydrophobicContact CD1-CD1 3.61Å; I166-I423 HydrophobicContact CD1-CG1 3.99Å
167S84.4Confident80.2Confident79 Ų7947.9 Ų47.955%0.55227%0.265SS*.Hα-helixtrans-62.2-41179.2-175.20000111.8L163 L164 L165 L171L163-S167 VanDerWaalsContact O-CB 3.31Å; L163-S167 WeakPolarHBondContact O-CB 3.16Å; L163-S167 PolarHBondContact O-N 3.22Å; L164-S167 PolarHBondContact O-N 3.1Å; L165-S167 VanDerWaalsContact C-N 3.33Å; L165-S167 PolarHBondContact O-N 2.53Å; S167-L171 PolarHBondContact O-N 3.02Å
168M80.7Confident79.2Confident57 Ų5743.4 Ų43.428%0.28124%0.241SC..Hα-helixtrans-73.2-43.6179.4-67.1-176.88400111.7F17 L164 L165 I166 L171 L172 M376F17-M168 HydrophobicContact CD1-CE 3.57Å; F17-M168 HydrophobicContact CD2-CE 3.83Å; F17-M168 HydrophobicContact CE1-CE 3.52Å; F17-M168 HydrophobicContact CE2-CE 3.75Å; F17-M168 HydrophobicContact CG-CE 3.75Å; F17-M168 HydrophobicContact CZ-CE 3.61Å; F17-M168 HydrophobicContact CZ-SD 4.4Å; L164-M168 HydrophobicContact CD2-CG 4.28Å; L164-M168 HydrophobicContact CD2-SD 3.5Å; L164-M168 WeakPolarHBondContact CD2-SD 3.29Å; L164-M168 HydrophobicContact CG-SD 4.25Å; L164-M168 WeakPolarHBondContact O-CG 3.34Å; L164-M168 PolarHBondContact O-N 3.06Å; L165-M168 PolarHBondContact O-N 3.47Å; I166-M168 VanDerWaalsContact C-N 3.32Å; I166-M168 PolarHBondContact O-N 3.09Å; M168-L171 WeakPolarHBondContact O-CB 3.33Å; M168-L171 PolarHBondContact O-N 3.44Å; M168-L172 PolarHBondContact O-N 3.34Å; M168-M376 HydrophobicContact CB-CE 3.2Å; M168-M376 HydrophobicContact CB-SD 3.81Å; M168-M376 HydrophobicContact CE-CE 3.74Å; M168-M376 HydrophobicContact CG-CE 3.94Å; M168-M376 HydrophobicContact SD-CE 3.53Å; M168-M376 VanDerWaalsContact SD-CE 3.53Å
169T83Confident78.5Confident0 Ų043.5 Ų43.50%024%0.242CC..Hα-helixtrans-57.2-52173.8-58.20000110.2L165 I166 L171 L172 T173 L379 D380 F383L165-T169 WeakPolarHBondContact O-CB 3.43Å; L165-T169 PolarHBondContact O-N 3.41Å; L165-T169 PolarHBondContact O-OG1 2.81Å; I166-T169 PolarHBondContact O-N 2.96Å; T169-L171 PolarHBondContact O-N 3.16Å; T169-L171 VanDerWaalsContact O-N 3.16Å; T169-L172 CarbonylContact O-C 3.6Å; T169-L172 WeakPolarHBondContact O-CA 3.17Å; T169-L172 PolarHBondContact O-N 3.37Å; T169-T173 PolarHBondContact O-N 3.49Å; T169-T173 PolarHBondContact O-OG1 3.13Å; T169-L379 HydrophobicContact CG2-CB 3.61Å; T169-L379 HydrophobicContact CG2-CD1 4.33Å; T169-L379 WeakPolarHBondContact OG1-CD1 3.42Å; T169-D380 WeakPolarHBondContact CG2-OD1 3.43Å; T169-F383 HydrophobicContact CG2-CD2 4.12Å; T169-F383 HydrophobicContact CG2-CE2 3.71Å
170A78.6Confident77.6Confident35 Ų3538.1 Ų38.129%0.28922%0.222SC..Hα-helixtrans-54.7-40.8-179.200000112.5I166 L172 T173 I174I166-A170 WeakPolarHBondContact O-CB 3.43Å; I166-A170 PolarHBondContact O-N 2.68Å; A170-L172 VanDerWaalsContact C-N 3.31Å; A170-L172 PolarHBondContact O-N 2.67Å; A170-T173 PolarHBondContact O-N 2.95Å; A170-I174 HydrophobicContact CB-CD1 4.5Å; A170-I174 WeakPolarHBondContact O-CB 3.36Å; A170-I174 WeakPolarHBondContact O-CD1 3.15Å; A170-I174 WeakPolarHBondContact O-CG1 3.12Å; A170-I174 PolarHBondContact O-N 3.34Å
171L73Confident76.9Confident103 Ų10334.5 Ų34.554%0.53920%0.203SC..Hα-helixtrans-59.8-40.7176.6-174.668.4000112.2L21 S167 M168 T169 T175L21-L171 HydrophobicContact CD1-CD2 4.27Å; S167-L171 PolarHBondContact O-N 3.02Å; M168-L171 WeakPolarHBondContact O-CB 3.33Å; M168-L171 PolarHBondContact O-N 3.44Å; T169-L171 PolarHBondContact O-N 3.16Å; T169-L171 VanDerWaalsContact O-N 3.16Å; L171-T175 WeakPolarHBondContact O-CG2 3.35Å; L171-T175 PolarHBondContact O-OG1 2.88Å
172L68.7Low76.4Confident28 Ų2834.5 Ų34.515%0.14720%0.203CC..Hα-helixtrans-77.5-40.5178.2-64178.7000112.2V20 L21 M168 T169 A170 I174 T175 G176 M376V20-L172 HydrophobicContact CG1-CD1 4.39Å; L21-L172 HydrophobicContact CB-CD2 4.44Å; L21-L172 HydrophobicContact CD1-CD2 4.36Å; L21-L172 HydrophobicContact CG-CD2 4.4Å; M168-L172 PolarHBondContact O-N 3.34Å; T169-L172 CarbonylContact O-C 3.6Å; T169-L172 WeakPolarHBondContact O-CA 3.17Å; T169-L172 PolarHBondContact O-N 3.37Å; A170-L172 VanDerWaalsContact C-N 3.31Å; A170-L172 PolarHBondContact O-N 2.67Å; L172-I174 PolarHBondContact O-N 2.92Å; L172-T175 PolarHBondContact O-N 3.19Å; L172-T175 PolarHBondContact O-OG1 3.43Å; L172-G176 PolarHBondContact O-N 2.69Å; L172-M376 HydrophobicContact CD1-SD 3.61Å
173T69.7Low75.9Confident33 Ų3339.6 Ų39.620%0.20222%0.223CC..Hα-helixtrans-64.2-42.5179.2-28.20000112T169 A170 T175 D380T169-T173 PolarHBondContact O-N 3.49Å; T169-T173 PolarHBondContact O-OG1 3.13Å; A170-T173 PolarHBondContact O-N 2.95Å; T173-T175 PolarHBondContact O-N 3.48Å; T173-D380 WeakPolarHBondContact CB-OD1 3.48Å; T173-D380 PolarHBondContact OG1-OD1 3.26Å
174I63.6Low75.4Confident63 Ų6335 Ų3532%0.32320%0.2SC..Hα-helixtrans-62.3-31.5-179.2-70.6161.3000110.6A170 L172 F650A170-I174 HydrophobicContact CB-CD1 4.5Å; A170-I174 WeakPolarHBondContact O-CB 3.36Å; A170-I174 WeakPolarHBondContact O-CD1 3.15Å; A170-I174 WeakPolarHBondContact O-CG1 3.12Å; A170-I174 PolarHBondContact O-N 3.34Å; L172-I174 PolarHBondContact O-N 2.92Å; I174-F650 HydrophobicContact CD1-CD2 4.41Å; I174-F650 HydrophobicContact CD1-CE2 3.43Å; I174-F650 VanDerWaalsContact CD1-CE2 3.43Å; I174-F650 HydrophobicContact CD1-CZ 3.81Å; I174-F650 HydrophobicContact CG1-CE2 3.93Å; I174-F650 HydrophobicContact CG1-CZ 4.02Å; I174-F650 HydrophobicContact CG2-CD2 3.96Å; I174-F650 HydrophobicContact CG2-CE2 3.96Å
175T58.5Low75.4Confident43 Ų4332.3 Ų32.326%0.26419%0.186SC..Hα-helixtrans-88.4-46.8-174.5510000112.1M28 R33 L171 L172 T173M28-T175 VanDerWaalsContact CG-O 3.27Å; M28-T175 WeakPolarHBondContact CG-O 3.46Å; M28-T175 VanDerWaalsContact SD-CB 3.53Å; R33-T175 PolarHBondContact NH2-O 3.41Å; L171-T175 WeakPolarHBondContact O-CG2 3.35Å; L171-T175 PolarHBondContact O-OG1 2.88Å; L172-T175 PolarHBondContact O-N 3.19Å; L172-T175 PolarHBondContact O-OG1 3.43Å; T173-T175 PolarHBondContact O-N 3.48Å
176G59.8Low75.4Confident11 Ų1133.9 Ų33.911%0.11320%0.195CC..Hα-helixtrans-83.2-42.9-157.800000120.7L172 A180L172-G176 PolarHBondContact O-N 2.69Å; G176-A180 VanDerWaalsContact CA-CB 3.43Å; G176-A180 WeakPolarHBondContact O-CB 3.34Å
177G67.1Low75.3Confident19 Ų1934.8 Ų34.820%0.19620%0.201CC..Hα-helixtrans63.8171.8-164.500000113.9V179 A180 V181G177-V179 VanDerWaalsContact C-N 3.26Å; G177-V179 PolarHBondContact O-N 3.15Å; G177-V179 VanDerWaalsContact O-N 3.15Å; G177-A180 PolarHBondContact O-N 2.99Å; G177-A180 VanDerWaalsContact O-N 3.16Å; G177-V181 WeakPolarHBondContact O-CG2 3.29Å; G177-V181 PolarHBondContact O-N 3.41Å
178L68.9Low75.4Confident8 Ų831.3 Ų31.34%0.04218%0.175CC..Hα-helixtrans-58.7-33-171.6-176.365.5000113.9Y39 F40 A42 V181 L182Y39-L178 WeakPolarHBondContact O-CB 3.39Å; F40-L178 WeakPolarHBondContact O-CD2 3.41Å; A42-L178 HydrophobicContact CB-CD2 4.42Å; L178-V181 PolarHBondContact O-N 3.28Å; L178-L182 HydrophobicContact CD1-CG 4.46Å; L178-L182 HydrophobicContact CG-CD1 4.1Å; L178-L182 HydrophobicContact CG-CG 4.37Å; L178-L182 VanDerWaalsContact O-CG 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.31Å; L178-L182 PolarHBondContact O-N 3.4Å
179V73.3Confident75.9Confident22 Ų2228.8 Ų28.813%0.13316%0.164CC..Hα-helixtrans-61.8-48.2178177.60000111.3A31 A42 M46 G177 V181 L182 Y183A31-V179 HydrophobicContact CB-CB 4.42Å; A31-V179 HydrophobicContact CB-CG1 4.48Å; A31-V179 HydrophobicContact CB-CG2 4.43Å; A42-V179 HydrophobicContact CB-CG2 3.5Å; A42-V179 VanDerWaalsContact CB-CG2 3.5Å; M46-V179 HydrophobicContact CE-CG1 4.45Å; M46-V179 HydrophobicContact CE-CG2 4.43Å; G177-V179 VanDerWaalsContact C-N 3.26Å; G177-V179 PolarHBondContact O-N 3.15Å; G177-V179 VanDerWaalsContact O-N 3.15Å; V179-V181 VanDerWaalsContact C-N 3.31Å; V179-V181 PolarHBondContact O-N 2.93Å; V179-L182 PolarHBondContact O-N 2.71Å; V179-Y183 HydrophobicContact CG1-CD2 3.91Å; V179-Y183 HydrophobicContact CG1-CE2 3.75Å; V179-Y183 VanDerWaalsContact O-CD2 3.24Å; V179-Y183 WeakPolarHBondContact O-CD2 3.39Å; V179-Y183 PolarHBondContact O-N 3.24Å
180A73.6Confident76.3Confident3 Ų333.5 Ų33.53%0.02519%0.192CC..Hα-helixtrans-63.5-42.9-179.600000110.6A27 M28 G176 G177 L182 Y183 T184A27-A180 HydrophobicContact CB-CB 4.14Å; M28-A180 HydrophobicContact CG-CB 4.49Å; G176-A180 VanDerWaalsContact CA-CB 3.43Å; G176-A180 WeakPolarHBondContact O-CB 3.34Å; G177-A180 PolarHBondContact O-N 2.99Å; G177-A180 VanDerWaalsContact O-N 3.16Å; A180-L182 VanDerWaalsContact C-N 3.34Å; A180-L182 PolarHBondContact O-N 3.07Å; A180-Y183 PolarHBondContact O-N 3.48Å; A180-T184 PolarHBondContact O-N 3.5Å; A180-T184 PolarHBondContact O-OG1 3.18Å; A180-T184 VanDerWaalsContact O-OG1 3.12Å
181V76.1Confident76.9Confident15 Ų1534.1 Ų34.19%0.09119%0.19CC..Hα-helixtrans-55.5-49.1175.9177.60000110.4G177 L178 V179 Y183 T184 D185 D380G177-V181 WeakPolarHBondContact O-CG2 3.29Å; G177-V181 PolarHBondContact O-N 3.41Å; L178-V181 PolarHBondContact O-N 3.28Å; V179-V181 VanDerWaalsContact C-N 3.31Å; V179-V181 PolarHBondContact O-N 2.93Å; V181-Y183 VanDerWaalsContact C-N 3.3Å; V181-Y183 PolarHBondContact O-N 3.08Å; V181-T184 WeakPolarHBondContact CA-OG1 3.41Å; V181-T184 PolarHBondContact O-N 2.91Å; V181-T184 PolarHBondContact O-OG1 3.17Å; V181-D185 WeakPolarHBondContact O-CB 3.49Å; V181-D185 PolarHBondContact O-N 3.13Å; V181-D380 HydrophobicContact CG2-CB 4.28Å
182L79.9Confident77.8Confident0 Ų029.3 Ų29.30%017%0.165CC..Hα-helixtrans-59.3-37.1179.7-74.6168.4000113.8A42 M46 V50 S54 L178 V179 A180 T186 R285A42-L182 HydrophobicContact CB-CD1 4Å; M46-L182 HydrophobicContact CG-CD1 3.78Å; M46-L182 HydrophobicContact SD-CD1 3.8Å; V50-L182 HydrophobicContact CG1-CB 3.82Å; S54-L182 WeakPolarHBondContact OG-CD2 3.24Å; L178-L182 HydrophobicContact CD1-CG 4.46Å; L178-L182 HydrophobicContact CG-CD1 4.1Å; L178-L182 HydrophobicContact CG-CG 4.37Å; L178-L182 VanDerWaalsContact O-CG 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.31Å; L178-L182 PolarHBondContact O-N 3.4Å; V179-L182 PolarHBondContact O-N 2.71Å; A180-L182 VanDerWaalsContact C-N 3.34Å; A180-L182 PolarHBondContact O-N 3.07Å; L182-T186 PolarHBondContact O-N 2.87Å; L182-T186 PolarHBondContact O-OG1 3.1Å; L182-R285 HydrophobicContact CD2-CG 4.47Å
183Y81.2Confident78.9Confident110 Ų11029.8 Ų29.843%0.43117%0.167SC..Hα-helixtrans-75.2-40.9177.8-79.4-68.1000112.6A27 V50 V179 A180 V181 D185 T186 L187A27-Y183 HydrophobicContact CB-CD2 4.29Å; V50-Y183 HydrophobicContact CG2-CE1 4.4Å; V179-Y183 HydrophobicContact CG1-CD2 3.91Å; V179-Y183 HydrophobicContact CG1-CE2 3.75Å; V179-Y183 VanDerWaalsContact O-CD2 3.24Å; V179-Y183 WeakPolarHBondContact O-CD2 3.39Å; V179-Y183 PolarHBondContact O-N 3.24Å; A180-Y183 PolarHBondContact O-N 3.48Å; V181-Y183 VanDerWaalsContact C-N 3.3Å; V181-Y183 PolarHBondContact O-N 3.08Å; Y183-D185 VanDerWaalsContact C-N 3.31Å; Y183-T186 PolarHBondContact O-N 3.18Å; Y183-L187 PolarHBondContact O-N 3.02Å
184T81.3Confident80.1Confident22 Ų2229.8 Ų29.814%0.13517%0.174CC..Hα-helixtrans-64.1-38.8174.750.90000111.1V20 I23 A180 V181 T186 L187 Q188V20-T184 HydrophobicContact CG1-CG2 3.98Å; I23-T184 HydrophobicContact CG2-CG2 4.44Å; A180-T184 PolarHBondContact O-N 3.5Å; A180-T184 PolarHBondContact O-OG1 3.18Å; A180-T184 VanDerWaalsContact O-OG1 3.12Å; V181-T184 WeakPolarHBondContact CA-OG1 3.41Å; V181-T184 PolarHBondContact O-N 2.91Å; V181-T184 PolarHBondContact O-OG1 3.17Å; T184-T186 VanDerWaalsContact C-N 3.29Å; T184-T186 PolarHBondContact O-N 3.06Å; T184-L187 PolarHBondContact O-N 2.86Å; T184-Q188 WeakPolarHBondContact O-CB 3.43Å; T184-Q188 PolarHBondContact O-N 3.2Å
185D86.1Confident81.5Confident0 Ų027 Ų270%016%0.162CC..Hα-helixtrans-59-41.2174.6-64.1-5.9000111.2S54 V57 V181 Y183 L187 Q188 A189 R285 S377S54-D185 PolarHBondContact OG-OD2 3.43Å; V57-D185 HydrophobicContact CB-CB 4.34Å; V57-D185 HydrophobicContact CG1-CB 4.26Å; V57-D185 WeakPolarHBondContact CG2-O 3.37Å; V181-D185 WeakPolarHBondContact O-CB 3.49Å; V181-D185 PolarHBondContact O-N 3.13Å; Y183-D185 VanDerWaalsContact C-N 3.31Å; D185-L187 PolarHBondContact O-N 3.06Å; D185-Q188 PolarHBondContact O-N 3.4Å; D185-A189 WeakPolarHBondContact O-CB 3.34Å; D185-A189 PolarHBondContact O-N 3.17Å; D185-R285 IonicContact OD2-CZ 3.97Å; D185-R285 VanDerWaalsContact OD2-CZ 3.25Å; D185-R285 IonicContact OD2-NH1 2.67Å; D185-R285 PolarHBondContact OD2-NH1 2.85Å; D185-R285 IonicContact OD2-NH2 3.87Å; D185-R285 PolarHBondContact OD2-NH2 3.19Å; D185-S377 WeakPolarHBondContact OD1-CB 2.73Å; D185-S377 PolarHBondContact OD1-OG 2.9Å
186T86.9Confident83.1Confident32 Ų3225 Ų2520%0.19615%0.149CC..Hα-helixtrans-64.5-44.2-178.7-56.40000111.6A53 L182 Y183 T184 Q188 A189 V190A53-T186 HydrophobicContact CB-CG2 4.26Å; L182-T186 PolarHBondContact O-N 2.87Å; L182-T186 PolarHBondContact O-OG1 3.1Å; Y183-T186 PolarHBondContact O-N 3.18Å; T184-T186 VanDerWaalsContact C-N 3.29Å; T184-T186 PolarHBondContact O-N 3.06Å; T186-Q188 VanDerWaalsContact C-N 3.33Å; T186-A189 PolarHBondContact O-N 3.07Å; T186-V190 PolarHBondContact O-N 2.9Å
187L86.1Confident84.8Confident48 Ų4827.8 Ų27.825%0.25116%0.161SC..Hα-helixtrans-62.1-44.8174.7174.264.3000110.8L19 I23 Y183 T184 D185 A189 V190 L191L19-L187 HydrophobicContact CD2-CD2 4.02Å; L19-L187 HydrophobicContact CG-CD2 4.35Å; I23-L187 HydrophobicContact CD1-CD2 3.51Å; Y183-L187 PolarHBondContact O-N 3.02Å; T184-L187 PolarHBondContact O-N 2.86Å; D185-L187 PolarHBondContact O-N 3.06Å; L187-A189 VanDerWaalsContact C-N 3.33Å; L187-A189 PolarHBondContact O-N 3.3Å; L187-V190 PolarHBondContact O-N 2.87Å; L187-L191 HydrophobicContact CD1-CD1 4.02Å; L187-L191 HydrophobicContact CD1-CG 4.35Å; L187-L191 HydrophobicContact CG-CD1 3.96Å; L187-L191 WeakPolarHBondContact O-CG 3.29Å; L187-L191 PolarHBondContact O-N 3.5Å
188Q88.3Confident86.2Confident5 Ų529.5 Ų29.52%0.02317%0.168CC..Hα-helixtrans-63.2-39.4-179.2-167.8-165.4-61.700112T184 D185 T186 V190 L191 M192 A373T184-Q188 WeakPolarHBondContact O-CB 3.43Å; T184-Q188 PolarHBondContact O-N 3.2Å; D185-Q188 PolarHBondContact O-N 3.4Å; T186-Q188 VanDerWaalsContact C-N 3.33Å; Q188-V190 VanDerWaalsContact C-N 3.29Å; Q188-V190 PolarHBondContact O-N 3.26Å; Q188-L191 PolarHBondContact O-N 3.37Å; Q188-M192 WeakPolarHBondContact O-CB 3.41Å; Q188-M192 PolarHBondContact O-N 3.42Å; Q188-A373 HydrophobicContact CG-CB 4.1Å; Q188-A373 PolarHBondContact OE1-O 3.09Å; Q188-A373 VanDerWaalsContact OE1-O 3.05Å
189A91.1Very high87.4Confident4 Ų429.1 Ų29.13%0.03317%0.166CC..Hα-helixtrans-54.3-47.1176.600000111.4A53 V57 D185 T186 L187 I193A53-A189 HydrophobicContact CB-CB 3.92Å; V57-A189 HydrophobicContact CG2-CB 3.53Å; D185-A189 WeakPolarHBondContact O-CB 3.34Å; D185-A189 PolarHBondContact O-N 3.17Å; T186-A189 PolarHBondContact O-N 3.07Å; L187-A189 VanDerWaalsContact C-N 3.33Å; L187-A189 PolarHBondContact O-N 3.3Å; A189-I193 WeakPolarHBondContact O-CB 3.24Å; A189-I193 WeakPolarHBondContact O-CD1 3.35Å; A189-I193 WeakPolarHBondContact O-CG1 3.44Å; A189-I193 PolarHBondContact O-N 3.03Å
190V91.3Very high88.5Confident100 Ų10028.5 Ų28.561%0.60616%0.162SC*.Hα-helixtrans-63.8-47.5-179.61760000111T186 L187 Q188 G194T186-V190 PolarHBondContact O-N 2.9Å; L187-V190 PolarHBondContact O-N 2.87Å; Q188-V190 VanDerWaalsContact C-N 3.29Å; Q188-V190 PolarHBondContact O-N 3.26Å; V190-G194 PolarHBondContact O-N 3.29Å
191L90.6Very high89.6Confident47 Ų4733.1 Ų33.125%0.24619%0.185CC..Hα-helixtrans-69.4-36.6-178-65.1172.6000112.3Y16 L187 Q188 G194 G195 V370Y16-L191 HydrophobicContact CD2-CD1 4.06Å; Y16-L191 HydrophobicContact CE2-CD1 3.47Å; Y16-L191 VanDerWaalsContact CE2-CD1 3.47Å; L187-L191 HydrophobicContact CD1-CD1 4.02Å; L187-L191 HydrophobicContact CD1-CG 4.35Å; L187-L191 HydrophobicContact CG-CD1 3.96Å; L187-L191 WeakPolarHBondContact O-CG 3.29Å; L187-L191 PolarHBondContact O-N 3.5Å; Q188-L191 PolarHBondContact O-N 3.37Å; L191-G194 PolarHBondContact O-N 2.95Å; L191-G195 PolarHBondContact O-N 3.48Å; L191-V370 HydrophobicContact CB-CG1 4.34Å; L191-V370 HydrophobicContact CB-CG2 3.58Å; L191-V370 HydrophobicContact CD1-CG2 4.38Å
192M91.3Very high90.6Very high3 Ų335.2 Ų35.22%0.01520%0.195CC..Hα-helixtrans-65.6-46.9176.8-174.6175.674.100111.6F56 V57 I60 F65 Q188 A196 V370F56-M192 HydrophobicContact CD1-CE 3.79Å; F56-M192 HydrophobicContact CE1-CE 3.29Å; F56-M192 HydrophobicContact CZ-CE 4.1Å; V57-M192 HydrophobicContact CG2-CE 4.17Å; I60-M192 HydrophobicContact CB-CE 3.74Å; I60-M192 HydrophobicContact CB-SD 4.45Å; I60-M192 HydrophobicContact CG2-CE 3.59Å; I60-M192 HydrophobicContact CG2-SD 3.88Å; F65-M192 HydrophobicContact CE2-CG 3.86Å; F65-M192 HydrophobicContact CE2-SD 3.61Å; F65-M192 HydrophobicContact CZ-CG 3.6Å; F65-M192 HydrophobicContact CZ-SD 3.94Å; Q188-M192 WeakPolarHBondContact O-CB 3.41Å; Q188-M192 PolarHBondContact O-N 3.42Å; M192-A196 WeakPolarHBondContact O-CB 3.3Å; M192-A196 PolarHBondContact O-N 2.97Å; M192-V370 VanDerWaalsContact CA-CG1 3.46Å; M192-V370 HydrophobicContact CB-CG1 3.68Å; M192-V370 HydrophobicContact CG-CG1 4.29Å
193I92.8Very high91.4Very high37 Ų3735.2 Ų35.219%0.1920%0.195CC..Hα-helixtrans-62.2-46.6175.6-68.3165.3000110F56 A189 L197 L305 L308F56-I193 HydrophobicContact CD1-CD1 4.44Å; F56-I193 HydrophobicContact CE1-CD1 3.92Å; F56-I193 HydrophobicContact CE1-CG1 3.83Å; F56-I193 HydrophobicContact CZ-CG1 4.34Å; A189-I193 WeakPolarHBondContact O-CB 3.24Å; A189-I193 WeakPolarHBondContact O-CD1 3.35Å; A189-I193 WeakPolarHBondContact O-CG1 3.44Å; A189-I193 PolarHBondContact O-N 3.03Å; I193-L197 HydrophobicContact CG2-CD1 3.64Å; I193-L197 HydrophobicContact CG2-CG 4.3Å; I193-L197 VanDerWaalsContact O-CB 3.25Å; I193-L197 WeakPolarHBondContact O-CB 3.29Å; I193-L197 WeakPolarHBondContact O-CG 3.2Å; I193-L197 PolarHBondContact O-N 3.1Å; I193-L305 HydrophobicContact CD1-CD2 3.8Å; I193-L308 HydrophobicContact CD1-CD1 4.19Å; I193-L308 HydrophobicContact CG1-CD1 4.13Å; I193-L308 HydrophobicContact CG2-CD1 4.07Å
194G93.5Very high92.2Very high33 Ų3331.9 Ų31.934%0.3418%0.184SC..Hα-helixtrans-61.6-46.9178.800000113.4V190 L191 T198V190-G194 PolarHBondContact O-N 3.29Å; L191-G194 PolarHBondContact O-N 2.95Å; G194-T198 WeakPolarHBondContact O-CB 3.36Å; G194-T198 PolarHBondContact O-N 3.32Å; G194-T198 PolarHBondContact O-OG1 3.35Å
195G92.8Very high92.9Very high6 Ų637 Ų376%0.06221%0.209CC..Hα-helixtrans-64.5-46.9178.700000112.6L191 T198 L199L191-G195 PolarHBondContact O-N 3.48Å; G195-T198 PolarHBondContact O-N 3.28Å; G195-L199 PolarHBondContact O-N 3.44Å
196A93.9Very high93.3Very high1 Ų142.3 Ų42.31%0.00823%0.233CC..Hα-helixtrans-67.4-38.8179.600000112.3F65 M192 L199 T200 V312 M367F65-A196 HydrophobicContact CE1-CB 4.39Å; M192-A196 WeakPolarHBondContact O-CB 3.3Å; M192-A196 PolarHBondContact O-N 2.97Å; A196-L199 PolarHBondContact O-N 2.9Å; A196-T200 WeakPolarHBondContact O-CB 3.46Å; A196-T200 PolarHBondContact O-N 3.06Å; A196-T200 PolarHBondContact O-OG1 3.01Å; A196-V312 HydrophobicContact CB-CB 3.81Å; A196-V312 HydrophobicContact CB-CG2 3.86Å; A196-M367 HydrophobicContact CB-CE 4.36Å
197L95.4Very high93.7Very high69 Ų6940.9 Ų40.936%0.36122%0.224SC..Hα-helixtrans-62-44.9172.6-77.9170.3000111.4I193 L199 T200 I201 V312I193-L197 HydrophobicContact CG2-CD1 3.64Å; I193-L197 HydrophobicContact CG2-CG 4.3Å; I193-L197 VanDerWaalsContact O-CB 3.25Å; I193-L197 WeakPolarHBondContact O-CB 3.29Å; I193-L197 WeakPolarHBondContact O-CG 3.2Å; I193-L197 PolarHBondContact O-N 3.1Å; L197-L199 PolarHBondContact O-N 3.07Å; L197-T200 PolarHBondContact O-N 3.34Å; L197-I201 VanDerWaalsContact O-CG1 3.29Å; L197-I201 WeakPolarHBondContact O-CG1 3.47Å; L197-I201 PolarHBondContact O-N 3.04Å; L197-V312 HydrophobicContact CD2-CG1 3.67Å; L197-V312 HydrophobicContact CG-CG1 4.12Å
198T95.2Very high94.1Very high54 Ų5441.3 Ų41.333%0.33124%0.24SC..Hα-helixtrans-62.9-44.8179.5-52.50000111.2G194 G195 T200 I201 M202 L363G194-T198 WeakPolarHBondContact O-CB 3.36Å; G194-T198 PolarHBondContact O-N 3.32Å; G194-T198 PolarHBondContact O-OG1 3.35Å; G195-T198 PolarHBondContact O-N 3.28Å; T198-T200 VanDerWaalsContact C-N 3.3Å; T198-T200 PolarHBondContact O-N 3.48Å; T198-I201 PolarHBondContact O-N 3.15Å; T198-M202 HydrophobicContact CG2-SD 4.37Å; T198-M202 WeakPolarHBondContact O-CG 3.32Å; T198-M202 PolarHBondContact O-N 2.87Å; T198-L363 HydrophobicContact CG2-CD2 3.47Å; T198-L363 VanDerWaalsContact CG2-CD2 3.47Å
199L95.8Very high94.4Very high0 Ų042.3 Ų42.30%025%0.252CS..Hα-helixtrans-55-48.6173.6-173.760000111.4G195 A196 L197 M202 S203 Y351 L354 V355 V358 M359G195-L199 PolarHBondContact O-N 3.44Å; A196-L199 PolarHBondContact O-N 2.9Å; L197-L199 PolarHBondContact O-N 3.07Å; L199-M202 PolarHBondContact O-N 3.25Å; L199-S203 WeakPolarHBondContact O-CB 3.22Å; L199-S203 PolarHBondContact O-N 3.12Å; L199-S203 PolarHBondContact O-OG 3.25Å; L199-Y351 HydrophobicContact CD2-CE1 3.83Å; L199-Y351 HydrophobicContact CD2-CE2 3.83Å; L199-Y351 VanDerWaalsContact CD2-CZ 3.42Å; L199-Y351 WeakPolarHBondContact CD2-OH 3.2Å; L199-L354 HydrophobicContact CD1-CD2 4.43Å; L199-L354 HydrophobicContact CD1-CG 4.23Å; L199-L354 HydrophobicContact CD2-CD2 4.16Å; L199-L354 HydrophobicContact CG-CD2 4.24Å; L199-V355 HydrophobicContact CD1-CG2 4.34Å; L199-V355 HydrophobicContact CD2-CG2 3.63Å; L199-V358 HydrophobicContact CD1-CB 4.24Å; L199-V358 HydrophobicContact CD1-CG1 4.47Å; L199-M359 HydrophobicContact CB-CE 3.46Å; L199-M359 VanDerWaalsContact CB-CE 3.46Å; L199-M359 HydrophobicContact CD1-CE 3.73Å; L199-M359 HydrophobicContact CD1-CG 3.81Å; L199-M359 HydrophobicContact CD2-CE 4.28Å; L199-M359 HydrophobicContact CG-CE 3.99Å
200T96.4Very high94.5Very high9 Ų946.1 Ų46.16%0.05527%0.271CS..Hα-helixtrans-62.8-47.2-175.4-58.60000110.8A196 L197 T198 S203 L204 F311 V312 P316A196-T200 WeakPolarHBondContact O-CB 3.46Å; A196-T200 PolarHBondContact O-N 3.06Å; A196-T200 PolarHBondContact O-OG1 3.01Å; L197-T200 PolarHBondContact O-N 3.34Å; T198-T200 VanDerWaalsContact C-N 3.3Å; T198-T200 PolarHBondContact O-N 3.48Å; T200-S203 PolarHBondContact O-N 2.97Å; T200-L204 HydrophobicContact CG2-CD1 3.84Å; T200-L204 HydrophobicContact CG2-CG 4.31Å; T200-L204 WeakPolarHBondContact O-CB 3.38Å; T200-L204 VanDerWaalsContact O-CG 3.27Å; T200-L204 WeakPolarHBondContact O-CG 3.39Å; T200-L204 PolarHBondContact O-N 3.41Å; T200-F311 WeakPolarHBondContact CG2-O 3.45Å; T200-V312 WeakPolarHBondContact OG1-CA 3.32Å; T200-P316 HydrophobicContact CG2-CG 4.2Å; T200-P316 VanDerWaalsContact OG1-CG 3.25Å; T200-P316 WeakPolarHBondContact OG1-CG 3.09Å
201I96.4Very high94.6Very high100 Ų10047 Ų4751%0.51327%0.268SS..Hα-helixtrans-60.4-50.1178.5-68165.1000110.3L197 T198 S203 L204 I205L197-I201 VanDerWaalsContact O-CG1 3.29Å; L197-I201 WeakPolarHBondContact O-CG1 3.47Å; L197-I201 PolarHBondContact O-N 3.04Å; T198-I201 PolarHBondContact O-N 3.15Å; I201-S203 VanDerWaalsContact C-N 3.3Å; I201-S203 PolarHBondContact O-N 3.25Å; I201-L204 PolarHBondContact O-N 3.38Å; I201-I205 HydrophobicContact CG2-CD1 4.02Å; I201-I205 VanDerWaalsContact O-CG1 3.3Å; I201-I205 WeakPolarHBondContact O-CG1 3.37Å; I201-I205 PolarHBondContact O-N 2.87Å
202M96.6Very high94.8Very high59 Ų5945 Ų4529%0.29126%0.26SS..Hα-helixtrans-60.2-41.4178.3-70.2-173.27200112.4T198 L199 I205 K206 V358T198-M202 HydrophobicContact CG2-SD 4.37Å; T198-M202 WeakPolarHBondContact O-CG 3.32Å; T198-M202 PolarHBondContact O-N 2.87Å; L199-M202 PolarHBondContact O-N 3.25Å; M202-I205 PolarHBondContact O-N 3.33Å; M202-K206 PolarHBondContact O-N 3.28Å; M202-V358 HydrophobicContact CB-CG1 3.7Å; M202-V358 HydrophobicContact CE-CG1 4.36Å; M202-V358 VanDerWaalsContact CE-O 3.23Å; M202-V358 WeakPolarHBondContact CE-O 3.31Å
203S96.6Very high95Very high0 Ų044.9 Ų44.90%026%0.259CS..Hα-helixtrans-69.2-41.7-179.1-58.80000111.5L199 T200 I201 I205 K206 V207L199-S203 WeakPolarHBondContact O-CB 3.22Å; L199-S203 PolarHBondContact O-N 3.12Å; L199-S203 PolarHBondContact O-OG 3.25Å; T200-S203 PolarHBondContact O-N 2.97Å; I201-S203 VanDerWaalsContact C-N 3.3Å; I201-S203 PolarHBondContact O-N 3.25Å; S203-I205 VanDerWaalsContact C-N 3.35Å; S203-I205 PolarHBondContact O-N 3.43Å; S203-K206 PolarHBondContact O-N 3.18Å; S203-V207 WeakPolarHBondContact O-CG2 3.33Å; S203-V207 PolarHBondContact O-N 3.07Å
204L96.9Very high95Very high41 Ų4149.9 Ų49.922%0.21528%0.276CS..Hα-helixtrans-61.2-41.9175.3-78170.8000111.7T200 I201 K206 V207 G208 G209 V213 I315 I319T200-L204 HydrophobicContact CG2-CD1 3.84Å; T200-L204 HydrophobicContact CG2-CG 4.31Å; T200-L204 WeakPolarHBondContact O-CB 3.38Å; T200-L204 VanDerWaalsContact O-CG 3.27Å; T200-L204 WeakPolarHBondContact O-CG 3.39Å; T200-L204 PolarHBondContact O-N 3.41Å; I201-L204 PolarHBondContact O-N 3.38Å; L204-K206 VanDerWaalsContact C-N 3.3Å; L204-K206 PolarHBondContact O-N 3.08Å; L204-V207 WeakPolarHBondContact O-CG2 3.5Å; L204-V207 PolarHBondContact O-N 3.44Å; L204-G208 PolarHBondContact O-N 3.4Å; L204-G209 PolarHBondContact O-N 3.26Å; L204-V213 HydrophobicContact CD2-CG2 3.81Å; L204-I315 HydrophobicContact CD2-CG2 4.24Å; L204-I319 HydrophobicContact CD2-CD1 3.92Å; L204-I319 HydrophobicContact CG-CD1 4.08Å
205I96.2Very high95Very high129 Ų12951.4 Ų51.466%0.66228%0.278SS*.Hα-helixtrans-58.8-43176.3-67.9164.6000110.6I201 M202 S203 V207 G208I201-I205 HydrophobicContact CG2-CD1 4.02Å; I201-I205 VanDerWaalsContact O-CG1 3.3Å; I201-I205 WeakPolarHBondContact O-CG1 3.37Å; I201-I205 PolarHBondContact O-N 2.87Å; M202-I205 PolarHBondContact O-N 3.33Å; S203-I205 VanDerWaalsContact C-N 3.35Å; S203-I205 PolarHBondContact O-N 3.43Å; I205-V207 PolarHBondContact O-N 3.29Å; I205-G208 PolarHBondContact O-N 3.42Å
206K95.4Very high95.2Very high112 Ų11255.1 Ų55.149%0.48729%0.293SS..Hα-helixtrans-63.9-36178.8-74.5-172177-174.30113.6M202 S203 L204 A357 V358M202-K206 PolarHBondContact O-N 3.28Å; S203-K206 PolarHBondContact O-N 3.18Å; L204-K206 VanDerWaalsContact C-N 3.3Å; L204-K206 PolarHBondContact O-N 3.08Å; K206-A357 PolarHBondContact NZ-O 2.89Å; K206-V358 HydrophobicContact CD-CG1 4.32Å; K206-V358 HydrophobicContact CD-CG2 4.18Å
207V95.6Very high95.3Very high1 Ų155.1 Ų55.11%0.00629%0.293CS..Hα-helixtrans-89.2-8.7-178.6-63.20000114S203 L204 I205 G212 V213 K216 I319 I322 L323S203-V207 WeakPolarHBondContact O-CG2 3.33Å; S203-V207 PolarHBondContact O-N 3.07Å; L204-V207 WeakPolarHBondContact O-CG2 3.5Å; L204-V207 PolarHBondContact O-N 3.44Å; I205-V207 PolarHBondContact O-N 3.29Å; V207-G212 WeakPolarHBondContact O-CA 3.35Å; V207-V213 HydrophobicContact CG2-CG2 3.76Å; V207-K216 WeakPolarHBondContact O-CE 3.4Å; V207-K216 PolarHBondContact O-NZ 3.06Å; V207-I319 HydrophobicContact CG1-CG1 4.48Å; V207-I319 HydrophobicContact CG1-CG2 3.62Å; V207-I319 HydrophobicContact CG2-CD1 4.3Å; V207-I319 HydrophobicContact CG2-CG1 4.13Å; V207-I322 HydrophobicContact CG1-CB 4.46Å; V207-I322 HydrophobicContact CG1-CD1 4.46Å; V207-I322 HydrophobicContact CG1-CG2 4.02Å; V207-L323 HydrophobicContact CG1-CD2 4.19Å; V207-L323 HydrophobicContact CG1-CG 4.39Å
208G94.1Very high95.3Very high57 Ų5754.9 Ų54.959%0.58829%0.291SS*.THydrogen-bonded Turntrans91.530.9-179.100000113.9L204 I205L204-G208 PolarHBondContact O-N 3.4Å; I205-G208 PolarHBondContact O-N 3.42Å
209G95.2Very high95.2Very high27 Ų2759.2 Ų59.228%0.27831%0.307SS..Hα-helixtrans83.5-170.517900000114L204 E211 G212 V213L204-G209 PolarHBondContact O-N 3.26Å; G209-E211 VanDerWaalsContact C-N 3.3Å; G209-E211 PolarHBondContact O-N 3.38Å; G209-G212 WeakPolarHBondContact O-CA 3.27Å; G209-G212 PolarHBondContact O-N 2.92Å; G209-G212 VanDerWaalsContact O-N 3.12Å; G209-V213 PolarHBondContact O-N 3.12Å
210L93.2Very high95.1Very high84 Ų8459.6 Ų59.644%0.4431%0.31SS..Hα-helixtrans-65.4-33.3-176.2-169.165.6000112.5G212 V213 R214 I315L210-G212 VanDerWaalsContact C-N 3.31Å; L210-V213 WeakPolarHBondContact O-CB 3.46Å; L210-V213 PolarHBondContact O-N 2.97Å; L210-R214 PolarHBondContact O-N 3.44Å; L210-I315 HydrophobicContact CD1-CD1 3.83Å
211E93.8Very high95Very high117 Ų11762.3 Ų62.355%0.54732%0.323SS..Hα-helixtrans-68.8-34.5174.4-164.458.6-156.700111.7G209 V213 R214 T215G209-E211 VanDerWaalsContact C-N 3.3Å; G209-E211 PolarHBondContact O-N 3.38Å; E211-V213 VanDerWaalsContact C-N 3.32Å; E211-R214 PolarHBondContact O-N 2.94Å; E211-T215 WeakPolarHBondContact O-CG2 3.36Å; E211-T215 PolarHBondContact O-N 3.36Å; E211-T215 PolarHBondContact O-OG1 3.15Å
212G94.6Very high94.7Very high7 Ų757.8 Ų57.87%0.07230%0.301CS..Hα-helixtrans-60.7-40.7169.100000112.1V207 G209 L210 T215 K216V207-G212 WeakPolarHBondContact O-CA 3.35Å; G209-G212 WeakPolarHBondContact O-CA 3.27Å; G209-G212 PolarHBondContact O-N 2.92Å; G209-G212 VanDerWaalsContact O-N 3.12Å; L210-G212 VanDerWaalsContact C-N 3.31Å; G212-T215 PolarHBondContact O-OG1 3.44Å; G212-K216 WeakPolarHBondContact O-CB 3.5Å; G212-K216 WeakPolarHBondContact O-CG 3.16Å; G212-K216 PolarHBondContact O-N 3.32Å
213V95.7Very high94.5Very high0 Ų058.9 Ų58.90%031%0.308CS..Hα-helixtrans-60.8-50172.8-179.90000110.3L204 V207 G209 L210 E211 T215 Y217 I315 M318 I319 I322L204-V213 HydrophobicContact CD2-CG2 3.81Å; V207-V213 HydrophobicContact CG2-CG2 3.76Å; G209-V213 PolarHBondContact O-N 3.12Å; L210-V213 WeakPolarHBondContact O-CB 3.46Å; L210-V213 PolarHBondContact O-N 2.97Å; E211-V213 VanDerWaalsContact C-N 3.32Å; V213-T215 VanDerWaalsContact C-N 3.34Å; V213-T215 PolarHBondContact O-N 3.35Å; V213-Y217 WeakPolarHBondContact O-CB 3.46Å; V213-Y217 PolarHBondContact O-N 3.21Å; V213-I315 HydrophobicContact CG2-CG2 4.47Å; V213-M318 HydrophobicContact CG1-CB 4.25Å; V213-M318 HydrophobicContact CG1-CE 4.1Å; V213-I319 HydrophobicContact CG2-CD1 4.04Å; V213-I319 HydrophobicContact CG2-CG1 3.69Å; V213-I322 HydrophobicContact CG1-CD1 4.35Å
214R92.6Very high94.1Very high141 Ų14160.4 Ų60.453%0.53232%0.317SS..Hα-helixtrans-57.5-45.6-177.6-165-172.5-1761713.9112.7L210 E211 L248L210-R214 PolarHBondContact O-N 3.44Å; E211-R214 PolarHBondContact O-N 2.94Å; R214-L248 HydrophobicContact CG-CD1 3.46Å; R214-L248 VanDerWaalsContact CG-CD1 3.46Å; R214-L248 HydrophobicContact CG-CD2 4.32Å; R214-L248 HydrophobicContact CG-CG 4.49Å
215T93.6Very high93.7Very high65 Ų6563.5 Ų63.540%0.39934%0.338SS..Hα-helixtrans-79.4-51.4-175.750.80000112.2E211 G212 V213 Y217 M218E211-T215 WeakPolarHBondContact O-CG2 3.36Å; E211-T215 PolarHBondContact O-N 3.36Å; E211-T215 PolarHBondContact O-OG1 3.15Å; G212-T215 PolarHBondContact O-OG1 3.44Å; V213-T215 VanDerWaalsContact C-N 3.34Å; V213-T215 PolarHBondContact O-N 3.35Å; T215-Y217 PolarHBondContact O-N 3.4Å; T215-M218 PolarHBondContact O-N 3.36Å
216K95.9Very high93.3Very high85 Ų8559.5 Ų59.537%0.3732%0.324SS..Hα-helixtrans-73.4-27.8-175.6-62.6176.4175.7171.30112.9V207 G212 M218 Q219 A220 I322V207-K216 WeakPolarHBondContact O-CE 3.4Å; V207-K216 PolarHBondContact O-NZ 3.06Å; G212-K216 WeakPolarHBondContact O-CB 3.5Å; G212-K216 WeakPolarHBondContact O-CG 3.16Å; G212-K216 PolarHBondContact O-N 3.32Å; K216-M218 VanDerWaalsContact C-N 3.29Å; K216-M218 PolarHBondContact O-N 3.48Å; K216-Q219 CarbonylContact O-C 3.5Å; K216-Q219 PolarHBondContact O-N 3.24Å; K216-A220 PolarHBondContact O-N 2.91Å; K216-I322 HydrophobicContact CB-CD1 4.07Å; K216-I322 HydrophobicContact CB-CG1 4.24Å; K216-I322 HydrophobicContact CB-CG2 3.77Å; K216-I322 HydrophobicContact CD-CG2 4.24Å
217Y95.9Very high92.9Very high0 Ų054.8 Ų54.80%030%0.304CS..Hα-helixtrans-59.3-43.1176-178.1-93.7000111.4A73 A74 G76 V213 T215 Q219 A220 P243 M318 R321A73-Y217 PolarHBondContact O-OH 3.08Å; A74-Y217 PolarHBondContact O-OH 2.85Å; G76-Y217 PolarHBondContact N-OH 3.22Å; G76-Y217 VanDerWaalsContact N-OH 3.12Å; V213-Y217 WeakPolarHBondContact O-CB 3.46Å; V213-Y217 PolarHBondContact O-N 3.21Å; T215-Y217 PolarHBondContact O-N 3.4Å; Y217-Q219 PolarHBondContact O-N 3.13Å; Y217-A220 WeakPolarHBondContact O-CB 3.47Å; Y217-A220 PolarHBondContact O-N 3.47Å; Y217-A220 VanDerWaalsContact O-N 3.15Å; Y217-P243 HydrophobicContact CD1-CB 4.26Å; Y217-P243 HydrophobicContact CE1-CB 3.83Å; Y217-P243 HydrophobicContact CE1-CG 4.47Å; Y217-P243 WeakPolarHBondContact O-CG 3.33Å; Y217-M318 HydrophobicContact CD1-CE 3.92Å; Y217-M318 HydrophobicContact CD2-CB 3.69Å; Y217-M318 HydrophobicContact CD2-CE 3.71Å; Y217-M318 HydrophobicContact CD2-CG 4.02Å; Y217-M318 HydrophobicContact CE1-CE 4.2Å; Y217-M318 HydrophobicContact CE2-CB 3.83Å; Y217-M318 HydrophobicContact CE2-CE 3.98Å; Y217-M318 HydrophobicContact CE2-CG 3.75Å; Y217-M318 HydrophobicContact CG-CE 3.67Å; Y217-R321 HydrophobicContact CE2-CB 4.33Å; Y217-R321 HydrophobicContact CE2-CG 4.4Å
218M94.7Very high92.5Very high65 Ų6557.3 Ų57.332%0.3232%0.32SS..THydrogen-bonded Turntrans-67.7-15.8177.7-64.2-54.5-60.700113.3T215 K216 P243 L248T215-M218 PolarHBondContact O-N 3.36Å; K216-M218 VanDerWaalsContact C-N 3.29Å; K216-M218 PolarHBondContact O-N 3.48Å; M218-P243 HydrophobicContact CE-CB 4.34Å; M218-P243 HydrophobicContact SD-CB 4.18Å; M218-L248 HydrophobicContact CG-CD1 4.32Å
219Q93.9Very high92.1Very high145 Ų14558.7 Ų58.768%0.67833%0.325SS*.THydrogen-bonded Turntrans-101.9-3178.1-61.9173.1-14.800112.6K216 Y217 I221K216-Q219 CarbonylContact O-C 3.5Å; K216-Q219 PolarHBondContact O-N 3.24Å; Y217-Q219 PolarHBondContact O-N 3.13Å; Q219-I221 VanDerWaalsContact C-N 3.33Å; Q219-I221 PolarHBondContact O-N 3.49Å
220A93.9Very high91.5Very high7 Ų761.9 Ų61.96%0.05835%0.349CS..  trans-79.780.2-174.800000111.1K216 Y217 R321 I322 I329K216-A220 PolarHBondContact O-N 2.91Å; Y217-A220 WeakPolarHBondContact O-CB 3.47Å; Y217-A220 PolarHBondContact O-N 3.47Å; Y217-A220 VanDerWaalsContact O-N 3.15Å; A220-R321 HydrophobicContact CB-CG 3.89Å; A220-R321 PolarHBondContact O-NE 3.48Å; A220-I322 HydrophobicContact CB-CG1 4.3Å; A220-I329 WeakPolarHBondContact O-CD1 3.4Å
221I93.2Very high90.5Very high66 Ų6658.6 Ų58.634%0.33834%0.336SS..  trans-117.1137.5-179.7-57.8168.4000107.9Q219 I241 E242Q219-I221 VanDerWaalsContact C-N 3.33Å; Q219-I221 PolarHBondContact O-N 3.49Å; I221-I241 HydrophobicContact CG2-CD1 3.8Å; I221-I241 HydrophobicContact CG2-CG1 4.09Å; I221-E242 HydrophobicContact CD1-CG 3.94Å; I221-E242 HydrophobicContact CG1-CG 4.32Å
222P91.7Very high90Very high6 Ų660.8 Ų60.84%0.03935%0.351CS..  trans-67.7148.5179.529.8-36.1000111.8V224 I227 I241 D326 I329 I331P222-V224 PolarHBondContact O-N 3.38Å; P222-I227 HydrophobicContact CB-CD1 3.89Å; P222-I241 HydrophobicContact CG-CB 4.03Å; P222-I241 HydrophobicContact CG-CD1 4.39Å; P222-I241 HydrophobicContact CG-CG2 4.11Å; P222-D326 WeakPolarHBondContact CA-OD1 3.41Å; P222-I329 HydrophobicContact CG-CB 4.07Å; P222-I329 HydrophobicContact CG-CG2 3.89Å; P222-I331 HydrophobicContact CG-CG2 4.21Å
223N91.2Very high89.6Confident82 Ų8264 Ų6444%0.43936%0.362SS..  trans-80.587.2177.1-171.3-7.1000111.2T225 A226 I227 D326N223-T225 VanDerWaalsContact C-N 3.31Å; N223-T225 PolarHBondContact O-N 3.28Å; N223-T225 PolarHBondContact OD1-OG1 3.23Å; N223-A226 HydrophobicContact CB-CB 4.1Å; N223-A226 PolarHBondContact O-N 2.58Å; N223-A226 VanDerWaalsContact O-N 3.17Å; N223-A226 PolarHBondContact OD1-N 3.3Å; N223-I227 WeakPolarHBondContact O-CG1 3.31Å; N223-I227 PolarHBondContact O-N 2.95Å; N223-D326 PolarHBondContact N-OD1 3.14Å
224V89.2Confident89Confident32 Ų3269.1 Ų69.119%0.19439%0.393CS..Hα-helixtrans-55.7-41.3-174.5-175.10000112.8P222 I227 T228 Y235 I241 I331P222-V224 PolarHBondContact O-N 3.38Å; V224-I227 PolarHBondContact O-N 3.29Å; V224-T228 HydrophobicContact CG1-CG2 4.2Å; V224-T228 WeakPolarHBondContact O-CB 3.45Å; V224-T228 WeakPolarHBondContact O-CG2 3.43Å; V224-T228 PolarHBondContact O-N 3.47Å; V224-T228 PolarHBondContact O-OG1 2.64Å; V224-Y235 HydrophobicContact CG1-CD1 4.13Å; V224-Y235 HydrophobicContact CG1-CD2 4.22Å; V224-Y235 HydrophobicContact CG1-CG 3.8Å; V224-I241 HydrophobicContact CG2-CD1 3.81Å; V224-I331 HydrophobicContact CB-CG2 4.49Å; V224-I331 HydrophobicContact CG1-CG2 4.4Å; V224-I331 HydrophobicContact CG2-CG2 3.97Å
225T87.5Confident88.8Confident106 Ų10666.7 Ų66.765%0.6538%0.384SS*.Hα-helixtrans-68.8-37.4-178.254.80000112N223 T228 A229N223-T225 VanDerWaalsContact C-N 3.31Å; N223-T225 PolarHBondContact O-N 3.28Å; N223-T225 PolarHBondContact OD1-OG1 3.23Å; T225-T228 WeakPolarHBondContact CA-OG1 3.43Å; T225-T228 PolarHBondContact O-OG1 3.19Å; T225-A229 WeakPolarHBondContact O-CB 3.31Å; T225-A229 PolarHBondContact O-N 2.92Å; T225-A229 VanDerWaalsContact O-N 3.09Å
226A87.4Confident88.3Confident45 Ų4564.9 Ų64.937%0.37237%0.374SS..Hα-helixtrans-68.5-42.8175.400000111.9N223 A229 A230N223-A226 HydrophobicContact CB-CB 4.1Å; N223-A226 PolarHBondContact O-N 2.58Å; N223-A226 VanDerWaalsContact O-N 3.17Å; N223-A226 PolarHBondContact OD1-N 3.3Å; A226-A229 PolarHBondContact O-N 3.27Å; A226-A230 VanDerWaalsContact O-CB 3.31Å; A226-A230 WeakPolarHBondContact O-CB 3.36Å; A226-A230 PolarHBondContact O-N 3.11Å
227I87.6Confident87.6Confident13 Ų1365.5 Ų65.57%0.06739%0.387CS..Hα-helixtrans-66-45.6-179.1-65.2168000111.1P222 N223 V224 A229 A230 G231 Y233 D326 I331 H335P222-I227 HydrophobicContact CB-CD1 3.89Å; N223-I227 WeakPolarHBondContact O-CG1 3.31Å; N223-I227 PolarHBondContact O-N 2.95Å; V224-I227 PolarHBondContact O-N 3.29Å; I227-A229 VanDerWaalsContact C-N 3.29Å; I227-A229 PolarHBondContact O-N 2.97Å; I227-A230 PolarHBondContact O-N 3.4Å; I227-G231 PolarHBondContact O-N 3.09Å; I227-Y233 HydrophobicContact CG2-CD2 4.11Å; I227-D326 HydrophobicContact CD1-CB 4.12Å; I227-I331 HydrophobicContact CB-CD1 4.12Å; I227-I331 HydrophobicContact CD1-CG2 4.12Å; I227-I331 HydrophobicContact CG2-CD1 3.48Å; I227-I331 VanDerWaalsContact CG2-CD1 3.48Å; I227-I331 HydrophobicContact CG2-CG1 4.05Å; I227-H335 WeakPolarHBondContact CG2-CD2 3.35Å; I227-H335 WeakPolarHBondContact CG2-NE2 3.39Å
228T87.3Confident87Confident54 Ų5468.1 Ų68.133%0.33141%0.405SS..Hα-helixtrans-69.8-23.8177.851.70000113.3V224 T225 G231 I331V224-T228 HydrophobicContact CG1-CG2 4.2Å; V224-T228 WeakPolarHBondContact O-CB 3.45Å; V224-T228 WeakPolarHBondContact O-CG2 3.43Å; V224-T228 PolarHBondContact O-N 3.47Å; V224-T228 PolarHBondContact O-OG1 2.64Å; T225-T228 WeakPolarHBondContact CA-OG1 3.43Å; T225-T228 PolarHBondContact O-OG1 3.19Å; T228-G231 CarbonylContact C-O 3.59Å; T228-G231 VanDerWaalsContact C-O 3.31Å; T228-G231 WeakPolarHBondContact CA-O 3.47Å; T228-I331 HydrophobicContact CG2-CD1 3.71Å
229A85Confident86.4Confident86 Ų8665.4 Ų65.471%0.71139%0.393SS*.Hα-helixtrans-80.2-34.3171.600000112.7T225 A226 I227T225-A229 WeakPolarHBondContact O-CB 3.31Å; T225-A229 PolarHBondContact O-N 2.92Å; T225-A229 VanDerWaalsContact O-N 3.09Å; A226-A229 PolarHBondContact O-N 3.27Å; I227-A229 VanDerWaalsContact C-N 3.29Å; I227-A229 PolarHBondContact O-N 2.97Å
230A83.1Confident85.7Confident94 Ų9466.6 Ų66.678%0.77740%0.398SS*.Hα-helixtrans-76.7-32.1-17900000113A226 I227A226-A230 VanDerWaalsContact O-CB 3.31Å; A226-A230 WeakPolarHBondContact O-CB 3.36Å; A226-A230 PolarHBondContact O-N 3.11Å; I227-A230 PolarHBondContact O-N 3.4Å
231G73.4Confident85.5Confident15 Ų1567 Ų6716%0.15540%0.398CS..SBendtrans-139.3150.1172.800000110.9I227 T228 Y233I227-G231 PolarHBondContact O-N 3.09Å; T228-G231 CarbonylContact C-O 3.59Å; T228-G231 VanDerWaalsContact C-O 3.31Å; T228-G231 WeakPolarHBondContact CA-O 3.47Å; G231-Y233 PolarHBondContact O-N 3.48Å
232N81.6Confident85.3Confident163 Ų16370.2 Ų70.287%0.87241%0.412SS*.  trans-72.555179.7-168.532.9000111.7
233Y86.1Confident85.4Confident75 Ų7570.6 Ų70.629%0.29442%0.415SS..PPolyproline II helixtrans-95.9145.4-177.8-56-60.4000110.5I227 G231 E334 H335 A338I227-Y233 HydrophobicContact CG2-CD2 4.11Å; G231-Y233 PolarHBondContact O-N 3.48Å; Y233-E334 HydrophobicContact CD1-CB 4.13Å; Y233-H335 HydrophobicContact CD1-CB 4.46Å; Y233-H335 HydrophobicContact CG-CB 4.3Å; Y233-A338 HydrophobicContact CE1-CB 4.17Å; Y233-A338 VanDerWaalsContact OH-CB 3.29Å; Y233-A338 WeakPolarHBondContact OH-CB 3.4Å
234T85.1Confident85.3Confident106 Ų10669.6 Ų69.665%0.6541%0.406SS*.PPolyproline II helixtrans-96127.9177.5-45.20000110.4
235Y87Confident85.3Confident91 Ų9173.3 Ų73.336%0.35743%0.431SS..PPolyproline II helixtrans-82.6128.3171.2169.8-124.8000110.4V224 P237 I241 I331V224-Y235 HydrophobicContact CG1-CD1 4.13Å; V224-Y235 HydrophobicContact CG1-CD2 4.22Å; V224-Y235 HydrophobicContact CG1-CG 3.8Å; Y235-P237 HydrophobicContact CE1-CG 4.25Å; Y235-I241 HydrophobicContact CE2-CD1 4.26Å; Y235-I241 HydrophobicContact CE2-CG2 4.34Å; Y235-I331 HydrophobicContact CD2-CB 3.95Å
236S83.1Confident85.4Confident26 Ų2671.4 Ų71.418%0.18242%0.417CS..  trans-110.3119.9171.9-167.20000110.6S238 C239 I331S236-S238 PolarHBondContact O-N 2.8Å; S236-S238 VanDerWaalsContact O-N 3.08Å; S236-S238 PolarHBondContact OG-OG 2.83Å; S236-C239 WeakPolarHBondContact O-CB 3.47Å; S236-C239 PolarHBondContact O-N 2.66Å; S236-I331 PolarHBondContact N-O 2.83Å
237P82.6Confident85.5Confident98 Ų9869.2 Ų69.264%0.63640%0.399SS*.THydrogen-bonded Turntrans-60-20.9-179.6-24.133.2000114.9Y235 C239Y235-P237 HydrophobicContact CE1-CG 4.25Å; P237-C239 VanDerWaalsContact C-N 3.29Å
238S82.6Confident85.8Confident56 Ų5670.3 Ų70.339%0.39241%0.405SS..THydrogen-bonded Turntrans-73.3-18.5176.449.50000113.7S236 H240 C496S236-S238 PolarHBondContact O-N 2.8Å; S236-S238 VanDerWaalsContact O-N 3.08Å; S236-S238 PolarHBondContact OG-OG 2.83Å; S238-H240 PolarHBondContact O-N 2.83Å; S238-H240 VanDerWaalsContact O-N 3.11Å; S238-H240 PolarHBondContact O-ND1 2.93Å; S238-C496 WeakPolarHBondContact CB-O 3.34Å; S238-C496 PolarHBondContact OG-O 3.18Å
239C80.9Confident86Confident8 Ų873.2 Ų73.25%0.05441%0.41CS..SBendtrans-79.687.9170.5-52.50000107.8S236 P237 I241 C496S236-C239 WeakPolarHBondContact O-CB 3.47Å; S236-C239 PolarHBondContact O-N 2.66Å; P237-C239 VanDerWaalsContact C-N 3.29Å; C239-I241 VanDerWaalsContact O-CG2 3.3Å; C239-I241 WeakPolarHBondContact O-CG2 3.37Å; C239-I241 PolarHBondContact O-N 3.33Å; C239-C496 HydrophobicContact CB-CB 3.75Å; C239-C496 WeakPolarHBondContact CB-SG 3.45Å; C239-C496 WeakPolarHBondContact SG-CB 3.24Å; C239-C496 CovalentContact SG-SG 2.03Å; C239-C496 PolarHBondContact SG-SG 3.25Å
240H81Confident86.3Confident169 Ų16969.1 Ų69.178%0.78238%0.376SS*.  trans-53.999.2-179.5-64.6100000111.8S238S238-H240 PolarHBondContact O-N 2.83Å; S238-H240 VanDerWaalsContact O-N 3.11Å; S238-H240 PolarHBondContact O-ND1 2.93Å
241I88.6Confident86.4Confident15 Ų1566.4 Ų66.48%0.07735%0.348CS..  trans-84.6-17.9-178.860175.6000113.2I221 P222 V224 Y235 C239 R321 I329I221-I241 HydrophobicContact CG2-CD1 3.8Å; I221-I241 HydrophobicContact CG2-CG1 4.09Å; P222-I241 HydrophobicContact CG-CB 4.03Å; P222-I241 HydrophobicContact CG-CD1 4.39Å; P222-I241 HydrophobicContact CG-CG2 4.11Å; V224-I241 HydrophobicContact CG2-CD1 3.81Å; Y235-I241 HydrophobicContact CE2-CD1 4.26Å; Y235-I241 HydrophobicContact CE2-CG2 4.34Å; C239-I241 VanDerWaalsContact O-CG2 3.3Å; C239-I241 WeakPolarHBondContact O-CG2 3.37Å; C239-I241 PolarHBondContact O-N 3.33Å; I241-R321 PolarHBondContact O-NH2 3.29Å; I241-R321 VanDerWaalsContact O-NH2 3.09Å; I241-I329 HydrophobicContact CB-CG2 4.01Å; I241-I329 HydrophobicContact CG2-CG2 4.1Å
242E90.3Very high87.2Confident135 Ų13566 Ų6663%0.63134%0.342SS*.SBendtrans-84.6144.3-177-59.9-171.6161.700111.9I221I221-E242 HydrophobicContact CD1-CG 3.94Å; I221-E242 HydrophobicContact CG1-CG 4.32Å
243P92.1Very high87.6Confident13 Ų1359.9 Ų59.98%0.08432%0.317CS..PPolyproline II helixtrans-61.7140.4170.5-16.627.6000111.6Y217 M218Y217-P243 HydrophobicContact CD1-CB 4.26Å; Y217-P243 HydrophobicContact CE1-CB 3.83Å; Y217-P243 HydrophobicContact CE1-CG 4.47Å; Y217-P243 WeakPolarHBondContact O-CG 3.33Å; M218-P243 HydrophobicContact CE-CB 4.34Å; M218-P243 HydrophobicContact SD-CB 4.18Å
244K90Very high87.8Confident61 Ų6159.4 Ų59.427%0.26532%0.324SS..PPolyproline II helixtrans-60.2142.6174.8-68.6-179.1176.1-179.50110.1N246 S247 E257 D258K244-N246 PolarHBondContact O-N 3.42Å; K244-N246 VanDerWaalsContact O-N 3.13Å; K244-S247 PolarHBondContact N-OG 2.81Å; K244-S247 VanDerWaalsContact O-CB 3.27Å; K244-S247 WeakPolarHBondContact O-CB 3.39Å; K244-S247 PolarHBondContact O-N 3.47Å; K244-S247 PolarHBondContact O-OG 3.44Å; K244-E257 IonicContact NZ-OE2 3.69Å; K244-D258 IonicContact NZ-OD1 3.25Å; K244-D258 PolarHBondContact NZ-OD1 3.11Å; K244-D258 IonicContact NZ-OD2 2.76Å; K244-D258 PolarHBondContact NZ-OD2 2.8Å
245P88.4Confident87.9Confident111 Ų11162.3 Ų62.372%0.72133%0.334SS*.THydrogen-bonded Turntrans-60.7-28.5-178.523.1-33.8000113.2
246N89.6Confident88Confident65 Ų6559.2 Ų59.235%0.34832%0.324SS..THydrogen-bonded Turntrans-94.818.6178-62.1-41.7000113.5K244 L248 R249 R252K244-N246 PolarHBondContact O-N 3.42Å; K244-N246 VanDerWaalsContact O-N 3.13Å; N246-L248 PolarHBondContact O-N 3.27Å; N246-L248 VanDerWaalsContact O-N 3.14Å; N246-R249 PolarHBondContact O-N 3.02Å; N246-R249 VanDerWaalsContact O-N 3.1Å; N246-R252 HydrophobicContact CB-CG 4.22Å; N246-R252 PolarHBondContact O-NE 2.61Å
247S90.8Very high87.9Confident0 Ų064.9 Ų64.90%035%0.347CS..THydrogen-bonded Turntrans-63.4-19.7-178.5-61.10000113.7G76 F77 K244 R249G76-S247 CarbonylContact C-O 3.6Å; G76-S247 WeakPolarHBondContact CA-O 3.34Å; F77-S247 PolarHBondContact N-O 3.42Å; K244-S247 PolarHBondContact N-OG 2.81Å; K244-S247 VanDerWaalsContact O-CB 3.27Å; K244-S247 WeakPolarHBondContact O-CB 3.39Å; K244-S247 PolarHBondContact O-N 3.47Å; K244-S247 PolarHBondContact O-OG 3.44Å; S247-R249 VanDerWaalsContact C-N 3.32Å
248L92.8Very high87.9Confident36 Ų3661.1 Ų61.119%0.18832%0.322CS..THydrogen-bonded Turntrans-9211.3178.8-58.7173.1000113.2F77 R214 M218 N246 M318F77-L248 HydrophobicContact CD2-CB 4.39Å; F77-L248 HydrophobicContact CD2-CD2 4.41Å; F77-L248 WeakPolarHBondContact CD2-O 3.38Å; F77-L248 HydrophobicContact CE2-CD2 4.13Å; F77-L248 HydrophobicContact CZ-CD2 4.49Å; R214-L248 HydrophobicContact CG-CD1 3.46Å; R214-L248 VanDerWaalsContact CG-CD1 3.46Å; R214-L248 HydrophobicContact CG-CD2 4.32Å; R214-L248 HydrophobicContact CG-CG 4.49Å; M218-L248 HydrophobicContact CG-CD1 4.32Å; N246-L248 PolarHBondContact O-N 3.27Å; N246-L248 VanDerWaalsContact O-N 3.14Å; L248-M318 HydrophobicContact CD2-CE 3.93Å
249R92.4Very high88.1Confident115 Ų11558.5 Ų58.543%0.43430%0.303SS..  trans-120.8136.9176-71.3-177.8166.8163.8-4.8110.5N246 S247 F704 L706N246-R249 PolarHBondContact O-N 3.02Å; N246-R249 VanDerWaalsContact O-N 3.1Å; S247-R249 VanDerWaalsContact C-N 3.32Å; R249-F704 WeakPolarHBondContact CA-O 3.35Å; R249-L706 PolarHBondContact NE-O 3.3Å; R249-L706 PolarHBondContact NH2-O 3.27Å
250I91.1Very high88.7Confident0 Ų058.1 Ų58.10%030%0.301CS..SBendtrans-70.4-64.2174.9-71.4-175.6000110.3F77 A81 F84 R252 M310 F701 F704F77-I250 HydrophobicContact CB-CG1 4.23Å; F77-I250 WeakPolarHBondContact O-CG1 3.49Å; A81-I250 HydrophobicContact CB-CG2 3.44Å; A81-I250 VanDerWaalsContact CB-CG2 3.44Å; F84-I250 HydrophobicContact CD2-CD1 3.72Å; F84-I250 HydrophobicContact CE2-CD1 3.59Å; I250-R252 PolarHBondContact O-N 2.64Å; I250-M310 HydrophobicContact CD1-CE 4.47Å; I250-F701 HydrophobicContact CG2-CE2 4.38Å; I250-F704 HydrophobicContact CB-CB 4.47Å; I250-F704 HydrophobicContact CD1-CB 3.3Å; I250-F704 HydrophobicContact CD1-CG 4.05Å; I250-F704 HydrophobicContact CG1-CB 3.67Å; I250-F704 PolarHBondContact N-O 3.15Å
251L85.9Confident89.1Confident37 Ų3756 Ų5619%0.19429%0.286CS..SBendtrans-84.7110.1177-69.6-172.2000110.3W261 F264 F701 S705L251-W261 HydrophobicContact CB-CB 3.81Å; L251-W261 HydrophobicContact CD1-CB 4.16Å; L251-W261 HydrophobicContact CD2-CB 3.83Å; L251-W261 HydrophobicContact CG-CB 4.15Å; L251-F264 HydrophobicContact CD2-CB 4.5Å; L251-F264 HydrophobicContact CD2-CD1 4.3Å; L251-F701 HydrophobicContact CD1-CD1 4.3Å; L251-F701 HydrophobicContact CD1-CE1 3.44Å; L251-F701 VanDerWaalsContact CD1-CE1 3.44Å; L251-F701 HydrophobicContact CD1-CZ 3.92Å; L251-F701 HydrophobicContact CD2-CE1 4.2Å; L251-F701 HydrophobicContact CD2-CZ 3.77Å; L251-F701 HydrophobicContact CG-CE1 3.9Å; L251-F701 HydrophobicContact CG-CZ 3.92Å; L251-S705 WeakPolarHBondContact CG-OG 3.49Å; L251-S705 PolarHBondContact N-OG 3.11Å
252R89.4Confident89.4Confident6 Ų656.1 Ų56.12%0.02329%0.288CS..BIsolated β-bridgetrans-96.6176179-59.6-179.5-179170.9-0111.2S75 N246 I250 D256 D258 W261S75-R252 PolarHBondContact O-NH2 3.43Å; N246-R252 HydrophobicContact CB-CG 4.22Å; N246-R252 PolarHBondContact O-NE 2.61Å; I250-R252 PolarHBondContact O-N 2.64Å; R252-D256 HydrophobicContact CB-CB 3.67Å; R252-D256 WeakPolarHBondContact CD-OD1 3.47Å; R252-D256 WeakPolarHBondContact CD-OD2 3.35Å; R252-D256 IonicContact CZ-OD1 2.91Å; R252-D256 IonicContact NH1-OD1 2.96Å; R252-D256 PolarHBondContact NH1-OD1 2.96Å; R252-D256 IonicContact NH1-OD2 3.66Å; R252-D256 PolarHBondContact NH1-OD2 2.96Å; R252-D258 IonicContact CZ-OD2 2.97Å; R252-D258 IonicContact NH1-OD2 3.38Å; R252-D258 PolarHBondContact NH1-OD2 2.99Å; R252-D258 IonicContact NH2-OD2 2.62Å; R252-W261 WeakPolarHBondContact O-CB 3.43Å; R252-W261 VanDerWaalsContact O-CD1 3.23Å; R252-W261 PolarHBondContact O-N 2.99Å
253G88.9Confident89.5Confident34 Ų3449.7 Ų49.735%0.35126%0.258SS..  trans-54159-17800000113.4L255 D256 P260G253-L255 PolarHBondContact O-N 3.39Å; G253-L255 VanDerWaalsContact O-N 3.1Å; G253-D256 VanDerWaalsContact O-CB 3.31Å; G253-D256 WeakPolarHBondContact O-CB 3.31Å; G253-D256 PolarHBondContact O-N 3.34Å; G253-P260 WeakPolarHBondContact O-CA 3.25Å
254P90.1Very high89.6Confident66 Ų6649 Ų4943%0.42925%0.254SS..THydrogen-bonded Turntrans-64.5-17.2-175.327.4-36.1000114.2P260 P262 Y513P254-P260 WeakPolarHBondContact O-CB 3.38Å; P254-P262 HydrophobicContact CB-CG 3.93Å; P254-Y513 PolarHBondContact O-OH 3.38Å
255L88.2Confident89.8Confident166 Ų16649.4 Ų49.487%0.86926%0.258SS*.THydrogen-bonded Turntrans-108.313.9177.8-58.9175.9000112.2G253G253-L255 PolarHBondContact O-N 3.39Å; G253-L255 VanDerWaalsContact O-N 3.1Å
256D88.1Confident90Very high26 Ų2648.5 Ų48.514%0.13925%0.247CC..  trans-64.7136.9175.8-167.1-97.8000110.5R252 G253 D258 I259 P260R252-D256 HydrophobicContact CB-CB 3.67Å; R252-D256 WeakPolarHBondContact CD-OD1 3.47Å; R252-D256 WeakPolarHBondContact CD-OD2 3.35Å; R252-D256 IonicContact CZ-OD1 2.91Å; R252-D256 IonicContact NH1-OD1 2.96Å; R252-D256 PolarHBondContact NH1-OD1 2.96Å; R252-D256 IonicContact NH1-OD2 3.66Å; R252-D256 PolarHBondContact NH1-OD2 2.96Å; G253-D256 VanDerWaalsContact O-CB 3.31Å; G253-D256 WeakPolarHBondContact O-CB 3.31Å; G253-D256 PolarHBondContact O-N 3.34Å; D256-D258 VanDerWaalsContact C-N 3.32Å; D256-D258 PolarHBondContact O-N 3.38Å; D256-D258 PolarHBondContact OD1-N 3.3Å; D256-I259 PolarHBondContact OD1-N 3.5Å; D256-I259 VanDerWaalsContact OD1-N 3.09Å; D256-P260 WeakPolarHBondContact O-CD 3.46Å
257E81.7Confident90.1Very high145 Ų14545.4 Ų45.468%0.67823%0.23SC*.SBendtrans-74-21-176.1-63.3174.4166.200113.7K244 H510K244-E257 IonicContact NZ-OE2 3.69Å; E257-H510 PolarHBondContact O-CD2 3.42Å; E257-H510 PolarHBondContact O-NE2 3.02Å
258D82.1Confident90.3Very high20 Ų2045.6 Ų45.611%0.10723%0.231CC..SBendtrans-100.8-52.5-177.6-51.2-26.3000110.4K244 R252 D256 H510K244-D258 IonicContact NZ-OD1 3.25Å; K244-D258 PolarHBondContact NZ-OD1 3.11Å; K244-D258 IonicContact NZ-OD2 2.76Å; K244-D258 PolarHBondContact NZ-OD2 2.8Å; R252-D258 IonicContact CZ-OD2 2.97Å; R252-D258 IonicContact NH1-OD2 3.38Å; R252-D258 PolarHBondContact NH1-OD2 2.99Å; R252-D258 IonicContact NH2-OD2 2.62Å; D256-D258 VanDerWaalsContact C-N 3.32Å; D256-D258 PolarHBondContact O-N 3.38Å; D256-D258 PolarHBondContact OD1-N 3.3Å; D258-H510 PolarHBondContact O-CE1 3.11Å; D258-H510 PolarHBondContact O-NE2 3.11Å
259I87.9Confident90.3Very high0 Ų045.3 Ų45.30%023%0.231CC..  trans-141.978-171.4-49.7-172.2000111A78 W82 D256 W261 F264 M512A78-I259 HydrophobicContact CB-CD1 3.32Å; A78-I259 HydrophobicContact CB-CG1 4.03Å; A78-I259 WeakPolarHBondContact O-CD1 3.43Å; W82-I259 HydrophobicContact CE3-CD1 4.33Å; W82-I259 HydrophobicContact CH2-CD1 3.99Å; W82-I259 HydrophobicContact CH2-CG1 4.16Å; W82-I259 HydrophobicContact CZ3-CD1 3.42Å; W82-I259 VanDerWaalsContact CZ3-CD1 3.42Å; W82-I259 HydrophobicContact CZ3-CG1 4.1Å; D256-I259 PolarHBondContact OD1-N 3.5Å; D256-I259 VanDerWaalsContact OD1-N 3.09Å; I259-W261 PolarHBondContact O-N 3.43Å; I259-F264 HydrophobicContact CG2-CB 4.25Å; I259-F264 HydrophobicContact CG2-CD2 3.94Å; I259-F264 HydrophobicContact CG2-CG 4.29Å; I259-M512 HydrophobicContact CG2-CE 4.41Å
260P92.3Very high90.3Very high0 Ų040.5 Ų40.50%021%0.214CC..BIsolated β-bridgetrans-70.6119.5172.228.6-32.2000109.6G253 P254 D256 G263 F264 H510 M512 Y513G253-P260 WeakPolarHBondContact O-CA 3.25Å; P254-P260 WeakPolarHBondContact O-CB 3.38Å; D256-P260 WeakPolarHBondContact O-CD 3.46Å; P260-G263 WeakPolarHBondContact O-CA 3.37Å; P260-G263 PolarHBondContact O-N 3.03Å; P260-F264 PolarHBondContact O-N 3.34Å; P260-H510 HydrophobicContact CG-CB 4.17Å; P260-M512 HydrophobicContact CG-SD 4.46Å; P260-Y513 HydrophobicContact CB-CE2 3.73Å; P260-Y513 HydrophobicContact CG-CD2 4.36Å; P260-Y513 HydrophobicContact CG-CE2 3.78Å
261W91.4Very high90.3Very high125 Ų12540.7 Ų40.747%0.47322%0.216SC..Hα-helixtrans-54.6-40.4-173.280.2-98.2000115.2L251 R252 I259 F264 I265L251-W261 HydrophobicContact CB-CB 3.81Å; L251-W261 HydrophobicContact CD1-CB 4.16Å; L251-W261 HydrophobicContact CD2-CB 3.83Å; L251-W261 HydrophobicContact CG-CB 4.15Å; R252-W261 WeakPolarHBondContact O-CB 3.43Å; R252-W261 VanDerWaalsContact O-CD1 3.23Å; R252-W261 PolarHBondContact O-N 2.99Å; I259-W261 PolarHBondContact O-N 3.43Å; W261-F264 PolarHBondContact O-N 3.01Å; W261-I265 WeakPolarHBondContact O-CG1 3.5Å; W261-I265 PolarHBondContact O-N 2.94Å
262P93.5Very high90.7Very high17 Ų1739.3 Ų39.311%0.1121%0.209CC..Hα-helixtrans-71.5-36.6179.8-7.723.1000110.8P254 F264 I265 L266 Y513P254-P262 HydrophobicContact CB-CG 3.93Å; P262-F264 VanDerWaalsContact C-N 3.3Å; P262-F264 PolarHBondContact O-N 3.4Å; P262-I265 PolarHBondContact O-N 3.2Å; P262-L266 WeakPolarHBondContact O-CB 3.3Å; P262-L266 WeakPolarHBondContact O-CG 3.38Å; P262-L266 PolarHBondContact O-N 3.31Å; P262-Y513 HydrophobicContact CB-CE1 4.01Å; P262-Y513 WeakPolarHBondContact CD-OH 3.4Å; P262-Y513 HydrophobicContact CG-CE1 4.46Å; P262-Y513 VanDerWaalsContact CG-OH 3.29Å; P262-Y513 WeakPolarHBondContact CG-OH 3.26Å
263G93.3Very high91Very high0 Ų040 Ų400%021%0.213CC..Hα-helixtrans-61-42.4173.200000111.1P260 G267 Q268P260-G263 WeakPolarHBondContact O-CA 3.37Å; P260-G263 PolarHBondContact O-N 3.03Å; G263-G267 VanDerWaalsContact O-CA 3.24Å; G263-G267 WeakPolarHBondContact O-CA 3.23Å; G263-G267 PolarHBondContact O-N 3.09Å; G263-Q268 PolarHBondContact O-N 3.49Å; G263-Q268 VanDerWaalsContact O-N 3.08Å
264F93.8Very high91.2Very high0 Ų038.9 Ų38.90%020%0.198CC..Iπ-helixtrans-63.4-49.5178.6-169.6-89.8000112.2A81 W82 N85 L251 I259 P260 W261 P262 Q268 T269 M512 F701A81-F264 HydrophobicContact CB-CD1 4.36Å; A81-F264 HydrophobicContact CB-CD2 4.07Å; A81-F264 HydrophobicContact CB-CE1 3.79Å; A81-F264 HydrophobicContact CB-CE2 3.46Å; A81-F264 VanDerWaalsContact CB-CE2 3.46Å; A81-F264 HydrophobicContact CB-CG 4.5Å; A81-F264 HydrophobicContact CB-CZ 3.32Å; A81-F264 WeakPolarHBondContact O-CZ 3.15Å; W82-F264 AromaticContact CD2-CE2 3.84Å; W82-F264 HydrophobicContact CD2-CE2 3.84Å; W82-F264 AromaticContact CE2-CE2 3.88Å; W82-F264 HydrophobicContact CE3-CE2 4.21Å; W82-F264 HydrophobicContact CG-CE2 4.18Å; W82-F264 HydrophobicContact CG-CZ 4.48Å; W82-F264 HydrophobicContact CZ2-CE2 4.27Å; N85-F264 HydrophobicContact CB-CE1 4.03Å; N85-F264 HydrophobicContact CB-CZ 4.02Å; N85-F264 VanDerWaalsContact ND2-CE1 3.3Å; N85-F264 WeakPolarHBondContact ND2-CE1 3.46Å; L251-F264 HydrophobicContact CD2-CB 4.5Å; L251-F264 HydrophobicContact CD2-CD1 4.3Å; I259-F264 HydrophobicContact CG2-CB 4.25Å; I259-F264 HydrophobicContact CG2-CD2 3.94Å; I259-F264 HydrophobicContact CG2-CG 4.29Å; P260-F264 PolarHBondContact O-N 3.34Å; W261-F264 PolarHBondContact O-N 3.01Å; P262-F264 VanDerWaalsContact C-N 3.3Å; P262-F264 PolarHBondContact O-N 3.4Å; F264-Q268 HydrophobicContact CD2-CB 3.84Å; F264-Q268 HydrophobicContact CD2-CG 3.87Å; F264-Q268 HydrophobicContact CE2-CB 4.13Å; F264-Q268 HydrophobicContact CE2-CG 3.66Å; F264-Q268 HydrophobicContact CG-CB 4.2Å; F264-Q268 HydrophobicContact CZ-CG 4.24Å; F264-Q268 CarbonylContact O-C 3.49Å; F264-Q268 WeakPolarHBondContact O-CA 3.24Å; F264-Q268 VanDerWaalsContact O-CB 3.27Å; F264-Q268 WeakPolarHBondContact O-CB 3.31Å; F264-Q268 PolarHBondContact O-N 2.93Å; F264-T269 PolarHBondContact O-N 3.21Å; F264-T269 PolarHBondContact O-OG1 3.12Å; F264-M512 HydrophobicContact CB-SD 3.97Å; F264-M512 HydrophobicContact CD2-CE 3.88Å; F264-M512 HydrophobicContact CD2-SD 4.07Å; F264-F701 HydrophobicContact CD1-CZ 4.23Å; F264-F701 HydrophobicContact CE1-CE2 4.1Å; F264-F701 HydrophobicContact CE1-CZ 4.09Å
265I93.4Very high91.4Very high68 Ų6837.1 Ų37.135%0.34918%0.183SC..Iπ-helixtrans-70.2-44.4-178.7-61.9-62.1000111.7W261 P262 T269 F701W261-I265 WeakPolarHBondContact O-CG1 3.5Å; W261-I265 PolarHBondContact O-N 2.94Å; P262-I265 PolarHBondContact O-N 3.2Å; I265-T269 VanDerWaalsContact O-CB 3.24Å; I265-T269 WeakPolarHBondContact O-CB 3.36Å; I265-T269 PolarHBondContact O-OG1 2.92Å; I265-F701 HydrophobicContact CD1-CE1 4.05Å; I265-F701 HydrophobicContact CD1-CZ 3.98Å
266L93.1Very high91.7Very high93 Ų9329.7 Ų29.749%0.48714%0.144SC..Iπ-helixtrans-88.6-20-172.6-59.6175.7000114.1P262 P270 A516P262-L266 WeakPolarHBondContact O-CB 3.3Å; P262-L266 WeakPolarHBondContact O-CG 3.38Å; P262-L266 PolarHBondContact O-N 3.31Å; L266-P270 WeakPolarHBondContact O-CG 3.2Å; L266-A516 HydrophobicContact CB-CB 4.13Å; L266-A516 WeakPolarHBondContact O-CB 3.24Å
267G92.6Very high92.1Very high0 Ų028.5 Ų28.50%014%0.137CC..Iπ-helixtrans-118.3-54-176.900000113.3G263 T269 P270 A271 M512G263-G267 VanDerWaalsContact O-CA 3.24Å; G263-G267 WeakPolarHBondContact O-CA 3.23Å; G263-G267 PolarHBondContact O-N 3.09Å; G267-T269 PolarHBondContact O-N 3.29Å; G267-P270 WeakPolarHBondContact O-CD 3.25Å; G267-A271 PolarHBondContact O-N 3.41Å; G267-A271 VanDerWaalsContact O-N 3.17Å; G267-M512 WeakPolarHBondContact CA-O 3.39Å
268Q93.5Very high92.6Very high3 Ų321.6 Ų21.61%0.01411%0.105CC..Iπ-helixtrans-67.3-38-179.5-173.362.14300112.2W82 G263 F264 A271 S272 M512W82-Q268 HydrophobicContact CZ2-CG 4.39Å; G263-Q268 PolarHBondContact O-N 3.49Å; G263-Q268 VanDerWaalsContact O-N 3.08Å; F264-Q268 HydrophobicContact CD2-CB 3.84Å; F264-Q268 HydrophobicContact CD2-CG 3.87Å; F264-Q268 HydrophobicContact CE2-CB 4.13Å; F264-Q268 HydrophobicContact CE2-CG 3.66Å; F264-Q268 HydrophobicContact CG-CB 4.2Å; F264-Q268 HydrophobicContact CZ-CG 4.24Å; F264-Q268 CarbonylContact O-C 3.49Å; F264-Q268 WeakPolarHBondContact O-CA 3.24Å; F264-Q268 VanDerWaalsContact O-CB 3.27Å; F264-Q268 WeakPolarHBondContact O-CB 3.31Å; F264-Q268 PolarHBondContact O-N 2.93Å; Q268-A271 WeakPolarHBondContact O-CB 3.07Å; Q268-A271 PolarHBondContact O-N 3.41Å; Q268-S272 PolarHBondContact O-N 3.15Å; Q268-S272 PolarHBondContact O-OG 3.29Å; Q268-S272 VanDerWaalsContact O-OG 3.06Å; Q268-M512 HydrophobicContact CB-CG 4.37Å; Q268-M512 HydrophobicContact CB-SD 4.33Å
269T94.4Very high93.2Very high31 Ų3120.8 Ų20.819%0.1910%0.101CC..Hα-helixtrans-63-47.5179.3-54.40000112.1N85 L89 F264 I265 G267 A271 S272 I273N85-T269 PolarHBondContact ND2-OG1 3.41Å; L89-T269 HydrophobicContact CD2-CG2 4.4Å; F264-T269 PolarHBondContact O-N 3.21Å; F264-T269 PolarHBondContact O-OG1 3.12Å; I265-T269 VanDerWaalsContact O-CB 3.24Å; I265-T269 WeakPolarHBondContact O-CB 3.36Å; I265-T269 PolarHBondContact O-OG1 2.92Å; G267-T269 PolarHBondContact O-N 3.29Å; T269-A271 VanDerWaalsContact C-N 3.34Å; T269-A271 PolarHBondContact O-N 2.93Å; T269-S272 WeakPolarHBondContact O-CB 3.5Å; T269-S272 PolarHBondContact O-N 3.27Å; T269-S272 VanDerWaalsContact O-N 3.17Å; T269-I273 PolarHBondContact O-N 3.5Å
270P91.8Very high93.3Very high14 Ų1421 Ų219%0.09110%0.102CC..Hα-helixtrans-57.1-41.4169.6-27.935.2000114.3L266 G267 S272 I273 A453 F519L266-P270 WeakPolarHBondContact O-CG 3.2Å; G267-P270 WeakPolarHBondContact O-CD 3.25Å; P270-S272 VanDerWaalsContact C-N 3.29Å; P270-S272 PolarHBondContact O-N 3.08Å; P270-I273 WeakPolarHBondContact O-CB 3.11Å; P270-I273 PolarHBondContact O-N 3.45Å; P270-I273 VanDerWaalsContact O-N 3.13Å; P270-A453 WeakPolarHBondContact O-CB 3.1Å; P270-F519 HydrophobicContact CB-CB 4.4Å; P270-F519 HydrophobicContact CB-CD1 4.39Å; P270-F519 HydrophobicContact CB-CD2 3.55Å; P270-F519 HydrophobicContact CB-CE2 3.83Å; P270-F519 HydrophobicContact CB-CG 3.86Å; P270-F519 HydrophobicContact CB-CZ 4.37Å; P270-F519 HydrophobicContact CG-CD1 4.38Å; P270-F519 HydrophobicContact CG-CD2 4.38Å; P270-F519 HydrophobicContact CG-CG 4.29Å
271A91.1Very high93.2Very high4 Ų421.1 Ų21.13%0.03310%0.103CC..Hα-helixtrans-60-40.9175.100000111.6G267 Q268 T269 I273 W274 Y275 P450G267-A271 PolarHBondContact O-N 3.41Å; G267-A271 VanDerWaalsContact O-N 3.17Å; Q268-A271 WeakPolarHBondContact O-CB 3.07Å; Q268-A271 PolarHBondContact O-N 3.41Å; T269-A271 VanDerWaalsContact C-N 3.34Å; T269-A271 PolarHBondContact O-N 2.93Å; A271-I273 VanDerWaalsContact C-N 3.29Å; A271-I273 PolarHBondContact O-N 3.23Å; A271-W274 WeakPolarHBondContact O-CB 3.47Å; A271-W274 PolarHBondContact O-N 3.25Å; A271-W274 VanDerWaalsContact O-N 3.13Å; A271-Y275 PolarHBondContact O-N 3.07Å; A271-P450 HydrophobicContact CB-CG 4.28Å
272S94.4Very high93.3Very high8 Ų815.2 Ų15.26%0.0568%0.08CC..Hα-helixtrans-67.5-25.3176.4-61.10000113.2Q268 T269 P270 W274 Y275 W276Q268-S272 PolarHBondContact O-N 3.15Å; Q268-S272 PolarHBondContact O-OG 3.29Å; Q268-S272 VanDerWaalsContact O-OG 3.06Å; T269-S272 WeakPolarHBondContact O-CB 3.5Å; T269-S272 PolarHBondContact O-N 3.27Å; T269-S272 VanDerWaalsContact O-N 3.17Å; P270-S272 VanDerWaalsContact C-N 3.29Å; P270-S272 PolarHBondContact O-N 3.08Å; S272-W274 VanDerWaalsContact C-N 3.26Å; S272-W274 PolarHBondContact O-N 3.38Å; S272-Y275 PolarHBondContact O-N 3.3Å; S272-W276 VanDerWaalsContact O-CD1 3.26Å; S272-W276 PolarHBondContact O-N 3.44Å
273I95.1Very high93.3Very high19 Ų1914.4 Ų14.410%0.0978%0.075CC..Hα-helixtrans-61.1-38.6171.6-67.2170.2000110.1L89 L92 F97 T269 P270 A271 C277 A453 L457L89-I273 HydrophobicContact CD1-CG1 4.5Å; L89-I273 HydrophobicContact CD2-CG1 3.66Å; L92-I273 HydrophobicContact CD2-CD1 4.28Å; L92-I273 HydrophobicContact CD2-CG1 4.07Å; L92-I273 HydrophobicContact CD2-CG2 4.42Å; F97-I273 HydrophobicContact CZ-CG2 4.25Å; T269-I273 PolarHBondContact O-N 3.5Å; P270-I273 WeakPolarHBondContact O-CB 3.11Å; P270-I273 PolarHBondContact O-N 3.45Å; P270-I273 VanDerWaalsContact O-N 3.13Å; A271-I273 VanDerWaalsContact C-N 3.29Å; A271-I273 PolarHBondContact O-N 3.23Å; I273-C277 HydrophobicContact CG2-CB 4.18Å; I273-C277 WeakPolarHBondContact O-CA 3.5Å; I273-C277 WeakPolarHBondContact O-CB 3.04Å; I273-C277 PolarHBondContact O-N 3.42Å; I273-A453 HydrophobicContact CB-CB 4.37Å; I273-L457 HydrophobicContact CD1-CD1 3.9Å; I273-L457 HydrophobicContact CD1-CD2 4.45Å; I273-L457 HydrophobicContact CG2-CD2 4.34Å; I273-L457 HydrophobicContact CG2-CG 4.35Å
274W93.6Very high93Very high11 Ų1114.6 Ų14.64%0.0428%0.076CC..Hα-helixtrans-59.4-50.4173.3163.579.5000110.8L133 A271 S272 W276 A278 D279 T449 A453L133-W274 HydrophobicContact CD1-CH2 4.19Å; L133-W274 HydrophobicContact CD1-CZ2 3.75Å; A271-W274 WeakPolarHBondContact O-CB 3.47Å; A271-W274 PolarHBondContact O-N 3.25Å; A271-W274 VanDerWaalsContact O-N 3.13Å; S272-W274 VanDerWaalsContact C-N 3.26Å; S272-W274 PolarHBondContact O-N 3.38Å; W274-W276 PolarHBondContact O-N 2.97Å; W274-A278 CarbonylContact O-C 3.31Å; W274-A278 WeakPolarHBondContact O-CA 3.05Å; W274-A278 WeakPolarHBondContact O-CB 2.98Å; W274-A278 PolarHBondContact O-N 2.85Å; W274-D279 PolarHBondContact O-N 2.82Å; W274-T449 HydrophobicContact CD2-CG2 3.52Å; W274-T449 HydrophobicContact CE3-CG2 3.32Å; W274-T449 HydrophobicContact CG-CG2 4.21Å; W274-T449 HydrophobicContact CH2-CG2 3.97Å; W274-T449 HydrophobicContact CZ2-CG2 4.14Å; W274-T449 HydrophobicContact CZ3-CG2 3.57Å; W274-A453 HydrophobicContact CB-CB 4.2Å
275Y93.4Very high92.9Very high29 Ų2914.9 Ų14.911%0.1148%0.077CC..Hα-helixtrans-58.8-47.9-177.5-177.5-87.9000112.3N59 A271 S272 D279 I282N59-Y275 WeakPolarHBondContact CB-OH 3.41Å; N59-Y275 VanDerWaalsContact ND2-CZ 3.32Å; N59-Y275 PolarHBondContact ND2-OH 2.93Å; A271-Y275 PolarHBondContact O-N 3.07Å; S272-Y275 PolarHBondContact O-N 3.3Å; Y275-D279 WeakPolarHBondContact O-CB 3.04Å; Y275-I282 HydrophobicContact CE1-CD1 4.24Å; Y275-I282 HydrophobicContact CE1-CG1 4.1Å
276W95.7Very high92.8Very high11 Ų1111.6 Ų11.64%0.0426%0.06CC..Hα-helixtrans-84.3-30.4-175.3-67.3106.3000113.8N59 A86 L89 L90 L93 S272 W274 I282N59-W276 HydrophobicContact CB-CH2 3.99Å; A86-W276 VanDerWaalsContact CB-CE2 3.44Å; A86-W276 HydrophobicContact CB-CH2 4.34Å; A86-W276 HydrophobicContact CB-CZ2 3.33Å; L89-W276 HydrophobicContact CB-CB 4Å; L89-W276 HydrophobicContact CB-CG 3.93Å; L90-W276 HydrophobicContact CD1-CE3 4.3Å; L90-W276 HydrophobicContact CD1-CH2 4.23Å; L90-W276 HydrophobicContact CD1-CZ3 3.99Å; L90-W276 HydrophobicContact CD2-CD2 4.25Å; L90-W276 HydrophobicContact CD2-CE3 3.35Å; L90-W276 HydrophobicContact CD2-CZ3 3.52Å; L90-W276 HydrophobicContact CG-CD2 4.06Å; L90-W276 HydrophobicContact CG-CE3 3.6Å; L90-W276 HydrophobicContact CG-CH2 4.4Å; L90-W276 HydrophobicContact CG-CZ3 3.8Å; L93-W276 WeakPolarHBondContact CD1-O 3.29Å; L93-W276 WeakPolarHBondContact CD2-O 3.43Å; S272-W276 VanDerWaalsContact O-CD1 3.26Å; S272-W276 PolarHBondContact O-N 3.44Å; W274-W276 PolarHBondContact O-N 2.97Å; W276-I282 HydrophobicContact CE3-CG2 4.06Å; W276-I282 HydrophobicContact CZ3-CD1 4.35Å
277C95.4Very high92.6Very high0 Ų07.2 Ų7.20%04%0.038CC..Hα-helixtrans-110.3-15.8-170.6-54.80000114.8F97 Y101 I273 V283F97-C277 HydrophobicContact CB-CB 4.46Å; F97-C277 HydrophobicContact CD1-CB 3.95Å; F97-C277 HydrophobicContact CD2-CB 3.6Å; F97-C277 VanDerWaalsContact CD2-SG 3.59Å; F97-C277 HydrophobicContact CE1-CB 3.96Å; F97-C277 HydrophobicContact CE2-CB 3.65Å; F97-C277 HydrophobicContact CG-CB 3.74Å; F97-C277 HydrophobicContact CZ-CB 3.81Å; Y101-C277 WeakPolarHBondContact CE2-O 3.3Å; Y101-C277 PolarHBondContact OH-O 3.21Å; I273-C277 HydrophobicContact CG2-CB 4.18Å; I273-C277 WeakPolarHBondContact O-CA 3.5Å; I273-C277 WeakPolarHBondContact O-CB 3.04Å; I273-C277 PolarHBondContact O-N 3.42Å; C277-V283 WeakPolarHBondContact O-CG2 3.43Å
278A93.6Very high92.3Very high1 Ų17.2 Ų7.21%0.0084%0.038CC..THydrogen-bonded Turntrans-131.7-8.4-175.600000114.4M109 W274 Q280 F456M109-A278 VanDerWaalsContact CG-O 3.32Å; M109-A278 WeakPolarHBondContact CG-O 3.35Å; W274-A278 CarbonylContact O-C 3.31Å; W274-A278 WeakPolarHBondContact O-CA 3.05Å; W274-A278 WeakPolarHBondContact O-CB 2.98Å; W274-A278 PolarHBondContact O-N 2.85Å; A278-Q280 PolarHBondContact O-N 3.38Å; A278-F456 HydrophobicContact CB-CD1 3.89Å; A278-F456 HydrophobicContact CB-CD2 3.89Å; A278-F456 HydrophobicContact CB-CE1 3.89Å; A278-F456 HydrophobicContact CB-CE2 3.88Å; A278-F456 HydrophobicContact CB-CG 3.89Å; A278-F456 HydrophobicContact CB-CZ 3.89Å
279D93.4Very high92.1Very high2 Ų27.2 Ų7.21%0.0114%0.038CC..  trans-71.7128.1173-165.5-47.2000110.4Y134 K138 W274 Y275 V281 I282 V283Y134-D279 PolarHBondContact OH-OD1 2.8Å; K138-D279 VanDerWaalsContact CE-OD2 3.3Å; K138-D279 WeakPolarHBondContact CE-OD2 3.37Å; K138-D279 IonicContact NZ-OD1 3.47Å; K138-D279 IonicContact NZ-OD2 2.89Å; K138-D279 PolarHBondContact NZ-OD2 3.46Å; W274-D279 PolarHBondContact O-N 2.82Å; Y275-D279 WeakPolarHBondContact O-CB 3.04Å; D279-V281 VanDerWaalsContact C-N 3.3Å; D279-V281 PolarHBondContact O-N 3.21Å; D279-V281 PolarHBondContact OD1-N 3.1Å; D279-I282 HydrophobicContact CB-CG1 4.44Å; D279-I282 PolarHBondContact O-N 3.33Å; D279-V283 WeakPolarHBondContact O-CG2 3.21Å; D279-V283 PolarHBondContact O-N 2.88Å
280Q90.9Very high91.6Very high4 Ų410.5 Ų10.52%0.0195%0.05CC..Hα-helixtrans-60.3-38.4-177.9-17666.923.900112.2Y107 T108 Y134 A278 I282 Q284 I389Y107-Q280 PolarHBondContact O-NE2 3.46Å; Y107-Q280 VanDerWaalsContact O-NE2 3.11Å; T108-Q280 VanDerWaalsContact CA-OE1 3.29Å; Y134-Q280 WeakPolarHBondContact OH-CB 3.41Å; Y134-Q280 PolarHBondContact OH-N 3.23Å; A278-Q280 PolarHBondContact O-N 3.38Å; Q280-I282 VanDerWaalsContact C-N 3.32Å; Q280-I282 PolarHBondContact O-N 3.45Å; Q280-Q284 VanDerWaalsContact NE2-OE1 3.11Å; Q280-Q284 WeakPolarHBondContact O-CB 3.38Å; Q280-Q284 PolarHBondContact O-N 3.11Å; Q280-I389 HydrophobicContact CB-CD1 3.81Å; Q280-I389 HydrophobicContact CB-CG1 4.33Å; Q280-I389 HydrophobicContact CG-CD1 4.06Å; Q280-I389 HydrophobicContact CG-CG1 4.07Å
281V90.1Very high91.5Very high4 Ų411.9 Ų11.92%0.0246%0.056CC..Hα-helixtrans-59.8-44.9-178.2172.70000110.9Y134 D279 R285 S385Y134-V281 HydrophobicContact CE2-CG2 4.46Å; Y134-V281 PolarHBondContact OH-N 3.14Å; D279-V281 VanDerWaalsContact C-N 3.3Å; D279-V281 PolarHBondContact O-N 3.21Å; D279-V281 PolarHBondContact OD1-N 3.1Å; V281-R285 WeakPolarHBondContact O-CG 3.21Å; V281-S385 WeakPolarHBondContact CA-OG 2.83Å; V281-S385 WeakPolarHBondContact CG2-OG 3.35Å
282I93Very high91.4Very high0 Ų011.9 Ų11.90%06%0.056CC..Hα-helixtrans-74.9-52.5-177.4-59.6-55.6000110.4L55 L93 Y275 W276 D279 Q280 Q284 R285 V286L55-I282 HydrophobicContact CD2-CG2 3.94Å; L93-I282 HydrophobicContact CD2-CG2 3.92Å; Y275-I282 HydrophobicContact CE1-CD1 4.24Å; Y275-I282 HydrophobicContact CE1-CG1 4.1Å; W276-I282 HydrophobicContact CE3-CG2 4.06Å; W276-I282 HydrophobicContact CZ3-CD1 4.35Å; D279-I282 HydrophobicContact CB-CG1 4.44Å; D279-I282 PolarHBondContact O-N 3.33Å; Q280-I282 VanDerWaalsContact C-N 3.32Å; Q280-I282 PolarHBondContact O-N 3.45Å; I282-Q284 PolarHBondContact O-N 3.23Å; I282-R285 PolarHBondContact O-N 3.46Å; I282-V286 PolarHBondContact O-N 3.07Å
283V93.1Very high91.3Very high0 Ų012 Ų120%06%0.057CC..Hα-helixtrans-66.3-38.6-173.2179.60000111.7L93 I98 Y101 M109 C277 D279 R285 V286 L287L93-V283 HydrophobicContact CD1-CG2 4.02Å; I98-V283 HydrophobicContact CD1-CG1 4.18Å; Y101-V283 HydrophobicContact CD2-CG1 3.54Å; Y101-V283 HydrophobicContact CE2-CG1 3.68Å; Y101-V283 HydrophobicContact CE2-CG2 4.13Å; M109-V283 HydrophobicContact CE-CB 4.11Å; M109-V283 HydrophobicContact CE-CG1 3.38Å; M109-V283 HydrophobicContact CG-CB 4.41Å; M109-V283 HydrophobicContact SD-CB 4.01Å; M109-V283 HydrophobicContact SD-CG1 3.71Å; M109-V283 HydrophobicContact SD-CG2 4.01Å; C277-V283 WeakPolarHBondContact O-CG2 3.43Å; D279-V283 WeakPolarHBondContact O-CG2 3.21Å; D279-V283 PolarHBondContact O-N 2.88Å; V283-R285 VanDerWaalsContact C-N 3.28Å; V283-R285 PolarHBondContact O-N 3.27Å; V283-V286 PolarHBondContact O-N 3.36Å; V283-L287 HydrophobicContact CG1-CD1 3.88Å; V283-L287 HydrophobicContact CG1-CG 4.12Å; V283-L287 WeakPolarHBondContact O-CG 3.38Å; V283-L287 PolarHBondContact O-N 2.95Å
284Q88.4Confident91.2Very high5 Ų512.4 Ų12.42%0.0236%0.059CC..Hα-helixtrans-60.4-36.9-179.8-175.6171.7-700112.4F40 Q280 I282 L287 A288 S385F40-Q284 PolarHBondContact O-NE2 3.22Å; Q280-Q284 VanDerWaalsContact NE2-OE1 3.11Å; Q280-Q284 WeakPolarHBondContact O-CB 3.38Å; Q280-Q284 PolarHBondContact O-N 3.11Å; I282-Q284 PolarHBondContact O-N 3.23Å; Q284-L287 PolarHBondContact O-N 3.3Å; Q284-A288 PolarHBondContact O-N 2.99Å; Q284-S385 PolarHBondContact OE1-OG 3.22Å
285R90.1Very high91.2Very high5 Ų511.9 Ų11.92%0.0196%0.057CC..Hα-helixtrans-67.9-40.5177.6-69.9177177.1-78.714.9111.9S54 L55 S58 L182 D185 V281 I282 V283 L287 A288 S381S54-R285 WeakPolarHBondContact OG-CD 3.47Å; S54-R285 PolarHBondContact OG-NE 3.07Å; S54-R285 PolarHBondContact OG-NH1 3.31Å; L55-R285 HydrophobicContact CD2-CB 4.15Å; S58-R285 PolarHBondContact OG-NE 3.44Å; S58-R285 PolarHBondContact OG-NH2 2.92Å; L182-R285 HydrophobicContact CD2-CG 4.47Å; D185-R285 IonicContact OD2-CZ 3.97Å; D185-R285 VanDerWaalsContact OD2-CZ 3.25Å; D185-R285 IonicContact OD2-NH1 2.67Å; D185-R285 PolarHBondContact OD2-NH1 2.85Å; D185-R285 IonicContact OD2-NH2 3.87Å; D185-R285 PolarHBondContact OD2-NH2 3.19Å; V281-R285 WeakPolarHBondContact O-CG 3.21Å; I282-R285 PolarHBondContact O-N 3.46Å; V283-R285 VanDerWaalsContact C-N 3.28Å; V283-R285 PolarHBondContact O-N 3.27Å; R285-L287 VanDerWaalsContact C-N 3.35Å; R285-A288 WeakPolarHBondContact O-CB 3.38Å; R285-A288 PolarHBondContact O-N 3.21Å; R285-S381 PolarHBondContact NH2-OG 3.4Å
286V92.1Very high91.3Very high0 Ų011.3 Ų11.30%06%0.055CC..Hα-helixtrans-69.6-34.7177-169.50000111.8L55 L93 I98 I282 V283 A288 A289 A295 T299L55-V286 HydrophobicContact CD1-CG2 3.77Å; L55-V286 HydrophobicContact CD2-CG2 3.75Å; L55-V286 HydrophobicContact CG-CG2 4.22Å; L93-V286 HydrophobicContact CD2-CG2 3.85Å; I98-V286 HydrophobicContact CD1-CB 3.6Å; I98-V286 HydrophobicContact CD1-CG1 3.54Å; I98-V286 HydrophobicContact CG1-CB 4.24Å; I98-V286 HydrophobicContact CG1-CG1 3.69Å; I98-V286 HydrophobicContact CG2-CG1 4.22Å; I282-V286 PolarHBondContact O-N 3.07Å; V283-V286 PolarHBondContact O-N 3.36Å; V286-A288 PolarHBondContact O-N 3.23Å; V286-A289 WeakPolarHBondContact O-CB 3.4Å; V286-A289 PolarHBondContact O-N 3.49Å; V286-A289 VanDerWaalsContact O-N 3.11Å; V286-A295 HydrophobicContact CG1-CB 3.68Å; V286-T299 HydrophobicContact CG1-CG2 4.48Å
287L89.1Confident91.3Very high1 Ų112.3 Ų12.31%0.0056%0.063CC..THydrogen-bonded Turntrans-67.9-13.2174.6-70.1176.3000113.9L41 I98 I102 M109 V283 Q284 R285 A289L41-L287 HydrophobicContact CD2-CB 4.14Å; I98-L287 HydrophobicContact CD1-CD2 4.29Å; I98-L287 HydrophobicContact CD1-CG 4.43Å; I102-L287 HydrophobicContact CG1-CD2 3.85Å; M109-L287 HydrophobicContact CE-CD1 4.27Å; V283-L287 HydrophobicContact CG1-CD1 3.88Å; V283-L287 HydrophobicContact CG1-CG 4.12Å; V283-L287 WeakPolarHBondContact O-CG 3.38Å; V283-L287 PolarHBondContact O-N 2.95Å; Q284-L287 PolarHBondContact O-N 3.3Å; R285-L287 VanDerWaalsContact C-N 3.35Å; L287-A289 PolarHBondContact O-N 2.92Å
288A86.8Confident91.3Very high0 Ų012.3 Ų12.30%06%0.063CC..THydrogen-bonded Turntrans-79-4172.100000113.2L41 R44 S45 M46 Q284 R285 V286L41-A288 WeakPolarHBondContact O-CB 3.27Å; R44-A288 CarbonylContact C-O 3.59Å; R44-A288 WeakPolarHBondContact CA-O 3.32Å; S45-A288 PolarHBondContact N-O 3.25Å; M46-A288 WeakPolarHBondContact CB-O 3.5Å; M46-A288 HydrophobicContact CG-CB 4.17Å; M46-A288 PolarHBondContact N-O 3.18Å; Q284-A288 PolarHBondContact O-N 2.99Å; R285-A288 WeakPolarHBondContact O-CB 3.38Å; R285-A288 PolarHBondContact O-N 3.21Å; V286-A288 PolarHBondContact O-N 3.23Å
289A88.7Confident91.5Very high3 Ų312.2 Ų12.23%0.0256%0.062CC..BIsolated β-bridgetrans-62.4146.2175.200000112.4I51 V286 L287 N291 H294 A295 M675I51-A289 HydrophobicContact CD1-CB 3.51Å; V286-A289 WeakPolarHBondContact O-CB 3.4Å; V286-A289 PolarHBondContact O-N 3.49Å; V286-A289 VanDerWaalsContact O-N 3.11Å; L287-A289 PolarHBondContact O-N 2.92Å; A289-N291 VanDerWaalsContact C-N 3.35Å; A289-N291 PolarHBondContact O-N 3.3Å; A289-H294 HydrophobicContact CB-CB 4.32Å; A289-A295 HydrophobicContact CB-CB 3.84Å; A289-M675 WeakPolarHBondContact O-CE 3.5Å
290K84.7Confident91.7Very high100 Ų10012.7 Ų12.744%0.4357%0.065SC..SBendtrans-68.4-31.4177.674.1-174.9-155.4-164.30114.3R44 M46 H294R44-K290 VanDerWaalsContact O-CA 3.26Å; R44-K290 WeakPolarHBondContact O-CA 3.34Å; M46-K290 PolarHBondContact O-N 3.44Å; K290-H294 WeakPolarHBondContact CE-CD2 3.23Å; K290-H294 WeakPolarHBondContact CE-CE1 3.33Å; K290-H294 WeakPolarHBondContact CE-NE2 3.45Å; K290-H294 HydrophobicContact CG-CB 4.24Å; K290-H294 PolarHBondContact NZ-CE1 2.77Å; K290-H294 PolarHBondContact NZ-NE2 2.52Å
291N88Confident91.9Very high42 Ų4214.4 Ų14.423%0.2257%0.073CC..SBendtrans-155.8171.3178.564.826000110.5A289 A293 H294 A295A289-N291 VanDerWaalsContact C-N 3.35Å; A289-N291 PolarHBondContact O-N 3.3Å; N291-A293 VanDerWaalsContact C-N 3.31Å; N291-A293 PolarHBondContact O-N 3.07Å; N291-A293 PolarHBondContact OD1-N 3.3Å; N291-H294 PolarHBondContact O-N 3.14Å; N291-H294 WeakPolarHBondContact OD1-CB 3.39Å; N291-H294 PolarHBondContact OD1-CD2 3.13Å; N291-H294 PolarHBondContact OD1-N 3.11Å; N291-A295 PolarHBondContact O-N 2.03Å; N291-A295 VanDerWaalsContact O-N 3.08Å
292I90Very high92.2Very high5 Ų514.2 Ų14.23%0.0267%0.072CC..Hα-helixtrans-63.9-34.4-177.9-171.863.2000113I98 P99 I102 H294 A295 K296 M675 E678I98-I292 HydrophobicContact CG2-CD1 3.81Å; P99-I292 HydrophobicContact CB-CD1 4.43Å; P99-I292 HydrophobicContact CG-CD1 3.86Å; I102-I292 HydrophobicContact CD1-CD1 3.95Å; I292-H294 VanDerWaalsContact C-N 3.33Å; I292-H294 PolarHBondContact O-N 3.44Å; I292-A295 HydrophobicContact CD1-CB 4.44Å; I292-A295 WeakPolarHBondContact O-CB 3.44Å; I292-A295 PolarHBondContact O-N 3.05Å; I292-K296 HydrophobicContact CG1-CD 4.39Å; I292-K296 HydrophobicContact CG1-CG 4.43Å; I292-K296 WeakPolarHBondContact O-CG 3.48Å; I292-K296 PolarHBondContact O-N 2.86Å; I292-M675 WeakPolarHBondContact CB-O 3.18Å; I292-M675 WeakPolarHBondContact CG2-O 3.45Å; I292-M675 PolarHBondContact N-O 3.01Å; I292-E678 HydrophobicContact CG2-CB 4.19Å
293A91.9Very high92.3Very high10 Ų1014.2 Ų14.28%0.0837%0.072CC..Hα-helixtrans-62.8-42.1177.600000111.2N291 K296 C297 L686N291-A293 VanDerWaalsContact C-N 3.31Å; N291-A293 PolarHBondContact O-N 3.07Å; N291-A293 PolarHBondContact OD1-N 3.3Å; A293-K296 PolarHBondContact O-N 3.43Å; A293-C297 VanDerWaalsContact O-CB 3.23Å; A293-C297 WeakPolarHBondContact O-CB 3.36Å; A293-C297 PolarHBondContact O-N 3.47Å; A293-L686 HydrophobicContact CB-CD1 4.13Å
294H93.1Very high92.5Very high28 Ų2820.4 Ų20.413%0.1310%0.099CC..Hα-helixtrans-68.1-37.1175.5-80.4-111.3000112.3N47 W48 A289 K290 N291 I292 S298N47-H294 PolarHBondContact OD1-CE1 3.34Å; N47-H294 PolarHBondContact OD1-ND1 3.41Å; W48-H294 HydrophobicContact CB-CB 4.17Å; W48-H294 VanDerWaalsContact CB-O 3.27Å; W48-H294 WeakPolarHBondContact CB-O 3.3Å; W48-H294 AromaticContact CD1-CE1 3.61Å; W48-H294 AromaticContact CD1-ND1 3.61Å; W48-H294 PolarHBondContact N-ND1 3.31Å; A289-H294 HydrophobicContact CB-CB 4.32Å; K290-H294 WeakPolarHBondContact CE-CD2 3.23Å; K290-H294 WeakPolarHBondContact CE-CE1 3.33Å; K290-H294 WeakPolarHBondContact CE-NE2 3.45Å; K290-H294 HydrophobicContact CG-CB 4.24Å; K290-H294 PolarHBondContact NZ-CE1 2.77Å; K290-H294 PolarHBondContact NZ-NE2 2.52Å; N291-H294 PolarHBondContact O-N 3.14Å; N291-H294 WeakPolarHBondContact OD1-CB 3.39Å; N291-H294 PolarHBondContact OD1-CD2 3.13Å; N291-H294 PolarHBondContact OD1-N 3.11Å; I292-H294 VanDerWaalsContact C-N 3.33Å; I292-H294 PolarHBondContact O-N 3.44Å; H294-S298 WeakPolarHBondContact O-CB 3.13Å; H294-S298 PolarHBondContact O-N 2.99Å
295A93.8Very high92.8Very high0 Ų021.3 Ų21.30%010%0.104CC..Hα-helixtrans-61.6-51173.100000111.6I98 V286 A289 N291 I292 C297 S298 T299I98-A295 HydrophobicContact CG2-CB 3.94Å; V286-A295 HydrophobicContact CG1-CB 3.68Å; A289-A295 HydrophobicContact CB-CB 3.84Å; N291-A295 PolarHBondContact O-N 2.03Å; N291-A295 VanDerWaalsContact O-N 3.08Å; I292-A295 HydrophobicContact CD1-CB 4.44Å; I292-A295 WeakPolarHBondContact O-CB 3.44Å; I292-A295 PolarHBondContact O-N 3.05Å; A295-C297 PolarHBondContact O-N 3.45Å; A295-S298 WeakPolarHBondContact O-CB 3.36Å; A295-S298 PolarHBondContact O-N 3.22Å; A295-S298 PolarHBondContact O-OG 2.95Å; A295-T299 PolarHBondContact O-N 3.45Å
296K96Very high93Very high17 Ų1721.2 Ų21.27%0.07410%0.104CC..Hα-helixtrans-62.3-41.5176.8-70.3176.7-178.5176.80112.7W95 I292 A293 S298 T299 L300 E678 L686W95-K296 HydrophobicContact CD2-CD 4.41Å; W95-K296 HydrophobicContact CD2-CG 4.44Å; W95-K296 HydrophobicContact CE3-CG 4.35Å; W95-K296 HydrophobicContact CH2-CB 3.95Å; W95-K296 HydrophobicContact CH2-CG 4.39Å; W95-K296 HydrophobicContact CZ2-CB 4.38Å; W95-K296 HydrophobicContact CZ2-CD 4.19Å; W95-K296 HydrophobicContact CZ3-CB 4.08Å; W95-K296 HydrophobicContact CZ3-CG 4.31Å; I292-K296 HydrophobicContact CG1-CD 4.39Å; I292-K296 HydrophobicContact CG1-CG 4.43Å; I292-K296 WeakPolarHBondContact O-CG 3.48Å; I292-K296 PolarHBondContact O-N 2.86Å; A293-K296 PolarHBondContact O-N 3.43Å; K296-S298 VanDerWaalsContact C-N 3.28Å; K296-S298 PolarHBondContact O-N 2.99Å; K296-T299 PolarHBondContact O-N 2.86Å; K296-T299 PolarHBondContact O-OG1 3.37Å; K296-L300 WeakPolarHBondContact O-CG 3.42Å; K296-L300 PolarHBondContact O-N 2.94Å; K296-E678 IonicContact NZ-OE1 3.42Å; K296-E678 PolarHBondContact NZ-OE1 2.86Å; K296-E678 IonicContact NZ-OE2 3.52Å; K296-E678 PolarHBondContact NZ-OE2 3.38Å; K296-L686 HydrophobicContact CB-CD1 4.27Å; K296-L686 HydrophobicContact CB-CD2 4.15Å; K296-L686 HydrophobicContact CD-CD1 4.1Å
297C95.8Very high93.1Very high31 Ų3122.2 Ų22.221%0.20911%0.109CC..Hα-helixtrans-64.1-35.8177.1-167.10000111.5W48 A293 A295 L300 M301 L686W48-C297 HydrophobicContact CB-CB 3.84Å; W48-C297 HydrophobicContact CD2-CB 4.23Å; W48-C297 HydrophobicContact CE3-CB 4.44Å; W48-C297 HydrophobicContact CG-CB 3.98Å; A293-C297 VanDerWaalsContact O-CB 3.23Å; A293-C297 WeakPolarHBondContact O-CB 3.36Å; A293-C297 PolarHBondContact O-N 3.47Å; A295-C297 PolarHBondContact O-N 3.45Å; C297-L300 PolarHBondContact O-N 3.34Å; C297-M301 PolarHBondContact O-N 3.04Å; C297-L686 HydrophobicContact CB-CD2 4.12Å
298S95.8Very high93.4Very high0 Ų024.1 Ų24.10%012%0.119CC..Hα-helixtrans-64.8-39.8175.177.50000112.8W48 I51 G52 H294 A295 K296 M301 A302W48-S298 WeakPolarHBondContact O-CB 3.47Å; I51-S298 WeakPolarHBondContact CG2-OG 3.28Å; G52-S298 WeakPolarHBondContact CA-O 3.26Å; H294-S298 WeakPolarHBondContact O-CB 3.13Å; H294-S298 PolarHBondContact O-N 2.99Å; A295-S298 WeakPolarHBondContact O-CB 3.36Å; A295-S298 PolarHBondContact O-N 3.22Å; A295-S298 PolarHBondContact O-OG 2.95Å; K296-S298 VanDerWaalsContact C-N 3.28Å; K296-S298 PolarHBondContact O-N 2.99Å; S298-M301 PolarHBondContact O-N 3Å; S298-A302 WeakPolarHBondContact O-CB 3.36Å; S298-A302 PolarHBondContact O-N 3.13Å
299T96.6Very high93.9Very high0 Ų024.1 Ų24.10%012%0.119CC..Hα-helixtrans-71.5-32.3176.862.90000112.3L55 L90 Q91 L93 V286 A295 K296 G303L55-T299 HydrophobicContact CD1-CG2 4.5Å; L90-T299 WeakPolarHBondContact O-CB 3.03Å; Q91-T299 PolarHBondContact NE2-O 3.18Å; Q91-T299 PolarHBondContact OE1-OG1 2.93Å; L93-T299 HydrophobicContact CD2-CG2 4.15Å; L93-T299 HydrophobicContact CG-CG2 4.4Å; V286-T299 HydrophobicContact CG1-CG2 4.48Å; A295-T299 PolarHBondContact O-N 3.45Å; K296-T299 PolarHBondContact O-N 2.86Å; K296-T299 PolarHBondContact O-OG1 3.37Å; T299-G303 PolarHBondContact O-N 3.28Å
300L97.4Very high94.2Very high12 Ų1224 Ų246%0.06312%0.118CC..Hα-helixtrans-64.2-48.2170.7-73170.3000111.6W95 K296 C297 G303 F304 L686 A689 L690 V693W95-L300 HydrophobicContact CH2-CD1 3.76Å; W95-L300 HydrophobicContact CH2-CD2 3.79Å; W95-L300 HydrophobicContact CH2-CG 3.65Å; W95-L300 HydrophobicContact CZ3-CD2 4.19Å; W95-L300 HydrophobicContact CZ3-CG 4.07Å; K296-L300 WeakPolarHBondContact O-CG 3.42Å; K296-L300 PolarHBondContact O-N 2.94Å; C297-L300 PolarHBondContact O-N 3.34Å; L300-G303 PolarHBondContact O-N 3Å; L300-F304 PolarHBondContact O-N 3.11Å; L300-L686 HydrophobicContact CD1-CD2 3.75Å; L300-A689 HydrophobicContact CD1-CB 3.62Å; L300-A689 HydrophobicContact CD2-CB 4.3Å; L300-L690 HydrophobicContact CD2-CB 4.28Å; L300-V693 HydrophobicContact CD2-CB 4.31Å; L300-V693 HydrophobicContact CD2-CG2 4.07Å
301M96.3Very high94.7Very high39 Ų3922.4 Ų22.419%0.19211%0.111CC..Hα-helixtrans-62-46.7178.9-168.6-178.576.600111.1W48 V49 A53 C297 S298 G303 F304 L305W48-M301 HydrophobicContact CE3-CB 4.17Å; W48-M301 HydrophobicContact CE3-SD 3.88Å; W48-M301 HydrophobicContact CH2-SD 4.38Å; W48-M301 HydrophobicContact CZ3-CB 3.99Å; W48-M301 HydrophobicContact CZ3-CG 4.01Å; W48-M301 HydrophobicContact CZ3-SD 3.41Å; W48-M301 WeakPolarHBondContact CZ3-SD 3.38Å; V49-M301 HydrophobicContact CG1-CE 4.43Å; V49-M301 HydrophobicContact CG1-SD 4.36Å; V49-M301 WeakPolarHBondContact O-CE 3.41Å; A53-M301 HydrophobicContact CB-CE 4.1Å; C297-M301 PolarHBondContact O-N 3.04Å; S298-M301 PolarHBondContact O-N 3Å; M301-G303 VanDerWaalsContact C-N 3.32Å; M301-G303 PolarHBondContact O-N 3.5Å; M301-F304 PolarHBondContact O-N 3.08Å; M301-L305 HydrophobicContact CE-CD1 4.47Å; M301-L305 HydrophobicContact CG-CD1 4.46Å; M301-L305 WeakPolarHBondContact O-CG 3.37Å; M301-L305 PolarHBondContact O-N 3.19Å
302A95.8Very high95.1Very high1 Ų120.8 Ų20.81%0.00810%0.103CC..Hα-helixtrans-60.5-41.6175.700000111.8L55 L90 S298 F304 L305 K306L55-A302 HydrophobicContact CB-CB 3.91Å; L55-A302 HydrophobicContact CD1-CB 4.03Å; L90-A302 HydrophobicContact CD1-CB 3.97Å; L90-A302 HydrophobicContact CD2-CB 4.32Å; S298-A302 WeakPolarHBondContact O-CB 3.36Å; S298-A302 PolarHBondContact O-N 3.13Å; A302-F304 VanDerWaalsContact C-N 3.35Å; A302-F304 PolarHBondContact O-N 3.42Å; A302-L305 PolarHBondContact O-N 3.14Å; A302-K306 WeakPolarHBondContact O-CB 3.5Å; A302-K306 PolarHBondContact O-N 3.08Å
303G95.8Very high95.3Very high0 Ų020.6 Ų20.60%010%0.102CC..Hα-helixtrans-62.8-3817600000113.1T299 L300 M301 K306T299-G303 PolarHBondContact O-N 3.28Å; L300-G303 PolarHBondContact O-N 3Å; M301-G303 VanDerWaalsContact C-N 3.32Å; M301-G303 PolarHBondContact O-N 3.5Å; G303-K306 WeakPolarHBondContact O-CB 3.33Å; G303-K306 PolarHBondContact O-N 3.31Å
304F95.6Very high95.6Very high129 Ų12920.1 Ų20.157%0.56610%0.098SC*.Hα-helixtrans-67.3-45.9173.6-179.9-99.4000112L300 M301 A302 K306 I307L300-F304 PolarHBondContact O-N 3.11Å; M301-F304 PolarHBondContact O-N 3.08Å; A302-F304 VanDerWaalsContact C-N 3.35Å; A302-F304 PolarHBondContact O-N 3.42Å; F304-K306 PolarHBondContact O-N 2.81Å; F304-I307 HydrophobicContact CD2-CD1 4.14Å; F304-I307 WeakPolarHBondContact O-CB 3.21Å; F304-I307 WeakPolarHBondContact O-CG1 3.34Å; F304-I307 PolarHBondContact O-N 3.05Å; F304-I307 VanDerWaalsContact O-N 3.15Å
305L95.2Very high95.8Very high24 Ų2419 Ų1913%0.1269%0.092CC..Hα-helixtrans-61.6-29.9176.7-68.5177.5000112.4F56 I193 M301 A302 I307 L308 P309F56-L305 HydrophobicContact CB-CB 4.37Å; F56-L305 HydrophobicContact CB-CD1 3.9Å; F56-L305 HydrophobicContact CD1-CB 4.49Å; F56-L305 HydrophobicContact CD1-CD1 4.17Å; F56-L305 HydrophobicContact CD2-CB 3.54Å; F56-L305 HydrophobicContact CD2-CD1 4.46Å; F56-L305 HydrophobicContact CE2-CB 3.84Å; F56-L305 WeakPolarHBondContact CE2-O 3.48Å; F56-L305 HydrophobicContact CG-CB 3.9Å; F56-L305 HydrophobicContact CG-CD1 3.94Å; F56-L305 HydrophobicContact CZ-CB 4.43Å; I193-L305 HydrophobicContact CD1-CD2 3.8Å; M301-L305 HydrophobicContact CE-CD1 4.47Å; M301-L305 HydrophobicContact CG-CD1 4.46Å; M301-L305 WeakPolarHBondContact O-CG 3.37Å; M301-L305 PolarHBondContact O-N 3.19Å; A302-L305 PolarHBondContact O-N 3.14Å; L305-I307 PolarHBondContact O-N 3Å; L305-I307 VanDerWaalsContact O-N 3.13Å; L305-L308 HydrophobicContact CD2-CD1 4.02Å; L305-L308 VanDerWaalsContact O-CB 3.29Å; L305-L308 WeakPolarHBondContact O-CB 3.27Å; L305-L308 WeakPolarHBondContact O-CG 3.47Å; L305-L308 PolarHBondContact O-N 2.9Å; L305-P309 WeakPolarHBondContact O-CD 3.33Å
306K94.9Very high95.9Very high3 Ų319 Ų191%0.0139%0.092CC..THydrogen-bonded Turntrans-65.8-7.4176.2-92.7-72.5-178.3176.30115.5N59 E83 A86 I87 L90 A302 G303 F304 L308 P309N59-K306 WeakPolarHBondContact OD1-CE 3.15Å; N59-K306 PolarHBondContact OD1-NZ 3.41Å; E83-K306 IonicContact OE1-NZ 3.59Å; E83-K306 PolarHBondContact OE1-NZ 3.38Å; E83-K306 WeakPolarHBondContact OE2-CD 3.42Å; E83-K306 WeakPolarHBondContact OE2-CE 3.24Å; E83-K306 IonicContact OE2-NZ 3.3Å; E83-K306 PolarHBondContact OE2-NZ 3.5Å; A86-K306 HydrophobicContact CB-CD 4.13Å; A86-K306 HydrophobicContact CB-CG 4.44Å; I87-K306 HydrophobicContact CG1-CB 3.88Å; L90-K306 HydrophobicContact CD1-CG 4.09Å; A302-K306 WeakPolarHBondContact O-CB 3.5Å; A302-K306 PolarHBondContact O-N 3.08Å; G303-K306 WeakPolarHBondContact O-CB 3.33Å; G303-K306 PolarHBondContact O-N 3.31Å; F304-K306 PolarHBondContact O-N 2.81Å; K306-L308 VanDerWaalsContact C-N 3.32Å; K306-P309 WeakPolarHBondContact O-CD 3.26Å
307I94.7Very high96Very high21 Ų2118.1 Ų18.111%0.1089%0.089CC..THydrogen-bonded Turntrans-72-31.2168.4-61.7165.9000110.6I87 F304 L305 F311 V696I87-I307 HydrophobicContact CD1-CG1 3.61Å; F304-I307 HydrophobicContact CD2-CD1 4.14Å; F304-I307 WeakPolarHBondContact O-CB 3.21Å; F304-I307 WeakPolarHBondContact O-CG1 3.34Å; F304-I307 PolarHBondContact O-N 3.05Å; F304-I307 VanDerWaalsContact O-N 3.15Å; L305-I307 PolarHBondContact O-N 3Å; L305-I307 VanDerWaalsContact O-N 3.13Å; I307-F311 HydrophobicContact CG2-CD2 4.48Å; I307-F311 HydrophobicContact CG2-CE2 4Å; I307-F311 WeakPolarHBondContact O-CD2 3.28Å; I307-V696 HydrophobicContact CD1-CG1 3.53Å; I307-V696 HydrophobicContact CG1-CG1 4.5Å
308L95.5Very high96.1Very high41 Ų4116.7 Ų16.722%0.2158%0.079CC..Hα-helixtrans-65.6-42.7-171.1-60.8174000115I193 L305 K306 M310 F311 V312I193-L308 HydrophobicContact CD1-CD1 4.19Å; I193-L308 HydrophobicContact CG1-CD1 4.13Å; I193-L308 HydrophobicContact CG2-CD1 4.07Å; L305-L308 HydrophobicContact CD2-CD1 4.02Å; L305-L308 VanDerWaalsContact O-CB 3.29Å; L305-L308 WeakPolarHBondContact O-CB 3.27Å; L305-L308 WeakPolarHBondContact O-CG 3.47Å; L305-L308 PolarHBondContact O-N 2.9Å; K306-L308 VanDerWaalsContact C-N 3.32Å; L308-M310 PolarHBondContact O-N 3.33Å; L308-M310 VanDerWaalsContact O-N 3.1Å; L308-F311 CarbonylContact O-C 3.31Å; L308-F311 WeakPolarHBondContact O-CA 3.26Å; L308-F311 PolarHBondContact O-N 3.46Å; L308-V312 HydrophobicContact CB-CG2 4.32Å; L308-V312 WeakPolarHBondContact O-CG2 3.06Å; L308-V312 PolarHBondContact O-N 2.86Å
309P95.6Very high96.2Very high0 Ų016.7 Ų16.70%08%0.079CC..Hα-helixtrans-55.8-30.9-174.1-32.241000114.9F56 I60 L68 E83 L305 K306 F311 I313 V314F56-P309 HydrophobicContact CE2-CG 4.13Å; I60-P309 HydrophobicContact CD1-CB 4.3Å; I60-P309 HydrophobicContact CD1-CG 3.61Å; I60-P309 HydrophobicContact CG1-CG 4.2Å; L68-P309 HydrophobicContact CD2-CB 4.45Å; E83-P309 HydrophobicContact CG-CB 3.94Å; E83-P309 VanDerWaalsContact OE2-CB 3.23Å; E83-P309 WeakPolarHBondContact OE2-CB 3.23Å; E83-P309 VanDerWaalsContact OE2-CG 3.23Å; E83-P309 WeakPolarHBondContact OE2-CG 3.38Å; L305-P309 WeakPolarHBondContact O-CD 3.33Å; K306-P309 WeakPolarHBondContact O-CD 3.26Å; P309-F311 VanDerWaalsContact C-N 3.27Å; P309-F311 PolarHBondContact O-N 3.49Å; P309-I313 HydrophobicContact CB-CD1 4.15Å; P309-I313 HydrophobicContact CB-CG1 4.43Å; P309-I313 WeakPolarHBondContact O-CA 3.37Å; P309-I313 VanDerWaalsContact O-CB 3.26Å; P309-I313 WeakPolarHBondContact O-CB 2.97Å; P309-I313 PolarHBondContact O-N 3.45Å; P309-V314 PolarHBondContact O-N 3.33Å
310M94.9Very high96.2Very high0 Ų016.7 Ų16.70%08%0.079CC..Iπ-helixtrans-57.1-43.2171.4-178.558.9179.700111.9F77 F84 I250 L308 V314 I315 F704F77-M310 HydrophobicContact CB-CE 3.73Å; F77-M310 HydrophobicContact CD1-CE 3.29Å; F77-M310 HydrophobicContact CD2-CE 4.23Å; F77-M310 HydrophobicContact CE1-CE 3.91Å; F77-M310 HydrophobicContact CG-CE 3.49Å; F77-M310 VanDerWaalsContact CG-CE 3.49Å; F84-M310 HydrophobicContact CE1-CB 4.01Å; F84-M310 HydrophobicContact CE1-CG 4.43Å; F84-M310 HydrophobicContact CE2-CG 4.48Å; F84-M310 HydrophobicContact CZ-CB 3.89Å; F84-M310 HydrophobicContact CZ-CG 3.81Å; I250-M310 HydrophobicContact CD1-CE 4.47Å; L308-M310 PolarHBondContact O-N 3.33Å; L308-M310 VanDerWaalsContact O-N 3.1Å; M310-V314 WeakPolarHBondContact O-CB 3.47Å; M310-V314 HydrophobicContact SD-CB 4.02Å; M310-V314 HydrophobicContact SD-CG1 4.06Å; M310-V314 HydrophobicContact SD-CG2 4.26Å; M310-I315 PolarHBondContact O-N 3.23Å; M310-I315 VanDerWaalsContact O-N 3.13Å; M310-F704 HydrophobicContact CE-CD1 3.69Å; M310-F704 HydrophobicContact CE-CE1 3.64Å; M310-F704 HydrophobicContact CE-CG 4.23Å; M310-F704 HydrophobicContact CE-CZ 4.14Å; M310-F704 HydrophobicContact CG-CZ 4.45Å
311F95.8Very high96.1Very high67 Ų6716.7 Ų16.729%0.2948%0.078SC..Iπ-helixtrans-86.3-34-177.2-59.5-79.7000113.5T200 I307 L308 P309 I315 P316 F704T200-F311 WeakPolarHBondContact CG2-O 3.45Å; I307-F311 HydrophobicContact CG2-CD2 4.48Å; I307-F311 HydrophobicContact CG2-CE2 4Å; I307-F311 WeakPolarHBondContact O-CD2 3.28Å; L308-F311 CarbonylContact O-C 3.31Å; L308-F311 WeakPolarHBondContact O-CA 3.26Å; L308-F311 PolarHBondContact O-N 3.46Å; P309-F311 VanDerWaalsContact C-N 3.27Å; P309-F311 PolarHBondContact O-N 3.49Å; F311-I315 HydrophobicContact CD1-CD1 3.76Å; F311-I315 HydrophobicContact CE1-CD1 4.39Å; F311-P316 WeakPolarHBondContact O-CD 3.37Å; F311-F704 HydrophobicContact CE1-CE2 4.5Å; F311-F704 AromaticContact CE1-CZ 3.98Å; F311-F704 HydrophobicContact CE1-CZ 3.98Å; F311-F704 HydrophobicContact CZ-CE2 4.02Å; F311-F704 AromaticContact CZ-CZ 3.97Å; F311-F704 HydrophobicContact CZ-CZ 3.97Å
312V95.9Very high96.2Very high9 Ų916.2 Ų16.26%0.0558%0.076CC..Iπ-helixtrans-105.3-5.2-171.3-48.60000114.7A196 L197 T200 L308 P316A196-V312 HydrophobicContact CB-CB 3.81Å; A196-V312 HydrophobicContact CB-CG2 3.86Å; L197-V312 HydrophobicContact CD2-CG1 3.67Å; L197-V312 HydrophobicContact CG-CG1 4.12Å; T200-V312 WeakPolarHBondContact OG1-CA 3.32Å; L308-V312 HydrophobicContact CB-CG2 4.32Å; L308-V312 WeakPolarHBondContact O-CG2 3.06Å; L308-V312 PolarHBondContact O-N 2.86Å; V312-P316 WeakPolarHBondContact O-CG 3.13Å
313I96.1Very high96.2Very high1 Ų119.2 Ų19.21%0.0059%0.092CC..Iπ-helixtrans-127-57.4178-55.5-174.4000110.8I60 H64 F65 L68 A69 P309 G317I60-I313 HydrophobicContact CG2-CD1 3.8Å; H64-I313 HydrophobicContact CB-CD1 3.97Å; H64-I313 WeakPolarHBondContact O-CG2 3.42Å; F65-I313 HydrophobicContact CD1-CD1 4.33Å; F65-I313 HydrophobicContact CD1-CG1 4.35Å; F65-I313 HydrophobicContact CE1-CD1 4.15Å; F65-I313 HydrophobicContact CE1-CG1 4.13Å; F65-I313 HydrophobicContact CZ-CD1 4.37Å; L68-I313 HydrophobicContact CB-CG2 4.29Å; L68-I313 HydrophobicContact CD2-CG2 4.19Å; L68-I313 HydrophobicContact CG-CG2 4.35Å; A69-I313 HydrophobicContact CB-CG2 3.72Å; P309-I313 HydrophobicContact CB-CD1 4.15Å; P309-I313 HydrophobicContact CB-CG1 4.43Å; P309-I313 WeakPolarHBondContact O-CA 3.37Å; P309-I313 VanDerWaalsContact O-CB 3.26Å; P309-I313 WeakPolarHBondContact O-CB 2.97Å; P309-I313 PolarHBondContact O-N 3.45Å; I313-G317 PolarHBondContact O-N 3.31Å
314V97Very high96.2Very high0 Ų020.9 Ų20.90%010%0.099CC..Iπ-helixtrans-66-52.6-176.3179.50000111.6L68 G76 V79 P309 M310 G317 M318L68-V314 HydrophobicContact CD1-CG2 4.26Å; L68-V314 HydrophobicContact CD2-CG2 4.04Å; L68-V314 HydrophobicContact CG-CG2 3.91Å; G76-V314 WeakPolarHBondContact O-CG1 3.4Å; V79-V314 HydrophobicContact CG2-CG1 4.05Å; V79-V314 HydrophobicContact CG2-CG2 3.99Å; P309-V314 PolarHBondContact O-N 3.33Å; M310-V314 WeakPolarHBondContact O-CB 3.47Å; M310-V314 HydrophobicContact SD-CB 4.02Å; M310-V314 HydrophobicContact SD-CG1 4.06Å; M310-V314 HydrophobicContact SD-CG2 4.26Å; V314-G317 WeakPolarHBondContact O-CA 3.29Å; V314-G317 PolarHBondContact O-N 3.2Å; V314-G317 VanDerWaalsContact O-N 3.11Å; V314-M318 PolarHBondContact O-N 3.34Å
315I97.1Very high96.1Very high3 Ų315.3 Ų15.32%0.0158%0.077CC..Hα-helixtrans-59.2-46.7177.9-77.7163.7000112.1F77 L204 L210 V213 M310 F311 G317 M318 I319F77-I315 HydrophobicContact CE1-CD1 4.36Å; F77-I315 HydrophobicContact CE1-CG1 3.8Å; L204-I315 HydrophobicContact CD2-CG2 4.24Å; L210-I315 HydrophobicContact CD1-CD1 3.83Å; V213-I315 HydrophobicContact CG2-CG2 4.47Å; M310-I315 PolarHBondContact O-N 3.23Å; M310-I315 VanDerWaalsContact O-N 3.13Å; F311-I315 HydrophobicContact CD1-CD1 3.76Å; F311-I315 HydrophobicContact CE1-CD1 4.39Å; I315-G317 VanDerWaalsContact C-N 3.3Å; I315-G317 PolarHBondContact O-N 3.48Å; I315-M318 WeakPolarHBondContact O-CB 3.43Å; I315-M318 PolarHBondContact O-N 2.7Å; I315-M318 VanDerWaalsContact O-N 3.11Å; I315-I319 HydrophobicContact CG2-CD1 3.78Å; I315-I319 HydrophobicContact CG2-CG1 4.34Å; I315-I319 WeakPolarHBondContact O-CG1 3.3Å; I315-I319 PolarHBondContact O-N 2.65Å
316P97.1Very high95.9Very high0 Ų017.6 Ų17.60%09%0.089CC..Hα-helixtrans-56.5-40.3171.6-33.440.5000113.6T200 F311 V312 M318 I319 S320 Y351 L354T200-P316 HydrophobicContact CG2-CG 4.2Å; T200-P316 VanDerWaalsContact OG1-CG 3.25Å; T200-P316 WeakPolarHBondContact OG1-CG 3.09Å; F311-P316 WeakPolarHBondContact O-CD 3.37Å; V312-P316 WeakPolarHBondContact O-CG 3.13Å; P316-M318 VanDerWaalsContact C-N 3.33Å; P316-M318 PolarHBondContact O-N 2.89Å; P316-I319 PolarHBondContact O-N 3.47Å; P316-S320 PolarHBondContact O-N 2.86Å; P316-Y351 HydrophobicContact CB-CD2 4.15Å; P316-Y351 HydrophobicContact CB-CE2 3.87Å; P316-Y351 HydrophobicContact CG-CE2 4.49Å; P316-L354 HydrophobicContact CB-CD2 3.76Å; P316-L354 WeakPolarHBondContact O-CD2 3.47Å
317G97.1Very high95.7Very high0 Ų020.2 Ų20.20%010%0.102CC..Hα-helixtrans-55.2-46.9171.500000112.7A69 A73 I313 V314 I315 S320 R321A69-G317 WeakPolarHBondContact O-CA 3.33Å; A73-G317 VanDerWaalsContact CB-O 3.25Å; A73-G317 WeakPolarHBondContact CB-O 3.36Å; I313-G317 PolarHBondContact O-N 3.31Å; V314-G317 WeakPolarHBondContact O-CA 3.29Å; V314-G317 PolarHBondContact O-N 3.2Å; V314-G317 VanDerWaalsContact O-N 3.11Å; I315-G317 VanDerWaalsContact C-N 3.3Å; I315-G317 PolarHBondContact O-N 3.48Å; G317-S320 WeakPolarHBondContact O-CB 3.39Å; G317-S320 PolarHBondContact O-N 3.25Å; G317-R321 PolarHBondContact O-N 3.24Å
318M97.5Very high95.6Very high0 Ų019.6 Ų19.60%010%0.099CC..Hα-helixtrans-62.8-41.2174.9-65.817571.100112.9G72 F77 V213 Y217 L248 V314 I315 P316 S320 R321 I322G72-M318 WeakPolarHBondContact O-CG 3.27Å; F77-M318 HydrophobicContact CD1-CE 3.98Å; F77-M318 HydrophobicContact CD1-SD 3.28Å; F77-M318 WeakPolarHBondContact CD1-SD 3.37Å; F77-M318 HydrophobicContact CE1-CE 3.82Å; F77-M318 HydrophobicContact CE1-SD 3.29Å; F77-M318 WeakPolarHBondContact CE1-SD 3.03Å; F77-M318 HydrophobicContact CG-SD 4.33Å; F77-M318 HydrophobicContact CZ-CE 4.35Å; F77-M318 HydrophobicContact CZ-SD 4.34Å; V213-M318 HydrophobicContact CG1-CB 4.25Å; V213-M318 HydrophobicContact CG1-CE 4.1Å; Y217-M318 HydrophobicContact CD1-CE 3.92Å; Y217-M318 HydrophobicContact CD2-CB 3.69Å; Y217-M318 HydrophobicContact CD2-CE 3.71Å; Y217-M318 HydrophobicContact CD2-CG 4.02Å; Y217-M318 HydrophobicContact CE1-CE 4.2Å; Y217-M318 HydrophobicContact CE2-CB 3.83Å; Y217-M318 HydrophobicContact CE2-CE 3.98Å; Y217-M318 HydrophobicContact CE2-CG 3.75Å; Y217-M318 HydrophobicContact CG-CE 3.67Å; L248-M318 HydrophobicContact CD2-CE 3.93Å; V314-M318 PolarHBondContact O-N 3.34Å; I315-M318 WeakPolarHBondContact O-CB 3.43Å; I315-M318 PolarHBondContact O-N 2.7Å; I315-M318 VanDerWaalsContact O-N 3.11Å; P316-M318 VanDerWaalsContact C-N 3.33Å; P316-M318 PolarHBondContact O-N 2.89Å; M318-S320 VanDerWaalsContact C-N 3.28Å; M318-S320 PolarHBondContact O-N 3.1Å; M318-R321 WeakPolarHBondContact O-CB 3.29Å; M318-R321 PolarHBondContact O-N 3.46Å; M318-I322 WeakPolarHBondContact O-CG1 3.42Å; M318-I322 PolarHBondContact O-N 2.98Å
319I97.9Very high95.4Very high0 Ų018.5 Ų18.50%09%0.093CC..Hα-helixtrans-63.3-38.3176.4-66.5165.4000110.8L204 V207 V213 I315 P316 R321 I322 L323 L354L204-I319 HydrophobicContact CD2-CD1 3.92Å; L204-I319 HydrophobicContact CG-CD1 4.08Å; V207-I319 HydrophobicContact CG1-CG1 4.48Å; V207-I319 HydrophobicContact CG1-CG2 3.62Å; V207-I319 HydrophobicContact CG2-CD1 4.3Å; V207-I319 HydrophobicContact CG2-CG1 4.13Å; V213-I319 HydrophobicContact CG2-CD1 4.04Å; V213-I319 HydrophobicContact CG2-CG1 3.69Å; I315-I319 HydrophobicContact CG2-CD1 3.78Å; I315-I319 HydrophobicContact CG2-CG1 4.34Å; I315-I319 WeakPolarHBondContact O-CG1 3.3Å; I315-I319 PolarHBondContact O-N 2.65Å; P316-I319 PolarHBondContact O-N 3.47Å; I319-R321 VanDerWaalsContact C-N 3.31Å; I319-R321 PolarHBondContact O-N 3.1Å; I319-I322 WeakPolarHBondContact O-CB 3.45Å; I319-I322 PolarHBondContact O-N 3.3Å; I319-I322 VanDerWaalsContact O-N 3.07Å; I319-L323 HydrophobicContact CG2-CD1 3.93Å; I319-L323 HydrophobicContact CG2-CG 4.24Å; I319-L323 PolarHBondContact O-N 2.62Å; I319-L354 HydrophobicContact CG2-CD1 4.13Å
320S97.1Very high95.1Very high0 Ų019.3 Ų19.30%010%0.098CC..Hα-helixtrans-59.4-43.9175.9-161.40000111.4P316 G317 M318 I322 L323 F324 I328 A350P316-S320 PolarHBondContact O-N 2.86Å; G317-S320 WeakPolarHBondContact O-CB 3.39Å; G317-S320 PolarHBondContact O-N 3.25Å; M318-S320 VanDerWaalsContact C-N 3.28Å; M318-S320 PolarHBondContact O-N 3.1Å; S320-I322 VanDerWaalsContact C-N 3.3Å; S320-I322 PolarHBondContact O-N 3.15Å; S320-L323 PolarHBondContact O-N 3.5Å; S320-F324 PolarHBondContact O-N 3.41Å; S320-I328 VanDerWaalsContact O-CD1 3.28Å; S320-I328 WeakPolarHBondContact O-CD1 3.39Å; S320-I328 VanDerWaalsContact OG-CD1 3.3Å; S320-I328 WeakPolarHBondContact OG-CD1 3.46Å; S320-A350 VanDerWaalsContact CB-O 3.24Å; S320-A350 WeakPolarHBondContact CB-O 3.46Å; S320-A350 PolarHBondContact OG-O 3.48Å
321R96.3Very high94.9Very high12 Ų1219.3 Ų19.35%0.04510%0.098CC..Hα-helixtrans-57.3-40.7172.3177.5170.4176.6152.511.7112.7A73 A74 Y217 A220 I241 G317 M318 I319 L323 A325 I329A73-R321 HydrophobicContact CB-CB 4.26Å; A73-R321 WeakPolarHBondContact O-CD 3.43Å; A73-R321 PolarHBondContact O-NH1 3.2Å; A74-R321 PolarHBondContact O-NH1 3.43Å; A74-R321 VanDerWaalsContact O-NH1 3.1Å; Y217-R321 HydrophobicContact CE2-CB 4.33Å; Y217-R321 HydrophobicContact CE2-CG 4.4Å; A220-R321 HydrophobicContact CB-CG 3.89Å; A220-R321 PolarHBondContact O-NE 3.48Å; I241-R321 PolarHBondContact O-NH2 3.29Å; I241-R321 VanDerWaalsContact O-NH2 3.09Å; G317-R321 PolarHBondContact O-N 3.24Å; M318-R321 WeakPolarHBondContact O-CB 3.29Å; M318-R321 PolarHBondContact O-N 3.46Å; I319-R321 VanDerWaalsContact C-N 3.31Å; I319-R321 PolarHBondContact O-N 3.1Å; R321-L323 VanDerWaalsContact C-N 3.34Å; R321-L323 PolarHBondContact O-N 3.11Å; R321-A325 WeakPolarHBondContact O-CA 3.1Å; R321-A325 WeakPolarHBondContact O-CB 3.42Å; R321-A325 PolarHBondContact O-N 3.43Å; R321-A325 VanDerWaalsContact O-N 3.12Å; R321-I329 HydrophobicContact CG-CD1 3.95Å; R321-I329 HydrophobicContact CG-CG1 4.4Å; R321-I329 VanDerWaalsContact NE-CD1 3.31Å
322I96.8Very high94.6Very high30 Ų3016.2 Ų16.215%0.1549%0.085CC..Hα-helixtrans-63.2-41178.3-65.2166.3000111.5V207 V213 K216 A220 M318 I319 S320V207-I322 HydrophobicContact CG1-CB 4.46Å; V207-I322 HydrophobicContact CG1-CD1 4.46Å; V207-I322 HydrophobicContact CG1-CG2 4.02Å; V213-I322 HydrophobicContact CG1-CD1 4.35Å; K216-I322 HydrophobicContact CB-CD1 4.07Å; K216-I322 HydrophobicContact CB-CG1 4.24Å; K216-I322 HydrophobicContact CB-CG2 3.77Å; K216-I322 HydrophobicContact CD-CG2 4.24Å; A220-I322 HydrophobicContact CB-CG1 4.3Å; M318-I322 WeakPolarHBondContact O-CG1 3.42Å; M318-I322 PolarHBondContact O-N 2.98Å; I319-I322 WeakPolarHBondContact O-CB 3.45Å; I319-I322 PolarHBondContact O-N 3.3Å; I319-I322 VanDerWaalsContact O-N 3.07Å; S320-I322 VanDerWaalsContact C-N 3.3Å; S320-I322 PolarHBondContact O-N 3.15Å
323L96.1Very high94.3Very high63 Ų6316.6 Ų16.633%0.339%0.088SC..Hα-helixtrans-86.1-27.7-174.7-63.8179.3000113.5V207 I319 S320 R321 L354 V358V207-L323 HydrophobicContact CG1-CD2 4.19Å; V207-L323 HydrophobicContact CG1-CG 4.39Å; I319-L323 HydrophobicContact CG2-CD1 3.93Å; I319-L323 HydrophobicContact CG2-CG 4.24Å; I319-L323 PolarHBondContact O-N 2.62Å; S320-L323 PolarHBondContact O-N 3.5Å; R321-L323 VanDerWaalsContact C-N 3.34Å; R321-L323 PolarHBondContact O-N 3.11Å; L323-L354 HydrophobicContact CD1-CD1 3.85Å; L323-V358 HydrophobicContact CD1-CG2 4.31Å
324F95.3Very high93.9Very high35 Ų3522.2 Ų22.215%0.15411%0.114CC..  trans-133.542.8-171.2-50.3-68.4000111.9S320 D326 E327 I328 R353 L354 A357S320-F324 PolarHBondContact O-N 3.41Å; F324-D326 VanDerWaalsContact C-N 3.26Å; F324-D326 PolarHBondContact O-N 3.33Å; F324-E327 HydrophobicContact CB-CB 4.49Å; F324-E327 PolarHBondContact O-N 3.1Å; F324-E327 VanDerWaalsContact O-N 3.08Å; F324-I328 HydrophobicContact CB-CD1 3.95Å; F324-I328 HydrophobicContact CB-CG1 4.36Å; F324-I328 WeakPolarHBondContact O-CG1 3.45Å; F324-I328 PolarHBondContact O-N 2.9Å; F324-R353 HydrophobicContact CB-CG 4.45Å; F324-R353 HydrophobicContact CD2-CG 3.93Å; F324-R353 HydrophobicContact CE2-CG 4.38Å; F324-R353 HydrophobicContact CG-CG 4.03Å; F324-L354 HydrophobicContact CE2-CD1 4.24Å; F324-A357 HydrophobicContact CE1-CB 4.05Å; F324-A357 HydrophobicContact CE2-CB 3.98Å; F324-A357 HydrophobicContact CZ-CB 3.29Å
325A94.2Very high93.6Very high13 Ų1322.7 Ų22.711%0.10712%0.116CC..Hα-helixtrans-53.6-42.9-178.800000112.5R321 E327 I328 I329R321-A325 WeakPolarHBondContact O-CA 3.1Å; R321-A325 WeakPolarHBondContact O-CB 3.42Å; R321-A325 PolarHBondContact O-N 3.43Å; R321-A325 VanDerWaalsContact O-N 3.12Å; A325-E327 PolarHBondContact O-N 3.13Å; A325-I328 PolarHBondContact O-N 3.19Å; A325-I329 HydrophobicContact CB-CD1 4.14Å; A325-I329 WeakPolarHBondContact O-CB 3.37Å; A325-I329 PolarHBondContact O-N 3.04Å
326D91.8Very high93.2Very high71 Ų7122.8 Ų22.838%0.3812%0.117SC..Hα-helixtrans-64.7-23.7-179.4-64-17.1000113.6P222 N223 I227 F324 H335P222-D326 WeakPolarHBondContact CA-OD1 3.41Å; N223-D326 PolarHBondContact N-OD1 3.14Å; I227-D326 HydrophobicContact CD1-CB 4.12Å; F324-D326 VanDerWaalsContact C-N 3.26Å; F324-D326 PolarHBondContact O-N 3.33Å; D326-H335 PolarHBondContact O-CE1 3.47Å
327E90.2Very high92.9Very high58 Ų5826.8 Ų26.827%0.27114%0.137SC..Hα-helixtrans-97.7-33.6-179.9-61.7-178.1-151.100111.8F324 A325 V339 C346 R353F324-E327 HydrophobicContact CB-CB 4.49Å; F324-E327 PolarHBondContact O-N 3.1Å; F324-E327 VanDerWaalsContact O-N 3.08Å; A325-E327 PolarHBondContact O-N 3.13Å; E327-V339 HydrophobicContact CB-CG1 4.04Å; E327-V339 WeakPolarHBondContact O-CG1 3.47Å; E327-C346 WeakPolarHBondContact O-CB 3.33Å; E327-R353 IonicContact OE1-CZ 2.64Å; E327-R353 IonicContact OE1-NE 3.02Å; E327-R353 IonicContact OE1-NH2 3.01Å; E327-R353 PolarHBondContact OE1-NH2 3.43Å; E327-R353 IonicContact OE2-CZ 3.56Å; E327-R353 IonicContact OE2-NE 3.22Å; E327-R353 PolarHBondContact OE2-NE 3.49Å; E327-R353 IonicContact OE2-NH2 3.1Å; E327-R353 PolarHBondContact OE2-NH2 3.08Å
328I92.5Very high92.5Very high9 Ų929.7 Ų29.75%0.04616%0.161CC..Hα-helixtrans-85.8-36.5-174.4-67.6168.5000111.5A73 S320 F324 A325 A350A73-I328 HydrophobicContact CB-CG2 4.17Å; S320-I328 VanDerWaalsContact O-CD1 3.28Å; S320-I328 WeakPolarHBondContact O-CD1 3.39Å; S320-I328 VanDerWaalsContact OG-CD1 3.3Å; S320-I328 WeakPolarHBondContact OG-CD1 3.46Å; F324-I328 HydrophobicContact CB-CD1 3.95Å; F324-I328 HydrophobicContact CB-CG1 4.36Å; F324-I328 WeakPolarHBondContact O-CG1 3.45Å; F324-I328 PolarHBondContact O-N 2.9Å; A325-I328 PolarHBondContact O-N 3.19Å; I328-A350 HydrophobicContact CD1-CB 3.98Å; I328-A350 HydrophobicContact CG1-CB 4.48Å
329I91.6Very high92Very high18 Ų1831.6 Ų31.69%0.09217%0.173CC..SBendtrans-105.3118.7-177.8-51.2160.4000108.2A220 P222 I241 R321 A325A220-I329 WeakPolarHBondContact O-CD1 3.4Å; P222-I329 HydrophobicContact CG-CB 4.07Å; P222-I329 HydrophobicContact CG-CG2 3.89Å; I241-I329 HydrophobicContact CB-CG2 4.01Å; I241-I329 HydrophobicContact CG2-CG2 4.1Å; R321-I329 HydrophobicContact CG-CD1 3.95Å; R321-I329 HydrophobicContact CG-CG1 4.4Å; R321-I329 VanDerWaalsContact NE-CD1 3.31Å; A325-I329 HydrophobicContact CB-CD1 4.14Å; A325-I329 WeakPolarHBondContact O-CB 3.37Å; A325-I329 PolarHBondContact O-N 3.04Å
330C89.3Confident91.5Very high16 Ų1632.2 Ų32.211%0.10818%0.177CC..  trans-91.2142.5178.7-46.20000112.3G332 C336 C346C330-G332 VanDerWaalsContact C-N 3.3Å; C330-C336 HydrophobicContact CB-CB 3.98Å; C330-C336 WeakPolarHBondContact CB-SG 3.46Å; C330-C336 WeakPolarHBondContact SG-CA 3.26Å; C330-C336 WeakPolarHBondContact SG-CB 3.02Å; C330-C336 CovalentContact SG-SG 2.01Å; C330-C336 PolarHBondContact SG-SG 3.03Å; C330-C346 VanDerWaalsContact SG-SG 3.65Å
331I90.6Very high90.9Very high0 Ų034.2 Ų34.20%020%0.197CC..SBendtrans-79.3-14.6170.563.5164.6000113.2P222 V224 I227 T228 Y235 S236 H335P222-I331 HydrophobicContact CG-CG2 4.21Å; V224-I331 HydrophobicContact CB-CG2 4.49Å; V224-I331 HydrophobicContact CG1-CG2 4.4Å; V224-I331 HydrophobicContact CG2-CG2 3.97Å; I227-I331 HydrophobicContact CB-CD1 4.12Å; I227-I331 HydrophobicContact CD1-CG2 4.12Å; I227-I331 HydrophobicContact CG2-CD1 3.48Å; I227-I331 VanDerWaalsContact CG2-CD1 3.48Å; I227-I331 HydrophobicContact CG2-CG1 4.05Å; T228-I331 HydrophobicContact CG2-CD1 3.71Å; Y235-I331 HydrophobicContact CD2-CB 3.95Å; S236-I331 PolarHBondContact N-O 2.83Å; I331-H335 HydrophobicContact CG1-CB 3.9Å
332G89.5Confident90.4Very high3 Ų334 Ų343%0.03120%0.198CC..SBendtrans-178.1170.1179.400000112.5C330 E334 H335 C336C330-G332 VanDerWaalsContact C-N 3.3Å; G332-E334 PolarHBondContact O-N 3.45Å; G332-H335 WeakPolarHBondContact O-CB 3.36Å; G332-H335 PolarHBondContact O-N 3.37Å; G332-C336 PolarHBondContact O-N 2.96Å; G332-C336 VanDerWaalsContact O-N 3.14Å
333P88.3Confident89.9Confident16 Ų1635.9 Ų35.910%0.10421%0.206CC..Hα-helixtrans-63.7-36-174.8-23.133.3000114.3H335 C336 M337 Q343 R495 D497P333-H335 VanDerWaalsContact C-N 3.34Å; P333-C336 PolarHBondContact O-N 3.23Å; P333-M337 PolarHBondContact O-N 3.34Å; P333-Q343 HydrophobicContact CB-CB 4.35Å; P333-R495 HydrophobicContact CG-CB 4.4Å; P333-D497 HydrophobicContact CG-CB 4.49Å; P333-D497 WeakPolarHBondContact CG-OD1 3.5Å
334E89.3Confident89.3Confident119 Ų11935.3 Ų35.356%0.55621%0.21SC*.Hα-helixtrans-64.3-41.2177.9-64.4-176.5162.700111.5Y233 G332 M337 A338Y233-E334 HydrophobicContact CD1-CB 4.13Å; G332-E334 PolarHBondContact O-N 3.45Å; E334-M337 PolarHBondContact O-N 3.4Å; E334-A338 PolarHBondContact O-N 2.9Å; E334-A338 VanDerWaalsContact O-N 3.14Å
335H90.1Very high88.9Confident11 Ų1134.3 Ų34.35%0.05121%0.209CC..Hα-helixtrans-63.6-45.3175176.8-98.6000111.3I227 Y233 D326 I331 G332 P333 M337 A338 V339I227-H335 WeakPolarHBondContact CG2-CD2 3.35Å; I227-H335 WeakPolarHBondContact CG2-NE2 3.39Å; Y233-H335 HydrophobicContact CD1-CB 4.46Å; Y233-H335 HydrophobicContact CG-CB 4.3Å; D326-H335 PolarHBondContact O-CE1 3.47Å; I331-H335 HydrophobicContact CG1-CB 3.9Å; G332-H335 WeakPolarHBondContact O-CB 3.36Å; G332-H335 PolarHBondContact O-N 3.37Å; P333-H335 VanDerWaalsContact C-N 3.34Å; H335-M337 VanDerWaalsContact C-N 3.29Å; H335-M337 PolarHBondContact O-N 2.9Å; H335-A338 PolarHBondContact O-N 3.28Å; H335-V339 WeakPolarHBondContact O-CG2 3.39Å; H335-V339 PolarHBondContact O-N 3.47Å; H335-V339 VanDerWaalsContact O-N 3.11Å
336C89.5Confident88.8Confident5 Ų533.8 Ų33.83%0.03421%0.205CC..Hα-helixtrans-59.8-40.8176.5-67.10000112.5C330 G332 P333 A338 V339 C340 G341 S342C330-C336 HydrophobicContact CB-CB 3.98Å; C330-C336 WeakPolarHBondContact CB-SG 3.46Å; C330-C336 WeakPolarHBondContact SG-CA 3.26Å; C330-C336 WeakPolarHBondContact SG-CB 3.02Å; C330-C336 CovalentContact SG-SG 2.01Å; C330-C336 PolarHBondContact SG-SG 3.03Å; G332-C336 PolarHBondContact O-N 2.96Å; G332-C336 VanDerWaalsContact O-N 3.14Å; P333-C336 PolarHBondContact O-N 3.23Å; C336-A338 VanDerWaalsContact C-N 3.3Å; C336-A338 PolarHBondContact O-N 3.17Å; C336-V339 PolarHBondContact O-N 3.05Å; C336-C340 PolarHBondContact O-N 2.88Å; C336-C340 PolarHBondContact O-SG 3.37Å; C336-C340 VanDerWaalsContact O-SG 3.41Å; C336-G341 PolarHBondContact O-N 3.41Å; C336-S342 CarbonylContact C-O 3.4Å; C336-S342 WeakPolarHBondContact CB-O 3.41Å
337M89.4Confident88.9Confident83 Ų8330.9 Ų30.941%0.40919%0.19SC..Hα-helixtrans-62.3-38.9178.3-80.4-60.6-67.100112.7P333 E334 H335 G341 S342 Q343P333-M337 PolarHBondContact O-N 3.34Å; E334-M337 PolarHBondContact O-N 3.4Å; H335-M337 VanDerWaalsContact C-N 3.29Å; H335-M337 PolarHBondContact O-N 2.9Å; M337-G341 WeakPolarHBondContact O-CA 3.31Å; M337-G341 PolarHBondContact O-N 3.48Å; M337-G341 VanDerWaalsContact O-N 3.13Å; M337-S342 PolarHBondContact N-O 2.94Å; M337-S342 PolarHBondContact SD-N 2.9Å; M337-Q343 HydrophobicContact CG-CB 4.27Å; M337-Q343 HydrophobicContact CG-CG 3.2Å; M337-Q343 HydrophobicContact SD-CB 4.39Å; M337-Q343 HydrophobicContact SD-CG 3.49Å; M337-Q343 WeakPolarHBondContact SD-CG 3.21Å; M337-Q343 PolarHBondContact SD-N 3.25Å
338A88.8Confident89Confident61 Ų6128.3 Ų28.350%0.50418%0.178SC..Hα-helixtrans-68.5-3617800000112.6Y233 E334 H335 C336Y233-A338 HydrophobicContact CE1-CB 4.17Å; Y233-A338 VanDerWaalsContact OH-CB 3.29Å; Y233-A338 WeakPolarHBondContact OH-CB 3.4Å; E334-A338 PolarHBondContact O-N 2.9Å; E334-A338 VanDerWaalsContact O-N 3.14Å; H335-A338 PolarHBondContact O-N 3.28Å; C336-A338 VanDerWaalsContact C-N 3.3Å; C336-A338 PolarHBondContact O-N 3.17Å
339V88.1Confident89Confident41 Ų4128.1 Ų28.125%0.24818%0.177CC..Hα-helixtrans-83.4-51-175.8177.30000112.5E327 H335 C336 I349E327-V339 HydrophobicContact CB-CG1 4.04Å; E327-V339 WeakPolarHBondContact O-CG1 3.47Å; H335-V339 WeakPolarHBondContact O-CG2 3.39Å; H335-V339 PolarHBondContact O-N 3.47Å; H335-V339 VanDerWaalsContact O-N 3.11Å; C336-V339 PolarHBondContact O-N 3.05Å; V339-I349 HydrophobicContact CG1-CD1 4.47Å
340C86.8Confident89.1Confident13 Ų1327.3 Ų27.39%0.08817%0.173CC..Hα-helixtrans-127.33.3-170.269.50000114.5C336 S342 C346 I349C336-C340 PolarHBondContact O-N 2.88Å; C336-C340 PolarHBondContact O-SG 3.37Å; C336-C340 VanDerWaalsContact O-SG 3.41Å; C340-S342 VanDerWaalsContact C-N 3.27Å; C340-S342 PolarHBondContact O-N 3.2Å; C340-C346 HydrophobicContact CB-CB 3.72Å; C340-C346 WeakPolarHBondContact CB-SG 3.43Å; C340-C346 WeakPolarHBondContact SG-CA 3.4Å; C340-C346 WeakPolarHBondContact SG-CB 3.43Å; C340-C346 CovalentContact SG-SG 2.04Å; C340-C346 PolarHBondContact SG-SG 3.27Å; C340-I349 HydrophobicContact CB-CD1 4.11Å; C340-I349 HydrophobicContact CB-CG1 4.45Å; C340-I349 HydrophobicContact CB-CG2 4.26Å
341G84.9Confident89.4Confident42 Ų4226.5 Ų26.543%0.43317%0.168SC..SBendtrans69.221178.400000114.7C336 M337C336-G341 PolarHBondContact O-N 3.41Å; M337-G341 WeakPolarHBondContact O-CA 3.31Å; M337-G341 PolarHBondContact O-N 3.48Å; M337-G341 VanDerWaalsContact O-N 3.13Å
342S86.2Confident89.4Confident7 Ų726.6 Ų26.65%0.04917%0.168CC..  trans-126.2135.8175.5169.90000109.4C336 M337 C340 A344 G345C336-S342 CarbonylContact C-O 3.4Å; C336-S342 WeakPolarHBondContact CB-O 3.41Å; M337-S342 PolarHBondContact N-O 2.94Å; M337-S342 PolarHBondContact SD-N 2.9Å; C340-S342 VanDerWaalsContact C-N 3.27Å; C340-S342 PolarHBondContact O-N 3.2Å; S342-A344 VanDerWaalsContact C-N 3.33Å; S342-A344 PolarHBondContact OG-N 3.08Å; S342-G345 PolarHBondContact OG-O 3.46Å
343Q85.8Confident89.6Confident70 Ų7028.1 Ų28.133%0.32717%0.173SC..SBendtrans-80.5-17.7174.8-71.8178.4-10.400112.9P333 M337P333-Q343 HydrophobicContact CB-CB 4.35Å; M337-Q343 HydrophobicContact CG-CB 4.27Å; M337-Q343 HydrophobicContact CG-CG 3.2Å; M337-Q343 HydrophobicContact SD-CB 4.39Å; M337-Q343 HydrophobicContact SD-CG 3.49Å; M337-Q343 WeakPolarHBondContact SD-CG 3.21Å; M337-Q343 PolarHBondContact SD-N 3.25Å
344A83.1Confident89.9Confident51 Ų5127.3 Ų27.342%0.42117%0.168SC..SBendtrans-89.1-28.3-169.900000113.3S342S342-A344 VanDerWaalsContact C-N 3.33Å; S342-A344 PolarHBondContact OG-N 3.08Å
345G87.8Confident90.1Very high13 Ų1321.7 Ų21.713%0.13414%0.142CC..  trans156.7158.3-179.400000113.2S342S342-G345 PolarHBondContact OG-O 3.46Å
346C91.4Very high90Very high2 Ų221.9 Ų21.91%0.01414%0.143CC..SBendtrans-11115.8-176.9-59.70000113.6E327 C330 C340 N348 I349E327-C346 WeakPolarHBondContact O-CB 3.33Å; C330-C346 VanDerWaalsContact SG-SG 3.65Å; C340-C346 HydrophobicContact CB-CB 3.72Å; C340-C346 WeakPolarHBondContact CB-SG 3.43Å; C340-C346 WeakPolarHBondContact SG-CA 3.4Å; C340-C346 WeakPolarHBondContact SG-CB 3.43Å; C340-C346 CovalentContact SG-SG 2.04Å; C340-C346 PolarHBondContact SG-SG 3.27Å; C346-N348 PolarHBondContact O-N 2.86Å; C346-I349 HydrophobicContact CB-CD1 4.41Å; C346-I349 HydrophobicContact CB-CG1 4.21Å; C346-I349 WeakPolarHBondContact O-CG1 3.38Å; C346-I349 PolarHBondContact O-N 3.02Å
347S93.2Very high90.1Very high11 Ų1123.3 Ų23.38%0.07716%0.155CC..G310 helixtrans-56.1-38.6178.57.20000113.2G70 I349 A350 G435G70-S347 WeakPolarHBondContact CA-O 3.41Å; G70-S347 WeakPolarHBondContact O-CB 3.44Å; S347-I349 PolarHBondContact O-N 2.67Å; S347-I349 VanDerWaalsContact O-N 3.16Å; S347-A350 WeakPolarHBondContact O-CB 3.27Å; S347-A350 PolarHBondContact O-N 3.04Å; S347-G435 PolarHBondContact OG-O 3.46Å
348N92.6Very high90.3Very high4 Ų419.8 Ų19.82%0.02114%0.138CC..G310 helixtrans-63.1-23-174.6-63.9-34.4000113.8I66 L148 C346 A350 Q433 G435 T437I66-N348 HydrophobicContact CG2-CB 3.77Å; I66-N348 WeakPolarHBondContact CG2-O 3.48Å; L148-N348 HydrophobicContact CD1-CB 4.19Å; C346-N348 PolarHBondContact O-N 2.86Å; N348-A350 VanDerWaalsContact C-N 3.28Å; N348-A350 PolarHBondContact O-N 2.99Å; N348-Q433 PolarHBondContact ND2-OE1 3.39Å; N348-Q433 VanDerWaalsContact ND2-OE1 3.12Å; N348-G435 PolarHBondContact ND2-O 3.29Å; N348-T437 PolarHBondContact ND2-OG1 3.03Å; N348-T437 PolarHBondContact OD1-N 2.99Å; N348-T437 PolarHBondContact OD1-OG1 2.83Å
349I92.3Very high90.4Very high5 Ų517.4 Ų17.43%0.02612%0.117CC..G310 helixtrans-83.1-4177.564.3155.6000113.2E152 V339 C340 C346 S347 Y351 P352 R353E152-I349 HydrophobicContact CG-CB 4.06Å; E152-I349 HydrophobicContact CG-CG2 3.73Å; V339-I349 HydrophobicContact CG1-CD1 4.47Å; C340-I349 HydrophobicContact CB-CD1 4.11Å; C340-I349 HydrophobicContact CB-CG1 4.45Å; C340-I349 HydrophobicContact CB-CG2 4.26Å; C346-I349 HydrophobicContact CB-CD1 4.41Å; C346-I349 HydrophobicContact CB-CG1 4.21Å; C346-I349 WeakPolarHBondContact O-CG1 3.38Å; C346-I349 PolarHBondContact O-N 3.02Å; S347-I349 PolarHBondContact O-N 2.67Å; S347-I349 VanDerWaalsContact O-N 3.16Å; I349-Y351 PolarHBondContact O-N 3.41Å; I349-P352 VanDerWaalsContact O-CD 3.3Å; I349-P352 WeakPolarHBondContact O-CD 3.23Å; I349-R353 WeakPolarHBondContact O-CB 3.27Å; I349-R353 PolarHBondContact O-N 3.48Å
350A94.7Very high90.6Very high0 Ų018.6 Ų18.60%013%0.126CC..Hα-helixtrans-54.7-51.2-174.300000113.2A73 S320 I328 S347 N348 R353 L354A73-A350 HydrophobicContact CB-CB 3.7Å; S320-A350 VanDerWaalsContact CB-O 3.24Å; S320-A350 WeakPolarHBondContact CB-O 3.46Å; S320-A350 PolarHBondContact OG-O 3.48Å; I328-A350 HydrophobicContact CD1-CB 3.98Å; I328-A350 HydrophobicContact CG1-CB 4.48Å; S347-A350 WeakPolarHBondContact O-CB 3.27Å; S347-A350 PolarHBondContact O-N 3.04Å; N348-A350 VanDerWaalsContact C-N 3.28Å; N348-A350 PolarHBondContact O-N 2.99Å; A350-R353 PolarHBondContact O-N 3.27Å; A350-L354 WeakPolarHBondContact O-CB 3.29Å; A350-L354 PolarHBondContact O-N 3.44Å; A350-L354 VanDerWaalsContact O-N 3.08Å
351Y94.4Very high90.7Very high0 Ų021 Ų210%014%0.14CC..Hα-helixtrans-68.4-50.1-178.6-162-84.9000113.3F65 A69 L199 P316 I349 R353 L354 V355 M367 M371F65-Y351 HydrophobicContact CB-CD1 4.36Å; F65-Y351 AromaticContact CD1-CD1 3.83Å; F65-Y351 HydrophobicContact CD1-CD1 3.83Å; F65-Y351 HydrophobicContact CD1-CD2 4.35Å; F65-Y351 AromaticContact CD1-CE1 3.35Å; F65-Y351 HydrophobicContact CD1-CE1 3.35Å; F65-Y351 AromaticContact CD1-CE2 3.93Å; F65-Y351 HydrophobicContact CD1-CE2 3.93Å; F65-Y351 HydrophobicContact CD1-CG 4.31Å; F65-Y351 AromaticContact CD1-CZ 3.4Å; F65-Y351 VanDerWaalsContact CD1-CZ 3.4Å; F65-Y351 AromaticContact CE1-CE1 3.82Å; F65-Y351 HydrophobicContact CE1-CE1 3.82Å; F65-Y351 HydrophobicContact CE1-CE2 4.27Å; F65-Y351 AromaticContact CE1-CZ 3.56Å; F65-Y351 WeakPolarHBondContact CE1-OH 3.4Å; F65-Y351 HydrophobicContact CG-CE1 4.34Å; F65-Y351 WeakPolarHBondContact O-CB 3.28Å; A69-Y351 HydrophobicContact CB-CD2 3.74Å; A69-Y351 HydrophobicContact CB-CG 4.11Å; L199-Y351 HydrophobicContact CD2-CE1 3.83Å; L199-Y351 HydrophobicContact CD2-CE2 3.83Å; L199-Y351 VanDerWaalsContact CD2-CZ 3.42Å; L199-Y351 WeakPolarHBondContact CD2-OH 3.2Å; P316-Y351 HydrophobicContact CB-CD2 4.15Å; P316-Y351 HydrophobicContact CB-CE2 3.87Å; P316-Y351 HydrophobicContact CG-CE2 4.49Å; I349-Y351 PolarHBondContact O-N 3.41Å; Y351-R353 PolarHBondContact O-N 3.33Å; Y351-L354 PolarHBondContact O-N 3.11Å; Y351-V355 HydrophobicContact CD1-CG2 3.86Å; Y351-V355 HydrophobicContact CE1-CG2 3.67Å; Y351-V355 WeakPolarHBondContact O-CG2 3.4Å; Y351-V355 PolarHBondContact O-N 3.43Å; Y351-M367 HydrophobicContact CE1-CE 3.71Å; Y351-M367 VanDerWaalsContact OH-CE 3.26Å; Y351-M367 WeakPolarHBondContact OH-CE 3.44Å; Y351-M371 HydrophobicContact CD1-CE 4.26Å; Y351-M371 HydrophobicContact CD1-SD 4.24Å; Y351-M371 HydrophobicContact CE1-CE 4.49Å; Y351-M371 HydrophobicContact CE1-SD 4Å
352P92.1Very high90.9Very high1 Ų119.9 Ų19.91%0.00613%0.128CC..Hα-helixtrans-53.8-43.6173.4-11.29.8000112.2I66 F149 E152 I349 L354 V355 M356I66-P352 HydrophobicContact CD1-CG 3.5Å; F149-P352 HydrophobicContact CD2-CB 3.86Å; F149-P352 HydrophobicContact CD2-CG 3.9Å; F149-P352 HydrophobicContact CE2-CB 4.07Å; F149-P352 HydrophobicContact CE2-CG 4.48Å; E152-P352 HydrophobicContact CB-CB 3.8Å; E152-P352 HydrophobicContact CB-CG 4.45Å; E152-P352 HydrophobicContact CG-CB 4.22Å; E152-P352 HydrophobicContact CG-CG 4.42Å; I349-P352 VanDerWaalsContact O-CD 3.3Å; I349-P352 WeakPolarHBondContact O-CD 3.23Å; P352-L354 VanDerWaalsContact C-N 3.3Å; P352-L354 PolarHBondContact O-N 3.03Å; P352-V355 PolarHBondContact O-N 3.42Å; P352-M356 WeakPolarHBondContact O-CG 3.23Å; P352-M356 PolarHBondContact O-N 2.82Å
353R92.3Very high91Very high35 Ų3521.7 Ų21.713%0.13214%0.137CC..Hα-helixtrans-61.5-40.5-178.8-171.861.2176.7109.41.2112.3F324 E327 I349 A350 Y351 A357F324-R353 HydrophobicContact CB-CG 4.45Å; F324-R353 HydrophobicContact CD2-CG 3.93Å; F324-R353 HydrophobicContact CE2-CG 4.38Å; F324-R353 HydrophobicContact CG-CG 4.03Å; E327-R353 IonicContact OE1-CZ 2.64Å; E327-R353 IonicContact OE1-NE 3.02Å; E327-R353 IonicContact OE1-NH2 3.01Å; E327-R353 PolarHBondContact OE1-NH2 3.43Å; E327-R353 IonicContact OE2-CZ 3.56Å; E327-R353 IonicContact OE2-NE 3.22Å; E327-R353 PolarHBondContact OE2-NE 3.49Å; E327-R353 IonicContact OE2-NH2 3.1Å; E327-R353 PolarHBondContact OE2-NH2 3.08Å; I349-R353 WeakPolarHBondContact O-CB 3.27Å; I349-R353 PolarHBondContact O-N 3.48Å; A350-R353 PolarHBondContact O-N 3.27Å; Y351-R353 PolarHBondContact O-N 3.33Å; R353-A357 WeakPolarHBondContact O-CB 3.49Å; R353-A357 PolarHBondContact O-N 2.92Å
354L94.6Very high91.2Very high0 Ų018.9 Ų18.90%012%0.123CC..Hα-helixtrans-65.9-45.2176.1-171.570.9000112L199 P316 I319 L323 F324 A350 Y351 P352 M356 A357 V358L199-L354 HydrophobicContact CD1-CD2 4.43Å; L199-L354 HydrophobicContact CD1-CG 4.23Å; L199-L354 HydrophobicContact CD2-CD2 4.16Å; L199-L354 HydrophobicContact CG-CD2 4.24Å; P316-L354 HydrophobicContact CB-CD2 3.76Å; P316-L354 WeakPolarHBondContact O-CD2 3.47Å; I319-L354 HydrophobicContact CG2-CD1 4.13Å; L323-L354 HydrophobicContact CD1-CD1 3.85Å; F324-L354 HydrophobicContact CE2-CD1 4.24Å; A350-L354 WeakPolarHBondContact O-CB 3.29Å; A350-L354 PolarHBondContact O-N 3.44Å; A350-L354 VanDerWaalsContact O-N 3.08Å; Y351-L354 PolarHBondContact O-N 3.11Å; P352-L354 VanDerWaalsContact C-N 3.3Å; P352-L354 PolarHBondContact O-N 3.03Å; L354-M356 VanDerWaalsContact C-N 3.32Å; L354-M356 PolarHBondContact O-N 3.33Å; L354-A357 PolarHBondContact O-N 2.94Å; L354-V358 HydrophobicContact CD1-CG2 3.54Å; L354-V358 HydrophobicContact CG-CG2 4.09Å; L354-V358 WeakPolarHBondContact O-CB 3.03Å; L354-V358 WeakPolarHBondContact O-CG2 3.44Å; L354-V358 PolarHBondContact O-N 2.87Å
355V93.1Very high91.4Very high0 Ų016.5 Ų16.50%010%0.103CC..Hα-helixtrans-55.9-49.7176.51710000110.3L199 Y351 P352 A357 M359 R364 M367L199-V355 HydrophobicContact CD1-CG2 4.34Å; L199-V355 HydrophobicContact CD2-CG2 3.63Å; Y351-V355 HydrophobicContact CD1-CG2 3.86Å; Y351-V355 HydrophobicContact CE1-CG2 3.67Å; Y351-V355 WeakPolarHBondContact O-CG2 3.4Å; Y351-V355 PolarHBondContact O-N 3.43Å; P352-V355 PolarHBondContact O-N 3.42Å; V355-A357 VanDerWaalsContact C-N 3.26Å; V355-A357 PolarHBondContact O-N 3.45Å; V355-M359 HydrophobicContact CG1-CG 4.44Å; V355-M359 HydrophobicContact CG1-SD 3.98Å; V355-M359 HydrophobicContact CG2-CE 4.46Å; V355-M359 WeakPolarHBondContact O-CB 3.22Å; V355-M359 PolarHBondContact O-N 3.19Å; V355-R364 HydrophobicContact CG1-CG 4.42Å; V355-M367 HydrophobicContact CG1-CB 4.27Å; V355-M367 HydrophobicContact CG1-CG 4.12Å; V355-M367 HydrophobicContact CG2-CG 4.19Å
356M89.8Confident91.5Very high15 Ų1518.6 Ų18.67%0.07411%0.111CC..Hα-helixtrans-66.9-25.3-176.7-65.8-56.2-70.800113.7A3 M5 P352 L354 R364 M368A3-M356 WeakPolarHBondContact O-CE 3.21Å; M5-M356 HydrophobicContact CG-CE 4.43Å; P352-M356 WeakPolarHBondContact O-CG 3.23Å; P352-M356 PolarHBondContact O-N 2.82Å; L354-M356 VanDerWaalsContact C-N 3.32Å; L354-M356 PolarHBondContact O-N 3.33Å; M356-R364 HydrophobicContact SD-CG 3.92Å; M356-M368 HydrophobicContact SD-SD 4.03Å
357A91.1Very high91.4Very high36 Ų3618.5 Ų18.530%0.29811%0.111SC..Hα-helixtrans-102.4-20.9-175.500000114.7K206 F324 R353 L354 V355K206-A357 PolarHBondContact NZ-O 2.89Å; F324-A357 HydrophobicContact CE1-CB 4.05Å; F324-A357 HydrophobicContact CE2-CB 3.98Å; F324-A357 HydrophobicContact CZ-CB 3.29Å; R353-A357 WeakPolarHBondContact O-CB 3.49Å; R353-A357 PolarHBondContact O-N 2.92Å; L354-A357 PolarHBondContact O-N 2.94Å; V355-A357 VanDerWaalsContact C-N 3.26Å; V355-A357 PolarHBondContact O-N 3.45Å
358V93.1Very high91Very high8 Ų818 Ų185%0.04811%0.107CC..Hα-helixtrans-105.8-38.3-175.8179.80000112.5L199 M202 K206 L323 L354L199-V358 HydrophobicContact CD1-CB 4.24Å; L199-V358 HydrophobicContact CD1-CG1 4.47Å; M202-V358 HydrophobicContact CB-CG1 3.7Å; M202-V358 HydrophobicContact CE-CG1 4.36Å; M202-V358 VanDerWaalsContact CE-O 3.23Å; M202-V358 WeakPolarHBondContact CE-O 3.31Å; K206-V358 HydrophobicContact CD-CG1 4.32Å; K206-V358 HydrophobicContact CD-CG2 4.18Å; L323-V358 HydrophobicContact CD1-CG2 4.31Å; L354-V358 HydrophobicContact CD1-CG2 3.54Å; L354-V358 HydrophobicContact CG-CG2 4.09Å; L354-V358 WeakPolarHBondContact O-CB 3.03Å; L354-V358 WeakPolarHBondContact O-CG2 3.44Å; L354-V358 PolarHBondContact O-N 2.87Å
359M91.9Very high90.8Very high12 Ų1217.9 Ų17.96%0.05911%0.106CC..SBendtrans-75.3141.5-176-66.9-163.4176.700112L199 V355 L363 R364 M367L199-M359 HydrophobicContact CB-CE 3.46Å; L199-M359 VanDerWaalsContact CB-CE 3.46Å; L199-M359 HydrophobicContact CD1-CE 3.73Å; L199-M359 HydrophobicContact CD1-CG 3.81Å; L199-M359 HydrophobicContact CD2-CE 4.28Å; L199-M359 HydrophobicContact CG-CE 3.99Å; V355-M359 HydrophobicContact CG1-CG 4.44Å; V355-M359 HydrophobicContact CG1-SD 3.98Å; V355-M359 HydrophobicContact CG2-CE 4.46Å; V355-M359 WeakPolarHBondContact O-CB 3.22Å; V355-M359 PolarHBondContact O-N 3.19Å; M359-L363 HydrophobicContact SD-CD2 4.45Å; M359-L363 HydrophobicContact SD-CG 4.07Å; M359-R364 HydrophobicContact CB-CB 3.93Å; M359-M367 HydrophobicContact CE-CB 3.68Å; M359-M367 HydrophobicContact CE-CG 3.53Å; M359-M367 HydrophobicContact CE-SD 3.99Å; M359-M367 HydrophobicContact SD-CB 3.52Å; M359-M367 VanDerWaalsContact SD-CB 3.52Å; M359-M367 HydrophobicContact SD-CG 4Å
360P91.7Very high90.6Very high66 Ų6617.7 Ų17.743%0.42911%0.105SC..PPolyproline II helixtrans-72.1163171.933.7-33.7000110.6L363 R364P360-L363 HydrophobicContact CG-CB 4Å; P360-L363 HydrophobicContact CG-CD2 4.39Å; P360-L363 PolarHBondContact O-N 3.33Å; P360-R364 WeakPolarHBondContact O-CB 3.39Å; P360-R364 PolarHBondContact O-N 2.92Å
361V89.6Confident90.2Very high64 Ų6418 Ų1839%0.38811%0.107SC..THydrogen-bonded Turntrans-54.6140.9173.6-176.80000110.4E6 A8 L363E6-V361 HydrophobicContact CB-CG1 3.97Å; E6-V361 VanDerWaalsContact CD-CG2 3.42Å; E6-V361 HydrophobicContact CG-CG1 4.47Å; E6-V361 HydrophobicContact CG-CG2 4.32Å; E6-V361 WeakPolarHBondContact OE1-CG2 3.43Å; E6-V361 WeakPolarHBondContact OE2-CG1 3.45Å; E6-V361 WeakPolarHBondContact OE2-CG2 3.35Å; A8-V361 HydrophobicContact CB-CG1 3.77Å; V361-L363 VanDerWaalsContact C-N 3.28Å; V361-L363 PolarHBondContact O-N 2.89Å
362G87.4Confident89.9Confident18 Ų1818.6 Ų18.619%0.18611%0.11CC..THydrogen-bonded Turntrans87.8-53.2-174.500000112.3D9 G365 L366D9-G362 WeakPolarHBondContact OD1-CA 3.32Å; D9-G362 PolarHBondContact OD1-N 3.39Å; G362-G365 PolarHBondContact O-N 3.39Å; G362-L366 PolarHBondContact O-N 3.27Å
363L88.9Confident89.5Confident44 Ų4418.8 Ų18.823%0.2311%0.111CC..Hα-helixtrans-69.8-36.7176.5-173.564.8000111.5T198 M359 P360 V361 L366 M367T198-L363 HydrophobicContact CG2-CD2 3.47Å; T198-L363 VanDerWaalsContact CG2-CD2 3.47Å; M359-L363 HydrophobicContact SD-CD2 4.45Å; M359-L363 HydrophobicContact SD-CG 4.07Å; P360-L363 HydrophobicContact CG-CB 4Å; P360-L363 HydrophobicContact CG-CD2 4.39Å; P360-L363 PolarHBondContact O-N 3.33Å; V361-L363 VanDerWaalsContact C-N 3.28Å; V361-L363 PolarHBondContact O-N 2.89Å; L363-L366 HydrophobicContact CD1-CD2 4.15Å; L363-L366 PolarHBondContact O-N 3.03Å; L363-M367 PolarHBondContact O-N 2.69Å
364R89.8Confident89.2Confident12 Ų1217.1 Ų17.15%0.04511%0.106CC..Hα-helixtrans-55.8-51.5170.2-179.5176.367.8162.5-4.2111R4 D9 V355 M356 M359 P360 L366 M367 M368R4-R364 PolarHBondContact O-NH1 2.97Å; R4-R364 VanDerWaalsContact O-NH1 3.15Å; R4-R364 PolarHBondContact O-NH2 3.48Å; D9-R364 IonicContact OD1-NE 3.56Å; D9-R364 IonicContact OD2-CZ 2.64Å; D9-R364 VanDerWaalsContact OD2-CZ 3.22Å; D9-R364 IonicContact OD2-NE 3.88Å; D9-R364 PolarHBondContact OD2-NE 3.31Å; D9-R364 IonicContact OD2-NH2 3.63Å; D9-R364 PolarHBondContact OD2-NH2 3.4Å; V355-R364 HydrophobicContact CG1-CG 4.42Å; M356-R364 HydrophobicContact SD-CG 3.92Å; M359-R364 HydrophobicContact CB-CB 3.93Å; P360-R364 WeakPolarHBondContact O-CB 3.39Å; P360-R364 PolarHBondContact O-N 2.92Å; R364-L366 PolarHBondContact O-N 2.94Å; R364-M367 PolarHBondContact O-N 2.92Å; R364-M368 WeakPolarHBondContact O-CG 3.41Å; R364-M368 PolarHBondContact O-N 3.26Å
365G88.6Confident88.8Confident0 Ų017.2 Ų17.20%011%0.106CC..Hα-helixtrans-58.8-41.8174.400000113.5D9 V13 G362 M368 A369D9-G365 PolarHBondContact OD1-N 2.91Å; V13-G365 WeakPolarHBondContact CG2-O 3.39Å; G362-G365 PolarHBondContact O-N 3.39Å; G365-M368 PolarHBondContact O-N 3.28Å; G365-A369 WeakPolarHBondContact O-CB 3.37Å; G365-A369 PolarHBondContact O-N 2.85Å
366L88.6Confident88.4Confident57 Ų5717.5 Ų17.530%0.29811%0.107SC..Hα-helixtrans-60.6-47.6175.3-176.662.5000111.6V12 G362 L363 R364 M368 A369 V370V12-L366 HydrophobicContact CG1-CB 3.81Å; V12-L366 HydrophobicContact CG1-CD1 4.12Å; G362-L366 PolarHBondContact O-N 3.27Å; L363-L366 HydrophobicContact CD1-CD2 4.15Å; L363-L366 PolarHBondContact O-N 3.03Å; R364-L366 PolarHBondContact O-N 2.94Å; L366-M368 VanDerWaalsContact C-N 3.29Å; L366-M368 PolarHBondContact O-N 3.02Å; L366-A369 WeakPolarHBondContact O-CB 3.35Å; L366-A369 PolarHBondContact O-N 3.44Å; L366-V370 HydrophobicContact CD1-CG2 4.46Å; L366-V370 VanDerWaalsContact O-CG2 3.25Å; L366-V370 WeakPolarHBondContact O-CG2 3.26Å; L366-V370 PolarHBondContact O-N 2.97Å
367M88.8Confident88.1Confident1 Ų117 Ų171%0.00511%0.105CC..Hα-helixtrans-61.4-41.1178.9-172.264.4-175.700111.5F65 A196 Y351 V355 M359 L363 R364 V370 M371F65-M367 HydrophobicContact CD1-CE 4.49Å; F65-M367 HydrophobicContact CE1-CE 3.86Å; F65-M367 HydrophobicContact CZ-CE 4.25Å; A196-M367 HydrophobicContact CB-CE 4.36Å; Y351-M367 HydrophobicContact CE1-CE 3.71Å; Y351-M367 VanDerWaalsContact OH-CE 3.26Å; Y351-M367 WeakPolarHBondContact OH-CE 3.44Å; V355-M367 HydrophobicContact CG1-CB 4.27Å; V355-M367 HydrophobicContact CG1-CG 4.12Å; V355-M367 HydrophobicContact CG2-CG 4.19Å; M359-M367 HydrophobicContact CE-CB 3.68Å; M359-M367 HydrophobicContact CE-CG 3.53Å; M359-M367 HydrophobicContact CE-SD 3.99Å; M359-M367 HydrophobicContact SD-CB 3.52Å; M359-M367 VanDerWaalsContact SD-CB 3.52Å; M359-M367 HydrophobicContact SD-CG 4Å; L363-M367 PolarHBondContact O-N 2.69Å; R364-M367 PolarHBondContact O-N 2.92Å; M367-V370 PolarHBondContact O-N 3.37Å; M367-M371 HydrophobicContact CE-CG 4.1Å; M367-M371 HydrophobicContact CE-SD 3.94Å; M367-M371 HydrophobicContact CG-SD 4.3Å; M367-M371 WeakPolarHBondContact O-CG 3.49Å; M367-M371 PolarHBondContact O-N 2.98Å
368M86.8Confident88Confident1 Ų115.9 Ų15.91%0.0059%0.094CC..Hα-helixtrans-61.5-45.9174.7-72.3-178.155.600112.2M5 V13 F149 S153 M356 R364 G365 L366 V370 M371 I372M5-M368 HydrophobicContact CE-CE 3.43Å; M5-M368 VanDerWaalsContact CE-CE 3.43Å; M5-M368 HydrophobicContact CE-SD 4.22Å; M5-M368 HydrophobicContact CG-CE 4.09Å; M5-M368 HydrophobicContact CG-SD 3.83Å; M5-M368 HydrophobicContact SD-CE 3.32Å; M5-M368 WeakPolarHBondContact SD-CE 3.22Å; M5-M368 HydrophobicContact SD-SD 3.25Å; V13-M368 HydrophobicContact CG2-CB 4.39Å; F149-M368 HydrophobicContact CE1-CB 4.1Å; F149-M368 HydrophobicContact CE1-CG 3.89Å; F149-M368 HydrophobicContact CZ-CB 4.33Å; F149-M368 HydrophobicContact CZ-CG 3.78Å; S153-M368 WeakPolarHBondContact OG-CE 3.19Å; M356-M368 HydrophobicContact SD-SD 4.03Å; R364-M368 WeakPolarHBondContact O-CG 3.41Å; R364-M368 PolarHBondContact O-N 3.26Å; G365-M368 PolarHBondContact O-N 3.28Å; L366-M368 VanDerWaalsContact C-N 3.29Å; L366-M368 PolarHBondContact O-N 3.02Å; M368-V370 VanDerWaalsContact C-N 3.27Å; M368-V370 PolarHBondContact O-N 3.49Å; M368-M371 PolarHBondContact O-N 3.48Å; M368-I372 VanDerWaalsContact O-CG1 3.26Å; M368-I372 WeakPolarHBondContact O-CG1 3.37Å; M368-I372 PolarHBondContact O-N 3.09Å
369A88Confident87.7Confident0 Ų015.5 Ų15.50%09%0.092CC..Hα-helixtrans-57.4-45.1177.900000111.1V13 Y16 G365 L366 I372 A373V13-A369 HydrophobicContact CB-CB 4.28Å; V13-A369 HydrophobicContact CG1-CB 4.34Å; V13-A369 HydrophobicContact CG2-CB 4.02Å; Y16-A369 HydrophobicContact CD1-CB 3.62Å; Y16-A369 HydrophobicContact CD2-CB 4.44Å; Y16-A369 HydrophobicContact CE1-CB 4.43Å; Y16-A369 HydrophobicContact CG-CB 3.63Å; G365-A369 WeakPolarHBondContact O-CB 3.37Å; G365-A369 PolarHBondContact O-N 2.85Å; L366-A369 WeakPolarHBondContact O-CB 3.35Å; L366-A369 PolarHBondContact O-N 3.44Å; A369-I372 PolarHBondContact O-N 3.34Å; A369-A373 WeakPolarHBondContact O-CB 3.12Å; A369-A373 PolarHBondContact O-N 2.83Å
370V87.6Confident87.4Confident1 Ų115.3 Ų15.31%0.0069%0.091CC..Hα-helixtrans-64.8-40.3179.5172.40000112.4L191 M192 L366 M367 M368 A373 A374L191-V370 HydrophobicContact CB-CG1 4.34Å; L191-V370 HydrophobicContact CB-CG2 3.58Å; L191-V370 HydrophobicContact CD1-CG2 4.38Å; M192-V370 VanDerWaalsContact CA-CG1 3.46Å; M192-V370 HydrophobicContact CB-CG1 3.68Å; M192-V370 HydrophobicContact CG-CG1 4.29Å; L366-V370 HydrophobicContact CD1-CG2 4.46Å; L366-V370 VanDerWaalsContact O-CG2 3.25Å; L366-V370 WeakPolarHBondContact O-CG2 3.26Å; L366-V370 PolarHBondContact O-N 2.97Å; M367-V370 PolarHBondContact O-N 3.37Å; M368-V370 VanDerWaalsContact C-N 3.27Å; M368-V370 PolarHBondContact O-N 3.49Å; V370-A373 WeakPolarHBondContact O-CB 3.17Å; V370-A373 PolarHBondContact O-N 3.27Å; V370-A374 PolarHBondContact O-N 3.4Å
371M87.1Confident87.1Confident6 Ų612.5 Ų12.53%0.037%0.073CC..Hα-helixtrans-69.4-39.5177.3-71.2-176.962.800112.3F65 F149 Y351 M367 M368 A373 A374 L375F65-M371 HydrophobicContact CB-CE 3.47Å; F65-M371 VanDerWaalsContact CB-CE 3.47Å; F65-M371 HydrophobicContact CD1-CE 4.3Å; F65-M371 HydrophobicContact CD2-CE 4.26Å; F65-M371 HydrophobicContact CD2-CG 4.45Å; F65-M371 HydrophobicContact CG-CE 3.77Å; F65-M371 HydrophobicContact CG-SD 4.43Å; F149-M371 HydrophobicContact CD1-CB 4.42Å; F149-M371 HydrophobicContact CD1-CE 4.49Å; F149-M371 HydrophobicContact CD2-CE 3.29Å; F149-M371 HydrophobicContact CD2-SD 4.02Å; F149-M371 HydrophobicContact CE1-CB 3.95Å; F149-M371 HydrophobicContact CE1-CE 4.4Å; F149-M371 HydrophobicContact CE1-SD 4.25Å; F149-M371 HydrophobicContact CE2-CE 3.19Å; F149-M371 HydrophobicContact CE2-SD 3.25Å; F149-M371 WeakPolarHBondContact CE2-SD 2.86Å; F149-M371 HydrophobicContact CG-CE 3.98Å; F149-M371 HydrophobicContact CZ-CB 4.02Å; F149-M371 HydrophobicContact CZ-CE 3.78Å; F149-M371 HydrophobicContact CZ-CG 4.25Å; F149-M371 HydrophobicContact CZ-SD 3.37Å; F149-M371 WeakPolarHBondContact CZ-SD 3.19Å; Y351-M371 HydrophobicContact CD1-CE 4.26Å; Y351-M371 HydrophobicContact CD1-SD 4.24Å; Y351-M371 HydrophobicContact CE1-CE 4.49Å; Y351-M371 HydrophobicContact CE1-SD 4Å; M367-M371 HydrophobicContact CE-CG 4.1Å; M367-M371 HydrophobicContact CE-SD 3.94Å; M367-M371 HydrophobicContact CG-SD 4.3Å; M367-M371 WeakPolarHBondContact O-CG 3.49Å; M367-M371 PolarHBondContact O-N 2.98Å; M368-M371 PolarHBondContact O-N 3.48Å; M371-A373 VanDerWaalsContact C-N 3.3Å; M371-A374 WeakPolarHBondContact O-CB 3.32Å; M371-A374 PolarHBondContact O-N 3.29Å; M371-L375 PolarHBondContact O-N 3.23Å; M371-L375 VanDerWaalsContact O-N 3.08Å
372I86.3Confident87.1Confident13 Ų1310 Ų107%0.0676%0.057CC..Hα-helixtrans-67.2-35.3173.9-56.8168.6000110.4F17 F149 L165 M368 A369 A374 L375 M376F17-I372 HydrophobicContact CZ-CB 4.04Å; F17-I372 HydrophobicContact CZ-CG2 3.68Å; F149-I372 HydrophobicContact CD1-CG1 4.46Å; F149-I372 HydrophobicContact CE1-CG1 4.5Å; L165-I372 HydrophobicContact CD2-CG2 3.77Å; M368-I372 VanDerWaalsContact O-CG1 3.26Å; M368-I372 WeakPolarHBondContact O-CG1 3.37Å; M368-I372 PolarHBondContact O-N 3.09Å; A369-I372 PolarHBondContact O-N 3.34Å; I372-A374 VanDerWaalsContact C-N 3.33Å; I372-A374 PolarHBondContact O-N 3.49Å; I372-L375 WeakPolarHBondContact O-CB 3.45Å; I372-L375 PolarHBondContact O-N 3.44Å; I372-M376 HydrophobicContact CG2-CE 3.71Å; I372-M376 WeakPolarHBondContact O-CG 3.15Å; I372-M376 PolarHBondContact O-N 3.11Å; I372-M376 VanDerWaalsContact O-N 3.09Å
373A84.4Confident87.1Confident5 Ų59.6 Ų9.64%0.0415%0.051CC..Hα-helixtrans-62.1-42.3171.600000112.5Y16 Q188 A369 V370 M371 L375 M376 S377Y16-A373 HydrophobicContact CE1-CB 3.41Å; Y16-A373 VanDerWaalsContact CE1-CB 3.41Å; Y16-A373 WeakPolarHBondContact OH-CB 3.38Å; Q188-A373 HydrophobicContact CG-CB 4.1Å; Q188-A373 PolarHBondContact OE1-O 3.09Å; Q188-A373 VanDerWaalsContact OE1-O 3.05Å; A369-A373 WeakPolarHBondContact O-CB 3.12Å; A369-A373 PolarHBondContact O-N 2.83Å; V370-A373 WeakPolarHBondContact O-CB 3.17Å; V370-A373 PolarHBondContact O-N 3.27Å; M371-A373 VanDerWaalsContact C-N 3.3Å; A373-L375 VanDerWaalsContact C-N 3.32Å; A373-L375 PolarHBondContact O-N 2.94Å; A373-M376 WeakPolarHBondContact O-CB 3.33Å; A373-M376 PolarHBondContact O-N 3.2Å; A373-S377 PolarHBondContact O-N 3.4Å
374A86Confident86.8Confident1 Ų18.4 Ų8.41%0.0085%0.045CC..Hα-helixtrans-59.8-44.817800000112.5V370 M371 I372 M376 S377 D378V370-A374 PolarHBondContact O-N 3.4Å; M371-A374 WeakPolarHBondContact O-CB 3.32Å; M371-A374 PolarHBondContact O-N 3.29Å; I372-A374 VanDerWaalsContact C-N 3.33Å; I372-A374 PolarHBondContact O-N 3.49Å; A374-M376 VanDerWaalsContact C-N 3.31Å; A374-M376 PolarHBondContact O-N 3.47Å; A374-S377 PolarHBondContact O-N 3.44Å; A374-D378 PolarHBondContact O-N 3.04Å
375L86.3Confident86.7Confident2 Ų28 Ų81%0.014%0.044CC..Hα-helixtrans-53.2-47.7169.5-76.4158.3000112.2S62 D142 G146 L165 M371 I372 A373 S377 D378 L379S62-L375 VanDerWaalsContact OG-CD2 3.22Å; S62-L375 WeakPolarHBondContact OG-CD2 3.08Å; D142-L375 WeakPolarHBondContact O-CD2 3.32Å; G146-L375 VanDerWaalsContact CA-CD2 3.43Å; L165-L375 HydrophobicContact CD1-CD1 4.48Å; L165-L375 HydrophobicContact CD2-CB 4.17Å; L165-L375 HydrophobicContact CD2-CD1 4.09Å; M371-L375 PolarHBondContact O-N 3.23Å; M371-L375 VanDerWaalsContact O-N 3.08Å; I372-L375 WeakPolarHBondContact O-CB 3.45Å; I372-L375 PolarHBondContact O-N 3.44Å; A373-L375 VanDerWaalsContact C-N 3.32Å; A373-L375 PolarHBondContact O-N 2.94Å; L375-S377 PolarHBondContact O-N 3.09Å; L375-D378 PolarHBondContact O-N 2.91Å; L375-L379 WeakPolarHBondContact O-CB 3.49Å; L375-L379 WeakPolarHBondContact O-CG 3.22Å; L375-L379 PolarHBondContact O-N 3.08Å
376M84.5Confident86.7Confident5 Ų58 Ų83%0.0254%0.044CC..Hα-helixtrans-64.3-42.7179.6-64.8-172-162.300112.4F17 M168 L172 I372 A373 A374 D378 L379 D380F17-M376 HydrophobicContact CD1-CE 4.33Å; F17-M376 HydrophobicContact CE1-CE 3.28Å; F17-M376 HydrophobicContact CE1-SD 3.78Å; F17-M376 HydrophobicContact CZ-CE 3.59Å; M168-M376 HydrophobicContact CB-CE 3.2Å; M168-M376 HydrophobicContact CB-SD 3.81Å; M168-M376 HydrophobicContact CE-CE 3.74Å; M168-M376 HydrophobicContact CG-CE 3.94Å; M168-M376 HydrophobicContact SD-CE 3.53Å; M168-M376 VanDerWaalsContact SD-CE 3.53Å; L172-M376 HydrophobicContact CD1-SD 3.61Å; I372-M376 HydrophobicContact CG2-CE 3.71Å; I372-M376 WeakPolarHBondContact O-CG 3.15Å; I372-M376 PolarHBondContact O-N 3.11Å; I372-M376 VanDerWaalsContact O-N 3.09Å; A373-M376 WeakPolarHBondContact O-CB 3.33Å; A373-M376 PolarHBondContact O-N 3.2Å; A374-M376 VanDerWaalsContact C-N 3.31Å; A374-M376 PolarHBondContact O-N 3.47Å; M376-D378 PolarHBondContact O-N 3.33Å; M376-L379 PolarHBondContact O-N 2.76Å; M376-D380 VanDerWaalsContact O-CB 3.28Å; M376-D380 WeakPolarHBondContact O-CB 3.28Å; M376-D380 PolarHBondContact O-N 3.31Å
377S84.2Confident86.6Confident4 Ų46 Ų63%0.0283%0.034CC..Hα-helixtrans-61.4-42.3177.8172.80000112.3V57 D185 A373 A374 L375 D380 S381V57-S377 WeakPolarHBondContact CG1-OG 3.49Å; D185-S377 WeakPolarHBondContact OD1-CB 2.73Å; D185-S377 PolarHBondContact OD1-OG 2.9Å; A373-S377 PolarHBondContact O-N 3.4Å; A374-S377 PolarHBondContact O-N 3.44Å; L375-S377 PolarHBondContact O-N 3.09Å; S377-D380 PolarHBondContact O-N 2.97Å; S377-S381 WeakPolarHBondContact O-CB 3.01Å; S377-S381 PolarHBondContact O-N 2.68Å; S377-S381 PolarHBondContact O-OG 3.32Å
378D87.8Confident86.4Confident13 Ų136 Ų67%0.074%0.035CC..Hα-helixtrans-67.9-46.5178.4-69.1-31.7000111.7S58 G61 A374 L375 M376 D380 S381 I382S58-D378 WeakPolarHBondContact CA-OD1 3.32Å; G61-D378 WeakPolarHBondContact CA-OD2 3.31Å; A374-D378 PolarHBondContact O-N 3.04Å; L375-D378 PolarHBondContact O-N 2.91Å; M376-D378 PolarHBondContact O-N 3.33Å; D378-D380 VanDerWaalsContact C-N 3.34Å; D378-D380 PolarHBondContact O-N 3.3Å; D378-S381 WeakPolarHBondContact O-CB 3.41Å; D378-S381 PolarHBondContact O-N 2.82Å; D378-I382 VanDerWaalsContact O-CG1 3.29Å; D378-I382 WeakPolarHBondContact O-CG1 3.48Å; D378-I382 PolarHBondContact O-N 3.04Å
379L88.3Confident86.5Confident0 Ų06 Ų60%04%0.035CC..Hα-helixtrans-58.9-45.7175.1-67.1173.3000111.3L139 D142 L143 T169 L375 M376 S381 I382 F383L139-L379 HydrophobicContact CD1-CD2 3.22Å; D142-L379 HydrophobicContact CB-CD2 4.46Å; D142-L379 WeakPolarHBondContact OD2-CD2 3.33Å; D142-L379 WeakPolarHBondContact OD2-CG 3.35Å; L143-L379 HydrophobicContact CD2-CD1 4.03Å; L143-L379 HydrophobicContact CD2-CD2 3.94Å; L143-L379 HydrophobicContact CG-CD2 4.21Å; T169-L379 HydrophobicContact CG2-CB 3.61Å; T169-L379 HydrophobicContact CG2-CD1 4.33Å; T169-L379 WeakPolarHBondContact OG1-CD1 3.42Å; L375-L379 WeakPolarHBondContact O-CB 3.49Å; L375-L379 WeakPolarHBondContact O-CG 3.22Å; L375-L379 PolarHBondContact O-N 3.08Å; M376-L379 PolarHBondContact O-N 2.76Å; L379-S381 VanDerWaalsContact C-N 3.29Å; L379-S381 PolarHBondContact O-N 3.47Å; L379-I382 PolarHBondContact O-N 3.34Å; L379-F383 HydrophobicContact CB-CE2 4.26Å; L379-F383 HydrophobicContact CB-CZ 4.24Å; L379-F383 HydrophobicContact CD2-CZ 4.45Å; L379-F383 WeakPolarHBondContact O-CB 3.3Å; L379-F383 VanDerWaalsContact O-CD1 3.32Å; L379-F383 WeakPolarHBondContact O-CD1 3.13Å; L379-F383 WeakPolarHBondContact O-CD2 3.08Å; L379-F383 WeakPolarHBondContact O-CG 3.41Å; L379-F383 PolarHBondContact O-N 3.46Å
380D84.3Confident86.6Confident9 Ų98.3 Ų8.35%0.0485%0.045CC..Hα-helixtrans-57.7-43176-79.9-22.3000111.6T169 T173 V181 M376 S377 D378 F383 N384T169-D380 WeakPolarHBondContact CG2-OD1 3.43Å; T173-D380 WeakPolarHBondContact CB-OD1 3.48Å; T173-D380 PolarHBondContact OG1-OD1 3.26Å; V181-D380 HydrophobicContact CG2-CB 4.28Å; M376-D380 VanDerWaalsContact O-CB 3.28Å; M376-D380 WeakPolarHBondContact O-CB 3.28Å; M376-D380 PolarHBondContact O-N 3.31Å; S377-D380 PolarHBondContact O-N 2.97Å; D378-D380 VanDerWaalsContact C-N 3.34Å; D378-D380 PolarHBondContact O-N 3.3Å; D380-F383 PolarHBondContact O-N 3.35Å; D380-N384 WeakPolarHBondContact O-CB 3.43Å; D380-N384 PolarHBondContact O-N 3.49Å
381S85.9Confident86.7Confident7 Ų78.3 Ų8.35%0.0494%0.044CC..Hα-helixtrans-62.2-48.4177.8-56.90000111.7R285 S377 D378 L379 N384 S385R285-S381 PolarHBondContact NH2-OG 3.4Å; S377-S381 WeakPolarHBondContact O-CB 3.01Å; S377-S381 PolarHBondContact O-N 2.68Å; S377-S381 PolarHBondContact O-OG 3.32Å; D378-S381 WeakPolarHBondContact O-CB 3.41Å; D378-S381 PolarHBondContact O-N 2.82Å; L379-S381 VanDerWaalsContact C-N 3.29Å; L379-S381 PolarHBondContact O-N 3.47Å; S381-N384 PolarHBondContact O-N 3.34Å; S381-S385 WeakPolarHBondContact O-CB 3.41Å; S381-S385 PolarHBondContact O-N 3.46Å; S381-S385 PolarHBondContact O-OG 3.07Å
382I89.1Confident86.5Confident11 Ų119.4 Ų9.46%0.0565%0.05CC..Hα-helixtrans-63.5-45.1179.1-64.3161.8000109.7Y134 K138 L139 D378 L379 N384 S385 A386 M418Y134-I382 HydrophobicContact CD2-CG2 4.45Å; Y134-I382 HydrophobicContact CG-CG2 4.46Å; K138-I382 HydrophobicContact CB-CD1 3.78Å; K138-I382 HydrophobicContact CB-CG1 4.37Å; K138-I382 HydrophobicContact CD-CG1 4.43Å; L139-I382 HydrophobicContact CB-CG2 4.37Å; D378-I382 VanDerWaalsContact O-CG1 3.29Å; D378-I382 WeakPolarHBondContact O-CG1 3.48Å; D378-I382 PolarHBondContact O-N 3.04Å; L379-I382 PolarHBondContact O-N 3.34Å; I382-N384 PolarHBondContact O-N 3.24Å; I382-S385 PolarHBondContact O-N 2.9Å; I382-A386 WeakPolarHBondContact O-CB 3.3Å; I382-A386 PolarHBondContact O-N 3.45Å; I382-M418 HydrophobicContact CG2-CE 4.22Å
383F87.5Confident86.5Confident10 Ų108.9 Ų8.94%0.0445%0.047CC..Hα-helixtrans-60.6-46179.2-66.6-9.9000111.7L139 T169 L379 D380 S387 V415 M418 V419L139-F383 HydrophobicContact CD1-CE1 3.59Å; L139-F383 HydrophobicContact CD1-CZ 4.17Å; L139-F383 HydrophobicContact CD2-CE1 3.91Å; L139-F383 HydrophobicContact CG-CE1 4.45Å; T169-F383 HydrophobicContact CG2-CD2 4.12Å; T169-F383 HydrophobicContact CG2-CE2 3.71Å; L379-F383 HydrophobicContact CB-CE2 4.26Å; L379-F383 HydrophobicContact CB-CZ 4.24Å; L379-F383 HydrophobicContact CD2-CZ 4.45Å; L379-F383 WeakPolarHBondContact O-CB 3.3Å; L379-F383 VanDerWaalsContact O-CD1 3.32Å; L379-F383 WeakPolarHBondContact O-CD1 3.13Å; L379-F383 WeakPolarHBondContact O-CD2 3.08Å; L379-F383 WeakPolarHBondContact O-CG 3.41Å; L379-F383 PolarHBondContact O-N 3.46Å; D380-F383 PolarHBondContact O-N 3.35Å; F383-S387 WeakPolarHBondContact O-CB 3.47Å; F383-S387 PolarHBondContact O-N 2.83Å; F383-V415 HydrophobicContact CB-CG1 3.89Å; F383-V415 HydrophobicContact CB-CG2 4.06Å; F383-V415 HydrophobicContact CD1-CG1 3.71Å; F383-V415 HydrophobicContact CD2-CG1 3.84Å; F383-V415 HydrophobicContact CE1-CG1 4.14Å; F383-V415 HydrophobicContact CE2-CG1 4.27Å; F383-V415 HydrophobicContact CG-CG1 3.53Å; F383-V415 HydrophobicContact CZ-CG1 4.41Å; F383-M418 HydrophobicContact CD1-CE 3.43Å; F383-M418 VanDerWaalsContact CD1-CE 3.43Å; F383-M418 HydrophobicContact CE1-CE 3.82Å; F383-V419 HydrophobicContact CE1-CG2 3.53Å; F383-V419 HydrophobicContact CE2-CG2 4.42Å; F383-V419 HydrophobicContact CZ-CG2 3.45Å; F383-V419 VanDerWaalsContact CZ-CG2 3.45Å
384N82.8Confident86.7Confident19 Ų199.8 Ų9.810%0.1025%0.052CC..Hα-helixtrans-64.5-48.6178.9-176.455.6000111.8D380 S381 I382 T388D380-N384 WeakPolarHBondContact O-CB 3.43Å; D380-N384 PolarHBondContact O-N 3.49Å; S381-N384 PolarHBondContact O-N 3.34Å; I382-N384 PolarHBondContact O-N 3.24Å; N384-T388 WeakPolarHBondContact O-CB 3.4Å; N384-T388 PolarHBondContact O-N 3.28Å; N384-T388 PolarHBondContact O-OG1 3.27Å
385S87.4Confident86.9Confident4 Ų412 Ų123%0.0286%0.06CC..Hα-helixtrans-67.8-41.5-179.7-67.60000112.6V281 Q284 S381 I382 T388 I389V281-S385 WeakPolarHBondContact CA-OG 2.83Å; V281-S385 WeakPolarHBondContact CG2-OG 3.35Å; Q284-S385 PolarHBondContact OE1-OG 3.22Å; S381-S385 WeakPolarHBondContact O-CB 3.41Å; S381-S385 PolarHBondContact O-N 3.46Å; S381-S385 PolarHBondContact O-OG 3.07Å; I382-S385 PolarHBondContact O-N 2.9Å; S385-T388 WeakPolarHBondContact O-CB 3.26Å; S385-T388 PolarHBondContact O-N 3.27Å; S385-I389 VanDerWaalsContact O-CG1 3.29Å; S385-I389 WeakPolarHBondContact O-CG1 3.37Å; S385-I389 PolarHBondContact O-N 3.24Å
386A89.1Confident86.8Confident0 Ų015.9 Ų15.90%08%0.078CC..Hα-helixtrans-63.8-44.7176.800000111.8Y134 I382 T388 I389 F390 F414 M418Y134-A386 HydrophobicContact CD2-CB 3.97Å; I382-A386 WeakPolarHBondContact O-CB 3.3Å; I382-A386 PolarHBondContact O-N 3.45Å; A386-T388 VanDerWaalsContact C-N 3.33Å; A386-T388 PolarHBondContact O-N 2.97Å; A386-I389 PolarHBondContact O-N 2.53Å; A386-F390 WeakPolarHBondContact O-CB 3.4Å; A386-F390 PolarHBondContact O-N 2.01Å; A386-F414 HydrophobicContact CB-CE1 4.09Å; A386-M418 HydrophobicContact CB-CE 4Å; A386-M418 HydrophobicContact CB-SD 3.5Å; A386-M418 WeakPolarHBondContact CB-SD 3.33Å
387S86.5Confident86.6Confident13 Ų1317 Ų179%0.0919%0.086CC..Hα-helixtrans-58.6-44.8173.5178.10000111.2F383 F390 T391 G411F383-S387 WeakPolarHBondContact O-CB 3.47Å; F383-S387 PolarHBondContact O-N 2.83Å; S387-F390 PolarHBondContact O-N 3.14Å; S387-T391 VanDerWaalsContact O-CB 3.25Å; S387-T391 WeakPolarHBondContact O-CB 2.85Å; S387-T391 WeakPolarHBondContact O-CG2 3.3Å; S387-T391 PolarHBondContact O-N 3.35Å; S387-T391 PolarHBondContact O-OG1 3.46Å; S387-G411 WeakPolarHBondContact OG-CA 3.41Å; S387-G411 PolarHBondContact OG-O 3.45Å
388T84.1Confident86.7Confident3 Ų323.8 Ų23.82%0.01812%0.121CC..Hα-helixtrans-60.1-50.5177.7-53.60000111.5F40 T108 N384 S385 A386 T391 L392F40-T388 HydrophobicContact CD1-CG2 4.01Å; F40-T388 WeakPolarHBondContact CD1-OG1 3.34Å; F40-T388 HydrophobicContact CE1-CG2 4.16Å; F40-T388 WeakPolarHBondContact CE1-OG1 3.45Å; F40-T388 HydrophobicContact CG-CG2 4.36Å; T108-T388 HydrophobicContact CG2-CG2 3.91Å; N384-T388 WeakPolarHBondContact O-CB 3.4Å; N384-T388 PolarHBondContact O-N 3.28Å; N384-T388 PolarHBondContact O-OG1 3.27Å; S385-T388 WeakPolarHBondContact O-CB 3.26Å; S385-T388 PolarHBondContact O-N 3.27Å; A386-T388 VanDerWaalsContact C-N 3.33Å; A386-T388 PolarHBondContact O-N 2.97Å; T388-T391 PolarHBondContact O-N 3.29Å; T388-T391 PolarHBondContact O-OG1 2.84Å; T388-L392 HydrophobicContact CG2-CD1 3.72Å; T388-L392 HydrophobicContact CG2-CG 4.48Å; T388-L392 WeakPolarHBondContact O-CB 3.33Å; T388-L392 PolarHBondContact O-N 3.12Å
389I89.2Confident86.6Confident1 Ų128.8 Ų28.81%0.00514%0.139CC..Iπ-helixtrans-61.1-49.5179.4-67.6165.4000110.1P110 A127 V131 Y134 Q280 S385 A386 T391 D393 I394P110-I389 HydrophobicContact CG-CG2 4.47Å; A127-I389 HydrophobicContact CB-CG2 3.63Å; V131-I389 HydrophobicContact CG2-CG2 4.14Å; Y134-I389 HydrophobicContact CE2-CD1 3.83Å; Q280-I389 HydrophobicContact CB-CD1 3.81Å; Q280-I389 HydrophobicContact CB-CG1 4.33Å; Q280-I389 HydrophobicContact CG-CD1 4.06Å; Q280-I389 HydrophobicContact CG-CG1 4.07Å; S385-I389 VanDerWaalsContact O-CG1 3.29Å; S385-I389 WeakPolarHBondContact O-CG1 3.37Å; S385-I389 PolarHBondContact O-N 3.24Å; A386-I389 PolarHBondContact O-N 2.53Å; I389-T391 PolarHBondContact O-N 2.84Å; I389-D393 WeakPolarHBondContact O-CA 3.22Å; I389-D393 WeakPolarHBondContact O-CB 3.18Å; I389-D393 PolarHBondContact O-N 3.17Å; I389-I394 PolarHBondContact O-N 2.55Å
390F91.1Very high86.1Confident48 Ų4837.4 Ų37.421%0.21118%0.177CC..Iπ-helixtrans-62.8-44.5-178-177.2-99.7000111.6A386 S387 I394 Y395 V410 F414A386-F390 WeakPolarHBondContact O-CB 3.4Å; A386-F390 PolarHBondContact O-N 2.01Å; S387-F390 PolarHBondContact O-N 3.14Å; F390-I394 HydrophobicContact CD2-CB 4.28Å; F390-I394 HydrophobicContact CD2-CD1 4Å; F390-I394 HydrophobicContact CD2-CG2 4.45Å; F390-I394 HydrophobicContact CE2-CG2 4.27Å; F390-I394 CarbonylContact O-C 3.59Å; F390-I394 WeakPolarHBondContact O-CB 3.48Å; F390-I394 PolarHBondContact O-N 3.44Å; F390-Y395 WeakPolarHBondContact O-CB 3.18Å; F390-Y395 PolarHBondContact O-N 3.38Å; F390-V410 HydrophobicContact CD1-CG1 4.2Å; F390-V410 HydrophobicContact CE1-CG1 3.72Å; F390-F414 HydrophobicContact CB-CD1 3.54Å; F390-F414 HydrophobicContact CB-CD2 4.16Å; F390-F414 HydrophobicContact CB-CE1 3.6Å; F390-F414 HydrophobicContact CB-CE2 4.22Å; F390-F414 HydrophobicContact CB-CG 3.83Å; F390-F414 HydrophobicContact CB-CZ 3.95Å; F390-F414 HydrophobicContact CD1-CB 3.62Å; F390-F414 HydrophobicContact CD1-CD1 4.11Å; F390-F414 AromaticContact CD1-CD2 3.7Å; F390-F414 HydrophobicContact CD1-CD2 3.7Å; F390-F414 HydrophobicContact CD1-CE2 4.43Å; F390-F414 AromaticContact CD1-CG 3.51Å; F390-F414 HydrophobicContact CD1-CG 3.51Å; F390-F414 HydrophobicContact CD2-CD1 4.41Å; F390-F414 AromaticContact CD2-CD2 3.47Å; F390-F414 HydrophobicContact CD2-CD2 3.47Å; F390-F414 VanDerWaalsContact CD2-CD2 3.47Å; F390-F414 HydrophobicContact CD2-CE1 4.35Å; F390-F414 AromaticContact CD2-CE2 3.4Å; F390-F414 HydrophobicContact CD2-CE2 3.4Å; F390-F414 VanDerWaalsContact CD2-CE2 3.4Å; F390-F414 HydrophobicContact CD2-CG 4Å; F390-F414 AromaticContact CD2-CZ 3.87Å; F390-F414 HydrophobicContact CD2-CZ 3.87Å; F390-F414 HydrophobicContact CE1-CB 3.95Å; F390-F414 AromaticContact CE1-CD2 3.89Å; F390-F414 HydrophobicContact CE1-CD2 3.89Å; F390-F414 HydrophobicContact CE1-CG 4.04Å; F390-F414 AromaticContact CE2-CD2 3.68Å; F390-F414 HydrophobicContact CE2-CD2 3.68Å; F390-F414 AromaticContact CE2-CE2 3.8Å; F390-F414 HydrophobicContact CE2-CE2 3.8Å; F390-F414 HydrophobicContact CE2-CG 4.48Å; F390-F414 HydrophobicContact CG-CB 4.14Å; F390-F414 AromaticContact CG-CD1 3.77Å; F390-F414 HydrophobicContact CG-CD1 3.77Å; F390-F414 AromaticContact CG-CD2 3.48Å; F390-F414 HydrophobicContact CG-CD2 3.48Å; F390-F414 VanDerWaalsContact CG-CD2 3.48Å; F390-F414 HydrophobicContact CG-CE1 4.02Å; F390-F414 AromaticContact CG-CE2 3.76Å; F390-F414 HydrophobicContact CG-CE2 3.76Å; F390-F414 AromaticContact CG-CG 3.49Å; F390-F414 HydrophobicContact CG-CG 3.49Å; F390-F414 VanDerWaalsContact CG-CG 3.49Å; F390-F414 HydrophobicContact CG-CZ 4.02Å; F390-F414 AromaticContact CZ-CD2 3.88Å; F390-F414 HydrophobicContact CZ-CD2 3.88Å; F390-F414 HydrophobicContact CZ-CE2 4.46Å; F390-F414 HydrophobicContact CZ-CG 4.49Å
391T88.1Confident86Confident0 Ų043 Ų430%021%0.211CC..Iπ-helixtrans-72.5-51.5-175.454.70000113.1S387 T388 I389 Y395 Q396 L407S387-T391 VanDerWaalsContact O-CB 3.25Å; S387-T391 WeakPolarHBondContact O-CB 2.85Å; S387-T391 WeakPolarHBondContact O-CG2 3.3Å; S387-T391 PolarHBondContact O-N 3.35Å; S387-T391 PolarHBondContact O-OG1 3.46Å; T388-T391 PolarHBondContact O-N 3.29Å; T388-T391 PolarHBondContact O-OG1 2.84Å; I389-T391 PolarHBondContact O-N 2.84Å; T391-Y395 WeakPolarHBondContact O-CB 3.46Å; T391-Q396 WeakPolarHBondContact O-CB 3.16Å; T391-Q396 PolarHBondContact O-N 3.01Å; T391-L407 VanDerWaalsContact CB-CD1 3.48Å; T391-L407 HydrophobicContact CG2-CD1 4.2Å; T391-L407 HydrophobicContact CG2-CG 4.24Å; T391-L407 VanDerWaalsContact CG2-O 3.3Å; T391-L407 WeakPolarHBondContact CG2-O 3.41Å
392L83.3Confident85.7Confident29 Ų2944 Ų4415%0.15222%0.22CC..Iπ-helixtrans-81.5-32.2-175.7-63.5178000113T108 K123 T388 L407T108-L392 HydrophobicContact CG2-CD1 4.12Å; K123-L392 PolarHBondContact NZ-O 2.57Å; T388-L392 HydrophobicContact CG2-CD1 3.72Å; T388-L392 HydrophobicContact CG2-CG 4.48Å; T388-L392 WeakPolarHBondContact O-CB 3.33Å; T388-L392 PolarHBondContact O-N 3.12Å; L392-L407 HydrophobicContact CD2-CD2 3.65Å
393D86.8Confident85.5Confident2 Ų246.5 Ų46.51%0.01124%0.239CC..Iπ-helixtrans-99.8-31.8-172.2-57.5-59.2000114T108 P110 K123 A127 I389 S397T108-D393 VanDerWaalsContact CB-OD2 3.31Å; T108-D393 WeakPolarHBondContact CB-OD2 3.13Å; T108-D393 PolarHBondContact OG1-OD1 2.82Å; T108-D393 PolarHBondContact OG1-OD2 3.49Å; P110-D393 HydrophobicContact CB-CB 4.03Å; P110-D393 HydrophobicContact CG-CB 4.22Å; P110-D393 WeakPolarHBondContact CG-OD2 3.4Å; K123-D393 WeakPolarHBondContact CE-OD1 3.37Å; K123-D393 HydrophobicContact CG-CB 4.38Å; K123-D393 IonicContact NZ-OD1 2.8Å; A127-D393 HydrophobicContact CB-CB 3.91Å; I389-D393 WeakPolarHBondContact O-CA 3.22Å; I389-D393 WeakPolarHBondContact O-CB 3.18Å; I389-D393 PolarHBondContact O-N 3.17Å; D393-S397 WeakPolarHBondContact O-CB 3.45Å; D393-S397 PolarHBondContact O-OG 3.45Å
394I88.8Confident85.1Confident25 Ų2549.8 Ų49.813%0.12825%0.254CS..Iπ-helixtrans-104.2-57179.8-57.4174.6000110.7A127 I389 F390 S397 L398A127-I394 HydrophobicContact CB-CD1 4.05Å; A127-I394 HydrophobicContact CB-CG1 3.82Å; I389-I394 PolarHBondContact O-N 2.55Å; F390-I394 HydrophobicContact CD2-CB 4.28Å; F390-I394 HydrophobicContact CD2-CD1 4Å; F390-I394 HydrophobicContact CD2-CG2 4.45Å; F390-I394 HydrophobicContact CE2-CG2 4.27Å; F390-I394 CarbonylContact O-C 3.59Å; F390-I394 WeakPolarHBondContact O-CB 3.48Å; F390-I394 PolarHBondContact O-N 3.44Å; I394-S397 WeakPolarHBondContact O-CB 3.23Å; I394-S397 PolarHBondContact O-N 2.87Å; I394-L398 HydrophobicContact CG2-CD1 4.46Å; I394-L398 PolarHBondContact O-N 3.49Å
395Y89.4Confident84.8Confident48 Ų4853 Ų5319%0.18827%0.265CS..Iπ-helixtrans-67.9-48.5-171.7-171.5-100.5000112.5F390 T391 S397 L398 R399 A402 E406 L407 V410F390-Y395 WeakPolarHBondContact O-CB 3.18Å; F390-Y395 PolarHBondContact O-N 3.38Å; T391-Y395 WeakPolarHBondContact O-CB 3.46Å; Y395-S397 PolarHBondContact O-N 3.45Å; Y395-L398 PolarHBondContact O-N 3.43Å; Y395-R399 HydrophobicContact CE1-CB 4.3Å; Y395-R399 PolarHBondContact O-N 2.95Å; Y395-A402 HydrophobicContact CE1-CB 4.22Å; Y395-E406 HydrophobicContact CE1-CG 4.38Å; Y395-E406 WeakPolarHBondContact CE1-OE1 3.5Å; Y395-E406 PolarHBondContact OH-OE1 2.86Å; Y395-L407 HydrophobicContact CD1-CD1 4.29Å; Y395-V410 HydrophobicContact CD1-CG1 4.27Å; Y395-V410 HydrophobicContact CD2-CG1 3.78Å; Y395-V410 HydrophobicContact CE1-CG1 4.49Å; Y395-V410 HydrophobicContact CE1-CG2 4.03Å; Y395-V410 HydrophobicContact CE2-CG1 4.03Å; Y395-V410 HydrophobicContact CE2-CG2 4.1Å; Y395-V410 HydrophobicContact CG-CG1 3.91Å
396Q83.8Confident84.7Confident83 Ų8354.4 Ų54.439%0.38827%0.271SS..Hα-helixtrans-64.9-25177.2-165.8173.517.100112.8T391 L398 R399T391-Q396 WeakPolarHBondContact O-CB 3.16Å; T391-Q396 PolarHBondContact O-N 3.01Å; Q396-L398 VanDerWaalsContact C-N 3.35Å; Q396-R399 CarbonylContact O-C 3.44Å; Q396-R399 VanDerWaalsContact O-C 3.31Å
397S81.7Confident84.4Confident28 Ų2855.1 Ų55.120%0.19628%0.275CS..Hα-helixtrans-69.3-33.5172.8-64.70000112.3N120 K123 D393 I394 Y395N120-S397 WeakPolarHBondContact ND2-CB 3.46Å; N120-S397 PolarHBondContact ND2-OG 3.37Å; K123-S397 PolarHBondContact NZ-OG 3.17Å; D393-S397 WeakPolarHBondContact O-CB 3.45Å; D393-S397 PolarHBondContact O-OG 3.45Å; I394-S397 WeakPolarHBondContact O-CB 3.23Å; I394-S397 PolarHBondContact O-N 2.87Å; Y395-S397 PolarHBondContact O-N 3.45Å
398L84.9Confident84Confident146 Ų14656.9 Ų56.976%0.76428%0.283SS*.Hα-helixtrans-82.4-40.2175.1-65.5170.8000111.8I394 Y395 Q396I394-L398 HydrophobicContact CG2-CD1 4.46Å; I394-L398 PolarHBondContact O-N 3.49Å; Y395-L398 PolarHBondContact O-N 3.43Å; Q396-L398 VanDerWaalsContact C-N 3.35Å
399R86.2Confident84Confident119 Ų11960.3 Ų60.345%0.44930%0.3SS..  trans-119.394.4-179.6-169.4176.4-178.1160.94.5111Y395 Q396 T401 E406Y395-R399 HydrophobicContact CE1-CB 4.3Å; Y395-R399 PolarHBondContact O-N 2.95Å; Q396-R399 CarbonylContact O-C 3.44Å; Q396-R399 VanDerWaalsContact O-C 3.31Å; R399-T401 VanDerWaalsContact C-N 3.31Å; R399-T401 PolarHBondContact O-N 2.98Å; R399-E406 WeakPolarHBondContact CD-OE1 3.23Å; R399-E406 IonicContact CZ-OE1 2.94Å; R399-E406 IonicContact CZ-OE2 2.82Å; R399-E406 IonicContact NE-OE1 3.18Å; R399-E406 PolarHBondContact NE-OE1 3.5Å; R399-E406 IonicContact NE-OE2 3.55Å; R399-E406 IonicContact NH1-OE1 3.88Å; R399-E406 PolarHBondContact NH1-OE1 2.63Å; R399-E406 IonicContact NH1-OE2 3.59Å; R399-E406 IonicContact NH2-OE2 2.8Å
400K78.5Confident84Confident181 Ų18161.6 Ų61.679%0.78731%0.308SS*.SBendtrans-64.1-29.3-174.4-63.9-176.8-179.4178.60114.5
401T81.6Confident83.7Confident125 Ų12559.3 Ų59.377%0.76730%0.298SS*.SBendtrans-115.566.9-179.155.70000110.3R399R399-T401 VanDerWaalsContact C-N 3.31Å; R399-T401 PolarHBondContact O-N 2.98Å
402A80.8Confident83.4Confident28 Ų2862 Ų6223%0.23131%0.308CS..  trans-91.7137.1172.100000110Y395Y395-A402 HydrophobicContact CE1-CB 4.22Å
403S84.2Confident83.7Confident65 Ų6566.3 Ų66.346%0.45533%0.329SS..  trans-72.8157.3171.870.30000110.8R405 E406 L407S403-R405 VanDerWaalsContact C-N 3.29Å; S403-R405 PolarHBondContact O-N 2.68Å; S403-E406 WeakPolarHBondContact O-CB 3.19Å; S403-E406 PolarHBondContact O-N 3.15Å; S403-E406 VanDerWaalsContact OG-CB 3.25Å; S403-E406 WeakPolarHBondContact OG-CB 3.38Å; S403-E406 PolarHBondContact OG-N 2.86Å; S403-L407 PolarHBondContact O-N 2.89Å
404Q78.9Confident83.9Confident79 Ų7967.4 Ų67.437%0.36933%0.334SS..Hα-helixtrans-60.2-39.8177-68.3-169.8-800112.1V36 E406 L407 L408V36-Q404 HydrophobicContact CG2-CG 4.01Å; Q404-E406 VanDerWaalsContact C-N 3.34Å; Q404-E406 PolarHBondContact O-N 3.37Å; Q404-L407 PolarHBondContact O-N 2.98Å; Q404-L408 WeakPolarHBondContact O-CG 3.47Å; Q404-L408 PolarHBondContact O-N 3.22Å; Q404-L408 VanDerWaalsContact O-N 3.15Å
405R77.5Confident83.9Confident87 Ų8767.3 Ų67.333%0.32833%0.334SS..Hα-helixtrans-61.7-42.9176.8-172.4178.4-176.7157.68.8111.7S403 L408 I409 D648S403-R405 VanDerWaalsContact C-N 3.29Å; S403-R405 PolarHBondContact O-N 2.68Å; R405-L408 PolarHBondContact O-N 3.09Å; R405-I409 HydrophobicContact CG-CD1 4.12Å; R405-I409 WeakPolarHBondContact O-CG1 3.49Å; R405-I409 PolarHBondContact O-N 3.28Å; R405-I409 VanDerWaalsContact O-N 3.13Å; R405-D648 IonicContact CZ-OD1 3.57Å; R405-D648 IonicContact NH2-OD1 3.35Å; R405-D648 PolarHBondContact NH2-OD1 3.16Å
406E85.3Confident83.9Confident33 Ų3369.2 Ų69.215%0.15435%0.35CS..Hα-helixtrans-61.6-45.4177.2-176.6-173.3161.500111.6Y395 R399 S403 Q404 L408 I409 V410Y395-E406 HydrophobicContact CE1-CG 4.38Å; Y395-E406 WeakPolarHBondContact CE1-OE1 3.5Å; Y395-E406 PolarHBondContact OH-OE1 2.86Å; R399-E406 WeakPolarHBondContact CD-OE1 3.23Å; R399-E406 IonicContact CZ-OE1 2.94Å; R399-E406 IonicContact CZ-OE2 2.82Å; R399-E406 IonicContact NE-OE1 3.18Å; R399-E406 PolarHBondContact NE-OE1 3.5Å; R399-E406 IonicContact NE-OE2 3.55Å; R399-E406 IonicContact NH1-OE1 3.88Å; R399-E406 PolarHBondContact NH1-OE1 2.63Å; R399-E406 IonicContact NH1-OE2 3.59Å; R399-E406 IonicContact NH2-OE2 2.8Å; S403-E406 WeakPolarHBondContact O-CB 3.19Å; S403-E406 PolarHBondContact O-N 3.15Å; S403-E406 VanDerWaalsContact OG-CB 3.25Å; S403-E406 WeakPolarHBondContact OG-CB 3.38Å; S403-E406 PolarHBondContact OG-N 2.86Å; Q404-E406 VanDerWaalsContact C-N 3.34Å; Q404-E406 PolarHBondContact O-N 3.37Å; E406-L408 VanDerWaalsContact C-N 3.3Å; E406-L408 PolarHBondContact O-N 3.01Å; E406-I409 PolarHBondContact O-N 3.3Å; E406-V410 HydrophobicContact CG-CG2 4.35Å; E406-V410 VanDerWaalsContact O-CG2 3.31Å; E406-V410 WeakPolarHBondContact O-CG2 3.38Å; E406-V410 PolarHBondContact O-N 2.69Å
407L81.1Confident84.3Confident15 Ų1568.9 Ų68.98%0.07935%0.354CS..Hα-helixtrans-58.7-42.9179.4-162.872.4000111.9T391 L392 Y395 S403 Q404 G411T391-L407 VanDerWaalsContact CB-CD1 3.48Å; T391-L407 HydrophobicContact CG2-CD1 4.2Å; T391-L407 HydrophobicContact CG2-CG 4.24Å; T391-L407 VanDerWaalsContact CG2-O 3.3Å; T391-L407 WeakPolarHBondContact CG2-O 3.41Å; L392-L407 HydrophobicContact CD2-CD2 3.65Å; Y395-L407 HydrophobicContact CD1-CD1 4.29Å; S403-L407 PolarHBondContact O-N 2.89Å; Q404-L407 PolarHBondContact O-N 2.98Å; L407-G411 PolarHBondContact O-N 2.86Å
408L79.2Confident84.8Confident49 Ų4967.6 Ų67.626%0.25735%0.345SS..Hα-helixtrans-65-42177.7-67.7172.9000112.3Y39 Q404 R405 E406 R412Y39-L408 HydrophobicContact CD1-CD2 4.16Å; Y39-L408 HydrophobicContact CE1-CD2 4.18Å; Q404-L408 WeakPolarHBondContact O-CG 3.47Å; Q404-L408 PolarHBondContact O-N 3.22Å; Q404-L408 VanDerWaalsContact O-N 3.15Å; R405-L408 PolarHBondContact O-N 3.09Å; E406-L408 VanDerWaalsContact C-N 3.3Å; E406-L408 PolarHBondContact O-N 3.01Å; L408-R412 WeakPolarHBondContact O-CG 3.4Å; L408-R412 PolarHBondContact O-N 2.96Å
409I84Confident85.2Confident75 Ų7561.3 Ų61.339%0.38531%0.313SS..Hα-helixtrans-65.7-47.6178.6-67.6166.9000110.4R405 E406 G411 R412 M413R405-I409 HydrophobicContact CG-CD1 4.12Å; R405-I409 WeakPolarHBondContact O-CG1 3.49Å; R405-I409 PolarHBondContact O-N 3.28Å; R405-I409 VanDerWaalsContact O-N 3.13Å; E406-I409 PolarHBondContact O-N 3.3Å; I409-G411 VanDerWaalsContact C-N 3.32Å; I409-G411 PolarHBondContact O-N 3.36Å; I409-R412 PolarHBondContact O-N 2.8Å; I409-M413 HydrophobicContact CG2-CG 4.44Å; I409-M413 WeakPolarHBondContact O-CG 3.28Å; I409-M413 PolarHBondContact O-N 3.28Å
410V88.1Confident85.5Confident28 Ų2860 Ų6017%0.1732%0.317CS..Hα-helixtrans-61.3-42.4179.6171.50000111F390 Y395 E406 R412 M413 F414F390-V410 HydrophobicContact CD1-CG1 4.2Å; F390-V410 HydrophobicContact CE1-CG1 3.72Å; Y395-V410 HydrophobicContact CD1-CG1 4.27Å; Y395-V410 HydrophobicContact CD2-CG1 3.78Å; Y395-V410 HydrophobicContact CE1-CG1 4.49Å; Y395-V410 HydrophobicContact CE1-CG2 4.03Å; Y395-V410 HydrophobicContact CE2-CG1 4.03Å; Y395-V410 HydrophobicContact CE2-CG2 4.1Å; Y395-V410 HydrophobicContact CG-CG1 3.91Å; E406-V410 HydrophobicContact CG-CG2 4.35Å; E406-V410 VanDerWaalsContact O-CG2 3.31Å; E406-V410 WeakPolarHBondContact O-CG2 3.38Å; E406-V410 PolarHBondContact O-N 2.69Å; V410-R412 PolarHBondContact O-N 2.91Å; V410-M413 PolarHBondContact O-N 2.9Å; V410-F414 WeakPolarHBondContact O-CB 3.5Å; V410-F414 PolarHBondContact O-N 2.99Å
411G84.8Confident86.3Confident0 Ų054.8 Ų54.80%030%0.298CS..Hα-helixtrans-58.9-43.9176.300000113.2S387 L407 I409 F414 V415S387-G411 WeakPolarHBondContact OG-CA 3.41Å; S387-G411 PolarHBondContact OG-O 3.45Å; L407-G411 PolarHBondContact O-N 2.86Å; I409-G411 VanDerWaalsContact C-N 3.32Å; I409-G411 PolarHBondContact O-N 3.36Å; G411-F414 WeakPolarHBondContact O-CB 3.43Å; G411-F414 PolarHBondContact O-N 3.44Å; G411-V415 WeakPolarHBondContact O-CG2 3.27Å; G411-V415 PolarHBondContact O-N 2.77Å; G411-V415 VanDerWaalsContact O-N 3.12Å
412R83.3Confident86.9Confident58 Ų5848.9 Ų48.922%0.21926%0.261CS..Hα-helixtrans-68.5-41.2177.3-68.9-179.2-175.8-163.86112.9L408 I409 V410 F414 V415 V416 F650L408-R412 WeakPolarHBondContact O-CG 3.4Å; L408-R412 PolarHBondContact O-N 2.96Å; I409-R412 PolarHBondContact O-N 2.8Å; V410-R412 PolarHBondContact O-N 2.91Å; R412-F414 VanDerWaalsContact C-N 3.27Å; R412-F414 PolarHBondContact O-N 3.27Å; R412-V415 PolarHBondContact O-N 3.09Å; R412-V416 PolarHBondContact O-N 3.1Å; R412-F650 PolarHBondContact NH1-O 2.93Å; R412-F650 PolarHBondContact NH2-O 3.25Å
413M88Confident87.5Confident118 Ų11850 Ų5058%0.58126%0.263SS*.Hα-helixtrans-61.2-39.5174.9-72.7-58-60.700111.5I409 V410 V416 V417I409-M413 HydrophobicContact CG2-CG 4.44Å; I409-M413 WeakPolarHBondContact O-CG 3.28Å; I409-M413 PolarHBondContact O-N 3.28Å; V410-M413 PolarHBondContact O-N 2.9Å; M413-V416 PolarHBondContact O-N 3.01Å; M413-V417 WeakPolarHBondContact O-CG2 3.45Å; M413-V417 PolarHBondContact O-N 2.61Å; M413-V417 VanDerWaalsContact O-N 3.12Å
414F90.9Very high88Confident25 Ų2550.4 Ų50.411%0.1127%0.27CS..Hα-helixtrans-62.8-41.2176176.4-102.8000112.5V131 A386 F390 V410 G411 R412 V416 V417 M418V131-F414 HydrophobicContact CB-CZ 4.48Å; V131-F414 HydrophobicContact CG1-CE2 4.37Å; V131-F414 HydrophobicContact CG1-CZ 3.62Å; V131-F414 HydrophobicContact CG2-CE1 4.42Å; V131-F414 HydrophobicContact CG2-CZ 4.01Å; A386-F414 HydrophobicContact CB-CE1 4.09Å; F390-F414 HydrophobicContact CB-CD1 3.54Å; F390-F414 HydrophobicContact CB-CD2 4.16Å; F390-F414 HydrophobicContact CB-CE1 3.6Å; F390-F414 HydrophobicContact CB-CE2 4.22Å; F390-F414 HydrophobicContact CB-CG 3.83Å; F390-F414 HydrophobicContact CB-CZ 3.95Å; F390-F414 HydrophobicContact CD1-CB 3.62Å; F390-F414 HydrophobicContact CD1-CD1 4.11Å; F390-F414 AromaticContact CD1-CD2 3.7Å; F390-F414 HydrophobicContact CD1-CD2 3.7Å; F390-F414 HydrophobicContact CD1-CE2 4.43Å; F390-F414 AromaticContact CD1-CG 3.51Å; F390-F414 HydrophobicContact CD1-CG 3.51Å; F390-F414 HydrophobicContact CD2-CD1 4.41Å; F390-F414 AromaticContact CD2-CD2 3.47Å; F390-F414 HydrophobicContact CD2-CD2 3.47Å; F390-F414 VanDerWaalsContact CD2-CD2 3.47Å; F390-F414 HydrophobicContact CD2-CE1 4.35Å; F390-F414 AromaticContact CD2-CE2 3.4Å; F390-F414 HydrophobicContact CD2-CE2 3.4Å; F390-F414 VanDerWaalsContact CD2-CE2 3.4Å; F390-F414 HydrophobicContact CD2-CG 4Å; F390-F414 AromaticContact CD2-CZ 3.87Å; F390-F414 HydrophobicContact CD2-CZ 3.87Å; F390-F414 HydrophobicContact CE1-CB 3.95Å; F390-F414 AromaticContact CE1-CD2 3.89Å; F390-F414 HydrophobicContact CE1-CD2 3.89Å; F390-F414 HydrophobicContact CE1-CG 4.04Å; F390-F414 AromaticContact CE2-CD2 3.68Å; F390-F414 HydrophobicContact CE2-CD2 3.68Å; F390-F414 AromaticContact CE2-CE2 3.8Å; F390-F414 HydrophobicContact CE2-CE2 3.8Å; F390-F414 HydrophobicContact CE2-CG 4.48Å; F390-F414 HydrophobicContact CG-CB 4.14Å; F390-F414 AromaticContact CG-CD1 3.77Å; F390-F414 HydrophobicContact CG-CD1 3.77Å; F390-F414 AromaticContact CG-CD2 3.48Å; F390-F414 HydrophobicContact CG-CD2 3.48Å; F390-F414 VanDerWaalsContact CG-CD2 3.48Å; F390-F414 HydrophobicContact CG-CE1 4.02Å; F390-F414 AromaticContact CG-CE2 3.76Å; F390-F414 HydrophobicContact CG-CE2 3.76Å; F390-F414 AromaticContact CG-CG 3.49Å; F390-F414 HydrophobicContact CG-CG 3.49Å; F390-F414 VanDerWaalsContact CG-CG 3.49Å; F390-F414 HydrophobicContact CG-CZ 4.02Å; F390-F414 AromaticContact CZ-CD2 3.88Å; F390-F414 HydrophobicContact CZ-CD2 3.88Å; F390-F414 HydrophobicContact CZ-CE2 4.46Å; F390-F414 HydrophobicContact CZ-CG 4.49Å; V410-F414 WeakPolarHBondContact O-CB 3.5Å; V410-F414 PolarHBondContact O-N 2.99Å; G411-F414 WeakPolarHBondContact O-CB 3.43Å; G411-F414 PolarHBondContact O-N 3.44Å; R412-F414 VanDerWaalsContact C-N 3.27Å; R412-F414 PolarHBondContact O-N 3.27Å; F414-V416 VanDerWaalsContact C-N 3.32Å; F414-V416 PolarHBondContact O-N 3.24Å; F414-V417 PolarHBondContact O-N 2.96Å; F414-M418 HydrophobicContact CE1-SD 4.44Å; F414-M418 WeakPolarHBondContact O-CB 3.41Å; F414-M418 PolarHBondContact O-N 2.78Å
415V89.2Confident88.6Confident23 Ų2350 Ų5014%0.13927%0.265CS..Hα-helixtrans-58.4-43.3174.5171.60000111.3F383 G411 R412 V417 M418 V419F383-V415 HydrophobicContact CB-CG1 3.89Å; F383-V415 HydrophobicContact CB-CG2 4.06Å; F383-V415 HydrophobicContact CD1-CG1 3.71Å; F383-V415 HydrophobicContact CD2-CG1 3.84Å; F383-V415 HydrophobicContact CE1-CG1 4.14Å; F383-V415 HydrophobicContact CE2-CG1 4.27Å; F383-V415 HydrophobicContact CG-CG1 3.53Å; F383-V415 HydrophobicContact CZ-CG1 4.41Å; G411-V415 WeakPolarHBondContact O-CG2 3.27Å; G411-V415 PolarHBondContact O-N 2.77Å; G411-V415 VanDerWaalsContact O-N 3.12Å; R412-V415 PolarHBondContact O-N 3.09Å; V415-V417 PolarHBondContact O-N 3.48Å; V415-M418 WeakPolarHBondContact O-CB 3.39Å; V415-M418 PolarHBondContact O-N 2.65Å; V415-V419 HydrophobicContact CG1-CG2 4.4Å; V415-V419 WeakPolarHBondContact O-CG2 3.27Å; V415-V419 PolarHBondContact O-N 3.38Å
416V90.1Very high89.3Confident88 Ų8845.9 Ų45.953%0.53325%0.25SC..Hα-helixtrans-60.5-45.7176.71760000111.3R412 M413 F414 M418 V419 V420R412-V416 PolarHBondContact O-N 3.1Å; M413-V416 PolarHBondContact O-N 3.01Å; F414-V416 VanDerWaalsContact C-N 3.32Å; F414-V416 PolarHBondContact O-N 3.24Å; V416-M418 VanDerWaalsContact C-N 3.33Å; V416-M418 PolarHBondContact O-N 3.19Å; V416-V419 PolarHBondContact O-N 3.43Å; V416-V420 WeakPolarHBondContact O-CG2 3.46Å; V416-V420 PolarHBondContact O-N 3.4Å
417V92.3Very high89.5Confident77 Ų7746.8 Ų46.847%0.46726%0.259SS..Hα-helixtrans-60.4-45.2176.7172.80000111M413 F414 V415 V419 V420 I421M413-V417 WeakPolarHBondContact O-CG2 3.45Å; M413-V417 PolarHBondContact O-N 2.61Å; M413-V417 VanDerWaalsContact O-N 3.12Å; F414-V417 PolarHBondContact O-N 2.96Å; V415-V417 PolarHBondContact O-N 3.48Å; V417-V419 VanDerWaalsContact C-N 3.34Å; V417-V419 PolarHBondContact O-N 3.12Å; V417-V420 PolarHBondContact O-N 2.84Å; V417-I421 HydrophobicContact CG1-CD1 3.87Å; V417-I421 WeakPolarHBondContact O-CG1 3.4Å; V417-I421 PolarHBondContact O-N 2.89Å; V417-I421 VanDerWaalsContact O-N 3.08Å
418M92.3Very high89.9Confident1 Ų147.7 Ų47.71%0.00527%0.265CS..Hα-helixtrans-59-44.6178.6-168.6-173.861.600111.6I135 L139 I382 F383 A386 F414 V415 V416 I421 S422I135-M418 HydrophobicContact CD1-CG 4.06Å; I135-M418 HydrophobicContact CG1-CG 3.45Å; I135-M418 VanDerWaalsContact CG1-CG 3.45Å; I135-M418 HydrophobicContact CG1-SD 4.34Å; L139-M418 HydrophobicContact CD2-CE 3.52Å; L139-M418 HydrophobicContact CD2-CG 3.88Å; L139-M418 HydrophobicContact CD2-SD 4.18Å; I382-M418 HydrophobicContact CG2-CE 4.22Å; F383-M418 HydrophobicContact CD1-CE 3.43Å; F383-M418 VanDerWaalsContact CD1-CE 3.43Å; F383-M418 HydrophobicContact CE1-CE 3.82Å; A386-M418 HydrophobicContact CB-CE 4Å; A386-M418 HydrophobicContact CB-SD 3.5Å; A386-M418 WeakPolarHBondContact CB-SD 3.33Å; F414-M418 HydrophobicContact CE1-SD 4.44Å; F414-M418 WeakPolarHBondContact O-CB 3.41Å; F414-M418 PolarHBondContact O-N 2.78Å; V415-M418 WeakPolarHBondContact O-CB 3.39Å; V415-M418 PolarHBondContact O-N 2.65Å; V416-M418 VanDerWaalsContact C-N 3.33Å; V416-M418 PolarHBondContact O-N 3.19Å; M418-I421 PolarHBondContact O-N 2.99Å; M418-S422 WeakPolarHBondContact O-CB 3.31Å; M418-S422 PolarHBondContact O-N 2.83Å; M418-S422 PolarHBondContact O-OG 3.49Å
419V92.3Very high90.3Very high13 Ų1345.4 Ų45.48%0.07925%0.253CS..Hα-helixtrans-61.7-45.9176.8168.80000111.7L139 I166 F383 V415 V416 V417 I421 S422 I423L139-V419 HydrophobicContact CD2-CG2 4.25Å; I166-V419 HydrophobicContact CD1-CG1 3.62Å; I166-V419 HydrophobicContact CG1-CG1 4.25Å; I166-V419 HydrophobicContact CG2-CG1 4.1Å; F383-V419 HydrophobicContact CE1-CG2 3.53Å; F383-V419 HydrophobicContact CE2-CG2 4.42Å; F383-V419 HydrophobicContact CZ-CG2 3.45Å; F383-V419 VanDerWaalsContact CZ-CG2 3.45Å; V415-V419 HydrophobicContact CG1-CG2 4.4Å; V415-V419 WeakPolarHBondContact O-CG2 3.27Å; V415-V419 PolarHBondContact O-N 3.38Å; V416-V419 PolarHBondContact O-N 3.43Å; V417-V419 VanDerWaalsContact C-N 3.34Å; V417-V419 PolarHBondContact O-N 3.12Å; V419-I421 VanDerWaalsContact C-N 3.33Å; V419-I421 PolarHBondContact O-N 3.13Å; V419-S422 PolarHBondContact O-N 2.84Å; V419-I423 HydrophobicContact CG1-CD1 3.97Å; V419-I423 HydrophobicContact CG1-CG1 4.41Å; V419-I423 WeakPolarHBondContact O-CG1 3Å; V419-I423 PolarHBondContact O-N 3.17Å
420V93.6Very high90.3Very high91 Ų9143.6 Ų43.655%0.55224%0.243SC*.Hα-helixtrans-60-44.3178.8171.60000111.2V416 V417 S422 I423 A424V416-V420 WeakPolarHBondContact O-CG2 3.46Å; V416-V420 PolarHBondContact O-N 3.4Å; V417-V420 PolarHBondContact O-N 2.84Å; V420-S422 VanDerWaalsContact C-N 3.34Å; V420-I423 PolarHBondContact O-N 2.83Å; V420-A424 PolarHBondContact O-N 3.16Å; V420-A424 VanDerWaalsContact O-N 3.11Å
421I94.9Very high90.2Very high73 Ų7348 Ų4837%0.37426%0.262SS..Hα-helixtrans-64.1-41.8177.4-63.2168.1000110.5I135 V417 M418 V419 A424 W425I135-I421 HydrophobicContact CG2-CB 4.36Å; I135-I421 HydrophobicContact CG2-CG2 3.66Å; V417-I421 HydrophobicContact CG1-CD1 3.87Å; V417-I421 WeakPolarHBondContact O-CG1 3.4Å; V417-I421 PolarHBondContact O-N 2.89Å; V417-I421 VanDerWaalsContact O-N 3.08Å; M418-I421 PolarHBondContact O-N 2.99Å; V419-I421 VanDerWaalsContact C-N 3.33Å; V419-I421 PolarHBondContact O-N 3.13Å; I421-A424 WeakPolarHBondContact O-CB 3.35Å; I421-A424 PolarHBondContact O-N 3.4Å; I421-W425 PolarHBondContact O-N 3.42Å
422S93.9Very high90Very high0 Ų050 Ų500%027%0.272CS..Hα-helixtrans-65.2-40.5178.6-750000113.4I135 L139 S140 M418 V419 V420 A424 W425 V426I135-S422 PolarHBondContact O-OG 3.32Å; L139-S422 VanDerWaalsContact CD2-OG 3.26Å; L139-S422 WeakPolarHBondContact CD2-OG 3.26Å; L139-S422 WeakPolarHBondContact CG-OG 3.19Å; S140-S422 WeakPolarHBondContact OG-CA 3.33Å; S140-S422 VanDerWaalsContact OG-CB 3.23Å; S140-S422 WeakPolarHBondContact OG-CB 3.34Å; S140-S422 PolarHBondContact OG-O 2.9Å; S140-S422 PolarHBondContact OG-OG 3.11Å; M418-S422 WeakPolarHBondContact O-CB 3.31Å; M418-S422 PolarHBondContact O-N 2.83Å; M418-S422 PolarHBondContact O-OG 3.49Å; V419-S422 PolarHBondContact O-N 2.84Å; V420-S422 VanDerWaalsContact C-N 3.34Å; S422-A424 VanDerWaalsContact C-N 3.3Å; S422-A424 PolarHBondContact O-N 2.79Å; S422-W425 WeakPolarHBondContact O-CB 3.31Å; S422-W425 PolarHBondContact O-N 2.57Å; S422-V426 PolarHBondContact O-N 3.33Å
423I93.6Very high89.9Confident53 Ų5347.5 Ų47.527%0.27226%0.263SS..Hα-helixtrans-60.2-44173.2-64.7168.7000110.2L143 I162 I166 V419 V420 W425 V426L143-I423 HydrophobicContact CD1-CG1 4.32Å; I162-I423 HydrophobicContact CG2-CD1 4.4Å; I162-I423 HydrophobicContact CG2-CG1 4.05Å; I166-I423 HydrophobicContact CD1-CD1 3.61Å; I166-I423 HydrophobicContact CD1-CG1 3.99Å; V419-I423 HydrophobicContact CG1-CD1 3.97Å; V419-I423 HydrophobicContact CG1-CG1 4.41Å; V419-I423 WeakPolarHBondContact O-CG1 3Å; V419-I423 PolarHBondContact O-N 3.17Å; V420-I423 PolarHBondContact O-N 2.83Å; I423-W425 PolarHBondContact O-N 2.95Å; I423-V426 PolarHBondContact O-N 2.82Å
424A94.2Very high89.4Confident73 Ų7343.8 Ų43.860%0.60326%0.255SS*.Hα-helixtrans-63.4-22.4177.400000112.9V420 I421 S422V420-A424 PolarHBondContact O-N 3.16Å; V420-A424 VanDerWaalsContact O-N 3.11Å; I421-A424 WeakPolarHBondContact O-CB 3.35Å; I421-A424 PolarHBondContact O-N 3.4Å; S422-A424 VanDerWaalsContact C-N 3.3Å; S422-A424 PolarHBondContact O-N 2.79Å
425W92.9Very high88.9Confident70 Ų7042.7 Ų42.727%0.26525%0.25SS..Hα-helixtrans-87.8-17.3178.6-161.6-103.3000114.3F136 I421 S422 I423 P427 V428 I429F136-W425 HydrophobicContact CD1-CB 4.46Å; F136-W425 AromaticContact CD1-CD1 3.77Å; F136-W425 AromaticContact CD1-CD2 3.43Å; F136-W425 HydrophobicContact CD1-CD2 3.43Å; F136-W425 VanDerWaalsContact CD1-CD2 3.43Å; F136-W425 AromaticContact CD1-CE2 3.45Å; F136-W425 VanDerWaalsContact CD1-CE2 3.45Å; F136-W425 AromaticContact CD1-CE3 3.96Å; F136-W425 HydrophobicContact CD1-CE3 3.96Å; F136-W425 AromaticContact CD1-CG 3.65Å; F136-W425 HydrophobicContact CD1-CG 3.65Å; F136-W425 HydrophobicContact CD1-CH2 4.43Å; F136-W425 AromaticContact CD1-CZ2 3.98Å; F136-W425 HydrophobicContact CD1-CZ2 3.98Å; F136-W425 HydrophobicContact CD1-CZ3 4.42Å; F136-W425 AromaticContact CD1-NE1 3.65Å; F136-W425 AromaticContact CE1-CD2 3.53Å; F136-W425 HydrophobicContact CE1-CD2 3.53Å; F136-W425 AromaticContact CE1-CE2 3.87Å; F136-W425 AromaticContact CE1-CE3 3.53Å; F136-W425 HydrophobicContact CE1-CE3 3.53Å; F136-W425 HydrophobicContact CE1-CG 4.04Å; F136-W425 HydrophobicContact CE1-CH2 4.19Å; F136-W425 HydrophobicContact CE1-CZ2 4.2Å; F136-W425 AromaticContact CE1-CZ3 3.87Å; F136-W425 HydrophobicContact CE1-CZ3 3.87Å; F136-W425 HydrophobicContact CZ-CE3 4.48Å; F136-W425 HydrophobicContact CZ-CZ3 4.45Å; I421-W425 PolarHBondContact O-N 3.42Å; S422-W425 WeakPolarHBondContact O-CB 3.31Å; S422-W425 PolarHBondContact O-N 2.57Å; I423-W425 PolarHBondContact O-N 2.95Å; W425-P427 VanDerWaalsContact C-CD 3.47Å; W425-V428 HydrophobicContact CD2-CB 4.13Å; W425-V428 HydrophobicContact CD2-CG1 4.43Å; W425-V428 HydrophobicContact CD2-CG2 4.21Å; W425-V428 HydrophobicContact CE3-CG2 4.1Å; W425-V428 HydrophobicContact CG-CB 4.48Å; W425-V428 HydrophobicContact CH2-CG1 4.22Å; W425-V428 HydrophobicContact CZ2-CB 4.39Å; W425-V428 HydrophobicContact CZ2-CG1 3.79Å; W425-V428 HydrophobicContact CZ3-CG2 4.31Å; W425-V428 VanDerWaalsContact O-CB 3.31Å; W425-V428 WeakPolarHBondContact O-CB 3.38Å; W425-V428 PolarHBondContact O-N 3.49Å; W425-I429 PolarHBondContact O-N 3Å
426V91.3Very high88.9Confident0 Ų043.2 Ų43.20%025%0.252CS..Hα-helixtrans-53.1-44.3-179.61720000113.6Y144 L158 I162 S422 I423 V428 I429 I430Y144-V426 HydrophobicContact CD2-CG1 4.08Å; L158-V426 HydrophobicContact CD2-CG1 4.32Å; I162-V426 HydrophobicContact CD1-CG1 4.22Å; I162-V426 HydrophobicContact CD1-CG2 4.19Å; S422-V426 PolarHBondContact O-N 3.33Å; I423-V426 PolarHBondContact O-N 2.82Å; V426-V428 PolarHBondContact O-N 2.76Å; V426-I429 WeakPolarHBondContact O-CB 3.21Å; V426-I429 PolarHBondContact O-N 3.18Å; V426-I429 VanDerWaalsContact O-N 3.07Å; V426-I430 HydrophobicContact CG1-CD1 4.14Å; V426-I430 PolarHBondContact O-N 3.12Å; V426-I430 VanDerWaalsContact O-N 3.13Å
427P89.4Confident88.9Confident53 Ų5339.1 Ų39.134%0.34423%0.227SC..Hα-helixtrans-58.2-34.6176.8-24.434.2000113.4W425 I429 I430 E431W425-P427 VanDerWaalsContact C-CD 3.47Å; P427-I429 VanDerWaalsContact C-N 3.34Å; P427-I430 PolarHBondContact O-N 2.87Å; P427-E431 PolarHBondContact O-N 3.29Å
428V89Confident88.9Confident34 Ų3435.8 Ų35.821%0.20621%0.206CC..Hα-helixtrans-65.8-41177.9-178.90000110.3W425 V426 I430 E431 M432 F489W425-V428 HydrophobicContact CD2-CB 4.13Å; W425-V428 HydrophobicContact CD2-CG1 4.43Å; W425-V428 HydrophobicContact CD2-CG2 4.21Å; W425-V428 HydrophobicContact CE3-CG2 4.1Å; W425-V428 HydrophobicContact CG-CB 4.48Å; W425-V428 HydrophobicContact CH2-CG1 4.22Å; W425-V428 HydrophobicContact CZ2-CB 4.39Å; W425-V428 HydrophobicContact CZ2-CG1 3.79Å; W425-V428 HydrophobicContact CZ3-CG2 4.31Å; W425-V428 VanDerWaalsContact O-CB 3.31Å; W425-V428 WeakPolarHBondContact O-CB 3.38Å; W425-V428 PolarHBondContact O-N 3.49Å; V426-V428 PolarHBondContact O-N 2.76Å; V428-I430 PolarHBondContact O-N 3.37Å; V428-E431 PolarHBondContact O-N 3.25Å; V428-M432 HydrophobicContact CG1-CG 3.96Å; V428-M432 HydrophobicContact CG1-SD 3.5Å; V428-M432 VanDerWaalsContact CG1-SD 3.5Å; V428-M432 VanDerWaalsContact O-CB 3.24Å; V428-M432 WeakPolarHBondContact O-CB 3.34Å; V428-M432 VanDerWaalsContact O-CG 3.23Å; V428-M432 WeakPolarHBondContact O-CG 3.32Å; V428-M432 PolarHBondContact O-N 2.97Å; V428-F489 HydrophobicContact CG1-CE2 3.85Å
429I88Confident88.8Confident0 Ų036.9 Ų36.90%021%0.211CC..Hα-helixtrans-62.4-43.8176.5-66.3168.8000111S140 V141 Y144 W425 V426 P427 E431 M432 Q433 T437 Y440S140-I429 VanDerWaalsContact C-CD1 3.48Å; V141-I429 HydrophobicContact CB-CD1 4.44Å; V141-I429 HydrophobicContact CG2-CD1 3.64Å; V141-I429 HydrophobicContact CG2-CG1 4.42Å; Y144-I429 HydrophobicContact CD1-CG2 3.95Å; Y144-I429 HydrophobicContact CE1-CG2 4.4Å; Y144-I429 HydrophobicContact CG-CG2 4.32Å; W425-I429 PolarHBondContact O-N 3Å; V426-I429 WeakPolarHBondContact O-CB 3.21Å; V426-I429 PolarHBondContact O-N 3.18Å; V426-I429 VanDerWaalsContact O-N 3.07Å; P427-I429 VanDerWaalsContact C-N 3.34Å; I429-E431 PolarHBondContact O-N 2.87Å; I429-M432 PolarHBondContact O-N 2.62Å; I429-Q433 VanDerWaalsContact O-CB 3.27Å; I429-Q433 WeakPolarHBondContact O-CB 3.21Å; I429-Q433 VanDerWaalsContact O-CG 3.24Å; I429-Q433 WeakPolarHBondContact O-CG 3.33Å; I429-Q433 PolarHBondContact O-N 2.62Å; I429-T437 HydrophobicContact CG2-CG2 4.41Å; I429-Y440 HydrophobicContact CG1-CE1 4.17Å; I429-Y440 HydrophobicContact CG2-CE1 4.42Å
430I85.4Confident88.7Confident37 Ų3736.9 Ų36.919%0.1921%0.21CC..Hα-helixtrans-55.9-44.6-179.6-67.1170.2000110.8Y144 L158 V426 P427 V428 Q433Y144-I430 HydrophobicContact CD2-CD1 4.36Å; Y144-I430 HydrophobicContact CD2-CG1 3.93Å; Y144-I430 HydrophobicContact CE2-CD1 4.03Å; Y144-I430 HydrophobicContact CE2-CG1 3.47Å; Y144-I430 VanDerWaalsContact CE2-CG1 3.47Å; L158-I430 HydrophobicContact CD2-CD1 3.8Å; V426-I430 HydrophobicContact CG1-CD1 4.14Å; V426-I430 PolarHBondContact O-N 3.12Å; V426-I430 VanDerWaalsContact O-N 3.13Å; P427-I430 PolarHBondContact O-N 2.87Å; V428-I430 PolarHBondContact O-N 3.37Å; I430-Q433 PolarHBondContact O-NE2 3.28Å
431E83.9Confident88.5Confident122 Ų12233.1 Ų33.157%0.5719%0.186SC*.Hα-helixtrans-78-32.5-179-67-65.814400113.4P427 V428 I429P427-E431 PolarHBondContact O-N 3.29Å; V428-E431 PolarHBondContact O-N 3.25Å; I429-E431 PolarHBondContact O-N 2.87Å
432M82.3Confident88.4Confident40 Ų4031 Ų3120%0.19718%0.175CC..Hα-helixtrans-91.1-23.8-172.1-72.6-166.275.700115.3V428 I429 G434 Y440 F489V428-M432 HydrophobicContact CG1-CG 3.96Å; V428-M432 HydrophobicContact CG1-SD 3.5Å; V428-M432 VanDerWaalsContact CG1-SD 3.5Å; V428-M432 VanDerWaalsContact O-CB 3.24Å; V428-M432 WeakPolarHBondContact O-CB 3.34Å; V428-M432 VanDerWaalsContact O-CG 3.23Å; V428-M432 WeakPolarHBondContact O-CG 3.32Å; V428-M432 PolarHBondContact O-N 2.97Å; I429-M432 PolarHBondContact O-N 2.62Å; M432-G434 PolarHBondContact O-N 3.08Å; M432-G434 VanDerWaalsContact O-N 3.09Å; M432-Y440 HydrophobicContact CB-CD2 4.19Å; M432-Y440 HydrophobicContact CB-CE2 3.68Å; M432-Y440 HydrophobicContact CE-CE2 4.31Å; M432-Y440 HydrophobicContact SD-CE2 4.38Å; M432-F489 HydrophobicContact CE-CB 4.33Å; M432-F489 HydrophobicContact CE-CD2 3.59Å; M432-F489 HydrophobicContact CE-CE2 4.34Å; M432-F489 HydrophobicContact CE-CG 4.37Å; M432-F489 HydrophobicContact SD-CD2 3.34Å; M432-F489 WeakPolarHBondContact SD-CD2 3.29Å; M432-F489 HydrophobicContact SD-CE2 3.49Å; M432-F489 WeakPolarHBondContact SD-CE2 3.41Å
433Q80.1Confident88.3Confident6 Ų633.7 Ų33.73%0.02819%0.188CC..SBendtrans-68.8-8.7-168.464.3-177.5-33.100116.1Y144 N348 I429 I430 G435 Q436 T437 Y440Y144-Q433 VanDerWaalsContact CE1-OE1 3.29Å; Y144-Q433 PolarHBondContact OH-NE2 3.45Å; N348-Q433 PolarHBondContact ND2-OE1 3.39Å; N348-Q433 VanDerWaalsContact ND2-OE1 3.12Å; I429-Q433 VanDerWaalsContact O-CB 3.27Å; I429-Q433 WeakPolarHBondContact O-CB 3.21Å; I429-Q433 VanDerWaalsContact O-CG 3.24Å; I429-Q433 WeakPolarHBondContact O-CG 3.33Å; I429-Q433 PolarHBondContact O-N 2.62Å; I430-Q433 PolarHBondContact O-NE2 3.28Å; Q433-G435 PolarHBondContact O-N 3.44Å; Q433-Q436 CarbonylContact O-C 3.57Å; Q433-Q436 PolarHBondContact O-N 3.14Å; Q433-Q436 VanDerWaalsContact O-N 3.08Å; Q433-T437 PolarHBondContact OE1-OG1 3.13Å; Q433-Y440 HydrophobicContact CB-CG 4.27Å
434G77.9Confident88.1Confident40 Ų4031.7 Ų31.741%0.41218%0.178SC..THydrogen-bonded Turntrans60.122.3176.300000115.1M432 Q436M432-G434 PolarHBondContact O-N 3.08Å; M432-G434 VanDerWaalsContact O-N 3.09Å; G434-Q436 VanDerWaalsContact C-N 3.3Å; G434-Q436 PolarHBondContact O-N 2.84Å
435G81.1Confident88Confident2 Ų228.7 Ų28.72%0.02115%0.153CC..THydrogen-bonded Turntrans84.4-11.4-17700000115.4S347 N348 Q433S347-G435 PolarHBondContact OG-O 3.46Å; N348-G435 PolarHBondContact ND2-O 3.29Å; Q433-G435 PolarHBondContact O-N 3.44Å
436Q88.9Confident88Confident35 Ų3525.3 Ų25.316%0.16414%0.14CC..  trans-126.988.2179-70.9-174.5-121.700111S71 A74 Q433 G434 Y438 I439 Y440S71-Q436 PolarHBondContact OG-NE2 3.28Å; A74-Q436 HydrophobicContact CB-CG 4.02Å; Q433-Q436 CarbonylContact O-C 3.57Å; Q433-Q436 PolarHBondContact O-N 3.14Å; Q433-Q436 VanDerWaalsContact O-N 3.08Å; G434-Q436 VanDerWaalsContact C-N 3.3Å; G434-Q436 PolarHBondContact O-N 2.84Å; Q436-Y438 PolarHBondContact O-N 3.36Å; Q436-Y438 VanDerWaalsContact O-N 3.14Å; Q436-I439 HydrophobicContact CB-CB 4.4Å; Q436-I439 HydrophobicContact CB-CD1 4.48Å; Q436-I439 HydrophobicContact CB-CG1 4.36Å; Q436-I439 PolarHBondContact O-N 3.22Å; Q436-Y440 PolarHBondContact O-N 3.27Å
437T89.9Confident88.1Confident2 Ų225.4 Ų25.41%0.01214%0.141CC..Hα-helixtrans-57.6-36.2-174-38.80000112.5V141 Y144 N348 I429 Q433 Y440 I441V141-T437 HydrophobicContact CG1-CG2 3.62Å; Y144-T437 HydrophobicContact CD1-CG2 4.38Å; N348-T437 PolarHBondContact ND2-OG1 3.03Å; N348-T437 PolarHBondContact OD1-N 2.99Å; N348-T437 PolarHBondContact OD1-OG1 2.83Å; I429-T437 HydrophobicContact CG2-CG2 4.41Å; Q433-T437 PolarHBondContact OE1-OG1 3.13Å; T437-Y440 WeakPolarHBondContact O-CB 3.39Å; T437-Y440 PolarHBondContact O-N 3.45Å; T437-I441 VanDerWaalsContact O-CG1 3.29Å; T437-I441 WeakPolarHBondContact O-CG1 3.45Å; T437-I441 PolarHBondContact O-N 2.96Å
438Y91.8Very high88.2Confident7 Ų723.1 Ų23.13%0.02713%0.125CC..Hα-helixtrans-64-44.7-178.5-167.5-94.5000112.6G67 L68 W82 Q436 Y440 I441 Q442G67-Y438 VanDerWaalsContact C-CB 3.43Å; G67-Y438 WeakPolarHBondContact O-CB 3.48Å; L68-Y438 HydrophobicContact CB-CD2 3.9Å; L68-Y438 HydrophobicContact CB-CE2 4Å; L68-Y438 HydrophobicContact CB-CG 4.35Å; L68-Y438 HydrophobicContact CD1-CD1 4.16Å; L68-Y438 HydrophobicContact CD1-CD2 4.45Å; L68-Y438 HydrophobicContact CD1-CE1 3.84Å; L68-Y438 HydrophobicContact CD1-CE2 4.14Å; L68-Y438 HydrophobicContact CD1-CG 4.45Å; W82-Y438 HydrophobicContact CB-CE1 4.41Å; W82-Y438 WeakPolarHBondContact CB-OH 3.47Å; W82-Y438 AromaticContact CD2-CE1 3.84Å; W82-Y438 HydrophobicContact CD2-CE1 3.84Å; W82-Y438 AromaticContact CE3-CE1 3.93Å; W82-Y438 HydrophobicContact CE3-CE1 3.93Å; W82-Y438 HydrophobicContact CG-CE1 4.05Å; W82-Y438 HydrophobicContact CZ3-CE1 4.47Å; Q436-Y438 PolarHBondContact O-N 3.36Å; Q436-Y438 VanDerWaalsContact O-N 3.14Å; Y438-Y440 VanDerWaalsContact C-N 3.3Å; Y438-Y440 PolarHBondContact O-N 2.94Å; Y438-I441 PolarHBondContact O-N 3.47Å; Y438-Q442 HydrophobicContact CD1-CG 4.11Å; Y438-Q442 HydrophobicContact CE1-CG 3.93Å; Y438-Q442 VanDerWaalsContact O-CG 3.3Å; Y438-Q442 WeakPolarHBondContact O-CG 3.48Å; Y438-Q442 PolarHBondContact O-N 2.9Å; Y438-Q442 VanDerWaalsContact O-N 3.11Å
439I90.5Very high88.4Confident24 Ų2421.5 Ų21.512%0.12312%0.116CC..Hα-helixtrans-63.9-40.7177.6-62.3-172.3000110.1Q436 I441 Q442 E443 Y511Q436-I439 HydrophobicContact CB-CB 4.4Å; Q436-I439 HydrophobicContact CB-CD1 4.48Å; Q436-I439 HydrophobicContact CB-CG1 4.36Å; Q436-I439 PolarHBondContact O-N 3.22Å; I439-I441 PolarHBondContact O-N 3.24Å; I439-Q442 CarbonylContact O-C 3.38Å; I439-Q442 PolarHBondContact O-N 3.15Å; I439-Q442 VanDerWaalsContact O-N 3.15Å; I439-E443 WeakPolarHBondContact O-CB 3.27Å; I439-E443 PolarHBondContact O-N 3.43Å; I439-Y511 HydrophobicContact CG2-CE1 4.25Å
440Y89.3Confident88.7Confident13 Ų1321.5 Ų21.55%0.05112%0.116CC..Hα-helixtrans-57.2-45.4174.9165.3-96.2000112.9V141 I429 M432 Q433 Q436 T437 Y438 Q442 E443 V444V141-Y440 HydrophobicContact CG2-CE1 4.44Å; I429-Y440 HydrophobicContact CG1-CE1 4.17Å; I429-Y440 HydrophobicContact CG2-CE1 4.42Å; M432-Y440 HydrophobicContact CB-CD2 4.19Å; M432-Y440 HydrophobicContact CB-CE2 3.68Å; M432-Y440 HydrophobicContact CE-CE2 4.31Å; M432-Y440 HydrophobicContact SD-CE2 4.38Å; Q433-Y440 HydrophobicContact CB-CG 4.27Å; Q436-Y440 PolarHBondContact O-N 3.27Å; T437-Y440 WeakPolarHBondContact O-CB 3.39Å; T437-Y440 PolarHBondContact O-N 3.45Å; Y438-Y440 VanDerWaalsContact C-N 3.3Å; Y438-Y440 PolarHBondContact O-N 2.94Å; Y440-Q442 VanDerWaalsContact C-N 3.31Å; Y440-Q442 PolarHBondContact O-N 3.32Å; Y440-E443 PolarHBondContact O-N 3.25Å; Y440-V444 HydrophobicContact CD2-CG2 4.29Å; Y440-V444 HydrophobicContact CE1-CG2 4.48Å; Y440-V444 HydrophobicContact CE2-CG2 3.81Å; Y440-V444 WeakPolarHBondContact O-CG2 3.31Å; Y440-V444 PolarHBondContact O-N 2.96Å
441I90.4Very high89.1Confident11 Ų1119.8 Ų19.86%0.05611%0.107CC..Hα-helixtrans-58.3-47175.6-61.2160.2000110.2E63 V141 T437 Y438 I439 E443 V444 A445E63-I441 HydrophobicContact CB-CD1 4.04Å; V141-I441 HydrophobicContact CB-CD1 4.38Å; V141-I441 HydrophobicContact CB-CG1 4.36Å; V141-I441 HydrophobicContact CG1-CD1 3.46Å; V141-I441 VanDerWaalsContact CG1-CD1 3.46Å; V141-I441 HydrophobicContact CG1-CG1 3.79Å; V141-I441 HydrophobicContact CG2-CG1 4.03Å; T437-I441 VanDerWaalsContact O-CG1 3.29Å; T437-I441 WeakPolarHBondContact O-CG1 3.45Å; T437-I441 PolarHBondContact O-N 2.96Å; Y438-I441 PolarHBondContact O-N 3.47Å; I439-I441 PolarHBondContact O-N 3.24Å; I441-E443 VanDerWaalsContact C-N 3.32Å; I441-E443 PolarHBondContact O-N 2.93Å; I441-V444 PolarHBondContact O-N 3.1Å; I441-A445 VanDerWaalsContact O-CB 3.29Å; I441-A445 WeakPolarHBondContact O-CB 3.3Å; I441-A445 PolarHBondContact O-N 3.01Å
442Q92.4Very high89.6Confident30 Ų3014.1 Ų14.114%0.148%0.08CC..Hα-helixtrans-66.9-34.3-178.1-63-60.1-28.300112.1W82 Y438 I439 Y440 G446 Y511W82-Q442 HydrophobicContact CZ2-CB 4.04Å; W82-Q442 HydrophobicContact CZ2-CG 3.87Å; W82-Q442 VanDerWaalsContact NE1-CD 3.27Å; W82-Q442 VanDerWaalsContact NE1-OE1 3.12Å; Y438-Q442 HydrophobicContact CD1-CG 4.11Å; Y438-Q442 HydrophobicContact CE1-CG 3.93Å; Y438-Q442 VanDerWaalsContact O-CG 3.3Å; Y438-Q442 WeakPolarHBondContact O-CG 3.48Å; Y438-Q442 PolarHBondContact O-N 2.9Å; Y438-Q442 VanDerWaalsContact O-N 3.11Å; I439-Q442 CarbonylContact O-C 3.38Å; I439-Q442 PolarHBondContact O-N 3.15Å; I439-Q442 VanDerWaalsContact O-N 3.15Å; Y440-Q442 VanDerWaalsContact C-N 3.31Å; Y440-Q442 PolarHBondContact O-N 3.32Å; Q442-G446 PolarHBondContact O-N 3.35Å; Q442-Y511 HydrophobicContact CB-CE2 4.35Å
443E91.2Very high90.2Very high55 Ų5512.2 Ų12.226%0.2577%0.071SC..Hα-helixtrans-64.9-52.5175.4179.5177.9-178.100111.2I439 Y440 I441 A445 G446 Y447 Y511I439-E443 WeakPolarHBondContact O-CB 3.27Å; I439-E443 PolarHBondContact O-N 3.43Å; Y440-E443 PolarHBondContact O-N 3.25Å; I441-E443 VanDerWaalsContact C-N 3.32Å; I441-E443 PolarHBondContact O-N 2.93Å; E443-A445 VanDerWaalsContact C-N 3.32Å; E443-A445 PolarHBondContact O-N 3.41Å; E443-G446 PolarHBondContact O-N 2.94Å; E443-G446 VanDerWaalsContact O-N 3.09Å; E443-Y447 VanDerWaalsContact CD-OH 3.32Å; E443-Y447 HydrophobicContact CG-CD2 4.23Å; E443-Y447 HydrophobicContact CG-CE1 4.41Å; E443-Y447 HydrophobicContact CG-CE2 3.34Å; E443-Y447 VanDerWaalsContact CG-CZ 3.43Å; E443-Y447 VanDerWaalsContact CG-OH 3.29Å; E443-Y447 WeakPolarHBondContact CG-OH 3.37Å; E443-Y447 WeakPolarHBondContact O-CD2 3.07Å; E443-Y447 PolarHBondContact O-N 3.25Å; E443-Y447 VanDerWaalsContact O-N 3.12Å; E443-Y447 WeakPolarHBondContact OE1-CE2 3.32Å; E443-Y447 PolarHBondContact OE1-OH 2.94Å; E443-Y511 HydrophobicContact CB-CD1 4.25Å; E443-Y511 HydrophobicContact CB-CD2 4.29Å; E443-Y511 HydrophobicContact CB-CG 4.12Å; E443-Y511 HydrophobicContact CG-CD1 4.31Å; E443-Y511 HydrophobicContact CG-CG 4.01Å
444V91.2Very high91Very high11 Ų1112 Ų127%0.0677%0.07CC..Hα-helixtrans-61.8-42.3178.6179.60000110.9T137 Y440 I441 G446 Y447 L485T137-V444 HydrophobicContact CG2-CB 3.98Å; T137-V444 HydrophobicContact CG2-CG1 3.45Å; T137-V444 VanDerWaalsContact CG2-CG1 3.45Å; Y440-V444 HydrophobicContact CD2-CG2 4.29Å; Y440-V444 HydrophobicContact CE1-CG2 4.48Å; Y440-V444 HydrophobicContact CE2-CG2 3.81Å; Y440-V444 WeakPolarHBondContact O-CG2 3.31Å; Y440-V444 PolarHBondContact O-N 2.96Å; I441-V444 PolarHBondContact O-N 3.1Å; V444-G446 VanDerWaalsContact C-N 3.34Å; V444-G446 PolarHBondContact O-N 3.05Å; V444-Y447 PolarHBondContact O-N 2.91Å; V444-L485 HydrophobicContact CG1-CD1 4.12Å; V444-L485 HydrophobicContact CG2-CD1 4.18Å
445A91.5Very high91.8Very high10 Ų1010.2 Ų10.28%0.0835%0.052CC..Hα-helixtrans-61.8-41.7173.900000111.6I441 E443 Y447 L448 T449I441-A445 VanDerWaalsContact O-CB 3.29Å; I441-A445 WeakPolarHBondContact O-CB 3.3Å; I441-A445 PolarHBondContact O-N 3.01Å; E443-A445 VanDerWaalsContact C-N 3.32Å; E443-A445 PolarHBondContact O-N 3.41Å; A445-Y447 PolarHBondContact O-N 3.04Å; A445-L448 PolarHBondContact O-N 3.38Å; A445-L448 VanDerWaalsContact O-N 3.16Å; A445-T449 HydrophobicContact CB-CG2 4.17Å; A445-T449 VanDerWaalsContact O-CB 3.3Å; A445-T449 WeakPolarHBondContact O-CB 3.43Å; A445-T449 VanDerWaalsContact O-CG2 3.24Å; A445-T449 WeakPolarHBondContact O-CG2 3.05Å; A445-T449 PolarHBondContact O-N 2.93Å; A445-T449 PolarHBondContact O-OG1 2.96Å
446G92.5Very high92.5Very high0 Ų010.2 Ų10.20%05%0.051CC..Hα-helixtrans-62.1-24.917800000114Q442 E443 V444 P450 A515Q442-G446 PolarHBondContact O-N 3.35Å; E443-G446 PolarHBondContact O-N 2.94Å; E443-G446 VanDerWaalsContact O-N 3.09Å; V444-G446 VanDerWaalsContact C-N 3.34Å; V444-G446 PolarHBondContact O-N 3.05Å; G446-P450 VanDerWaalsContact O-CD 3.24Å; G446-P450 WeakPolarHBondContact O-CD 3.48Å; G446-P450 WeakPolarHBondContact O-CG 3.4Å; G446-A515 WeakPolarHBondContact O-CB 3.21Å
447Y92.9Very high92.9Very high2 Ų210.2 Ų10.21%0.0085%0.052CC..Hα-helixtrans-81.4-23.9175.5-60.5-35000114.3E443 V444 A445 G481 R484 L485 A488 Y511 F514 L518E443-Y447 VanDerWaalsContact CD-OH 3.32Å; E443-Y447 HydrophobicContact CG-CD2 4.23Å; E443-Y447 HydrophobicContact CG-CE1 4.41Å; E443-Y447 HydrophobicContact CG-CE2 3.34Å; E443-Y447 VanDerWaalsContact CG-CZ 3.43Å; E443-Y447 VanDerWaalsContact CG-OH 3.29Å; E443-Y447 WeakPolarHBondContact CG-OH 3.37Å; E443-Y447 WeakPolarHBondContact O-CD2 3.07Å; E443-Y447 PolarHBondContact O-N 3.25Å; E443-Y447 VanDerWaalsContact O-N 3.12Å; E443-Y447 WeakPolarHBondContact OE1-CE2 3.32Å; E443-Y447 PolarHBondContact OE1-OH 2.94Å; V444-Y447 PolarHBondContact O-N 2.91Å; A445-Y447 PolarHBondContact O-N 3.04Å; Y447-G481 WeakPolarHBondContact O-CA 3.39Å; Y447-R484 HydrophobicContact CD1-CB 4.27Å; Y447-R484 HydrophobicContact CD1-CG 3.55Å; Y447-R484 HydrophobicContact CE1-CG 3.37Å; Y447-R484 HydrophobicContact CE2-CG 4.4Å; Y447-R484 HydrophobicContact CG-CG 4.17Å; Y447-R484 PolarHBondContact OH-NH1 3.29Å; Y447-R484 PolarHBondContact OH-NH2 3.49Å; Y447-R484 VanDerWaalsContact OH-NH2 3.13Å; Y447-L485 HydrophobicContact CD2-CB 4.21Å; Y447-L485 HydrophobicContact CD2-CD1 3.95Å; Y447-A488 HydrophobicContact CE2-CB 4.12Å; Y447-Y511 WeakPolarHBondContact OH-CB 3.4Å; Y447-F514 AromaticContact CD1-CD1 3.74Å; Y447-F514 HydrophobicContact CD1-CD1 3.74Å; Y447-F514 HydrophobicContact CD1-CE1 4.12Å; Y447-F514 HydrophobicContact CE1-CD1 4.11Å; Y447-L518 WeakPolarHBondContact O-CD2 3.25Å
448L92Very high93.2Very high4 Ų411.5 Ų11.52%0.0216%0.059CC..Hα-helixtrans-118.6-28.5-169.4-65.9176.9000114.3L132 L133 A445 F478 L485L132-L448 HydrophobicContact CD2-CD1 4.21Å; L133-L448 HydrophobicContact CD2-CB 3.97Å; L133-L448 HydrophobicContact CD2-CD1 3.64Å; L133-L448 HydrophobicContact CD2-CG 4.45Å; A445-L448 PolarHBondContact O-N 3.38Å; A445-L448 VanDerWaalsContact O-N 3.16Å; L448-F478 HydrophobicContact CD2-CD2 4.44Å; L448-F478 HydrophobicContact CD2-CE2 4.44Å; L448-L485 HydrophobicContact CD1-CD2 4.2Å
449T92.6Very high93.3Very high1 Ų111.2 Ų11.21%0.0066%0.057CC..SBendtrans-87.4-30.3-171.5670000115.9L133 W274 A445 P451 I452 A453L133-T449 HydrophobicContact CD1-CG2 3.95Å; W274-T449 HydrophobicContact CD2-CG2 3.52Å; W274-T449 HydrophobicContact CE3-CG2 3.32Å; W274-T449 HydrophobicContact CG-CG2 4.21Å; W274-T449 HydrophobicContact CH2-CG2 3.97Å; W274-T449 HydrophobicContact CZ2-CG2 4.14Å; W274-T449 HydrophobicContact CZ3-CG2 3.57Å; A445-T449 HydrophobicContact CB-CG2 4.17Å; A445-T449 VanDerWaalsContact O-CB 3.3Å; A445-T449 WeakPolarHBondContact O-CB 3.43Å; A445-T449 VanDerWaalsContact O-CG2 3.24Å; A445-T449 WeakPolarHBondContact O-CG2 3.05Å; A445-T449 PolarHBondContact O-N 2.93Å; A445-T449 PolarHBondContact O-OG1 2.96Å; T449-P451 VanDerWaalsContact C-CD 3.5Å; T449-I452 WeakPolarHBondContact O-CB 3.07Å; T449-I452 PolarHBondContact O-N 3.01Å; T449-A453 PolarHBondContact O-N 3.49Å; T449-A453 VanDerWaalsContact O-N 3.14Å
450P94.8Very high93.5Very high0 Ų010 Ų100%05%0.051CC..Hα-helixtrans-58.6-39.1-177.9-2129.8000115.2A271 G446 I452 A453 A454 A515 L518 F519A271-P450 HydrophobicContact CB-CG 4.28Å; G446-P450 VanDerWaalsContact O-CD 3.24Å; G446-P450 WeakPolarHBondContact O-CD 3.48Å; G446-P450 WeakPolarHBondContact O-CG 3.4Å; P450-I452 PolarHBondContact O-N 3.5Å; P450-A453 PolarHBondContact O-N 2.93Å; P450-A454 PolarHBondContact O-N 2.85Å; P450-A515 WeakPolarHBondContact CB-O 3.46Å; P450-A515 HydrophobicContact CG-CB 3.72Å; P450-L518 HydrophobicContact CG-CD2 4.41Å; P450-F519 HydrophobicContact CB-CB 3.91Å; P450-F519 WeakPolarHBondContact O-CD2 3.37Å
451P94.9Very high93.8Very high0 Ų013.6 Ų13.60%07%0.067CC..Hα-helixtrans-56.2-40.4173.9-27.535.8000112.6T449 A454 L455 L518T449-P451 VanDerWaalsContact C-CD 3.5Å; P451-A454 WeakPolarHBondContact O-CB 3.18Å; P451-A454 PolarHBondContact O-N 3.47Å; P451-L455 WeakPolarHBondContact O-CG 3.18Å; P451-L455 PolarHBondContact O-N 3.4Å; P451-L455 VanDerWaalsContact O-N 3.09Å; P451-L518 HydrophobicContact CG-CD2 3.76Å; P451-L518 HydrophobicContact CG-CG 3.77Å
452I93.8Very high94Very high3 Ų316.3 Ų16.32%0.0158%0.077CC..Hα-helixtrans-65.8-46.5-179.8-50.8174.1000109.9F126 L129 T449 P450 A454 L455 F456F126-I452 HydrophobicContact CD2-CD1 4.16Å; F126-I452 HydrophobicContact CD2-CG1 4.48Å; F126-I452 HydrophobicContact CD2-CG2 3.76Å; F126-I452 HydrophobicContact CE2-CD1 3.95Å; F126-I452 HydrophobicContact CE2-CG2 3.41Å; F126-I452 VanDerWaalsContact CE2-CG2 3.41Å; F126-I452 HydrophobicContact CZ-CG2 4.37Å; L129-I452 HydrophobicContact CD2-CD1 3.51Å; L129-I452 HydrophobicContact CD2-CG1 3.94Å; L129-I452 HydrophobicContact CG-CD1 4.14Å; T449-I452 WeakPolarHBondContact O-CB 3.07Å; T449-I452 PolarHBondContact O-N 3.01Å; P450-I452 PolarHBondContact O-N 3.5Å; I452-A454 PolarHBondContact O-N 3.06Å; I452-L455 PolarHBondContact O-N 3.22Å; I452-L455 VanDerWaalsContact O-N 3.08Å; I452-F456 HydrophobicContact CG2-CD2 3.71Å; I452-F456 HydrophobicContact CG2-CE2 3.75Å; I452-F456 WeakPolarHBondContact O-CD2 3.45Å; I452-F456 PolarHBondContact O-N 2.98Å
453A95.4Very high94Very high0 Ų020 Ų200%09%0.093CC..Hα-helixtrans-56.2-41.9176.300000111.6P270 I273 W274 T449 P450 L455 F456 L457 F519P270-A453 WeakPolarHBondContact O-CB 3.1Å; I273-A453 HydrophobicContact CB-CB 4.37Å; W274-A453 HydrophobicContact CB-CB 4.2Å; T449-A453 PolarHBondContact O-N 3.49Å; T449-A453 VanDerWaalsContact O-N 3.14Å; P450-A453 PolarHBondContact O-N 2.93Å; A453-L455 PolarHBondContact O-N 3.27Å; A453-F456 PolarHBondContact O-N 3.39Å; A453-L457 WeakPolarHBondContact O-CB 2.99Å; A453-L457 WeakPolarHBondContact O-CG 3.49Å; A453-L457 PolarHBondContact O-N 3.4Å; A453-F519 HydrophobicContact CB-CD2 4.36Å; A453-F519 HydrophobicContact CB-CE2 4.29Å
454A96.5Very high94.1Very high2 Ų220.8 Ų20.82%0.0179%0.093CC..Hα-helixtrans-60.5-45.2175.300000111.9P450 P451 I452 L457 L458 F519P450-A454 PolarHBondContact O-N 2.85Å; P451-A454 WeakPolarHBondContact O-CB 3.18Å; P451-A454 PolarHBondContact O-N 3.47Å; I452-A454 PolarHBondContact O-N 3.06Å; A454-L457 PolarHBondContact O-N 3.01Å; A454-L458 WeakPolarHBondContact O-CB 3.48Å; A454-L458 VanDerWaalsContact O-CG 3.27Å; A454-L458 WeakPolarHBondContact O-CG 3.39Å; A454-L458 PolarHBondContact O-N 2.94Å; A454-F519 VanDerWaalsContact CA-CE2 3.49Å; A454-F519 HydrophobicContact CB-CD2 3.73Å; A454-F519 HydrophobicContact CB-CE2 3.7Å; A454-F519 HydrophobicContact CB-CG 4.46Å; A454-F519 HydrophobicContact CB-CZ 4.39Å
455L95.3Very high94.2Very high3 Ų320.2 Ų20.22%0.0169%0.09CC..Hα-helixtrans-64.4-41.5179.3-65.6-173.9000113L122 P451 I452 A453 G459 A470 A526L122-L455 HydrophobicContact CD1-CD1 4.15Å; P451-L455 WeakPolarHBondContact O-CG 3.18Å; P451-L455 PolarHBondContact O-N 3.4Å; P451-L455 VanDerWaalsContact O-N 3.09Å; I452-L455 PolarHBondContact O-N 3.22Å; I452-L455 VanDerWaalsContact O-N 3.08Å; A453-L455 PolarHBondContact O-N 3.27Å; L455-G459 PolarHBondContact O-N 3.31Å; L455-A470 WeakPolarHBondContact CD1-O 3.35Å; L455-A470 HydrophobicContact CD2-CB 3.99Å; L455-A470 VanDerWaalsContact CD2-O 3.3Å; L455-A470 WeakPolarHBondContact CD2-O 3.42Å; L455-A526 HydrophobicContact CD2-CB 4.23Å
456F95.3Very high94.3Very high1 Ų120 Ų200%0.0049%0.087CC..Hα-helixtrans-67.7-42.4177.6-89.4-98.3000111.7F97 Y101 M109 Y112 L113 F126 A278 I452 A453 G459 V460F97-F456 HydrophobicContact CE1-CB 4.25Å; Y101-F456 VanDerWaalsContact OH-CD1 3.28Å; Y101-F456 WeakPolarHBondContact OH-CD1 3.01Å; Y101-F456 WeakPolarHBondContact OH-CE1 3.45Å; M109-F456 HydrophobicContact CB-CE1 4.43Å; M109-F456 HydrophobicContact CB-CZ 4.07Å; M109-F456 HydrophobicContact SD-CE1 4.31Å; Y112-F456 HydrophobicContact CD1-CD1 4.05Å; Y112-F456 AromaticContact CD1-CE1 3.62Å; Y112-F456 HydrophobicContact CD1-CE1 3.62Å; Y112-F456 HydrophobicContact CD1-CZ 4.38Å; Y112-F456 HydrophobicContact CE1-CD1 4.05Å; Y112-F456 HydrophobicContact CE1-CE1 4.11Å; L113-F456 HydrophobicContact CD1-CE2 3.8Å; L113-F456 HydrophobicContact CD1-CZ 4.04Å; L113-F456 HydrophobicContact CD2-CD2 4.21Å; L113-F456 HydrophobicContact CD2-CE1 4.46Å; L113-F456 HydrophobicContact CD2-CE2 3.86Å; L113-F456 HydrophobicContact CD2-CZ 3.99Å; L113-F456 HydrophobicContact CG-CE2 3.97Å; L113-F456 HydrophobicContact CG-CZ 3.85Å; F126-F456 HydrophobicContact CD2-CE2 4.48Å; F126-F456 HydrophobicContact CE1-CE2 4.39Å; F126-F456 HydrophobicContact CE1-CZ 4.21Å; F126-F456 HydrophobicContact CE2-CE2 4.18Å; F126-F456 HydrophobicContact CZ-CE2 4.11Å; F126-F456 HydrophobicContact CZ-CZ 4.24Å; A278-F456 HydrophobicContact CB-CD1 3.89Å; A278-F456 HydrophobicContact CB-CD2 3.89Å; A278-F456 HydrophobicContact CB-CE1 3.89Å; A278-F456 HydrophobicContact CB-CE2 3.88Å; A278-F456 HydrophobicContact CB-CG 3.89Å; A278-F456 HydrophobicContact CB-CZ 3.89Å; I452-F456 HydrophobicContact CG2-CD2 3.71Å; I452-F456 HydrophobicContact CG2-CE2 3.75Å; I452-F456 WeakPolarHBondContact O-CD2 3.45Å; I452-F456 PolarHBondContact O-N 2.98Å; A453-F456 PolarHBondContact O-N 3.39Å; F456-G459 PolarHBondContact O-N 3Å; F456-V460 WeakPolarHBondContact O-CB 3.2Å; F456-V460 VanDerWaalsContact O-CG2 3.32Å; F456-V460 WeakPolarHBondContact O-CG2 3.46Å; F456-V460 PolarHBondContact O-N 3.23Å
457L96.1Very high94.3Very high35 Ų3521.8 Ų21.818%0.18310%0.095CC..Hα-helixtrans-61.9-46.9174.6-73.4172.4000111.6F97 I273 A453 A454 G459 V460 F461 F519F97-L457 HydrophobicContact CE2-CD2 4.45Å; F97-L457 HydrophobicContact CZ-CD2 4Å; I273-L457 HydrophobicContact CD1-CD1 3.9Å; I273-L457 HydrophobicContact CD1-CD2 4.45Å; I273-L457 HydrophobicContact CG2-CD2 4.34Å; I273-L457 HydrophobicContact CG2-CG 4.35Å; A453-L457 WeakPolarHBondContact O-CB 2.99Å; A453-L457 WeakPolarHBondContact O-CG 3.49Å; A453-L457 PolarHBondContact O-N 3.4Å; A454-L457 PolarHBondContact O-N 3.01Å; L457-G459 VanDerWaalsContact C-N 3.31Å; L457-G459 PolarHBondContact O-N 3.45Å; L457-V460 PolarHBondContact O-N 3.28Å; L457-F461 HydrophobicContact CD2-CD2 4.02Å; L457-F461 HydrophobicContact CD2-CE2 3.72Å; L457-F461 WeakPolarHBondContact O-CB 3.17Å; L457-F461 WeakPolarHBondContact O-CD2 3.39Å; L457-F461 PolarHBondContact O-N 3.03Å; L457-F519 HydrophobicContact CD1-CE2 3.85Å; L457-F519 HydrophobicContact CD1-CZ 3.75Å
458L96Very high94.3Very high30 Ų3023.9 Ų23.916%0.15711%0.109CC..Hα-helixtrans-63.5-38.4175.7-70.5173.9000111.8A454 W462 C465 A526 V527A454-L458 WeakPolarHBondContact O-CB 3.48Å; A454-L458 VanDerWaalsContact O-CG 3.27Å; A454-L458 WeakPolarHBondContact O-CG 3.39Å; A454-L458 PolarHBondContact O-N 2.94Å; L458-W462 HydrophobicContact CD2-CB 4.34Å; L458-W462 HydrophobicContact CD2-CE3 3.97Å; L458-W462 WeakPolarHBondContact O-CA 3.43Å; L458-W462 WeakPolarHBondContact O-CB 3.39Å; L458-W462 PolarHBondContact O-N 3.33Å; L458-W462 VanDerWaalsContact O-O 3.1Å; L458-C465 HydrophobicContact CB-CB 4.46Å; L458-A526 HydrophobicContact CD1-CB 3.67Å; L458-V527 HydrophobicContact CD1-CG2 4.28Å; L458-V527 HydrophobicContact CD2-CG2 3.95Å
459G93.8Very high94.4Very high0 Ų023.7 Ų23.70%011%0.108CC..Hα-helixtrans-61.1-47.4176.900000112.4R116 L455 F456 L457R116-G459 WeakPolarHBondContact CD-O 3.24Å; R116-G459 PolarHBondContact NE-O 2.96Å; L455-G459 PolarHBondContact O-N 3.31Å; F456-G459 PolarHBondContact O-N 3Å; L457-G459 VanDerWaalsContact C-N 3.31Å; L457-G459 PolarHBondContact O-N 3.45Å
460V95.1Very high94.5Very high0 Ų023.7 Ų23.70%011%0.108CC..Hα-helixtrans-76.8-41.7-175.4170.40000112.6V96 F97 V100 Y112 F456 L457 T545 V546V96-V460 HydrophobicContact CG1-CG1 3.88Å; F97-V460 HydrophobicContact CD1-CG2 3.84Å; F97-V460 HydrophobicContact CE1-CB 4.41Å; F97-V460 HydrophobicContact CE1-CG2 3.69Å; V100-V460 HydrophobicContact CG2-CG1 4.38Å; Y112-V460 HydrophobicContact CE1-CG2 4.35Å; Y112-V460 WeakPolarHBondContact OH-CG2 2.97Å; F456-V460 WeakPolarHBondContact O-CB 3.2Å; F456-V460 VanDerWaalsContact O-CG2 3.32Å; F456-V460 WeakPolarHBondContact O-CG2 3.46Å; F456-V460 PolarHBondContact O-N 3.23Å; L457-V460 PolarHBondContact O-N 3.28Å; V460-T545 WeakPolarHBondContact O-CA 3.17Å; V460-V546 HydrophobicContact CG1-CG2 3.53Å; V460-V546 PolarHBondContact O-N 3.39Å; V460-V546 VanDerWaalsContact O-N 3.15Å
461F95.4Very high94.5Very high87 Ų8725 Ų2538%0.38211%0.113SC..Hα-helixtrans-98.8-28.2-171.7-69.9-74.6000114.6V96 L457 V546 W547V96-F461 HydrophobicContact CB-CZ 4.48Å; V96-F461 HydrophobicContact CG1-CE1 3.95Å; V96-F461 HydrophobicContact CG1-CE2 4.02Å; V96-F461 HydrophobicContact CG1-CZ 3.41Å; V96-F461 VanDerWaalsContact CG1-CZ 3.41Å; V96-F461 HydrophobicContact CG2-CZ 4.37Å; L457-F461 HydrophobicContact CD2-CD2 4.02Å; L457-F461 HydrophobicContact CD2-CE2 3.72Å; L457-F461 WeakPolarHBondContact O-CB 3.17Å; L457-F461 WeakPolarHBondContact O-CD2 3.39Å; L457-F461 PolarHBondContact O-N 3.03Å; F461-V546 HydrophobicContact CD1-CG2 4.33Å; F461-V546 HydrophobicContact CE1-CG2 4.25Å; F461-W547 PolarHBondContact O-NE1 3.49Å
462W95.3Very high94.5Very high68 Ų6831.8 Ų31.826%0.25814%0.139SC..  trans-111.3112.5-172.3-168.947.5000112.4R116 L458 R464 C465 V527 L531R116-W462 PolarHBondContact NH2-O 2.85Å; L458-W462 HydrophobicContact CD2-CB 4.34Å; L458-W462 HydrophobicContact CD2-CE3 3.97Å; L458-W462 WeakPolarHBondContact O-CA 3.43Å; L458-W462 WeakPolarHBondContact O-CB 3.39Å; L458-W462 PolarHBondContact O-N 3.33Å; L458-W462 VanDerWaalsContact O-O 3.1Å; W462-R464 VanDerWaalsContact C-N 3.27Å; W462-R464 HydrophobicContact CD2-CB 4.23Å; W462-R464 HydrophobicContact CH2-CB 4.3Å; W462-R464 HydrophobicContact CH2-CG 4.34Å; W462-R464 HydrophobicContact CZ2-CB 3.69Å; W462-R464 HydrophobicContact CZ2-CG 3.93Å; W462-R464 PolarHBondContact O-N 3.48Å; W462-C465 HydrophobicContact CD2-CB 4.36Å; W462-C465 HydrophobicContact CE3-CB 3.51Å; W462-C465 HydrophobicContact CZ3-CB 3.98Å; W462-V527 HydrophobicContact CE3-CG2 4.18Å; W462-V527 HydrophobicContact CH2-CB 4.09Å; W462-V527 HydrophobicContact CH2-CG1 3.85Å; W462-V527 HydrophobicContact CH2-CG2 4.07Å; W462-V527 HydrophobicContact CZ2-CG1 4.32Å; W462-V527 HydrophobicContact CZ3-CB 4.14Å; W462-V527 HydrophobicContact CZ3-CG1 4.37Å; W462-V527 HydrophobicContact CZ3-CG2 3.76Å; W462-L531 HydrophobicContact CH2-CD2 4.21Å; W462-L531 HydrophobicContact CH2-CG 4.05Å; W462-L531 HydrophobicContact CZ2-CD2 3.92Å; W462-L531 HydrophobicContact CZ2-CG 4.18Å
463K92.8Very high94.6Very high109 Ų10931.6 Ų31.647%0.47414%0.138SC..THydrogen-bonded Turntrans-63.2-30.8-177.7-62-178.7-178.4177.30113.6R116 P536 V541 W547R116-K463 PolarHBondContact NH2-O 3.27Å; K463-P536 VanDerWaalsContact O-CG 3.26Å; K463-P536 WeakPolarHBondContact O-CG 3.46Å; K463-V541 HydrophobicContact CB-CG1 3.95Å; K463-V541 HydrophobicContact CD-CG1 4.35Å; K463-V541 HydrophobicContact CG-CG1 3.84Å; K463-W547 HydrophobicContact CD-CB 4.4Å; K463-W547 HydrophobicContact CD-CG 4.34Å; K463-W547 HydrophobicContact CG-CG 4.25Å
464R93.1Very high94.6Very high70 Ų7031.6 Ų31.626%0.26414%0.138SC..THydrogen-bonded Turntrans-83.9-12.3-171-175.459.1-176.287.1-0.8113.9W462 N466 S530 L531 T533W462-R464 VanDerWaalsContact C-N 3.27Å; W462-R464 HydrophobicContact CD2-CB 4.23Å; W462-R464 HydrophobicContact CH2-CB 4.3Å; W462-R464 HydrophobicContact CH2-CG 4.34Å; W462-R464 HydrophobicContact CZ2-CB 3.69Å; W462-R464 HydrophobicContact CZ2-CG 3.93Å; W462-R464 PolarHBondContact O-N 3.48Å; R464-N466 PolarHBondContact NH1-ND2 2.99Å; R464-N466 PolarHBondContact O-N 3.41Å; R464-S530 PolarHBondContact NH1-O 3.35Å; R464-S530 PolarHBondContact NH2-O 3.32Å; R464-S530 VanDerWaalsContact NH2-O 3.14Å; R464-L531 HydrophobicContact CG-CD2 3.96Å; R464-L531 PolarHBondContact NH2-O 3.36Å; R464-T533 PolarHBondContact NH1-O 3.2Å; R464-T533 PolarHBondContact NH2-O 3.5Å
465C93.4Very high94.5Very high0 Ų034 Ų340%015%0.15CC..  trans-60.8126.8177-154.70000110.5R116 F117 L458 W462R116-C465 PolarHBondContact NH1-O 3.16Å; R116-C465 PolarHBondContact NH2-O 3.3Å; F117-C465 HydrophobicContact CE1-CB 3.97Å; L458-C465 HydrophobicContact CB-CB 4.46Å; W462-C465 HydrophobicContact CD2-CB 4.36Å; W462-C465 HydrophobicContact CE3-CB 3.51Å; W462-C465 HydrophobicContact CZ3-CB 3.98Å
466N92.9Very high94.6Very high5 Ų536 Ų363%0.02716%0.162CC..  trans-118.1173.7179.862.927.6000111.9R464 T468 G469 A470 S530 T533 S534R464-N466 PolarHBondContact NH1-ND2 2.99Å; R464-N466 PolarHBondContact O-N 3.41Å; N466-T468 PolarHBondContact O-N 3.21Å; N466-T468 PolarHBondContact OD1-OG1 3.35Å; N466-G469 PolarHBondContact O-N 3.28Å; N466-G469 PolarHBondContact OD1-N 3.13Å; N466-A470 WeakPolarHBondContact O-CB 3.46Å; N466-A470 PolarHBondContact O-N 3.39Å; N466-S530 PolarHBondContact N-OG 3.47Å; N466-S530 PolarHBondContact ND2-O 3.43Å; N466-S530 VanDerWaalsContact ND2-O 3.12Å; N466-S530 WeakPolarHBondContact OD1-CA 3.36Å; N466-S530 PolarHBondContact OD1-OG 3.41Å; N466-T533 PolarHBondContact ND2-OG1 3.36Å; N466-T533 PolarHBondContact OD1-OG1 2.9Å; N466-S534 PolarHBondContact ND2-O 3.49Å
467E92.9Very high94.5Very high37 Ų3735.9 Ų35.917%0.17316%0.161CC..Hα-helixtrans-59.9-46-176.8-167.4-88.1174.100112.7F117 G469 A470 F471F117-E467 HydrophobicContact CB-CB 4.11Å; F117-E467 HydrophobicContact CB-CG 4.27Å; F117-E467 WeakPolarHBondContact O-CB 3.25Å; E467-G469 PolarHBondContact O-N 2.74Å; E467-A470 PolarHBondContact O-N 3.14Å; E467-F471 VanDerWaalsContact O-CB 3.27Å; E467-F471 WeakPolarHBondContact O-CB 3.47Å; E467-F471 PolarHBondContact O-N 2.91Å
468T92.7Very high94.4Very high47 Ų4737.1 Ų37.129%0.28817%0.165SC..Hα-helixtrans-62.4-43.9-177.739.10000111.6N466 W472 T533N466-T468 PolarHBondContact O-N 3.21Å; N466-T468 PolarHBondContact OD1-OG1 3.35Å; T468-W472 PolarHBondContact O-N 3.41Å; T468-W472 VanDerWaalsContact O-N 3.08Å; T468-T533 WeakPolarHBondContact OG1-CB 3.37Å; T468-T533 PolarHBondContact OG1-OG1 3.36Å
469G94.6Very high94.4Very high0 Ų039 Ų390%018%0.178CC..Hα-helixtrans-65.3-47.5175.800000112.1N466 E467 F471 W472 G473 A526N466-G469 PolarHBondContact O-N 3.28Å; N466-G469 PolarHBondContact OD1-N 3.13Å; E467-G469 PolarHBondContact O-N 2.74Å; G469-F471 VanDerWaalsContact C-N 3.33Å; G469-F471 PolarHBondContact O-N 3.27Å; G469-W472 PolarHBondContact O-N 3.41Å; G469-G473 PolarHBondContact O-N 3.43Å; G469-A526 VanDerWaalsContact O-CA 3.29Å; G469-A526 WeakPolarHBondContact O-CA 3.41Å
470A94.9Very high94.5Very high0 Ų042 Ų420%019%0.194CC..Hα-helixtrans-60.9-41.5178.700000112.6F117 L122 L455 N466 E467 G474F117-A470 HydrophobicContact CD1-CB 3.82Å; F117-A470 HydrophobicContact CD2-CB 4.36Å; F117-A470 HydrophobicContact CE1-CB 3.65Å; F117-A470 HydrophobicContact CE2-CB 4.19Å; F117-A470 HydrophobicContact CG-CB 4.17Å; F117-A470 HydrophobicContact CZ-CB 3.83Å; L122-A470 HydrophobicContact CD2-CB 4Å; L455-A470 WeakPolarHBondContact CD1-O 3.35Å; L455-A470 HydrophobicContact CD2-CB 3.99Å; L455-A470 VanDerWaalsContact CD2-O 3.3Å; L455-A470 WeakPolarHBondContact CD2-O 3.42Å; N466-A470 WeakPolarHBondContact O-CB 3.46Å; N466-A470 PolarHBondContact O-N 3.39Å; E467-A470 PolarHBondContact O-N 3.14Å; A470-G474 PolarHBondContact O-N 3.47Å
471F94.6Very high94.5Very high28 Ų2842 Ų4212%0.12319%0.194CC..Hα-helixtrans-64.4-50.5178.2-179.8-97.6000112R121 E467 G469 G474 M475R121-F471 HydrophobicContact CB-CD2 4.25Å; R121-F471 HydrophobicContact CB-CE2 4.27Å; E467-F471 VanDerWaalsContact O-CB 3.27Å; E467-F471 WeakPolarHBondContact O-CB 3.47Å; E467-F471 PolarHBondContact O-N 2.91Å; G469-F471 VanDerWaalsContact C-N 3.33Å; G469-F471 PolarHBondContact O-N 3.27Å; F471-G474 PolarHBondContact O-N 2.86Å; F471-M475 HydrophobicContact CE2-CE 4.19Å; F471-M475 HydrophobicContact CZ-CE 3.93Å; F471-M475 VanDerWaalsContact O-CB 3.29Å; F471-M475 WeakPolarHBondContact O-CB 3.42Å; F471-M475 PolarHBondContact O-N 3.27Å
472W95.1Very high94.4Very high142 Ų14239.6 Ų39.654%0.53819%0.186SC..Hα-helixtrans-70.5-35.3-179.3-75.1113.2000113T468 G469 T476 V525T468-W472 PolarHBondContact O-N 3.41Å; T468-W472 VanDerWaalsContact O-N 3.08Å; G469-W472 PolarHBondContact O-N 3.41Å; W472-T476 WeakPolarHBondContact O-CB 3.47Å; W472-T476 PolarHBondContact O-N 2.81Å; W472-T476 PolarHBondContact O-OG1 2.89Å; W472-V525 HydrophobicContact CB-CG1 4.31Å
473G95.8Very high94.4Very high0 Ų040.5 Ų40.50%020%0.195CC..Hα-helixtrans-61-51.4171.500000111.3G469 M475 T476 G477 S522G469-G473 PolarHBondContact O-N 3.43Å; G473-M475 PolarHBondContact O-N 3.01Å; G473-T476 PolarHBondContact O-N 3Å; G473-G477 PolarHBondContact O-N 3.25Å; G473-S522 WeakPolarHBondContact CA-O 3.44Å; G473-S522 PolarHBondContact O-OG 3.35Å; G473-S522 VanDerWaalsContact O-OG 3.07Å
474G94.7Very high94.4Very high0 Ų035.9 Ų35.90%018%0.175CC..Hα-helixtrans-58.2-46.9175.900000113.2Y125 A470 F471 G477 F478Y125-G474 PolarHBondContact OH-O 3.11Å; A470-G474 PolarHBondContact O-N 3.47Å; F471-G474 PolarHBondContact O-N 2.86Å; G474-G477 PolarHBondContact O-N 3.46Å; G474-F478 WeakPolarHBondContact O-CB 3.38Å; G474-F478 PolarHBondContact O-N 2.78Å
475M94.7Very high94.3Very high53 Ų5334.8 Ų34.826%0.26117%0.174SC..Hα-helixtrans-65.1-41.8-179.8-171.258.462.100112.2Y125 F471 G473 G477 F478 V479Y125-M475 HydrophobicContact CD2-CE 4.34Å; F471-M475 HydrophobicContact CE2-CE 4.19Å; F471-M475 HydrophobicContact CZ-CE 3.93Å; F471-M475 VanDerWaalsContact O-CB 3.29Å; F471-M475 WeakPolarHBondContact O-CB 3.42Å; F471-M475 PolarHBondContact O-N 3.27Å; G473-M475 PolarHBondContact O-N 3.01Å; M475-G477 VanDerWaalsContact C-N 3.33Å; M475-G477 PolarHBondContact O-N 2.89Å; M475-F478 PolarHBondContact O-N 2.92Å; M475-F478 HydrophobicContact SD-CD1 4.22Å; M475-V479 HydrophobicContact CG-CG2 4.45Å; M475-V479 VanDerWaalsContact O-CG2 3.31Å; M475-V479 WeakPolarHBondContact O-CG2 3.39Å; M475-V479 PolarHBondContact O-N 3.28Å; M475-V479 HydrophobicContact SD-CG2 4.29Å
476T96.3Very high94.3Very high43 Ų4338.8 Ų38.826%0.26420%0.195SC..Hα-helixtrans-60.3-46.7175.8-57.20000110.5W472 G473 V479 L480 I521 V525W472-T476 WeakPolarHBondContact O-CB 3.47Å; W472-T476 PolarHBondContact O-N 2.81Å; W472-T476 PolarHBondContact O-OG1 2.89Å; G473-T476 PolarHBondContact O-N 3Å; T476-V479 PolarHBondContact O-N 3.16Å; T476-L480 HydrophobicContact CG2-CD1 4.1Å; T476-L480 WeakPolarHBondContact O-CB 3.47Å; T476-L480 WeakPolarHBondContact O-CG 3.26Å; T476-L480 PolarHBondContact O-N 2.96Å; T476-I521 HydrophobicContact CG2-CG2 4.15Å; T476-V525 HydrophobicContact CG2-CG2 4.36Å
477G95.1Very high94.2Very high0 Ų041.4 Ų41.40%021%0.208CC..Hα-helixtrans-61.6-43.517500000113G473 G474 M475 V479 G481 L518G473-G477 PolarHBondContact O-N 3.25Å; G474-G477 PolarHBondContact O-N 3.46Å; M475-G477 VanDerWaalsContact C-N 3.33Å; M475-G477 PolarHBondContact O-N 2.89Å; G477-V479 PolarHBondContact O-N 2.04Å; G477-G481 PolarHBondContact O-N 3.48Å; G477-L518 WeakPolarHBondContact O-CD1 3.37Å
478F93.9Very high93.9Very high60 Ų6040.3 Ų40.326%0.26321%0.205SC..Hα-helixtrans-62.1-44.3178178.8-105.8000112.6Y125 L129 L448 G474 M475 T482Y125-F478 HydrophobicContact CE2-CB 4.09Å; Y125-F478 HydrophobicContact CE2-CD2 4.38Å; Y125-F478 HydrophobicContact CE2-CG 4.1Å; Y125-F478 WeakPolarHBondContact OH-CB 3.21Å; L129-F478 HydrophobicContact CD1-CD2 4.02Å; L129-F478 HydrophobicContact CD1-CE2 3.8Å; L129-F478 HydrophobicContact CD2-CD2 4.36Å; L448-F478 HydrophobicContact CD2-CD2 4.44Å; L448-F478 HydrophobicContact CD2-CE2 4.44Å; G474-F478 WeakPolarHBondContact O-CB 3.38Å; G474-F478 PolarHBondContact O-N 2.78Å; M475-F478 PolarHBondContact O-N 2.92Å; M475-F478 HydrophobicContact SD-CD1 4.22Å; F478-T482 VanDerWaalsContact O-CB 3.24Å; F478-T482 WeakPolarHBondContact O-CB 3.47Å; F478-T482 PolarHBondContact O-N 2.88Å; F478-T482 PolarHBondContact O-OG1 3.03Å
479V95.8Very high93.6Very high69 Ų6941.4 Ų41.442%0.41821%0.206SC..Hα-helixtrans-64.5-50.4179.1170.40000110.6M475 T476 G477 G481 T482 I483M475-V479 HydrophobicContact CG-CG2 4.45Å; M475-V479 VanDerWaalsContact O-CG2 3.31Å; M475-V479 WeakPolarHBondContact O-CG2 3.39Å; M475-V479 PolarHBondContact O-N 3.28Å; M475-V479 HydrophobicContact SD-CG2 4.29Å; T476-V479 PolarHBondContact O-N 3.16Å; G477-V479 PolarHBondContact O-N 2.04Å; V479-G481 VanDerWaalsContact C-N 3.33Å; V479-G481 PolarHBondContact O-N 3.06Å; V479-T482 PolarHBondContact O-N 3.22Å; V479-I483 HydrophobicContact CG1-CD1 3.78Å; V479-I483 WeakPolarHBondContact O-CB 3.46Å; V479-I483 VanDerWaalsContact O-CG1 3.23Å; V479-I483 WeakPolarHBondContact O-CG1 3.4Å; V479-I483 PolarHBondContact O-N 3.09Å
480L96.2Very high93.3Very high65 Ų6548.5 Ų48.534%0.3424%0.237SC..Hα-helixtrans-61.1-42.7178.4-68.8176.7000111.9T476 I483 R484 L518 I521T476-L480 HydrophobicContact CG2-CD1 4.1Å; T476-L480 WeakPolarHBondContact O-CB 3.47Å; T476-L480 WeakPolarHBondContact O-CG 3.26Å; T476-L480 PolarHBondContact O-N 2.96Å; L480-I483 PolarHBondContact O-N 3.38Å; L480-R484 PolarHBondContact O-N 3.15Å; L480-L518 HydrophobicContact CB-CD1 3.57Å; L480-L518 HydrophobicContact CD1-CD1 4.31Å; L480-I521 HydrophobicContact CD1-CD1 4.43Å; L480-I521 HydrophobicContact CD1-CG2 4.1Å
481G94.9Very high92.9Very high0 Ų053.3 Ų53.30%026%0.256CS..Hα-helixtrans-61.6-47.8176.200000113.2Y447 G477 V479 I483 R484 L485Y447-G481 WeakPolarHBondContact O-CA 3.39Å; G477-G481 PolarHBondContact O-N 3.48Å; V479-G481 VanDerWaalsContact C-N 3.33Å; V479-G481 PolarHBondContact O-N 3.06Å; G481-I483 PolarHBondContact O-N 3.45Å; G481-R484 PolarHBondContact O-N 3.23Å; G481-L485 WeakPolarHBondContact O-CB 3.23Å; G481-L485 PolarHBondContact O-N 2.94Å
482T93.6Very high92.3Very high36 Ų3657.6 Ų57.622%0.22127%0.272CS..Hα-helixtrans-64.7-40178.5-56.90000111.4F478 V479 R484 L485 I486F478-T482 VanDerWaalsContact O-CB 3.24Å; F478-T482 WeakPolarHBondContact O-CB 3.47Å; F478-T482 PolarHBondContact O-N 2.88Å; F478-T482 PolarHBondContact O-OG1 3.03Å; V479-T482 PolarHBondContact O-N 3.22Å; T482-R484 VanDerWaalsContact C-N 3.34Å; T482-R484 PolarHBondContact O-N 3.21Å; T482-L485 PolarHBondContact O-N 3.03Å; T482-I486 HydrophobicContact CG2-CD1 3.84Å; T482-I486 HydrophobicContact CG2-CG1 4.32Å; T482-I486 WeakPolarHBondContact O-CB 3.29Å; T482-I486 VanDerWaalsContact O-CG1 3.25Å; T482-I486 WeakPolarHBondContact O-CG1 3.44Å; T482-I486 PolarHBondContact O-N 3.16Å
483I94.4Very high91.6Very high87 Ų8757.4 Ų57.445%0.44628%0.277SS..Hα-helixtrans-58.7-47.4173.5-70.9165.6000110.1V479 L480 G481 L485 I486 L487V479-I483 HydrophobicContact CG1-CD1 3.78Å; V479-I483 WeakPolarHBondContact O-CB 3.46Å; V479-I483 VanDerWaalsContact O-CG1 3.23Å; V479-I483 WeakPolarHBondContact O-CG1 3.4Å; V479-I483 PolarHBondContact O-N 3.09Å; L480-I483 PolarHBondContact O-N 3.38Å; G481-I483 PolarHBondContact O-N 3.45Å; I483-L485 VanDerWaalsContact C-N 3.34Å; I483-L485 PolarHBondContact O-N 3.44Å; I483-I486 PolarHBondContact O-N 3.08Å; I483-L487 HydrophobicContact CG2-CD1 3.93Å; I483-L487 HydrophobicContact CG2-CG 4.41Å; I483-L487 WeakPolarHBondContact O-CB 3.41Å; I483-L487 VanDerWaalsContact O-CG 3.26Å; I483-L487 WeakPolarHBondContact O-CG 3.4Å; I483-L487 PolarHBondContact O-N 3.05Å
484R92.9Very high91Very high11 Ų1159 Ų594%0.04229%0.287CS..Hα-helixtrans-63.7-38.8178.4-178.862.3175.883.8-1.8112.6Y447 L480 G481 T482 L487 A488 F514Y447-R484 HydrophobicContact CD1-CB 4.27Å; Y447-R484 HydrophobicContact CD1-CG 3.55Å; Y447-R484 HydrophobicContact CE1-CG 3.37Å; Y447-R484 HydrophobicContact CE2-CG 4.4Å; Y447-R484 HydrophobicContact CG-CG 4.17Å; Y447-R484 PolarHBondContact OH-NH1 3.29Å; Y447-R484 PolarHBondContact OH-NH2 3.49Å; Y447-R484 VanDerWaalsContact OH-NH2 3.13Å; L480-R484 PolarHBondContact O-N 3.15Å; G481-R484 PolarHBondContact O-N 3.23Å; T482-R484 VanDerWaalsContact C-N 3.34Å; T482-R484 PolarHBondContact O-N 3.21Å; R484-L487 PolarHBondContact O-N 3.37Å; R484-A488 WeakPolarHBondContact O-CB 3.03Å; R484-A488 PolarHBondContact O-N 3.24Å; R484-F514 HydrophobicContact CB-CD1 4.25Å; R484-F514 HydrophobicContact CB-CE1 3.55Å; R484-F514 HydrophobicContact CB-CE2 3.92Å; R484-F514 HydrophobicContact CB-CZ 3.37Å; R484-F514 HydrophobicContact CG-CD1 3.88Å; R484-F514 HydrophobicContact CG-CD2 4.15Å; R484-F514 HydrophobicContact CG-CE1 3.72Å; R484-F514 HydrophobicContact CG-CE2 4Å; R484-F514 HydrophobicContact CG-CG 4.09Å; R484-F514 HydrophobicContact CG-CZ 3.79Å
485L91.6Very high90.4Very high47 Ų4764.2 Ų64.225%0.24631%0.307CS..Hα-helixtrans-64.3-45.8175.8-179.766.9000111.5V444 Y447 L448 G481 T482 I483 L487 A488 F489V444-L485 HydrophobicContact CG1-CD1 4.12Å; V444-L485 HydrophobicContact CG2-CD1 4.18Å; Y447-L485 HydrophobicContact CD2-CB 4.21Å; Y447-L485 HydrophobicContact CD2-CD1 3.95Å; L448-L485 HydrophobicContact CD1-CD2 4.2Å; G481-L485 WeakPolarHBondContact O-CB 3.23Å; G481-L485 PolarHBondContact O-N 2.94Å; T482-L485 PolarHBondContact O-N 3.03Å; I483-L485 VanDerWaalsContact C-N 3.34Å; I483-L485 PolarHBondContact O-N 3.44Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-L487 PolarHBondContact O-N 3.16Å; L485-A488 WeakPolarHBondContact O-CB 2.96Å; L485-A488 PolarHBondContact O-N 2.54Å; L485-F489 PolarHBondContact O-N 3.48Å
486I92.1Very high89.9Confident85 Ų8564.1 Ų64.144%0.43631%0.311SS..Hα-helixtrans-61.4-44.2176.1-70.5169.7000110.3T482 I483 A488 F489 F490T482-I486 HydrophobicContact CG2-CD1 3.84Å; T482-I486 HydrophobicContact CG2-CG1 4.32Å; T482-I486 WeakPolarHBondContact O-CB 3.29Å; T482-I486 VanDerWaalsContact O-CG1 3.25Å; T482-I486 WeakPolarHBondContact O-CG1 3.44Å; T482-I486 PolarHBondContact O-N 3.16Å; I483-I486 PolarHBondContact O-N 3.08Å; I486-A488 VanDerWaalsContact C-N 3.34Å; I486-A488 PolarHBondContact O-N 3.28Å; I486-F489 WeakPolarHBondContact O-CB 3.41Å; I486-F489 PolarHBondContact O-N 3.22Å; I486-F489 VanDerWaalsContact O-N 3.15Å; I486-F490 HydrophobicContact CG2-CD2 3.61Å; I486-F490 HydrophobicContact CG2-CE2 3.42Å; I486-F490 VanDerWaalsContact CG2-CE2 3.42Å; I486-F490 WeakPolarHBondContact O-CD2 3.42Å; I486-F490 PolarHBondContact O-N 2.85Å
487L91.3Very high89.2Confident59 Ų5965.7 Ų65.731%0.30932%0.318SS..Hα-helixtrans-62.5-39.7175.7-70.4172.1000112.1I483 R484 L485 F489 F490 Y491 I506I483-L487 HydrophobicContact CG2-CD1 3.93Å; I483-L487 HydrophobicContact CG2-CG 4.41Å; I483-L487 WeakPolarHBondContact O-CB 3.41Å; I483-L487 VanDerWaalsContact O-CG 3.26Å; I483-L487 WeakPolarHBondContact O-CG 3.4Å; I483-L487 PolarHBondContact O-N 3.05Å; R484-L487 PolarHBondContact O-N 3.37Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-L487 PolarHBondContact O-N 3.16Å; L487-F489 VanDerWaalsContact C-N 3.27Å; L487-F489 PolarHBondContact O-N 2.95Å; L487-F490 PolarHBondContact O-N 2.88Å; L487-Y491 HydrophobicContact CD2-CD2 4.21Å; L487-Y491 HydrophobicContact CD2-CE2 3.97Å; L487-Y491 WeakPolarHBondContact O-CB 3.45Å; L487-Y491 WeakPolarHBondContact O-CD2 3.14Å; L487-Y491 PolarHBondContact O-N 3.26Å; L487-I506 HydrophobicContact CB-CD1 3.9Å; L487-I506 HydrophobicContact CD1-CD1 4.46Å
488A87.4Confident88.7Confident14 Ų1470.2 Ų70.212%0.11634%0.339CS..Hα-helixtrans-62.5-35.8174.500000111.9Y447 R484 L485 I486 Y491Y447-A488 HydrophobicContact CE2-CB 4.12Å; R484-A488 WeakPolarHBondContact O-CB 3.03Å; R484-A488 PolarHBondContact O-N 3.24Å; L485-A488 WeakPolarHBondContact O-CB 2.96Å; L485-A488 PolarHBondContact O-N 2.54Å; I486-A488 VanDerWaalsContact C-N 3.34Å; I486-A488 PolarHBondContact O-N 3.28Å; A488-Y491 CarbonylContact O-C 3.19Å
489F86.6Confident88.2Confident70 Ų7071.9 Ų71.931%0.30736%0.356SS..Hα-helixtrans-69.6-37.5177.8-169.7-90.3000113.3V428 M432 L485 I486 L487 R492V428-F489 HydrophobicContact CG1-CE2 3.85Å; M432-F489 HydrophobicContact CE-CB 4.33Å; M432-F489 HydrophobicContact CE-CD2 3.59Å; M432-F489 HydrophobicContact CE-CE2 4.34Å; M432-F489 HydrophobicContact CE-CG 4.37Å; M432-F489 HydrophobicContact SD-CD2 3.34Å; M432-F489 WeakPolarHBondContact SD-CD2 3.29Å; M432-F489 HydrophobicContact SD-CE2 3.49Å; M432-F489 WeakPolarHBondContact SD-CE2 3.41Å; L485-F489 PolarHBondContact O-N 3.48Å; I486-F489 WeakPolarHBondContact O-CB 3.41Å; I486-F489 PolarHBondContact O-N 3.22Å; I486-F489 VanDerWaalsContact O-N 3.15Å; L487-F489 VanDerWaalsContact C-N 3.27Å; L487-F489 PolarHBondContact O-N 2.95Å; F489-R492 VanDerWaalsContact CE1-NH2 3.32Å; F489-R492 VanDerWaalsContact CZ-NH2 3.26Å; F489-R492 WeakPolarHBondContact O-CG 3.49Å; F489-R492 PolarHBondContact O-NE 2.96Å
490F87.7Confident87.6Confident149 Ų14972 Ų7265%0.65435%0.354SS*.Hα-helixtrans-79-44.9177.4-76.5-65.2000112.5I486 L487 R492I486-F490 HydrophobicContact CG2-CD2 3.61Å; I486-F490 HydrophobicContact CG2-CE2 3.42Å; I486-F490 VanDerWaalsContact CG2-CE2 3.42Å; I486-F490 WeakPolarHBondContact O-CD2 3.42Å; I486-F490 PolarHBondContact O-N 2.85Å; L487-F490 PolarHBondContact O-N 2.88Å; F490-R492 PolarHBondContact O-N 3.12Å
491Y86.6Confident87Confident102 Ų10275.4 Ų75.440%0.437%0.373SS..SBendtrans-96.665.8-179.9-64.2-68.1000110.5L487 A488 R502 P503L487-Y491 HydrophobicContact CD2-CD2 4.21Å; L487-Y491 HydrophobicContact CD2-CE2 3.97Å; L487-Y491 WeakPolarHBondContact O-CB 3.45Å; L487-Y491 WeakPolarHBondContact O-CD2 3.14Å; L487-Y491 PolarHBondContact O-N 3.26Å; A488-Y491 CarbonylContact O-C 3.19Å; Y491-R502 WeakPolarHBondContact O-CD 3.47Å; Y491-P503 HydrophobicContact CD1-CG 3.84Å; Y491-P503 HydrophobicContact CD2-CG 3.93Å; Y491-P503 HydrophobicContact CE1-CG 3.63Å; Y491-P503 HydrophobicContact CE2-CG 3.74Å; Y491-P503 VanDerWaalsContact CG-CD 3.41Å; Y491-P503 HydrophobicContact CG-CG 3.96Å
492R81.9Confident86.6Confident118 Ų11878 Ų7845%0.44538%0.383SS..PPolyproline II helixtrans-65.5148-179.7-57.7-177-170.5174.1-0.1110.7F489 F490 R502F489-R492 VanDerWaalsContact CE1-NH2 3.32Å; F489-R492 VanDerWaalsContact CZ-NH2 3.26Å; F489-R492 WeakPolarHBondContact O-CG 3.49Å; F489-R492 PolarHBondContact O-NE 2.96Å; F490-R492 PolarHBondContact O-N 3.12Å; R492-R502 WeakPolarHBondContact O-CD 3.5Å
493Q81.2Confident86.4Confident138 Ų13878.6 Ų78.665%0.64539%0.387SS*.PPolyproline II helixtrans-56.7123.3169.7-172.6166.2-1.900108.4
494P82.8Confident85.9Confident34 Ų3481.9 Ų81.922%0.22140%0.398CS..PPolyproline II helixtrans-63.1161.317733.3-42.1000109.4Q498 D500P494-Q498 HydrophobicContact CB-CB 4.13Å; P494-D500 HydrophobicContact CG-CB 3.93Å
495R82.6Confident85.5Confident108 Ų10886.2 Ų86.241%0.40842%0.418SS..PPolyproline II helixtrans-62.3154.3168.1-61.3178.2-176.5153.42.6109.5P333 D497 Q498P333-R495 HydrophobicContact CG-CB 4.4Å; R495-D497 WeakPolarHBondContact CB-OD1 3.29Å; R495-D497 PolarHBondContact O-N 3.25Å; R495-D497 VanDerWaalsContact O-N 3.11Å; R495-Q498 HydrophobicContact CB-CG 4.36Å; R495-Q498 PolarHBondContact O-N 3.41Å
496C82.3Confident85.1Confident52 Ų5284.7 Ų84.735%0.35141%0.409SS..THydrogen-bonded Turntrans-61.9-23.5-176.460.90000113.2S238 C239 Q498S238-C496 WeakPolarHBondContact CB-O 3.34Å; S238-C496 PolarHBondContact OG-O 3.18Å; C239-C496 HydrophobicContact CB-CB 3.75Å; C239-C496 WeakPolarHBondContact CB-SG 3.45Å; C239-C496 WeakPolarHBondContact SG-CB 3.24Å; C239-C496 CovalentContact SG-SG 2.03Å; C239-C496 PolarHBondContact SG-SG 3.25Å; C496-Q498 VanDerWaalsContact C-N 3.34Å
497D82.8Confident84.6Confident76 Ų7683.2 Ų83.241%0.40640%0.404SS..THydrogen-bonded Turntrans-83.70.1175.665-37.8000114.6P333 R495P333-D497 HydrophobicContact CG-CB 4.49Å; P333-D497 WeakPolarHBondContact CG-OD1 3.5Å; R495-D497 WeakPolarHBondContact CB-OD1 3.29Å; R495-D497 PolarHBondContact O-N 3.25Å; R495-D497 VanDerWaalsContact O-N 3.11Å
498Q84.6Confident84.2Confident94 Ų9486.1 Ų86.144%0.43942%0.416SS..SBendtrans-116.8148.6-175.5-66.4-179.12.500112.2P494 R495 C496P494-Q498 HydrophobicContact CB-CB 4.13Å; R495-Q498 HydrophobicContact CB-CG 4.36Å; R495-Q498 PolarHBondContact O-N 3.41Å; C496-Q498 VanDerWaalsContact C-N 3.34Å
499P82.9Confident84.3Confident95 Ų9588 Ų8862%0.61742%0.423SS*.  trans-67.1143.9175.428.5-34.4000111.5N501P499-N501 PolarHBondContact O-N 3.34Å
500D83.1Confident84.6Confident71 Ų7186 Ų8638%0.3842%0.415SS..  trans-80.9100.5177.2-162.6-10.1000111.8P494 R502P494-D500 HydrophobicContact CG-CB 3.93Å; D500-R502 VanDerWaalsContact C-N 3.35Å; D500-R502 WeakPolarHBondContact OD1-CB 3.11Å; D500-R502 WeakPolarHBondContact OD1-CG 3.36Å; D500-R502 IonicContact OD1-CZ 2.88Å; D500-R502 PolarHBondContact OD1-N 2.83Å; D500-R502 IonicContact OD1-NE 3.63Å; D500-R502 PolarHBondContact OD1-NE 3.32Å; D500-R502 IonicContact OD1-NH2 3.86Å; D500-R502 IonicContact OD2-CZ 3.65Å; D500-R502 VanDerWaalsContact OD2-CZ 3.3Å; D500-R502 IonicContact OD2-NE 2.7Å; D500-R502 PolarHBondContact OD2-NE 3.48Å; D500-R502 VanDerWaalsContact OD2-NE 3.1Å; D500-R502 IonicContact OD2-NH2 2.66Å; D500-R502 PolarHBondContact OD2-NH2 3.25Å
501N84Confident84.8Confident138 Ų13879.4 Ų79.474%0.73839%0.386SS*.  trans-92.48178-64.4-38.6000113P499P499-N501 PolarHBondContact O-N 3.34Å
502R87.3Confident85.2Confident55 Ų5574.5 Ų74.521%0.20837%0.367CS..SBendtrans-67.8146.5-179.7-64.6179.5-69.91771.9110.5Y491 R492 D500 V507Y491-R502 WeakPolarHBondContact O-CD 3.47Å; R492-R502 WeakPolarHBondContact O-CD 3.5Å; D500-R502 VanDerWaalsContact C-N 3.35Å; D500-R502 WeakPolarHBondContact OD1-CB 3.11Å; D500-R502 WeakPolarHBondContact OD1-CG 3.36Å; D500-R502 IonicContact OD1-CZ 2.88Å; D500-R502 PolarHBondContact OD1-N 2.83Å; D500-R502 IonicContact OD1-NE 3.63Å; D500-R502 PolarHBondContact OD1-NE 3.32Å; D500-R502 IonicContact OD1-NH2 3.86Å; D500-R502 IonicContact OD2-CZ 3.65Å; D500-R502 VanDerWaalsContact OD2-CZ 3.3Å; D500-R502 IonicContact OD2-NE 2.7Å; D500-R502 PolarHBondContact OD2-NE 3.48Å; D500-R502 VanDerWaalsContact OD2-NE 3.1Å; D500-R502 IonicContact OD2-NH2 2.66Å; D500-R502 PolarHBondContact OD2-NH2 3.25Å; R502-V507 HydrophobicContact CB-CG2 3.59Å
503P88.2Confident85.8Confident48 Ų4872.2 Ų72.231%0.31236%0.358SS..  trans-57.5144.8176.4-23.631.1000112Y491 F505 I506 V507Y491-P503 HydrophobicContact CD1-CG 3.84Å; Y491-P503 HydrophobicContact CD2-CG 3.93Å; Y491-P503 HydrophobicContact CE1-CG 3.63Å; Y491-P503 HydrophobicContact CE2-CG 3.74Å; Y491-P503 VanDerWaalsContact CG-CD 3.41Å; Y491-P503 HydrophobicContact CG-CG 3.96Å; P503-F505 PolarHBondContact O-N 3.24Å; P503-I506 HydrophobicContact CB-CG1 4.46Å; P503-I506 HydrophobicContact CG-CG1 4.49Å; P503-I506 PolarHBondContact O-N 3.23Å; P503-V507 PolarHBondContact O-N 2.84Å
504F84.7Confident86.4Confident155 Ų15566.9 Ų66.968%0.6833%0.333SS*.Hα-helixtrans-46.4-42.4179178.5-88.7000113.3I506 V507 H508F504-I506 VanDerWaalsContact C-N 3.31Å; F504-I506 PolarHBondContact O-N 2.83Å; F504-V507 PolarHBondContact O-N 3.27Å; F504-H508 AromaticContact CD2-CD2 3.09Å; F504-H508 WeakPolarHBondContact CD2-CD2 3.26Å; F504-H508 AromaticContact CD2-NE2 3.42Å; F504-H508 WeakPolarHBondContact CD2-NE2 3.47Å; F504-H508 HydrophobicContact CE1-CB 4.43Å; F504-H508 AromaticContact CE2-CD2 3.08Å; F504-H508 WeakPolarHBondContact CE2-CD2 3.5Å; F504-H508 AromaticContact CE2-CG 3.86Å; F504-H508 AromaticContact CE2-NE2 3.38Å; F504-H508 WeakPolarHBondContact CE2-NE2 3.41Å; F504-H508 AromaticContact CG-CD2 3.63Å; F504-H508 HydrophobicContact CZ-CB 4.29Å; F504-H508 AromaticContact CZ-CD2 3.62Å; F504-H508 PolarHBondContact O-CD2 2.9Å; F504-H508 VanDerWaalsContact O-CD2 3.29Å; F504-H508 PolarHBondContact O-N 3.5Å
505F83.1Confident87Confident103 Ų10365.2 Ų65.245%0.45232%0.323SS..Hα-helixtrans-63.3-32.7179.5-176.8-89.6000113.6P503 I509P503-F505 PolarHBondContact O-N 3.24Å; F505-I509 HydrophobicContact CD2-CD1 3.29Å; F505-I509 HydrophobicContact CD2-CG1 4.34Å; F505-I509 HydrophobicContact CE1-CD1 4.43Å; F505-I509 HydrophobicContact CE2-CD1 3.18Å; F505-I509 HydrophobicContact CE2-CG1 4.49Å; F505-I509 HydrophobicContact CG-CD1 4.01Å; F505-I509 HydrophobicContact CZ-CD1 3.8Å; F505-I509 VanDerWaalsContact O-CB 3.32Å; F505-I509 WeakPolarHBondContact O-CB 3.46Å; F505-I509 PolarHBondContact O-N 3.23Å
506I83.4Confident87.7Confident14 Ų1460.6 Ų60.67%0.07231%0.307CS..Hα-helixtrans-79.7-37.2179.6-61.3-63.7000110.9L487 P503 F504L487-I506 HydrophobicContact CB-CD1 3.9Å; L487-I506 HydrophobicContact CD1-CD1 4.46Å; P503-I506 HydrophobicContact CB-CG1 4.46Å; P503-I506 HydrophobicContact CG-CG1 4.49Å; P503-I506 PolarHBondContact O-N 3.23Å; F504-I506 VanDerWaalsContact C-N 3.31Å; F504-I506 PolarHBondContact O-N 2.83Å
507V82.3Confident88.3Confident55 Ų5561.9 Ų61.933%0.33331%0.314SS..Hα-helixtrans-72.9-46.8-178.21790000111.6R502 P503 F504R502-V507 HydrophobicContact CB-CG2 3.59Å; P503-V507 PolarHBondContact O-N 2.84Å; F504-V507 PolarHBondContact O-N 3.27Å
508H83.7Confident89Confident119 Ų11958.4 Ų58.455%0.55130%0.295SS*.Hα-helixtrans-93.8-17.3-169.6-64.8-69.8000114.7F504 H510F504-H508 AromaticContact CD2-CD2 3.09Å; F504-H508 WeakPolarHBondContact CD2-CD2 3.26Å; F504-H508 AromaticContact CD2-NE2 3.42Å; F504-H508 WeakPolarHBondContact CD2-NE2 3.47Å; F504-H508 HydrophobicContact CE1-CB 4.43Å; F504-H508 AromaticContact CE2-CD2 3.08Å; F504-H508 WeakPolarHBondContact CE2-CD2 3.5Å; F504-H508 AromaticContact CE2-CG 3.86Å; F504-H508 AromaticContact CE2-NE2 3.38Å; F504-H508 WeakPolarHBondContact CE2-NE2 3.41Å; F504-H508 AromaticContact CG-CD2 3.63Å; F504-H508 HydrophobicContact CZ-CB 4.29Å; F504-H508 AromaticContact CZ-CD2 3.62Å; F504-H508 PolarHBondContact O-CD2 2.9Å; F504-H508 VanDerWaalsContact O-CD2 3.29Å; F504-H508 PolarHBondContact O-N 3.5Å; H508-H510 PolarHBondContact O-N 3.29Å
509I89.1Confident89.6Confident53 Ų5355 Ų5527%0.27228%0.279SS..SBendtrans-9896.8176.8-54.2-174.2000109.4F505 F514F505-I509 HydrophobicContact CD2-CD1 3.29Å; F505-I509 HydrophobicContact CD2-CG1 4.34Å; F505-I509 HydrophobicContact CE1-CD1 4.43Å; F505-I509 HydrophobicContact CE2-CD1 3.18Å; F505-I509 HydrophobicContact CE2-CG1 4.49Å; F505-I509 HydrophobicContact CG-CD1 4.01Å; F505-I509 HydrophobicContact CZ-CD1 3.8Å; F505-I509 VanDerWaalsContact O-CB 3.32Å; F505-I509 WeakPolarHBondContact O-CB 3.46Å; F505-I509 PolarHBondContact O-N 3.23Å; I509-F514 HydrophobicContact CG2-CB 4.45Å
510H91.8Very high90.2Very high30 Ų3058.1 Ų58.114%0.13928%0.278CS..  trans-56.3141.5174.7-165-95.3000111.3E257 D258 P260 H508 M512 Y513 F514E257-H510 PolarHBondContact O-CD2 3.42Å; E257-H510 PolarHBondContact O-NE2 3.02Å; D258-H510 PolarHBondContact O-CE1 3.11Å; D258-H510 PolarHBondContact O-NE2 3.11Å; P260-H510 HydrophobicContact CG-CB 4.17Å; H508-H510 PolarHBondContact O-N 3.29Å; H510-M512 PolarHBondContact ND1-N 3Å; H510-M512 PolarHBondContact O-N 2.93Å; H510-M512 VanDerWaalsContact O-N 3.12Å; H510-Y513 HydrophobicContact CB-CD2 3.87Å; H510-Y513 HydrophobicContact CB-CE2 4.48Å; H510-Y513 PolarHBondContact O-N 3.15Å; H510-F514 PolarHBondContact O-N 3.21Å
511Y92.1Very high90.9Very high9 Ų957.7 Ų57.74%0.03528%0.275CS..Hα-helixtrans-58.5-31.3-174.675.2-90.4000112.9W82 I439 Q442 E443 Y447 F514 A515W82-Y511 WeakPolarHBondContact CZ2-OH 3.47Å; I439-Y511 HydrophobicContact CG2-CE1 4.25Å; Q442-Y511 HydrophobicContact CB-CE2 4.35Å; E443-Y511 HydrophobicContact CB-CD1 4.25Å; E443-Y511 HydrophobicContact CB-CD2 4.29Å; E443-Y511 HydrophobicContact CB-CG 4.12Å; E443-Y511 HydrophobicContact CG-CD1 4.31Å; E443-Y511 HydrophobicContact CG-CG 4.01Å; Y447-Y511 WeakPolarHBondContact OH-CB 3.4Å; Y511-F514 WeakPolarHBondContact O-CB 3.36Å; Y511-F514 PolarHBondContact O-N 3.13Å; Y511-A515 WeakPolarHBondContact O-CB 3.39Å; Y511-A515 PolarHBondContact O-N 3.37Å
512M94.4Very high91.5Very high0 Ų051.1 Ų51.10%024%0.24CC..Hα-helixtrans-66.2-37.4176.6-63.8-178.6-176.100112.7W82 I259 P260 F264 G267 Q268 H510 A515 A516W82-M512 HydrophobicContact CH2-CE 3.52Å; W82-M512 HydrophobicContact CZ2-CE 3.43Å; W82-M512 VanDerWaalsContact CZ2-CE 3.43Å; I259-M512 HydrophobicContact CG2-CE 4.41Å; P260-M512 HydrophobicContact CG-SD 4.46Å; F264-M512 HydrophobicContact CB-SD 3.97Å; F264-M512 HydrophobicContact CD2-CE 3.88Å; F264-M512 HydrophobicContact CD2-SD 4.07Å; G267-M512 WeakPolarHBondContact CA-O 3.39Å; Q268-M512 HydrophobicContact CB-CG 4.37Å; Q268-M512 HydrophobicContact CB-SD 4.33Å; H510-M512 PolarHBondContact ND1-N 3Å; H510-M512 PolarHBondContact O-N 2.93Å; H510-M512 VanDerWaalsContact O-N 3.12Å; M512-A515 WeakPolarHBondContact O-CB 3.38Å; M512-A515 PolarHBondContact O-N 2.94Å; M512-A516 PolarHBondContact O-N 3.41Å
513Y95.1Very high92Very high69 Ų6949.1 Ų49.127%0.27124%0.237SC..Hα-helixtrans-68-40.6173.5-73.8-63.8000111.2P254 P260 P262 H510 A515 A516 V517P254-Y513 PolarHBondContact O-OH 3.38Å; P260-Y513 HydrophobicContact CB-CE2 3.73Å; P260-Y513 HydrophobicContact CG-CD2 4.36Å; P260-Y513 HydrophobicContact CG-CE2 3.78Å; P262-Y513 HydrophobicContact CB-CE1 4.01Å; P262-Y513 WeakPolarHBondContact CD-OH 3.4Å; P262-Y513 HydrophobicContact CG-CE1 4.46Å; P262-Y513 VanDerWaalsContact CG-OH 3.29Å; P262-Y513 WeakPolarHBondContact CG-OH 3.26Å; H510-Y513 HydrophobicContact CB-CD2 3.87Å; H510-Y513 HydrophobicContact CB-CE2 4.48Å; H510-Y513 PolarHBondContact O-N 3.15Å; Y513-A515 VanDerWaalsContact C-N 3.31Å; Y513-A515 PolarHBondContact O-N 3.05Å; Y513-A516 WeakPolarHBondContact O-CB 3.49Å; Y513-A516 PolarHBondContact O-N 3.46Å; Y513-V517 WeakPolarHBondContact O-CG2 3.3Å; Y513-V517 PolarHBondContact O-N 2.82Å
514F94.9Very high92.4Very high26 Ų2652 Ų5211%0.11425%0.249CC..Hα-helixtrans-59.7-44173.5-174.5-89.5000111.3Y447 R484 I509 H510 Y511 A516 V517 L518Y447-F514 AromaticContact CD1-CD1 3.74Å; Y447-F514 HydrophobicContact CD1-CD1 3.74Å; Y447-F514 HydrophobicContact CD1-CE1 4.12Å; Y447-F514 HydrophobicContact CE1-CD1 4.11Å; R484-F514 HydrophobicContact CB-CD1 4.25Å; R484-F514 HydrophobicContact CB-CE1 3.55Å; R484-F514 HydrophobicContact CB-CE2 3.92Å; R484-F514 HydrophobicContact CB-CZ 3.37Å; R484-F514 HydrophobicContact CG-CD1 3.88Å; R484-F514 HydrophobicContact CG-CD2 4.15Å; R484-F514 HydrophobicContact CG-CE1 3.72Å; R484-F514 HydrophobicContact CG-CE2 4Å; R484-F514 HydrophobicContact CG-CG 4.09Å; R484-F514 HydrophobicContact CG-CZ 3.79Å; I509-F514 HydrophobicContact CG2-CB 4.45Å; H510-F514 PolarHBondContact O-N 3.21Å; Y511-F514 WeakPolarHBondContact O-CB 3.36Å; Y511-F514 PolarHBondContact O-N 3.13Å; F514-A516 VanDerWaalsContact C-N 3.32Å; F514-A516 PolarHBondContact O-N 3.03Å; F514-V517 PolarHBondContact O-N 2.93Å; F514-L518 HydrophobicContact CE1-CB 4.47Å; F514-L518 HydrophobicContact CE1-CD1 4.23Å; F514-L518 HydrophobicContact CE1-CD2 4.13Å; F514-L518 HydrophobicContact CZ-CD1 4.42Å; F514-L518 VanDerWaalsContact O-CB 3.28Å; F514-L518 WeakPolarHBondContact O-CB 3.37Å; F514-L518 PolarHBondContact O-N 2.88Å
515A95.6Very high93Very high0 Ų046.5 Ų46.50%023%0.228CC..Hα-helixtrans-59.2-40.7175.700000112.3G446 P450 Y511 M512 Y513 L518 F519G446-A515 WeakPolarHBondContact O-CB 3.21Å; P450-A515 WeakPolarHBondContact CB-O 3.46Å; P450-A515 HydrophobicContact CG-CB 3.72Å; Y511-A515 WeakPolarHBondContact O-CB 3.39Å; Y511-A515 PolarHBondContact O-N 3.37Å; M512-A515 WeakPolarHBondContact O-CB 3.38Å; M512-A515 PolarHBondContact O-N 2.94Å; Y513-A515 VanDerWaalsContact C-N 3.31Å; Y513-A515 PolarHBondContact O-N 3.05Å; A515-L518 PolarHBondContact O-N 3.46Å; A515-F519 WeakPolarHBondContact O-CB 3.17Å; A515-F519 PolarHBondContact O-N 3.01Å
516A96.1Very high93.7Very high10 Ų1041.6 Ų41.68%0.08321%0.206CC..Hα-helixtrans-61-50.8174.500000111.3L266 M512 Y513 F514 L518 F519 W520L266-A516 HydrophobicContact CB-CB 4.13Å; L266-A516 WeakPolarHBondContact O-CB 3.24Å; M512-A516 PolarHBondContact O-N 3.41Å; Y513-A516 WeakPolarHBondContact O-CB 3.49Å; Y513-A516 PolarHBondContact O-N 3.46Å; F514-A516 VanDerWaalsContact C-N 3.32Å; F514-A516 PolarHBondContact O-N 3.03Å; A516-L518 VanDerWaalsContact C-N 3.27Å; A516-L518 PolarHBondContact O-N 3.16Å; A516-F519 WeakPolarHBondContact O-CB 3.34Å; A516-F519 PolarHBondContact O-N 3.04Å; A516-W520 PolarHBondContact O-N 2.9Å; A516-W520 VanDerWaalsContact O-N 3.09Å
517V95.9Very high94.4Very high80 Ų8043 Ų4349%0.48522%0.215SC..Hα-helixtrans-58.2-43.3177.4171.60000110.7Y513 F514 F519 W520 I521Y513-V517 WeakPolarHBondContact O-CG2 3.3Å; Y513-V517 PolarHBondContact O-N 2.82Å; F514-V517 PolarHBondContact O-N 2.93Å; V517-F519 PolarHBondContact O-N 3.11Å; V517-W520 PolarHBondContact O-N 3.1Å; V517-I521 HydrophobicContact CG1-CD1 3.48Å; V517-I521 VanDerWaalsContact CG1-CD1 3.48Å; V517-I521 HydrophobicContact CG1-CG1 4.14Å; V517-I521 WeakPolarHBondContact O-CB 2.92Å; V517-I521 VanDerWaalsContact O-CG1 3.32Å; V517-I521 WeakPolarHBondContact O-CG1 3.39Å; V517-I521 PolarHBondContact O-N 2.98Å
518L96.3Very high95.1Very high2 Ų244 Ų441%0.0122%0.221CC..Hα-helixtrans-63.2-43.2-179.3-163.668.2000112.4Y447 P450 P451 G477 L480 F514 A515 A516 S522Y447-L518 WeakPolarHBondContact O-CD2 3.25Å; P450-L518 HydrophobicContact CG-CD2 4.41Å; P451-L518 HydrophobicContact CG-CD2 3.76Å; P451-L518 HydrophobicContact CG-CG 3.77Å; G477-L518 WeakPolarHBondContact O-CD1 3.37Å; L480-L518 HydrophobicContact CB-CD1 3.57Å; L480-L518 HydrophobicContact CD1-CD1 4.31Å; F514-L518 HydrophobicContact CE1-CB 4.47Å; F514-L518 HydrophobicContact CE1-CD1 4.23Å; F514-L518 HydrophobicContact CE1-CD2 4.13Å; F514-L518 HydrophobicContact CZ-CD1 4.42Å; F514-L518 VanDerWaalsContact O-CB 3.28Å; F514-L518 WeakPolarHBondContact O-CB 3.37Å; F514-L518 PolarHBondContact O-N 2.88Å; A515-L518 PolarHBondContact O-N 3.46Å; A516-L518 VanDerWaalsContact C-N 3.27Å; A516-L518 PolarHBondContact O-N 3.16Å; L518-S522 VanDerWaalsContact O-CB 3.23Å; L518-S522 WeakPolarHBondContact O-CB 3.44Å; L518-S522 PolarHBondContact O-N 3.22Å
519F96.9Very high95.7Very high24 Ų2440 Ų4011%0.10521%0.206CC..Hα-helixtrans-57.6-52.1173.6175.3-96.8000111.5P270 P450 A453 A454 L457 A515 A516 V517 G523P270-F519 HydrophobicContact CB-CB 4.4Å; P270-F519 HydrophobicContact CB-CD1 4.39Å; P270-F519 HydrophobicContact CB-CD2 3.55Å; P270-F519 HydrophobicContact CB-CE2 3.83Å; P270-F519 HydrophobicContact CB-CG 3.86Å; P270-F519 HydrophobicContact CB-CZ 4.37Å; P270-F519 HydrophobicContact CG-CD1 4.38Å; P270-F519 HydrophobicContact CG-CD2 4.38Å; P270-F519 HydrophobicContact CG-CG 4.29Å; P450-F519 HydrophobicContact CB-CB 3.91Å; P450-F519 WeakPolarHBondContact O-CD2 3.37Å; A453-F519 HydrophobicContact CB-CD2 4.36Å; A453-F519 HydrophobicContact CB-CE2 4.29Å; A454-F519 VanDerWaalsContact CA-CE2 3.49Å; A454-F519 HydrophobicContact CB-CD2 3.73Å; A454-F519 HydrophobicContact CB-CE2 3.7Å; A454-F519 HydrophobicContact CB-CG 4.46Å; A454-F519 HydrophobicContact CB-CZ 4.39Å; L457-F519 HydrophobicContact CD1-CE2 3.85Å; L457-F519 HydrophobicContact CD1-CZ 3.75Å; A515-F519 WeakPolarHBondContact O-CB 3.17Å; A515-F519 PolarHBondContact O-N 3.01Å; A516-F519 WeakPolarHBondContact O-CB 3.34Å; A516-F519 PolarHBondContact O-N 3.04Å; V517-F519 PolarHBondContact O-N 3.11Å; F519-G523 PolarHBondContact O-N 2.85Å
520W96.1Very high96Very high160 Ų16037.5 Ų37.561%0.60619%0.193SC*.Hα-helixtrans-69.2-40.6-175.9-72.3113.2000112.9A516 V517 G523 L524A516-W520 PolarHBondContact O-N 2.9Å; A516-W520 VanDerWaalsContact O-N 3.09Å; V517-W520 PolarHBondContact O-N 3.1Å; W520-G523 PolarHBondContact O-N 3.48Å; W520-L524 VanDerWaalsContact O-CB 3.24Å; W520-L524 WeakPolarHBondContact O-CB 3.36Å; W520-L524 PolarHBondContact O-N 2.82Å
521I97.2Very high96.2Very high62 Ų6240.9 Ų40.932%0.31821%0.211SC..Hα-helixtrans-63.9-47.8176.3-70.6176.7000110.4T476 L480 V517 G523 L524 V525T476-I521 HydrophobicContact CG2-CG2 4.15Å; L480-I521 HydrophobicContact CD1-CD1 4.43Å; L480-I521 HydrophobicContact CD1-CG2 4.1Å; V517-I521 HydrophobicContact CG1-CD1 3.48Å; V517-I521 VanDerWaalsContact CG1-CD1 3.48Å; V517-I521 HydrophobicContact CG1-CG1 4.14Å; V517-I521 WeakPolarHBondContact O-CB 2.92Å; V517-I521 VanDerWaalsContact O-CG1 3.32Å; V517-I521 WeakPolarHBondContact O-CG1 3.39Å; V517-I521 PolarHBondContact O-N 2.98Å; I521-G523 VanDerWaalsContact C-N 3.32Å; I521-G523 PolarHBondContact O-N 3.43Å; I521-L524 PolarHBondContact O-N 3.25Å; I521-V525 HydrophobicContact CG2-CG2 4.39Å; I521-V525 WeakPolarHBondContact O-CG2 3.26Å; I521-V525 PolarHBondContact O-N 3.35Å
522S97.1Very high96.4Very high0 Ų045.5 Ų45.50%024%0.244CC..Hα-helixtrans-58.1-46177.1176.90000111.3G473 L518 A526G473-S522 WeakPolarHBondContact CA-O 3.44Å; G473-S522 PolarHBondContact O-OG 3.35Å; G473-S522 VanDerWaalsContact O-OG 3.07Å; L518-S522 VanDerWaalsContact O-CB 3.23Å; L518-S522 WeakPolarHBondContact O-CB 3.44Å; L518-S522 PolarHBondContact O-N 3.22Å; S522-A526 WeakPolarHBondContact O-CB 3.33Å; S522-A526 PolarHBondContact O-N 2.7Å
523G97.1Very high96.4Very high13 Ų1347.7 Ų47.713%0.13426%0.257CS..Hα-helixtrans-62.4-44.3176.200000113F519 W520 I521 A526 V527F519-G523 PolarHBondContact O-N 2.85Å; W520-G523 PolarHBondContact O-N 3.48Å; I521-G523 VanDerWaalsContact C-N 3.32Å; I521-G523 PolarHBondContact O-N 3.43Å; G523-A526 PolarHBondContact O-N 2.98Å; G523-V527 WeakPolarHBondContact O-CB 3.18Å; G523-V527 VanDerWaalsContact O-CG2 3.26Å; G523-V527 WeakPolarHBondContact O-CG2 3.28Å; G523-V527 PolarHBondContact O-N 3.13Å
524L97.6Very high96.1Very high109 Ų10949 Ų4957%0.57128%0.276SS*.Hα-helixtrans-63-47.7179.1-179.765.3000111.5W520 I521 A526 V527 V528W520-L524 VanDerWaalsContact O-CB 3.24Å; W520-L524 WeakPolarHBondContact O-CB 3.36Å; W520-L524 PolarHBondContact O-N 2.82Å; I521-L524 PolarHBondContact O-N 3.25Å; L524-A526 VanDerWaalsContact C-N 3.32Å; L524-A526 PolarHBondContact O-N 3.3Å; L524-V527 PolarHBondContact O-N 3.39Å; L524-V528 HydrophobicContact CD1-CG2 4.06Å; L524-V528 HydrophobicContact CG-CG2 4.36Å; L524-V528 WeakPolarHBondContact O-CB 3.12Å; L524-V528 WeakPolarHBondContact O-CG2 3.5Å; L524-V528 PolarHBondContact O-N 3.45Å
525V97.8Very high95.9Very high39 Ų3950.9 Ų50.924%0.23630%0.297CS..Hα-helixtrans-60.4-45176.4172.70000110.1W472 T476 I521 V527 V528 V529W472-V525 HydrophobicContact CB-CG1 4.31Å; T476-V525 HydrophobicContact CG2-CG2 4.36Å; I521-V525 HydrophobicContact CG2-CG2 4.39Å; I521-V525 WeakPolarHBondContact O-CG2 3.26Å; I521-V525 PolarHBondContact O-N 3.35Å; V525-V527 VanDerWaalsContact C-N 3.3Å; V525-V527 PolarHBondContact O-N 3.09Å; V525-V528 PolarHBondContact O-N 3.44Å; V525-V529 HydrophobicContact CG1-CG2 4.11Å; V525-V529 VanDerWaalsContact O-CB 3.32Å; V525-V529 WeakPolarHBondContact O-CB 3.3Å; V525-V529 VanDerWaalsContact O-CG2 3.29Å; V525-V529 WeakPolarHBondContact O-CG2 3.35Å; V525-V529 PolarHBondContact O-N 3.25Å
526A97.1Very high95.6Very high0 Ų051.9 Ų51.90%030%0.303CS..Hα-helixtrans-60.1-40.6177.200000112.5L455 L458 G469 S522 G523 L524 S530L455-A526 HydrophobicContact CD2-CB 4.23Å; L458-A526 HydrophobicContact CD1-CB 3.67Å; G469-A526 VanDerWaalsContact O-CA 3.29Å; G469-A526 WeakPolarHBondContact O-CA 3.41Å; S522-A526 WeakPolarHBondContact O-CB 3.33Å; S522-A526 PolarHBondContact O-N 2.7Å; G523-A526 PolarHBondContact O-N 2.98Å; L524-A526 VanDerWaalsContact C-N 3.32Å; L524-A526 PolarHBondContact O-N 3.3Å; A526-S530 WeakPolarHBondContact O-CB 3.35Å; A526-S530 PolarHBondContact O-N 3.37Å; A526-S530 PolarHBondContact O-OG 2.78Å
527V97.5Very high95.2Very high43 Ų4356 Ų5626%0.26132%0.324SS..Hα-helixtrans-67-53.8177.3169.10000111.6L458 W462 G523 L524 V525 V529 S530 L531L458-V527 HydrophobicContact CD1-CG2 4.28Å; L458-V527 HydrophobicContact CD2-CG2 3.95Å; W462-V527 HydrophobicContact CE3-CG2 4.18Å; W462-V527 HydrophobicContact CH2-CB 4.09Å; W462-V527 HydrophobicContact CH2-CG1 3.85Å; W462-V527 HydrophobicContact CH2-CG2 4.07Å; W462-V527 HydrophobicContact CZ2-CG1 4.32Å; W462-V527 HydrophobicContact CZ3-CB 4.14Å; W462-V527 HydrophobicContact CZ3-CG1 4.37Å; W462-V527 HydrophobicContact CZ3-CG2 3.76Å; G523-V527 WeakPolarHBondContact O-CB 3.18Å; G523-V527 VanDerWaalsContact O-CG2 3.26Å; G523-V527 WeakPolarHBondContact O-CG2 3.28Å; G523-V527 PolarHBondContact O-N 3.13Å; L524-V527 PolarHBondContact O-N 3.39Å; V525-V527 VanDerWaalsContact C-N 3.3Å; V525-V527 PolarHBondContact O-N 3.09Å; V527-V529 PolarHBondContact O-N 2.96Å; V527-S530 PolarHBondContact O-N 3.5Å; V527-L531 HydrophobicContact CG1-CD1 4.01Å; V527-L531 WeakPolarHBondContact O-CG 3.22Å; V527-L531 PolarHBondContact O-N 3.03Å
528V97.4Very high94.6Very high76 Ų7658.7 Ų58.746%0.46134%0.336SS..Hα-helixtrans-60.1-51.1-176.9171.90000110.5L524 V525 S530 L531 C532L524-V528 HydrophobicContact CD1-CG2 4.06Å; L524-V528 HydrophobicContact CG-CG2 4.36Å; L524-V528 WeakPolarHBondContact O-CB 3.12Å; L524-V528 WeakPolarHBondContact O-CG2 3.5Å; L524-V528 PolarHBondContact O-N 3.45Å; V525-V528 PolarHBondContact O-N 3.44Å; V528-S530 VanDerWaalsContact C-N 3.32Å; V528-S530 PolarHBondContact O-N 2.86Å; V528-L531 PolarHBondContact O-N 3.46Å; V528-C532 PolarHBondContact O-N 2.89Å; V528-C532 VanDerWaalsContact O-N 3.07Å; V528-C532 PolarHBondContact O-SG 3.31Å
529V96.8Very high93.8Very high36 Ų3664.9 Ų64.922%0.21836%0.364CS..Hα-helixtrans-63.9-40179.9175.60000110.7V525 V527 L531 C532 T533V525-V529 HydrophobicContact CG1-CG2 4.11Å; V525-V529 VanDerWaalsContact O-CB 3.32Å; V525-V529 WeakPolarHBondContact O-CB 3.3Å; V525-V529 VanDerWaalsContact O-CG2 3.29Å; V525-V529 WeakPolarHBondContact O-CG2 3.35Å; V525-V529 PolarHBondContact O-N 3.25Å; V527-V529 PolarHBondContact O-N 2.96Å; V529-L531 VanDerWaalsContact C-N 3.33Å; V529-L531 PolarHBondContact O-N 3.39Å; V529-C532 PolarHBondContact O-N 3.37Å; V529-T533 HydrophobicContact CG1-CG2 4.27Å; V529-T533 WeakPolarHBondContact O-CB 3.48Å; V529-T533 WeakPolarHBondContact O-CG2 3.4Å; V529-T533 PolarHBondContact O-N 3.26Å; V529-T533 VanDerWaalsContact O-N 3.12Å; V529-T533 PolarHBondContact O-OG1 2.86Å
530S96.1Very high93.2Very high0 Ų065.9 Ų65.90%037%0.369CS..Hα-helixtrans-61-41.6176.6-67.30000112.3R464 N466 A526 V527 V528 C532 T533R464-S530 PolarHBondContact NH1-O 3.35Å; R464-S530 PolarHBondContact NH2-O 3.32Å; R464-S530 VanDerWaalsContact NH2-O 3.14Å; N466-S530 PolarHBondContact N-OG 3.47Å; N466-S530 PolarHBondContact ND2-O 3.43Å; N466-S530 VanDerWaalsContact ND2-O 3.12Å; N466-S530 WeakPolarHBondContact OD1-CA 3.36Å; N466-S530 PolarHBondContact OD1-OG 3.41Å; A526-S530 WeakPolarHBondContact O-CB 3.35Å; A526-S530 PolarHBondContact O-N 3.37Å; A526-S530 PolarHBondContact O-OG 2.78Å; V527-S530 PolarHBondContact O-N 3.5Å; V528-S530 VanDerWaalsContact C-N 3.32Å; V528-S530 PolarHBondContact O-N 2.86Å; S530-C532 VanDerWaalsContact C-N 3.32Å; S530-C532 PolarHBondContact O-N 3.46Å; S530-T533 PolarHBondContact O-N 2.93Å; S530-T533 PolarHBondContact O-OG1 3.32Å
531L95.7Very high92.8Very high100 Ų10059 Ų5952%0.52435%0.345SS..Hα-helixtrans-66.7-34.6178.4-70.6174.3000112.3W462 R464 V527 V528 V529W462-L531 HydrophobicContact CH2-CD2 4.21Å; W462-L531 HydrophobicContact CH2-CG 4.05Å; W462-L531 HydrophobicContact CZ2-CD2 3.92Å; W462-L531 HydrophobicContact CZ2-CG 4.18Å; R464-L531 HydrophobicContact CG-CD2 3.96Å; R464-L531 PolarHBondContact NH2-O 3.36Å; V527-L531 HydrophobicContact CG1-CD1 4.01Å; V527-L531 WeakPolarHBondContact O-CG 3.22Å; V527-L531 PolarHBondContact O-N 3.03Å; V528-L531 PolarHBondContact O-N 3.46Å; V529-L531 VanDerWaalsContact C-N 3.33Å; V529-L531 PolarHBondContact O-N 3.39Å
532C95.8Very high92.1Very high107 Ų10761.1 Ų61.172%0.72335%0.349SS*.Hα-helixtrans-81.2-8.1178.9-64.40000114.6V528 V529 S530V528-C532 PolarHBondContact O-N 2.89Å; V528-C532 VanDerWaalsContact O-N 3.07Å; V528-C532 PolarHBondContact O-SG 3.31Å; V529-C532 PolarHBondContact O-N 3.37Å; S530-C532 VanDerWaalsContact C-N 3.32Å; S530-C532 PolarHBondContact O-N 3.46Å
533T93.8Very high91.5Very high45 Ų4561.8 Ų61.828%0.27635%0.354SS..SBendtrans-120.4173.7-176.249.70000111.5R464 N466 T468 V529 S530R464-T533 PolarHBondContact NH1-O 3.2Å; R464-T533 PolarHBondContact NH2-O 3.5Å; N466-T533 PolarHBondContact ND2-OG1 3.36Å; N466-T533 PolarHBondContact OD1-OG1 2.9Å; T468-T533 WeakPolarHBondContact OG1-CB 3.37Å; T468-T533 PolarHBondContact OG1-OG1 3.36Å; V529-T533 HydrophobicContact CG1-CG2 4.27Å; V529-T533 WeakPolarHBondContact O-CB 3.48Å; V529-T533 WeakPolarHBondContact O-CG2 3.4Å; V529-T533 PolarHBondContact O-N 3.26Å; V529-T533 VanDerWaalsContact O-N 3.12Å; V529-T533 PolarHBondContact O-OG1 2.86Å; S530-T533 PolarHBondContact O-N 2.93Å; S530-T533 PolarHBondContact O-OG1 3.32Å
534S89.8Confident91.1Very high96 Ų9661.2 Ų61.267%0.67135%0.347SS*.PPolyproline II helixtrans-59.4144.7-17452.40000113.4N466N466-S534 PolarHBondContact ND2-O 3.49Å
535A90.3Very high90.8Very high67 Ų6756 Ų5655%0.55432%0.32SS*.PPolyproline II helixtrans-63.7148176.200000111.8
536P89.8Confident90.5Very high21 Ų2155.3 Ų55.314%0.13632%0.316CS..PPolyproline II helixtrans-68158.7172.431.2-34.7000110.6K463 V541K463-P536 VanDerWaalsContact O-CG 3.26Å; K463-P536 WeakPolarHBondContact O-CG 3.46Å; P536-V541 HydrophobicContact CB-CG2 4.25Å; P536-V541 HydrophobicContact CG-CG2 3.87Å
537D87.6Confident90Very high96 Ų9660.6 Ų60.651%0.51334%0.336SS..PPolyproline II helixtrans-72.2149.8179.2-177.350.2000112E539 Q540 V541D537-E539 VanDerWaalsContact C-N 3.26Å; D537-E539 PolarHBondContact O-N 3.17Å; D537-E539 WeakPolarHBondContact OD2-CB 3.25Å; D537-E539 PolarHBondContact OD2-N 3Å; D537-Q540 HydrophobicContact CB-CG 4.12Å; D537-Q540 WeakPolarHBondContact O-CB 3.37Å; D537-Q540 PolarHBondContact O-N 3.25Å; D537-V541 PolarHBondContact O-N 3.43Å
538D83.1Confident89.3Confident137 Ų13758.9 Ų58.973%0.73333%0.326SS*.Hα-helixtrans-64-33-175.8-88-20.1000111.9V541 R542D538-V541 PolarHBondContact O-N 3.04Å; D538-R542 VanDerWaalsContact O-CB 3.27Å; D538-R542 WeakPolarHBondContact O-CB 3.4Å; D538-R542 PolarHBondContact O-N 3.08Å
539E79.7Confident88.6Confident131 Ų13157 Ų5761%0.61231%0.314SS*.Hα-helixtrans-66.9-40.9178-170.1175.7178.700111.8D537 V541 R542D537-E539 VanDerWaalsContact C-N 3.26Å; D537-E539 PolarHBondContact O-N 3.17Å; D537-E539 WeakPolarHBondContact OD2-CB 3.25Å; D537-E539 PolarHBondContact OD2-N 3Å; E539-V541 VanDerWaalsContact C-N 3.31Å; E539-V541 PolarHBondContact O-N 3.04Å; E539-R542 PolarHBondContact O-N 2.8Å
540Q83.7Confident87.8Confident45 Ų4561.9 Ų61.921%0.2133%0.328CS..Hα-helixtrans-58.8-45.5176.6-62.7179.1-46.200110.3F117 G118 D537 T544F117-Q540 PolarHBondContact O-NE2 2.96Å; G118-Q540 VanDerWaalsContact CA-NE2 3.29Å; D537-Q540 HydrophobicContact CB-CG 4.12Å; D537-Q540 WeakPolarHBondContact O-CB 3.37Å; D537-Q540 PolarHBondContact O-N 3.25Å; Q540-T544 WeakPolarHBondContact O-CB 3.39Å; Q540-T544 WeakPolarHBondContact O-CG2 3.42Å; Q540-T544 PolarHBondContact O-OG1 3.08Å
541V87.3Confident86.9Confident17 Ų1769.3 Ų69.310%0.10336%0.36CS..Hα-helixtrans-75-32.6-178.3178.90000112.1K463 P536 D537 D538 E539 T543 T545K463-V541 HydrophobicContact CB-CG1 3.95Å; K463-V541 HydrophobicContact CD-CG1 4.35Å; K463-V541 HydrophobicContact CG-CG1 3.84Å; P536-V541 HydrophobicContact CB-CG2 4.25Å; P536-V541 HydrophobicContact CG-CG2 3.87Å; D537-V541 PolarHBondContact O-N 3.43Å; D538-V541 PolarHBondContact O-N 3.04Å; E539-V541 VanDerWaalsContact C-N 3.31Å; E539-V541 PolarHBondContact O-N 3.04Å; V541-T543 PolarHBondContact O-N 3.27Å; V541-T545 HydrophobicContact CG1-CG2 3.9Å; V541-T545 PolarHBondContact O-OG1 3.27Å
542R83.5Confident85.7Confident105 Ų10565.7 Ų65.740%0.39634%0.342SS..Hα-helixtrans-59.8-42.9-174.3-171.4-178.879.9168.56.8112.5Y103 D538 E539 G548Y103-R542 WeakPolarHBondContact CE1-O 3.25Å; D538-R542 VanDerWaalsContact O-CB 3.27Å; D538-R542 WeakPolarHBondContact O-CB 3.4Å; D538-R542 PolarHBondContact O-N 3.08Å; E539-R542 PolarHBondContact O-N 2.8Å; R542-G548 WeakPolarHBondContact O-CA 3.37Å
543T83.6Confident84.2Confident15 Ų1566.5 Ų66.59%0.09234%0.335CS..Hα-helixtrans-101.8-6.6-171.759.50000114.8Y103 S104 K115 V541Y103-T543 WeakPolarHBondContact CD1-O 3.2Å; Y103-T543 HydrophobicContact CE1-CG2 4.34Å; S104-T543 WeakPolarHBondContact CA-O 3.39Å; S104-T543 WeakPolarHBondContact CB-O 3.43Å; S104-T543 PolarHBondContact N-O 3.44Å; K115-T543 WeakPolarHBondContact CE-OG1 3.45Å; V541-T543 PolarHBondContact O-N 3.27Å
544T88.4Confident82.7Confident0 Ų072.8 Ų72.80%036%0.358CS..Hα-helixtrans-121.46-168.365.80000114.3V100 Y112 K115 R116 Q540V100-T544 VanDerWaalsContact CG1-C 3.42Å; V100-T544 WeakPolarHBondContact CG1-O 3.2Å; Y112-T544 HydrophobicContact CE2-CG2 4.44Å; Y112-T544 PolarHBondContact OH-O 3.02Å; K115-T544 HydrophobicContact CB-CG2 4.28Å; K115-T544 HydrophobicContact CD-CG2 4.42Å; K115-T544 HydrophobicContact CG-CG2 3.9Å; R116-T544 HydrophobicContact CB-CG2 4.31Å; R116-T544 WeakPolarHBondContact CD-OG1 3.33Å; Q540-T544 WeakPolarHBondContact O-CB 3.39Å; Q540-T544 WeakPolarHBondContact O-CG2 3.42Å; Q540-T544 PolarHBondContact O-OG1 3.08Å
545T92.3Very high81.2Confident1 Ų170 Ų701%0.00634%0.337CS..SBendtrans-125.4154.7-179670000112.4V460 V541 W547 G548 L549V460-T545 WeakPolarHBondContact O-CA 3.17Å; V541-T545 HydrophobicContact CG1-CG2 3.9Å; V541-T545 PolarHBondContact O-OG1 3.27Å; T545-W547 PolarHBondContact O-N 2.91Å; T545-G548 PolarHBondContact O-N 3.29Å; T545-G548 VanDerWaalsContact O-N 3.09Å; T545-G548 PolarHBondContact OG1-N 3.49Å; T545-L549 PolarHBondContact O-N 2.6Å
546V90.8Very high79.6Confident24 Ų2470.5 Ų70.515%0.14534%0.335CS..Hα-helixtrans-58.3-32.4174.5178.40000111.3V96 V100 V460 F461 L549 R550V96-V546 HydrophobicContact CG1-CG2 3.93Å; V100-V546 HydrophobicContact CG2-CG2 3.92Å; V460-V546 HydrophobicContact CG1-CG2 3.53Å; V460-V546 PolarHBondContact O-N 3.39Å; V460-V546 VanDerWaalsContact O-N 3.15Å; F461-V546 HydrophobicContact CD1-CG2 4.33Å; F461-V546 HydrophobicContact CE1-CG2 4.25Å; V546-L549 WeakPolarHBondContact O-CB 3.47Å; V546-L549 PolarHBondContact O-N 2.97Å; V546-R550 PolarHBondContact O-N 3.36Å
547W88.1Confident77.9Confident111 Ų11174.6 Ų74.642%0.4236%0.355SS..Hα-helixtrans-70.6-35.3178.9-56.2104.9000113.1F461 K463 T545 L549 R550 K551F461-W547 PolarHBondContact O-NE1 3.49Å; K463-W547 HydrophobicContact CD-CB 4.4Å; K463-W547 HydrophobicContact CD-CG 4.34Å; K463-W547 HydrophobicContact CG-CG 4.25Å; T545-W547 PolarHBondContact O-N 2.91Å; W547-L549 VanDerWaalsContact C-N 3.34Å; W547-R550 PolarHBondContact O-N 3.36Å; W547-K551 PolarHBondContact O-N 2.83Å; W547-K551 VanDerWaalsContact O-N 3.09Å
548G81Confident76.1Confident6 Ų678.4 Ų78.46%0.06237%0.367CS..Hα-helixtrans-59.2-47.4171.300000111.6R542 T545 R550 K551 L552R542-G548 WeakPolarHBondContact O-CA 3.37Å; T545-G548 PolarHBondContact O-N 3.29Å; T545-G548 VanDerWaalsContact O-N 3.09Å; T545-G548 PolarHBondContact OG1-N 3.49Å; G548-R550 PolarHBondContact O-N 3.01Å; G548-K551 WeakPolarHBondContact O-CB 3.19Å; G548-K551 PolarHBondContact O-N 3.17Å; G548-K551 VanDerWaalsContact O-N 3.14Å; G548-L552 PolarHBondContact O-N 2.98Å; G548-L552 VanDerWaalsContact O-N 3.12Å
549L82.7Confident74.4Confident37 Ų3775.7 Ų75.719%0.19435%0.352CS..Hα-helixtrans-60.2-45.7176-170.973.4000112.5P99 Y103 T545 V546 W547 K551 L552 E553 L676P99-L549 HydrophobicContact CB-CD2 3.51Å; Y103-L549 HydrophobicContact CD1-CD1 4.38Å; Y103-L549 HydrophobicContact CG-CD1 4.29Å; T545-L549 PolarHBondContact O-N 2.6Å; V546-L549 WeakPolarHBondContact O-CB 3.47Å; V546-L549 PolarHBondContact O-N 2.97Å; W547-L549 VanDerWaalsContact C-N 3.34Å; L549-K551 PolarHBondContact O-N 3.49Å; L549-L552 VanDerWaalsContact O-CB 3.32Å; L549-L552 WeakPolarHBondContact O-CB 3.2Å; L549-L552 PolarHBondContact O-N 3.18Å; L549-E553 PolarHBondContact O-N 3.31Å; L549-L676 HydrophobicContact CD1-CD1 4.16Å; L549-L676 HydrophobicContact CD1-CD2 4.4Å
550R81.4Confident73.1Confident138 Ų13871.7 Ų71.752%0.52133%0.332SS..Hα-helixtrans-60.8-33.3175.7-75.9-175-178.3-175.31112.8V546 W547 G548 L552 K554V546-R550 PolarHBondContact O-N 3.36Å; W547-R550 PolarHBondContact O-N 3.36Å; G548-R550 PolarHBondContact O-N 3.01Å; R550-L552 VanDerWaalsContact C-N 3.33Å; R550-K554 WeakPolarHBondContact O-CG 3.44Å; R550-K554 PolarHBondContact O-N 3.12Å
551K75.7Confident71.4Confident156 Ų15671.3 Ų71.368%0.67834%0.336SS*.Hα-helixtrans-69.2-34.4176-167176.9-179.4-1800111.1W547 G548 L549W547-K551 PolarHBondContact O-N 2.83Å; W547-K551 VanDerWaalsContact O-N 3.09Å; G548-K551 WeakPolarHBondContact O-CB 3.19Å; G548-K551 PolarHBondContact O-N 3.17Å; G548-K551 VanDerWaalsContact O-N 3.14Å; L549-K551 PolarHBondContact O-N 3.49Å
552L71.1Confident69.3Low25 Ų2577.7 Ų77.713%0.13137%0.365CS..Hα-helixtrans-66.7-44.8174-173.772.4000112.1Y103 G548 L549 R550 K554 V555 R560 L676Y103-L552 HydrophobicContact CD2-CD2 4.08Å; Y103-L552 HydrophobicContact CE2-CD2 3.74Å; G548-L552 PolarHBondContact O-N 2.98Å; G548-L552 VanDerWaalsContact O-N 3.12Å; L549-L552 VanDerWaalsContact O-CB 3.32Å; L549-L552 WeakPolarHBondContact O-CB 3.2Å; L549-L552 PolarHBondContact O-N 3.18Å; R550-L552 VanDerWaalsContact C-N 3.33Å; L552-K554 VanDerWaalsContact C-N 3.26Å; L552-K554 PolarHBondContact O-N 3.02Å; L552-V555 PolarHBondContact O-N 3.42Å; L552-V555 VanDerWaalsContact O-N 3.17Å; L552-R560 PolarHBondContact O-NH2 3.24Å; L552-L676 HydrophobicContact CD2-CD1 4.34Å
553E65.4Low67.1Low124 Ų12480.2 Ų80.258%0.57938%0.378SS*.Hα-helixtrans-62.6-31.4-179.5-164.3176.2-170.800112.4L549 V555 K683L549-E553 PolarHBondContact O-N 3.31Å; E553-V555 VanDerWaalsContact C-N 3.3Å; E553-V555 PolarHBondContact O-N 3.34Å; E553-K683 IonicContact OE1-NZ 3.05Å; E553-K683 PolarHBondContact OE1-NZ 3.49Å
554K60.9Low65Low177 Ų17783.5 Ų83.577%0.7739%0.39SS*.THydrogen-bonded Turntrans-73.7-12.9177.3-72.2-179.1179.9-168.80114.9R550 L552 P556R550-K554 WeakPolarHBondContact O-CG 3.44Å; R550-K554 PolarHBondContact O-N 3.12Å; L552-K554 VanDerWaalsContact C-N 3.26Å; L552-K554 PolarHBondContact O-N 3.02Å; K554-P556 WeakPolarHBondContact O-CD 3.28Å
555V59.3Low62.5Low38 Ų3885.7 Ų85.723%0.2341%0.412CS..SBendtrans-85.8118.9176.6-178.90000108.7L552 E553 D559 R560L552-V555 PolarHBondContact O-N 3.42Å; L552-V555 VanDerWaalsContact O-N 3.17Å; E553-V555 VanDerWaalsContact C-N 3.3Å; E553-V555 PolarHBondContact O-N 3.34Å; V555-D559 HydrophobicContact CG1-CB 4.18Å; V555-R560 HydrophobicContact CG1-CB 4.27Å
556P55.7Low60Low76 Ų7690.5 Ų90.549%0.49444%0.437SS..  trans-53.4141.4177.6-23.932.9000111.7K554 K558 D559 R560K554-P556 WeakPolarHBondContact O-CD 3.28Å; P556-K558 PolarHBondContact O-N 3.45Å; P556-D559 HydrophobicContact CB-CB 4.44Å; P556-D559 PolarHBondContact O-N 2.86Å; P556-D559 VanDerWaalsContact O-N 3.12Å; P556-R560 WeakPolarHBondContact O-CB 3.22Å; P556-R560 PolarHBondContact O-N 2.8Å
557L54.6Low56.9Low108 Ų108100.4 Ų100.457%0.56547%0.472SS*.Hα-helixtrans-56.9-33.4-177.8-81.3161.8000113.2R560 A561 Y677L557-R560 WeakPolarHBondContact O-CB 3.31Å; L557-R560 PolarHBondContact O-N 3.25Å; L557-A561 PolarHBondContact O-N 3.32Å; L557-Y677 HydrophobicContact CD1-CE2 4.42Å
558K49.7Very low54.2Low176 Ų176104 Ų10477%0.76549%0.494SS*.Hα-helixtrans-63-51.8175.1-120.2175.1177.9174.40111.5P556 R560 A561 E562P556-K558 PolarHBondContact O-N 3.45Å; K558-R560 VanDerWaalsContact C-N 3.25Å; K558-R560 PolarHBondContact O-N 3.2Å; K558-A561 PolarHBondContact O-N 3.45Å; K558-E562 PolarHBondContact O-N 3.45Å; K558-E562 VanDerWaalsContact O-N 3.13Å
559D47.8Very low51.6Low79 Ų79112.3 Ų112.342%0.42253%0.528SS..Hα-helixtrans-67.3-26.8175.6-64.3-13.1000112.3V555 P556 E562 K563V555-D559 HydrophobicContact CG1-CB 4.18Å; P556-D559 HydrophobicContact CB-CB 4.44Å; P556-D559 PolarHBondContact O-N 2.86Å; P556-D559 VanDerWaalsContact O-N 3.12Å; D559-E562 PolarHBondContact O-N 2.93Å; D559-K563 WeakPolarHBondContact O-CB 3.32Å; D559-K563 PolarHBondContact O-N 3.3Å
560R52.2Low49Very low48 Ų48118.7 Ų118.718%0.18156%0.563CS.*Hα-helixtrans-68.6-38.4174.8-166.3-173.3-71.1178-2.5111L552 V555 P556 L557 K558 Y564L552-R560 PolarHBondContact O-NH2 3.24Å; V555-R560 HydrophobicContact CG1-CB 4.27Å; P556-R560 WeakPolarHBondContact O-CB 3.22Å; P556-R560 PolarHBondContact O-N 2.8Å; L557-R560 WeakPolarHBondContact O-CB 3.31Å; L557-R560 PolarHBondContact O-N 3.25Å; K558-R560 VanDerWaalsContact C-N 3.25Å; K558-R560 PolarHBondContact O-N 3.2Å; R560-Y564 HydrophobicContact CG-CD2 4.33Å; R560-Y564 HydrophobicContact CG-CE2 4.42Å; R560-Y564 VanDerWaalsContact O-CD2 3.3Å; R560-Y564 WeakPolarHBondContact O-CD2 3.17Å
561A47.1Very low46.4Very low36 Ų36120.1 Ų120.130%0.29858%0.575SS.*Hα-helixtrans-69.5-41173.400000111.5L557 K558 G565 L566L557-A561 PolarHBondContact O-N 3.32Å; K558-A561 PolarHBondContact O-N 3.45Å; A561-G565 PolarHBondContact O-N 3.05Å; A561-L566 HydrophobicContact CB-CB 4.16Å; A561-L566 HydrophobicContact CB-CD1 4.08Å; A561-L566 WeakPolarHBondContact O-CB 3.01Å; A561-L566 PolarHBondContact O-N 3.17Å
562E43.8Very low44Very low151 Ų151118.2 Ų118.271%0.70658%0.58SS**Hα-helixtrans-70.7-41-179.7-73.9-176.4160.700113.4K558 D559 Y564 G565K558-E562 PolarHBondContact O-N 3.45Å; K558-E562 VanDerWaalsContact O-N 3.13Å; D559-E562 PolarHBondContact O-N 2.93Å; E562-Y564 VanDerWaalsContact C-N 3.33Å; E562-Y564 PolarHBondContact O-N 3.49Å; E562-G565 PolarHBondContact O-N 3.3Å
563K36.7Very low41.8Very low158 Ų158124.9 Ų124.969%0.68762%0.616SS**Hα-helixtrans-71.7-22-176.7-167.1172-173.1170.70114.3D559D559-K563 WeakPolarHBondContact O-CB 3.32Å; D559-K563 PolarHBondContact O-N 3.3Å
564Y39.8Very low40.2Very low84 Ų84122.6 Ų122.633%0.32963%0.625SS.*THydrogen-bonded Turntrans-109.114.1178.6-67.3-87.5000113.2R560 E562 Q666R560-Y564 HydrophobicContact CG-CD2 4.33Å; R560-Y564 HydrophobicContact CG-CE2 4.42Å; R560-Y564 VanDerWaalsContact O-CD2 3.3Å; R560-Y564 WeakPolarHBondContact O-CD2 3.17Å; E562-Y564 VanDerWaalsContact C-N 3.33Å; E562-Y564 PolarHBondContact O-N 3.49Å; Y564-Q666 PolarHBondContact O-NE2 3.25Å
565G35.9Very low38.4Very low46 Ų46119.6 Ų119.647%0.47463%0.627SS.*THydrogen-bonded Turntrans77.538166.700000115.8A561 E562 R567A561-G565 PolarHBondContact O-N 3.05Å; E562-G565 PolarHBondContact O-N 3.3Å; G565-R567 PolarHBondContact O-N 3.07Å; G565-R567 VanDerWaalsContact O-N 3.11Å
566L40.2Very low36.7Very low102 Ų102126.4 Ų126.453%0.53466%0.656SS.*  trans-79.630.8172.5-93149.9000114.2A561A561-L566 HydrophobicContact CB-CB 4.16Å; A561-L566 HydrophobicContact CB-CD1 4.08Å; A561-L566 WeakPolarHBondContact O-CB 3.01Å; A561-L566 PolarHBondContact O-N 3.17Å
567R26.9Very low35.1Very low232 Ų232128.1 Ų128.188%0.87567%0.665SS**  trans-120.782.5169.4-156.1177.8-174.3-169.92108.3G565 K569G565-R567 PolarHBondContact O-N 3.07Å; G565-R567 VanDerWaalsContact O-N 3.11Å; R567-K569 PolarHBondContact O-N 3.18Å
568E29.8Very low33.6Very low187 Ų187132.5 Ų132.587%0.87468%0.675SS**  trans-60.1126.8160.3-114178173.400107.6N570E568-N570 PolarHBondContact O-N 2.7Å
569K27Very low32.4Very low181 Ų181134.2 Ų134.279%0.78768%0.679SS**  trans-55.9125.3179.2-76173172176.70109.2R567 Q571R567-K569 PolarHBondContact O-N 3.18Å; K569-Q571 VanDerWaalsContact C-N 3.34Å; K569-Q571 PolarHBondContact O-N 2.87Å
570N28.5Very low31.5Very low171 Ų171139.2 Ų139.291%0.91470%0.696SS**  trans-60.599.2154.4-86.2-10000108.4E568E568-N570 PolarHBondContact O-N 2.7Å
571Q26Very low30.5Very low167 Ų167144.5 Ų144.578%0.7873%0.728SS**  trans-145.994.7155.2-105.7173.2-0.300108.8K569K569-Q571 VanDerWaalsContact C-N 3.34Å; K569-Q571 PolarHBondContact O-N 2.87Å
572C26.3Very low29.8Very low116 Ų116148.7 Ų148.778%0.78474%0.744SS**  trans28.1108.7150.7-59.40000119.7
573N24.8Very low29.2Very low166 Ų166145 Ų14589%0.88873%0.734SS**  175.2152.792.4-100.6-7.5000110.6
574G31.3Very low28.9Very low75 Ų75141.3 Ų141.377%0.77373%0.732SS**  trans-61.9139.2-156.100000117.7
575S23.1Very low28.6Very low115 Ų115142.1 Ų142.180%0.80474%0.743SS**  trans-175.8107.6134.7220000107.7V577S575-V577 PolarHBondContact O-N 3Å
576E22.8Very low28.7Very low181 Ų181142.5 Ų142.585%0.84674%0.736SS**  trans-68.6118.4175-81.3-174.8142.200110.2
577V23.1Very low28.2Very low111 Ų111145.3 Ų145.367%0.67374%0.743SS**  trans-114.2107.5161.1178.80000107.2S575 Y579S575-V577 PolarHBondContact O-N 3Å; V577-Y579 HydrophobicContact CG1-CD2 4.11Å; V577-Y579 HydrophobicContact CG1-CE2 3.94Å; V577-Y579 PolarHBondContact O-N 3.48Å
578Y23.2Very low28.3Very low201 Ų201141 Ų14179%0.78874%0.735SS**  trans-65.2108173.5-101.9-96.6000110.2
579Y25.1Very low28.4Very low212 Ų212138.8 Ų138.883%0.83172%0.724SS**  trans-92.5102.3159.5-89.4-86.1000109.5V577 D581V577-Y579 HydrophobicContact CG1-CD2 4.11Å; V577-Y579 HydrophobicContact CG1-CE2 3.94Å; V577-Y579 PolarHBondContact O-N 3.48Å; Y579-D581 PolarHBondContact O-N 2.92Å
580K27.6Very low28.6Very low183 Ų183139.7 Ų139.780%0.79672%0.723SS**  trans-62.5119.9155.9-91.2176.3171.8172.80107.1
581D31Very low28.6Very low159 Ų159136.5 Ų136.585%0.8571%0.713SS**  trans167.567.2142.6-81.2-18000110.1Y579Y579-D581 PolarHBondContact O-N 2.92Å
582I32.3Very low28.9Very low124 Ų124135.2 Ų135.264%0.63671%0.71SS**  trans-116.4126161.4-59.8176.7000106.6V586I582-V586 HydrophobicContact CG2-CB 3.76Å; I582-V586 HydrophobicContact CG2-CG1 4Å; I582-V586 HydrophobicContact CG2-CG2 4.15Å
583P31.8Very low29.1Very low75 Ų75137.1 Ų137.149%0.48771%0.713SS.*  trans-55.8137.6176.1-2332.7000111.6D585 V586P583-D585 WeakPolarHBondContact CB-OD1 3.32Å; P583-D585 PolarHBondContact O-N 3Å; P583-D585 VanDerWaalsContact O-N 3.08Å; P583-V586 PolarHBondContact O-N 3.49Å
584A30.4Very low29.4Very low79 Ų79132.3 Ų132.365%0.65370%0.703SS**Hα-helixtrans-59.6-23.7-17300000113.7V586 K587 M588A584-V586 VanDerWaalsContact C-N 3.33Å; A584-V586 PolarHBondContact O-N 2.96Å; A584-K587 WeakPolarHBondContact O-CB 3.36Å; A584-K587 PolarHBondContact O-N 2.9Å; A584-K587 VanDerWaalsContact O-N 3.09Å; A584-M588 PolarHBondContact O-N 3.32Å
585D33.1Very low29.2Very low102 Ų102133.5 Ų133.555%0.54571%0.705SS.*Hα-helixtrans-63.8-29.9175.732.3-46.3000113.3P583 K587P583-D585 WeakPolarHBondContact CB-OD1 3.32Å; P583-D585 PolarHBondContact O-N 3Å; P583-D585 VanDerWaalsContact O-N 3.08Å; D585-K587 VanDerWaalsContact C-N 3.31Å
586V39.4Very low29.2Very low54 Ų54136.4 Ų136.433%0.32771%0.706SS.*Hα-helixtrans-74.8-24.3172.3-178.40000111.7I582 P583 A584I582-V586 HydrophobicContact CG2-CB 3.76Å; I582-V586 HydrophobicContact CG2-CG1 4Å; I582-V586 HydrophobicContact CG2-CG2 4.15Å; P583-V586 PolarHBondContact O-N 3.49Å; A584-V586 VanDerWaalsContact C-N 3.33Å; A584-V586 PolarHBondContact O-N 2.96Å
587K29.6Very low29.3Very low161 Ų161133.6 Ų133.670%0.770%0.695SS**Hα-helixtrans-74.1-33.4178.6-135.8178.4-174.2-1770111.3A584 D585 C591A584-K587 WeakPolarHBondContact O-CB 3.36Å; A584-K587 PolarHBondContact O-N 2.9Å; A584-K587 VanDerWaalsContact O-N 3.09Å; D585-K587 VanDerWaalsContact C-N 3.31Å; K587-C591 PolarHBondContact O-N 3.36Å
588M27.6Very low29.3Very low141 Ų141137.2 Ų137.270%0.69570%0.702SS**Hα-helixtrans-74.5-35.8-177.1-153.5178.317500112.3A584 C591A584-M588 PolarHBondContact O-N 3.32Å; M588-C591 PolarHBondContact O-N 3.17Å
589E31.8Very low29.3Very low140 Ų140135.1 Ų135.165%0.65470%0.704SS**Hα-helixtrans-67.3-34.4175.1-123.9173.8-17700112.3C591E589-C591 VanDerWaalsContact C-N 3.33Å; E589-C591 PolarHBondContact O-N 3.06Å
590R31.7Very low29.2Very low201 Ų201133 Ų13376%0.75871%0.706SS**Hα-helixtrans-70.9-23.6175.2-80.5-174.4-179.8171.81.2114.3
591C29.2Very low28.9Very low104 Ų104130.3 Ų130.370%0.70371%0.705SS**Hα-helixtrans-86-14.6-178-80.40000113.9K587 M588 E589K587-C591 PolarHBondContact O-N 3.36Å; M588-C591 PolarHBondContact O-N 3.17Å; E589-C591 VanDerWaalsContact C-N 3.33Å; E589-C591 PolarHBondContact O-N 3.06Å
592L31.3Very low29Very low139 Ų139128 Ų12873%0.72870%0.698SS**SBendtrans-87.4-14.4-177.9-81.6156.7000113.7
593D30.8Very low28.5Very low156 Ų156126.2 Ų126.283%0.83470%0.697SS**SBendtrans-100.819.5-172.9-90.2-3.6000115
594G31.7Very low28.1Very low66 Ų66128.1 Ų128.168%0.6871%0.707SS**  trans-163.697.3176.100000114.5
595A27.1Very low27.8Very low99 Ų99130.4 Ų130.482%0.81871%0.709SS**  trans-113.6121.8160.300000109.1
596E23.4Very low27.4Very low176 Ų176133.7 Ų133.782%0.82272%0.72SS**  trans-174.5121.2130.4-100.5-165.7156.300112.5
597I24.5Very low26.6Very low122 Ų122138.1 Ų138.163%0.62674%0.742SS**  trans89.7123.4130.7-64.5173000122.6
598K22.1Very low27Very low187 Ų187136.2 Ų136.281%0.81375%0.746SS**  trans89.4106145-86.9164.4-170.1178.20123.1
599L23.2Very low26.8Very low157 Ų157133.4 Ų133.482%0.82275%0.745SS**  11.2124.5125-98.1124.6000118.8
600L23Very low26.4Very low168 Ų168132.8 Ų132.888%0.8875%0.751SS**  -176.9143.1112.8-93.1157.6000111
601V21.1Very low26.7Very low127 Ų127128.4 Ų128.477%0.7775%0.749SS**  trans-117171174.7168.80000105.8
602P33.6Very low26.4Very low109 Ų109128.8 Ų128.871%0.70875%0.753SS**  cis-121.3-170.4-11.421.94.8000110.9
603S22.4Very low26Very low87 Ų87127.7 Ų127.761%0.60875%0.752SS**  177.6150.652.8-45.50000112.1
604T23.1Very low25.7Very low116 Ų116128 Ų12871%0.71275%0.749SS**  trans57.6141.6134.252.80000120.5
605D23.5Very low25.2Very low127 Ų127131.3 Ų131.368%0.67976%0.755SS**  cis-169152.619.7-109.4-20.7000112.1
606H25.3Very low25.2Very low171 Ų171131.9 Ų131.979%0.79275%0.754SS**  trans51.6118.3140.2-75.4-55.7000126.2
607D22.8Very low25.7Very low146 Ų146129.3 Ų129.378%0.78175%0.752SS**  trans-41.4171.1137.3-90.1-31.6000115.3
608P37.3Very low25.7Very low122 Ų122128 Ų12879%0.79276%0.759SS**  cis-149.9172.933.933.6-8000120.2
609A23.9Very low25.8Very low81 Ų81125 Ų12567%0.66976%0.762SS**  trans-9.8157.2149.700000119.6
610T24.1Very low25.7Very low128 Ų128124 Ų12479%0.78576%0.762SS**  cis-175.9-163.223.6-6.50000107.5
611P38.3Very low26.3Very low109 Ų109121.6 Ų121.671%0.70876%0.757SS**  -122.9-154.6-85.733.5-8.2000113.5
612S23Very low26.4Very low111 Ų111120 Ų12078%0.77676%0.757SS**  trans92147.2161.875.50000117.3
613T22.4Very low26Very low116 Ų116124 Ų12471%0.71277%0.767SS**  cis-169156.8-18-670000106.1
614E23.8Very low25.9Very low164 Ų164128.7 Ų128.777%0.76678%0.779SS**  trans-4.4146.5164.2-54.2174.8156.700120.1
615T22.2Very low26.1Very low134 Ų134129.5 Ų129.582%0.82279%0.786SS**  175.9152.280.721.20000111.6
616S25.4Very low26Very low112 Ų112127.5 Ų127.578%0.78379%0.787SS**  trans-72.6176.4163.7-75.10000111.6
617P35.5Very low25.8Very low121 Ų121128.4 Ų128.479%0.78679%0.789SS**  cis-156.3171.936.740.7-15.9000121.1
618A23.6Very low25.7Very low95 Ų95127.3 Ų127.379%0.78579%0.793SS**  trans49128.5141.700000124.4
619S23.9Very low25Very low125 Ų125129.3 Ų129.387%0.87479%0.792SS**  -175.7136.8125.141.10000113.3
620T20.8Very low24.9Very low134 Ų134134.4 Ų134.482%0.82280%0.804SS**  trans-103-175.3171.6-6.40000109
621P37.3Very low24.8Very low118 Ų118134.6 Ų134.677%0.76680%0.8SS**  cis-142.5-167.9-12.835.3-11.7000116.4
622A21.9Very low24.1Very low94 Ų94138.4 Ų138.478%0.77781%0.811SS**  trans95.7137.9157.200000116.7
623E24.9Very low24.1Very low193 Ų193139.6 Ų139.690%0.90281%0.813SS**  cis-150.3161.325.3-71.9177.8134.800112.8
624Q21.8Very low24.1Very low186 Ų186145 Ų14587%0.86982%0.82SS**  trans-102.3165.8164-76.7179.7-3300110.5
625P26.4Very low24.2Very low132 Ų132142.7 Ų142.786%0.85782%0.82SS**  -141.7163.199.130-10.8000116.3
626A20.9Very low24.3Very low85 Ų85145.1 Ų145.170%0.70282%0.822SS**  trans-52.9164.9-178.100000116.1
627F20.7Very low24.6Very low191 Ų191149.3 Ų149.384%0.83883%0.829SS**  -174134.452.9-140.1-88.3000109.9
628S22.3Very low24.3Very low123 Ų123146.5 Ų146.586%0.8682%0.822SS**  trans173.2124.5132.549.80000110.1
629Q21.1Very low24.9Very low163 Ų163151.5 Ų151.576%0.76283%0.829SS**  trans-108.1130.6-172.4-176.51764.500107.9
630M22.8Very low25.6Very low189 Ų189151.8 Ų151.893%0.93182%0.815SS**  trans-150.3131.4155.4-133.4167.3-179.800108.9
631D21.2Very low26.5Very low131 Ų131147.5 Ų147.570%0.70180%0.797SS**  trans-68.5135.1-150.2-60.1-64.2000115.7
632M23.4Very low26.6Very low189 Ų189149 Ų14993%0.93180%0.798SS**  trans-106.5110.3157.5-89.1-148.1-85.700109.6R634M632-R634 PolarHBondContact O-N 2.81Å
633V24.4Very low27.3Very low137 Ų137149 Ų14983%0.8379%0.791SS**PPolyproline II helixtrans-63.5118.8168.8175.10000108.9
634R21.7Very low28.2Very low228 Ų228145.2 Ų145.286%0.8678%0.775SS**PPolyproline II helixtrans-72.4127.2171.5-158.3-177.1-152.6175.25.5108.2M632 E636M632-R634 PolarHBondContact O-N 2.81Å; R634-E636 PolarHBondContact O-N 3Å
635P26.9Very low29.3Very low117 Ų117145 Ų14576%0.7677%0.766SS**PPolyproline II helixtrans-77120.9164.630.3-26.5000107.7
636E24.2Very low30.1Very low184 Ų184146.1 Ų146.186%0.8676%0.758SS**PPolyproline II helixtrans-55.5134.3166.2-70.4-177.9142.100109.8R634 G638R634-E636 PolarHBondContact O-N 3Å; E636-G638 PolarHBondContact O-N 3.28Å
637Q30.5Very low31.4Very low201 Ų201145.5 Ų145.594%0.93974%0.742SS**  trans-67.387.7164-85.1173.3-33.900108.4
638G29Very low32.6Very low62 Ų62138.6 Ų138.664%0.63971%0.714SS**  trans-67.7130.416800000110.7E636 K640E636-G638 PolarHBondContact O-N 3.28Å; G638-K640 PolarHBondContact O-N 2.99Å
639E36.2Very low33.7Very low200 Ų200138 Ų13894%0.93571%0.708SS**  trans-50.1111.1169.3-75.3-178.1125.100110.2G641E639-G641 PolarHBondContact O-N 3.12Å
640K39.9Very low34.9Very low131 Ų131134.6 Ų134.657%0.5769%0.691SS**  trans-61.9111.8173.8-73.1-175.4174.1-172.10109G638 D648G638-K640 PolarHBondContact O-N 2.99Å; K640-D648 IonicContact NZ-OD2 3.45Å
641G39.2Very low36Very low44 Ų44126.7 Ų126.745%0.45465%0.654SS.*  trans-57.5155.8177.800000113.3E639 C643 M644 R645E639-G641 PolarHBondContact O-N 3.12Å; G641-C643 PolarHBondContact O-N 3.33Å; G641-M644 PolarHBondContact O-N 3.4Å; G641-R645 PolarHBondContact O-N 2.93Å
642L40.2Very low37Very low150 Ų150122 Ų12279%0.78564%0.637SS**Hα-helixtrans-48.3-36.4-179.9-162.190.1000112.9R645 F646L642-R645 PolarHBondContact O-N 3.2Å; L642-F646 PolarHBondContact O-N 2.92Å
643C36.3Very low38Very low92 Ų92116.1 Ų116.162%0.62261%0.605SS**Hα-helixtrans-64.3-40.9177.7-1720000112.7G641 F646 I647G641-C643 PolarHBondContact O-N 3.33Å; C643-F646 WeakPolarHBondContact O-CB 3.44Å; C643-F646 PolarHBondContact O-N 3.48Å; C643-I647 VanDerWaalsContact O-CG1 3.26Å; C643-I647 WeakPolarHBondContact O-CG1 3.49Å; C643-I647 PolarHBondContact O-N 3.12Å
644M42.4Very low38.4Very low115 Ų115119 Ų11957%0.56761%0.606SS**Hα-helixtrans-71.6-33.3176.8-98.8168.7176.600112.4G641 I647 D648G641-M644 PolarHBondContact O-N 3.4Å; M644-I647 PolarHBondContact O-N 3.01Å; M644-D648 WeakPolarHBondContact O-CB 3.48Å; M644-D648 PolarHBondContact O-N 3.07Å
645R45.6Very low38.8Very low181 Ų181115.5 Ų115.568%0.68360%0.6SS**Hα-helixtrans-67.5-36.2170.7-75.5-175.1172.6177.7-0.1112.2G641 L642 D648 C649G641-R645 PolarHBondContact O-N 2.93Å; L642-R645 PolarHBondContact O-N 3.2Å; R645-D648 PolarHBondContact O-N 3.41Å; R645-C649 VanDerWaalsContact O-CB 3.26Å; R645-C649 WeakPolarHBondContact O-CB 3.48Å; R645-C649 PolarHBondContact O-N 2.94Å
646F43.1Very low38.9Very low156 Ų156118 Ų11868%0.68460%0.601SS**Hα-helixtrans-63.9-42.3172.1-130.6-91.2000111.1L642 C643 C649 F650L642-F646 PolarHBondContact O-N 2.92Å; C643-F646 WeakPolarHBondContact O-CB 3.44Å; C643-F646 PolarHBondContact O-N 3.48Å; F646-C649 PolarHBondContact O-N 3.48Å; F646-F650 VanDerWaalsContact O-CB 3.22Å; F646-F650 WeakPolarHBondContact O-CB 3.47Å; F646-F650 PolarHBondContact O-N 3.04Å
647I48.1Very low39.3Very low72 Ų72115.5 Ų115.537%0.36960%0.601SS.*Hα-helixtrans-67.6-40.2176.6-68.9165.3000111.7C643 M644 F650 C651C643-I647 VanDerWaalsContact O-CG1 3.26Å; C643-I647 WeakPolarHBondContact O-CG1 3.49Å; C643-I647 PolarHBondContact O-N 3.12Å; M644-I647 PolarHBondContact O-N 3.01Å; I647-F650 CarbonylContact O-C 3.58Å; I647-F650 PolarHBondContact O-N 3.4Å; I647-C651 WeakPolarHBondContact O-CB 3.39Å; I647-C651 PolarHBondContact O-N 2.94Å; I647-C651 PolarHBondContact O-SG 2.88Å
648D46Very low39.2Very low46 Ų46114 Ų11425%0.24659%0.593CS.*Hα-helixtrans-70.4-35.2177.6-74.3-16.3000111.4R405 K640 M644 R645 C651 G652R405-D648 IonicContact CZ-OD1 3.57Å; R405-D648 IonicContact NH2-OD1 3.35Å; R405-D648 PolarHBondContact NH2-OD1 3.16Å; K640-D648 IonicContact NZ-OD2 3.45Å; M644-D648 WeakPolarHBondContact O-CB 3.48Å; M644-D648 PolarHBondContact O-N 3.07Å; R645-D648 PolarHBondContact O-N 3.41Å; D648-C651 PolarHBondContact O-N 3.32Å; D648-G652 PolarHBondContact O-N 3.4Å
649C45.9Very low39Very low111 Ų111114.3 Ų114.375%0.7560%0.597SS**Hα-helixtrans-63.7-43.5168.9-174.80000111.6R645 F646R645-C649 VanDerWaalsContact O-CB 3.26Å; R645-C649 WeakPolarHBondContact O-CB 3.48Å; R645-C649 PolarHBondContact O-N 2.94Å; F646-C649 PolarHBondContact O-N 3.48Å
650F46.2Very low38.5Very low91 Ų91109.1 Ų109.140%0.39959%0.588SS.*Hα-helixtrans-65.6-39.9176.4-162.7-100.1000111.8I174 R412 F646 I647I174-F650 HydrophobicContact CD1-CD2 4.41Å; I174-F650 HydrophobicContact CD1-CE2 3.43Å; I174-F650 VanDerWaalsContact CD1-CE2 3.43Å; I174-F650 HydrophobicContact CD1-CZ 3.81Å; I174-F650 HydrophobicContact CG1-CE2 3.93Å; I174-F650 HydrophobicContact CG1-CZ 4.02Å; I174-F650 HydrophobicContact CG2-CD2 3.96Å; I174-F650 HydrophobicContact CG2-CE2 3.96Å; R412-F650 PolarHBondContact NH1-O 2.93Å; R412-F650 PolarHBondContact NH2-O 3.25Å; F646-F650 VanDerWaalsContact O-CB 3.22Å; F646-F650 WeakPolarHBondContact O-CB 3.47Å; F646-F650 PolarHBondContact O-N 3.04Å; I647-F650 CarbonylContact O-C 3.58Å; I647-F650 PolarHBondContact O-N 3.4Å
651C45Very low38Very low23 Ų23109.3 Ų109.316%0.15560%0.603CS.*Hα-helixtrans-84.3-18.2-175.3-670000113.8I647 D648 Y653I647-C651 WeakPolarHBondContact O-CB 3.39Å; I647-C651 PolarHBondContact O-N 2.94Å; I647-C651 PolarHBondContact O-SG 2.88Å; D648-C651 PolarHBondContact O-N 3.32Å; C651-Y653 PolarHBondContact O-N 3.49Å; C651-Y653 VanDerWaalsContact O-N 3.07Å
652G43.9Very low37.5Very low33 Ų33114.6 Ų114.634%0.3462%0.616SS.*  trans59.222.7171.400000115.5D648D648-G652 PolarHBondContact O-N 3.4Å
653Y42.6Very low36.9Very low65 Ų65117.1 Ų117.126%0.25562%0.62SS.*  trans-113.1124.3-172.4-165.5-102.8000111C651 E655C651-Y653 PolarHBondContact O-N 3.49Å; C651-Y653 VanDerWaalsContact O-N 3.07Å; Y653-E655 HydrophobicContact CD1-CG 4.12Å; Y653-E655 HydrophobicContact CE1-CB 4.49Å; Y653-E655 HydrophobicContact CE1-CG 3.78Å
654K33.4Very low36.7Very low197 Ų197115.8 Ų115.886%0.85761%0.609SS**  trans-102.5123.4163.3-81.8-177.6175-179.90107.3E656K654-E656 PolarHBondContact O-N 3.38Å
655E31Very low36.9Very low155 Ų155115 Ų11572%0.72462%0.615SS**  trans-67.6125.8172.8-81.2172164.100109.8Y653Y653-E655 HydrophobicContact CD1-CG 4.12Å; Y653-E655 HydrophobicContact CE1-CB 4.49Å; Y653-E655 HydrophobicContact CE1-CG 3.78Å
656E28.6Very low36.5Very low169 Ų169111.5 Ų111.579%0.7961%0.606SS**  trans-110.7143.8155-81.5-167.1166.900108.9K654 H658K654-E656 PolarHBondContact O-N 3.38Å; E656-H658 PolarHBondContact O-N 2.76Å
657P32.6Very low36.9Very low131 Ų131110.2 Ų110.285%0.85160%0.602SS**PPolyproline II helixtrans-71.1130.7-174.722.9-22.5000111.5
658H28.3Very low37.4Very low169 Ų169110.4 Ų110.478%0.78260%0.604SS**PPolyproline II helixtrans-64.2129.1-178.2-80.8-53.9000113.6E656E656-H658 PolarHBondContact O-N 2.76Å
659G24Very low38.1Very low70 Ų70112.2 Ų112.272%0.72261%0.611SS**PPolyproline II helixtrans-95.6126.8155.100000111.2
660A25.6Very low38.8Very low91 Ų91111.8 Ų111.875%0.75260%0.597SS**  trans33.7145.2157.900000122Q662A660-Q662 PolarHBondContact O-N 2.67Å
661P29.5Very low39.8Very low135 Ų135110.9 Ų110.988%0.87760%0.599SS**  trans-65.8128.4177.220.5-17.4000111.2
662Q29.6Very low41.1Very low155 Ų155110.7 Ų110.772%0.72460%0.597SS**  trans-70.8137.1-168.4-162.117610.900111.6A660 V664A660-Q662 PolarHBondContact O-N 2.67Å; Q662-V664 HydrophobicContact CB-CG2 3.53Å; Q662-V664 HydrophobicContact CG-CG2 3.67Å; Q662-V664 WeakPolarHBondContact O-CG2 3.39Å; Q662-V664 PolarHBondContact O-N 3.36Å
663K26.6Very low42.3Very low202 Ų202110.9 Ų110.988%0.87860%0.595SS**  trans-7272.6167.5-79.6178.7174.3175.60109.4S665K663-S665 PolarHBondContact O-N 3.29Å
664V33.8Very low43.7Very low65 Ų65111 Ų11139%0.39461%0.609SS.*Hα-helixtrans-75.8-22.2-164.9178.30000115.4Q662 Q666 D668Q662-V664 HydrophobicContact CB-CG2 3.53Å; Q662-V664 HydrophobicContact CG-CG2 3.67Å; Q662-V664 WeakPolarHBondContact O-CG2 3.39Å; Q662-V664 PolarHBondContact O-N 3.36Å; V664-Q666 PolarHBondContact O-N 3.2Å; V664-D668 WeakPolarHBondContact CG1-OD2 3.24Å
665S45.7Very low45.8Very low97 Ų97102.1 Ų102.168%0.67857%0.571SS**Hα-helixtrans-78-28.4-164.7-164.30000116.6K663K663-S665 PolarHBondContact O-N 3.29Å
666Q37.6Very low48.1Very low108 Ų10896.2 Ų96.251%0.50554%0.544SS..Hα-helixtrans-98.8-22.6-170.3-148.6178.67.500113.2Y564 V664Y564-Q666 PolarHBondContact O-NE2 3.25Å; V664-Q666 PolarHBondContact O-N 3.2Å
667E50.3Low50.6Low129 Ų12993.1 Ų93.160%0.60353%0.526SS*.Hα-helixtrans-80.6-40.8179.3-154165.9-162.200110.7E669 K670 V671E667-E669 VanDerWaalsContact C-N 3.34Å; E667-E669 PolarHBondContact O-N 3.46Å; E667-K670 PolarHBondContact O-N 2.98Å; E667-V671 WeakPolarHBondContact O-CG2 3.28Å; E667-V671 PolarHBondContact O-N 3.43Å; E667-V671 VanDerWaalsContact O-N 3.07Å
668D59.2Low52.9Low77 Ų7788.5 Ų88.541%0.41249%0.493SS..Hα-helixtrans-63.2-35.3175.6-79.7-17.3000113.1V664 T672V664-D668 WeakPolarHBondContact CG1-OD2 3.24Å; D668-T672 WeakPolarHBondContact O-CB 3.33Å; D668-T672 PolarHBondContact O-N 3.18Å; D668-T672 PolarHBondContact O-OG1 3.22Å
669E61.6Low55.5Low84 Ų8482.1 Ų82.139%0.39347%0.467SS..Hα-helixtrans-67.1-38.9176.2-78.2-169.215800112.1E667 T672 A673E667-E669 VanDerWaalsContact C-N 3.34Å; E667-E669 PolarHBondContact O-N 3.46Å; E669-T672 PolarHBondContact O-N 3Å; E669-A673 WeakPolarHBondContact O-CB 3.46Å; E669-A673 PolarHBondContact O-N 3.46Å
670K59.9Low58.2Low102 Ų10283 Ų8344%0.44346%0.461SS..Hα-helixtrans-67.2-43.1176.2-71177.7-175.6176.70111.5E667 T672 A673 A674E667-K670 PolarHBondContact O-N 2.98Å; K670-T672 VanDerWaalsContact C-N 3.32Å; K670-T672 PolarHBondContact O-N 3.41Å; K670-A673 PolarHBondContact O-N 2.83Å; K670-A674 WeakPolarHBondContact O-CB 3.35Å; K670-A674 PolarHBondContact O-N 2.99Å
671V67.3Low61Low72 Ų7288.9 Ų88.944%0.43646%0.464SS..Hα-helixtrans-61.8-41.8175.3173.40000110.8E667 A674 M675E667-V671 WeakPolarHBondContact O-CG2 3.28Å; E667-V671 PolarHBondContact O-N 3.43Å; E667-V671 VanDerWaalsContact O-N 3.07Å; V671-A674 PolarHBondContact O-N 3.28Å; V671-M675 WeakPolarHBondContact O-CB 3.33Å; V671-M675 PolarHBondContact O-N 3.35Å
672T71.4Confident63.8Low19 Ų1986.1 Ų86.112%0.11744%0.441CS..Hα-helixtrans-65.4-43.8178-57.90000111.8I102 Y103 D668 E669 K670 A674 M675 L676I102-T672 HydrophobicContact CG2-CG2 4.3Å; I102-T672 VanDerWaalsContact O-CG2 3.31Å; I102-T672 WeakPolarHBondContact O-CG2 3.25Å; Y103-T672 HydrophobicContact CD2-CG2 4.41Å; D668-T672 WeakPolarHBondContact O-CB 3.33Å; D668-T672 PolarHBondContact O-N 3.18Å; D668-T672 PolarHBondContact O-OG1 3.22Å; E669-T672 PolarHBondContact O-N 3Å; K670-T672 VanDerWaalsContact C-N 3.32Å; K670-T672 PolarHBondContact O-N 3.41Å; T672-A674 PolarHBondContact O-N 3.33Å; T672-M675 PolarHBondContact O-N 2.9Å; T672-L676 HydrophobicContact CG2-CD1 4.11Å; T672-L676 WeakPolarHBondContact O-CG 3.41Å; T672-L676 PolarHBondContact O-N 2.9Å
673A69.6Low66.7Low37 Ų3782.6 Ų82.631%0.30642%0.423SS..Hα-helixtrans-64.4-38.9176.900000112.4E669 K670 L676 Y677E669-A673 WeakPolarHBondContact O-CB 3.46Å; E669-A673 PolarHBondContact O-N 3.46Å; K670-A673 PolarHBondContact O-N 2.83Å; A673-L676 PolarHBondContact O-N 3.22Å; A673-Y677 PolarHBondContact O-N 3.21Å
674A72.1Confident69.8Low67 Ų6779 Ų7955%0.55441%0.413SS*.Hα-helixtrans-66.1-39.8174.500000111.9K670 V671 T672 L676 Y677K670-A674 WeakPolarHBondContact O-CB 3.35Å; K670-A674 PolarHBondContact O-N 2.99Å; V671-A674 PolarHBondContact O-N 3.28Å; T672-A674 PolarHBondContact O-N 3.33Å; A674-L676 VanDerWaalsContact C-N 3.32Å; A674-L676 PolarHBondContact O-N 3.48Å; A674-Y677 WeakPolarHBondContact O-CB 3.42Å; A674-Y677 PolarHBondContact O-N 2.68Å
675M76.7Confident72.7Confident11 Ų1181.6 Ų81.65%0.05442%0.424CS..Hα-helixtrans-65.6-34.5177.8-171.7-178.5-95.900112.6R44 I102 A289 I292 V671 T672 Y677R44-M675 HydrophobicContact CB-CE 4.06Å; R44-M675 HydrophobicContact CG-CE 4Å; I102-M675 HydrophobicContact CB-SD 4.24Å; I102-M675 HydrophobicContact CD1-CG 4.19Å; I102-M675 HydrophobicContact CD1-SD 3.83Å; I102-M675 HydrophobicContact CG1-SD 3.81Å; I102-M675 HydrophobicContact CG2-CB 4.12Å; I102-M675 HydrophobicContact CG2-CG 3.85Å; I102-M675 HydrophobicContact CG2-SD 3.45Å; I102-M675 WeakPolarHBondContact CG2-SD 3.21Å; A289-M675 WeakPolarHBondContact O-CE 3.5Å; I292-M675 WeakPolarHBondContact CB-O 3.18Å; I292-M675 WeakPolarHBondContact CG2-O 3.45Å; I292-M675 PolarHBondContact N-O 3.01Å; V671-M675 WeakPolarHBondContact O-CB 3.33Å; V671-M675 PolarHBondContact O-N 3.35Å; T672-M675 PolarHBondContact O-N 2.9Å; M675-Y677 VanDerWaalsContact C-N 3.33Å
676L80.8Confident75Confident31 Ų3177.4 Ų77.416%0.16239%0.394CS..THydrogen-bonded Turntrans-81.4-7.9178.9-71.3170.5000114.1I102 Y103 L549 L552 T672 A673 A674I102-L676 HydrophobicContact CB-CD2 4.03Å; I102-L676 HydrophobicContact CG2-CD1 4.45Å; I102-L676 HydrophobicContact CG2-CD2 3.69Å; I102-L676 HydrophobicContact CG2-CG 3.76Å; Y103-L676 HydrophobicContact CD2-CD1 3.94Å; Y103-L676 HydrophobicContact CG-CD1 4.26Å; L549-L676 HydrophobicContact CD1-CD1 4.16Å; L549-L676 HydrophobicContact CD1-CD2 4.4Å; L552-L676 HydrophobicContact CD2-CD1 4.34Å; T672-L676 HydrophobicContact CG2-CD1 4.11Å; T672-L676 WeakPolarHBondContact O-CG 3.41Å; T672-L676 PolarHBondContact O-N 2.9Å; A673-L676 PolarHBondContact O-N 3.22Å; A674-L676 VanDerWaalsContact C-N 3.32Å; A674-L676 PolarHBondContact O-N 3.48Å
677Y79.6Confident77.7Confident103 Ų10375.5 Ų75.540%0.40439%0.387SS..  trans-71.3134.9179.6-177.6-104.1000111.2L557 A673 A674 M675L557-Y677 HydrophobicContact CD1-CE2 4.42Å; A673-Y677 PolarHBondContact O-N 3.21Å; A674-Y677 WeakPolarHBondContact O-CB 3.42Å; A674-Y677 PolarHBondContact O-N 2.68Å; M675-Y677 VanDerWaalsContact C-N 3.33Å
678E82.6Confident79.9Confident34 Ų3475.4 Ų75.416%0.15939%0.39CS..  trans-134.5124.8-179.2-172.4174.8-14200108.6I292 K296 D682 K683 L686I292-E678 HydrophobicContact CG2-CB 4.19Å; K296-E678 IonicContact NZ-OE1 3.42Å; K296-E678 PolarHBondContact NZ-OE1 2.86Å; K296-E678 IonicContact NZ-OE2 3.52Å; K296-E678 PolarHBondContact NZ-OE2 3.38Å; E678-D682 HydrophobicContact CG-CB 4.43Å; E678-K683 HydrophobicContact CG-CB 4.09Å; E678-L686 WeakPolarHBondContact OE1-CD1 3.19Å
679S81.1Confident81.6Confident35 Ų3573.1 Ų73.125%0.24538%0.382CS..  trans-65.5144.7177.11770000110.6R681 D682 K683S679-R681 PolarHBondContact O-N 3.3Å; S679-D682 PolarHBondContact O-N 3.42Å; S679-D682 VanDerWaalsContact O-N 3.11Å; S679-K683 PolarHBondContact O-N 3.38Å
680P82.2Confident83.3Confident90 Ų9070.9 Ų70.958%0.58437%0.372SS*.Hα-helixtrans-55.3-36177.2-26.133.9000113.7I684P680-I684 WeakPolarHBondContact O-CG1 3.34Å; P680-I684 PolarHBondContact O-N 2.95Å
681R84.9Confident85.1Confident214 Ų21473 Ų7381%0.80838%0.382SS*.Hα-helixtrans-66.8-46.5176.9-67.8-175.6-178.6179.51.2111.4S679 K683 I684 L685S679-R681 PolarHBondContact O-N 3.3Å; R681-K683 VanDerWaalsContact C-N 3.31Å; R681-K683 PolarHBondContact O-N 3.21Å; R681-I684 PolarHBondContact O-N 3.41Å; R681-L685 PolarHBondContact O-N 3.29Å; R681-L685 VanDerWaalsContact O-N 3.09Å
682D88.3Confident86.4Confident76 Ų7675.9 Ų75.941%0.40639%0.392SS..Hα-helixtrans-62.3-41.6178.6-63.1-13.6000110.7E678 S679 I684 L685 L686E678-D682 HydrophobicContact CG-CB 4.43Å; S679-D682 PolarHBondContact O-N 3.42Å; S679-D682 VanDerWaalsContact O-N 3.11Å; D682-I684 VanDerWaalsContact C-N 3.35Å; D682-I684 PolarHBondContact O-N 3.04Å; D682-L685 PolarHBondContact O-N 3Å; D682-L686 HydrophobicContact CB-CD1 4.48Å; D682-L686 VanDerWaalsContact O-CB 3.27Å; D682-L686 WeakPolarHBondContact O-CB 3.45Å; D682-L686 WeakPolarHBondContact O-CG 3.47Å; D682-L686 PolarHBondContact O-N 2.92Å
683K89.3Confident87.6Confident81 Ų8175.7 Ų75.735%0.35239%0.391SS..Hα-helixtrans-59.2-43177.5-168.3170.8-174.4170.50112.3E553 E678 S679 R681 N687E553-K683 IonicContact OE1-NZ 3.05Å; E553-K683 PolarHBondContact OE1-NZ 3.49Å; E678-K683 HydrophobicContact CG-CB 4.09Å; S679-K683 PolarHBondContact O-N 3.38Å; R681-K683 VanDerWaalsContact C-N 3.31Å; R681-K683 PolarHBondContact O-N 3.21Å; K683-N687 WeakPolarHBondContact O-CB 3.49Å; K683-N687 PolarHBondContact O-N 2.98Å; K683-N687 VanDerWaalsContact O-N 3.09Å; K683-N687 PolarHBondContact O-ND2 3.05Å; K683-N687 VanDerWaalsContact O-ND2 3.1Å
684I91.8Very high88.9Confident128 Ų12875.3 Ų75.366%0.65639%0.386SS*.Hα-helixtrans-65-48.3177.2-67.9167.2000110.4P680 R681 D682 L686 N687 L688P680-I684 WeakPolarHBondContact O-CG1 3.34Å; P680-I684 PolarHBondContact O-N 2.95Å; R681-I684 PolarHBondContact O-N 3.41Å; D682-I684 VanDerWaalsContact C-N 3.35Å; D682-I684 PolarHBondContact O-N 3.04Å; I684-L686 PolarHBondContact O-N 2.74Å; I684-N687 PolarHBondContact O-N 2.83Å; I684-L688 PolarHBondContact O-N 3.4Å
685L93.9Very high90Very high119 Ų11974.3 Ų74.362%0.62338%0.375SS*.Hα-helixtrans-64.6-42.2-177.6-169.7139.5000111.9R681 D682 L688 A689R681-L685 PolarHBondContact O-N 3.29Å; R681-L685 VanDerWaalsContact O-N 3.09Å; D682-L685 PolarHBondContact O-N 3Å; L685-L688 PolarHBondContact O-N 3.26Å; L685-A689 WeakPolarHBondContact O-CB 3.29Å; L685-A689 PolarHBondContact O-N 3.43Å
686L94.5Very high90.9Very high8 Ų876.3 Ų76.34%0.04239%0.387CS..Hα-helixtrans-64.7-40.8176.8-72.8168.3000112W95 A293 K296 C297 L300 E678 D682 I684 A689 L690W95-L686 HydrophobicContact CZ2-CB 4.15Å; A293-L686 HydrophobicContact CB-CD1 4.13Å; K296-L686 HydrophobicContact CB-CD1 4.27Å; K296-L686 HydrophobicContact CB-CD2 4.15Å; K296-L686 HydrophobicContact CD-CD1 4.1Å; C297-L686 HydrophobicContact CB-CD2 4.12Å; L300-L686 HydrophobicContact CD1-CD2 3.75Å; E678-L686 WeakPolarHBondContact OE1-CD1 3.19Å; D682-L686 HydrophobicContact CB-CD1 4.48Å; D682-L686 VanDerWaalsContact O-CB 3.27Å; D682-L686 WeakPolarHBondContact O-CB 3.45Å; D682-L686 WeakPolarHBondContact O-CG 3.47Å; D682-L686 PolarHBondContact O-N 2.92Å; I684-L686 PolarHBondContact O-N 2.74Å; L686-A689 PolarHBondContact O-N 3.39Å; L686-L690 VanDerWaalsContact O-CB 3.31Å; L686-L690 WeakPolarHBondContact O-CB 3.43Å; L686-L690 PolarHBondContact O-N 2.81Å
687N95.1Very high91.5Very high69 Ų6974.9 Ų74.937%0.36938%0.38SS..Hα-helixtrans-69.9-34.3177-72-26.5000112.6W95 K683 I684 L690 F691W95-N687 PolarHBondContact NE1-OD1 3.06Å; K683-N687 WeakPolarHBondContact O-CB 3.49Å; K683-N687 PolarHBondContact O-N 2.98Å; K683-N687 VanDerWaalsContact O-N 3.09Å; K683-N687 PolarHBondContact O-ND2 3.05Å; K683-N687 VanDerWaalsContact O-ND2 3.1Å; I684-N687 PolarHBondContact O-N 2.83Å; N687-L690 WeakPolarHBondContact O-CB 3.27Å; N687-L690 PolarHBondContact O-N 3.06Å; N687-F691 PolarHBondContact O-N 2.83Å
688L95.9Very high92.1Very high126 Ų12674.4 Ų74.466%0.6638%0.383SS*.Hα-helixtrans-64.2-46.9172.7-173.376.8000110.9I684 L685 L690 F691 M692I684-L688 PolarHBondContact O-N 3.4Å; L685-L688 PolarHBondContact O-N 3.26Å; L688-L690 VanDerWaalsContact C-N 3.34Å; L688-L690 PolarHBondContact O-N 3.36Å; L688-F691 PolarHBondContact O-N 3.02Å; L688-M692 PolarHBondContact O-N 3.3Å
689A95.9Very high92.7Very high30 Ų3078.6 Ų78.625%0.24840%0.401CS..Hα-helixtrans-63.6-39.4176.900000111.9L300 L685 L686 M692 V693L300-A689 HydrophobicContact CD1-CB 3.62Å; L300-A689 HydrophobicContact CD2-CB 4.3Å; L685-A689 WeakPolarHBondContact O-CB 3.29Å; L685-A689 PolarHBondContact O-N 3.43Å; L686-A689 PolarHBondContact O-N 3.39Å; A689-M692 PolarHBondContact O-N 3.49Å; A689-V693 WeakPolarHBondContact O-CG2 3.33Å; A689-V693 PolarHBondContact O-N 2.96Å
690L96.8Very high93.3Very high37 Ų3778.7 Ų78.719%0.19440%0.399CS..Hα-helixtrans-56.3-50.7172.5173.266000111.5Q91 W95 L300 L686 N687 L688 M692 V693 C694Q91-L690 HydrophobicContact CB-CD1 3.48Å; Q91-L690 VanDerWaalsContact CB-CD1 3.48Å; Q91-L690 HydrophobicContact CG-CD1 3.61Å; W95-L690 HydrophobicContact CD2-CD1 4.34Å; W95-L690 HydrophobicContact CD2-CD2 4.01Å; W95-L690 HydrophobicContact CE3-CD1 4.18Å; W95-L690 HydrophobicContact CG-CD2 4.26Å; W95-L690 HydrophobicContact CH2-CB 4Å; W95-L690 HydrophobicContact CH2-CD1 4.24Å; W95-L690 HydrophobicContact CZ2-CB 3.73Å; W95-L690 HydrophobicContact CZ2-CD1 4.36Å; W95-L690 HydrophobicContact CZ2-CD2 4.02Å; W95-L690 HydrophobicContact CZ2-CG 4.25Å; W95-L690 HydrophobicContact CZ3-CD1 4.15Å; L300-L690 HydrophobicContact CD2-CB 4.28Å; L686-L690 VanDerWaalsContact O-CB 3.31Å; L686-L690 WeakPolarHBondContact O-CB 3.43Å; L686-L690 PolarHBondContact O-N 2.81Å; N687-L690 WeakPolarHBondContact O-CB 3.27Å; N687-L690 PolarHBondContact O-N 3.06Å; L688-L690 VanDerWaalsContact C-N 3.34Å; L688-L690 PolarHBondContact O-N 3.36Å; L690-M692 VanDerWaalsContact C-N 3.29Å; L690-M692 PolarHBondContact O-N 3.23Å; L690-V693 PolarHBondContact O-N 2.64Å; L690-C694 WeakPolarHBondContact O-CB 3.3Å; L690-C694 PolarHBondContact O-N 3.18Å; L690-C694 PolarHBondContact O-SG 3.22Å; L690-C694 VanDerWaalsContact O-SG 3.42Å
691F96.8Very high93.7Very high146 Ų14676.1 Ų76.164%0.6438%0.378SS*.Hα-helixtrans-58.8-43.4178.5178.4-98.7000111.4N687 L688 S695N687-F691 PolarHBondContact O-N 2.83Å; L688-F691 PolarHBondContact O-N 3.02Å; F691-S695 WeakPolarHBondContact O-CB 3.38Å; F691-S695 PolarHBondContact O-N 3.39Å; F691-S695 PolarHBondContact O-OG 2.93Å
692M96.3Very high94Very high133 Ų13369.4 Ų69.466%0.65536%0.361SS*.Hα-helixtrans-61.3-52.8177.7-173.6-174.1-126.200112L688 A689 L690 C694 S695 V696L688-M692 PolarHBondContact O-N 3.3Å; A689-M692 PolarHBondContact O-N 3.49Å; L690-M692 VanDerWaalsContact C-N 3.29Å; L690-M692 PolarHBondContact O-N 3.23Å; M692-C694 PolarHBondContact O-N 3.02Å; M692-S695 PolarHBondContact O-N 3.02Å; M692-V696 WeakPolarHBondContact O-CG2 3.42Å; M692-V696 PolarHBondContact O-N 3.23Å
693V95.9Very high94.2Very high14 Ų1472.4 Ų72.49%0.08537%0.368CS..Hα-helixtrans-63.1-44.2-177.5172.50000111.2I87 L300 A689 L690 V696 G697I87-V693 HydrophobicContact CG2-CG1 3.61Å; L300-V693 HydrophobicContact CD2-CB 4.31Å; L300-V693 HydrophobicContact CD2-CG2 4.07Å; A689-V693 WeakPolarHBondContact O-CG2 3.33Å; A689-V693 PolarHBondContact O-N 2.96Å; L690-V693 PolarHBondContact O-N 2.64Å; V693-V696 PolarHBondContact O-N 3.15Å; V693-G697 PolarHBondContact O-N 2.95Å
694C95.9Very high94.3Very high29 Ų2969.3 Ų69.320%0.19635%0.354CS..Hα-helixtrans-64.4-41.4176.3-71.50000112.1L88 L690 M692 G697 I698L88-C694 HydrophobicContact CD2-CB 4.11Å; L690-C694 WeakPolarHBondContact O-CB 3.3Å; L690-C694 PolarHBondContact O-N 3.18Å; L690-C694 PolarHBondContact O-SG 3.22Å; L690-C694 VanDerWaalsContact O-SG 3.42Å; M692-C694 PolarHBondContact O-N 3.02Å; C694-G697 PolarHBondContact O-N 3.43Å; C694-I698 VanDerWaalsContact O-CG1 3.28Å; C694-I698 WeakPolarHBondContact O-CG1 3.34Å; C694-I698 PolarHBondContact O-N 2.98Å
695S96.1Very high94.1Very high47 Ų4764.2 Ų64.233%0.32933%0.33SS..Hα-helixtrans-63.7-42.6178.3-61.70000111.6F691 M692 F699F691-S695 WeakPolarHBondContact O-CB 3.38Å; F691-S695 PolarHBondContact O-N 3.39Å; F691-S695 PolarHBondContact O-OG 2.93Å; M692-S695 PolarHBondContact O-N 3.02Å; S695-F699 VanDerWaalsContact O-CB 3.23Å; S695-F699 WeakPolarHBondContact O-CB 3.19Å; S695-F699 PolarHBondContact O-N 3.42Å
696V95.1Very high93.6Very high52 Ų5266 Ų6632%0.31534%0.339SS..Hα-helixtrans-64.9-44175.5173.90000110.9I307 M692 V693 F699 M700I307-V696 HydrophobicContact CD1-CG1 3.53Å; I307-V696 HydrophobicContact CG1-CG1 4.5Å; M692-V696 WeakPolarHBondContact O-CG2 3.42Å; M692-V696 PolarHBondContact O-N 3.23Å; V693-V696 PolarHBondContact O-N 3.15Å; V696-F699 PolarHBondContact O-N 3.08Å; V696-M700 HydrophobicContact CG1-CG 4.3Å; V696-M700 WeakPolarHBondContact O-CB 3.48Å; V696-M700 VanDerWaalsContact O-CG 3.27Å; V696-M700 WeakPolarHBondContact O-CG 3.23Å; V696-M700 PolarHBondContact O-N 2.91Å
697G93.1Very high93.5Very high1 Ų168.9 Ų68.91%0.0135%0.354CS..Hα-helixtrans-59.5-47.3177.100000112.7V693 C694 M700 F701V693-G697 PolarHBondContact O-N 2.95Å; C694-G697 PolarHBondContact O-N 3.43Å; G697-M700 PolarHBondContact O-N 3.38Å; G697-F701 WeakPolarHBondContact O-CB 3.43Å; G697-F701 PolarHBondContact O-N 3.26Å
698I93.6Very high93.4Very high93 Ų9368.8 Ų68.848%0.47735%0.353SS..Hα-helixtrans-64.1-44.8176.8-66.5165.6000110.7L88 C694 M700 F701 V702L88-I698 HydrophobicContact CD1-CG1 4.43Å; L88-I698 HydrophobicContact CD2-CG1 4.26Å; C694-I698 VanDerWaalsContact O-CG1 3.28Å; C694-I698 WeakPolarHBondContact O-CG1 3.34Å; C694-I698 PolarHBondContact O-N 2.98Å; I698-M700 VanDerWaalsContact C-N 3.35Å; I698-M700 PolarHBondContact O-N 3.36Å; I698-F701 PolarHBondContact O-N 2.92Å; I698-V702 HydrophobicContact CG2-CG2 4.36Å; I698-V702 WeakPolarHBondContact O-CG2 3.44Å; I698-V702 PolarHBondContact O-N 3.42Å
699F95Very high93.3Very high122 Ų12265.7 Ų65.754%0.53534%0.336SS..Hα-helixtrans-57.5-48177.4171.9-96.2000111.5S695 V696 F701 V702 Y703S695-F699 VanDerWaalsContact O-CB 3.23Å; S695-F699 WeakPolarHBondContact O-CB 3.19Å; S695-F699 PolarHBondContact O-N 3.42Å; V696-F699 PolarHBondContact O-N 3.08Å; F699-F701 VanDerWaalsContact C-N 3.35Å; F699-F701 PolarHBondContact O-N 3.23Å; F699-V702 PolarHBondContact O-N 3.48Å; F699-Y703 HydrophobicContact CZ-CD2 4.34Å; F699-Y703 WeakPolarHBondContact O-CB 3.4Å; F699-Y703 PolarHBondContact O-N 3.29Å
700M93.1Very high93.1Very high38 Ų3867.8 Ų67.819%0.18734%0.341CS..Hα-helixtrans-62.8-42.6178.6-71.2-64.4169.300111.7F84 V696 G697 I698 V702 Y703 F704F84-M700 HydrophobicContact CD1-CB 4.3Å; F84-M700 HydrophobicContact CD2-CB 4.04Å; F84-M700 HydrophobicContact CE1-CB 3.98Å; F84-M700 HydrophobicContact CE1-CG 4.49Å; F84-M700 HydrophobicContact CE2-CB 3.7Å; F84-M700 HydrophobicContact CG-CB 4.33Å; F84-M700 HydrophobicContact CZ-CB 3.67Å; F84-M700 HydrophobicContact CZ-CG 4.33Å; V696-M700 HydrophobicContact CG1-CG 4.3Å; V696-M700 WeakPolarHBondContact O-CB 3.48Å; V696-M700 VanDerWaalsContact O-CG 3.27Å; V696-M700 WeakPolarHBondContact O-CG 3.23Å; V696-M700 PolarHBondContact O-N 2.91Å; G697-M700 PolarHBondContact O-N 3.38Å; I698-M700 VanDerWaalsContact C-N 3.35Å; I698-M700 PolarHBondContact O-N 3.36Å; M700-V702 VanDerWaalsContact C-N 3.35Å; M700-V702 PolarHBondContact O-N 2.98Å; M700-Y703 PolarHBondContact O-N 3.3Å; M700-F704 WeakPolarHBondContact O-CD2 3.48Å; M700-F704 PolarHBondContact O-N 2.75Å; M700-F704 VanDerWaalsContact O-N 3.11Å; M700-F704 HydrophobicContact SD-CE2 4.12Å
701F89.7Confident92.9Very high36 Ų3669.7 Ų69.716%0.15835%0.35CS..Hα-helixtrans-61.5-42177.7-162.2-100.8000112.4A81 F84 I250 L251 F264 I265 G697 I698 F699 S705A81-F701 HydrophobicContact CB-CE2 4.36Å; F84-F701 HydrophobicContact CB-CB 4.43Å; F84-F701 HydrophobicContact CB-CD2 3.74Å; F84-F701 HydrophobicContact CD2-CB 4.47Å; F84-F701 HydrophobicContact CD2-CD2 4.32Å; I250-F701 HydrophobicContact CG2-CE2 4.38Å; L251-F701 HydrophobicContact CD1-CD1 4.3Å; L251-F701 HydrophobicContact CD1-CE1 3.44Å; L251-F701 VanDerWaalsContact CD1-CE1 3.44Å; L251-F701 HydrophobicContact CD1-CZ 3.92Å; L251-F701 HydrophobicContact CD2-CE1 4.2Å; L251-F701 HydrophobicContact CD2-CZ 3.77Å; L251-F701 HydrophobicContact CG-CE1 3.9Å; L251-F701 HydrophobicContact CG-CZ 3.92Å; F264-F701 HydrophobicContact CD1-CZ 4.23Å; F264-F701 HydrophobicContact CE1-CE2 4.1Å; F264-F701 HydrophobicContact CE1-CZ 4.09Å; I265-F701 HydrophobicContact CD1-CE1 4.05Å; I265-F701 HydrophobicContact CD1-CZ 3.98Å; G697-F701 WeakPolarHBondContact O-CB 3.43Å; G697-F701 PolarHBondContact O-N 3.26Å; I698-F701 PolarHBondContact O-N 2.92Å; F699-F701 VanDerWaalsContact C-N 3.35Å; F699-F701 PolarHBondContact O-N 3.23Å; F701-S705 VanDerWaalsContact O-CB 3.29Å; F701-S705 WeakPolarHBondContact O-CB 3.37Å; F701-S705 PolarHBondContact O-N 2.98Å; F701-S705 PolarHBondContact O-OG 3.16Å
702V91.3Very high92.7Very high73 Ų7364.6 Ų64.644%0.44233%0.331SS..Hα-helixtrans-70.7-47.7176.6173.30000111.2I698 F699 M700 F704 S705 L706I698-V702 HydrophobicContact CG2-CG2 4.36Å; I698-V702 WeakPolarHBondContact O-CG2 3.44Å; I698-V702 PolarHBondContact O-N 3.42Å; F699-V702 PolarHBondContact O-N 3.48Å; M700-V702 VanDerWaalsContact C-N 3.35Å; M700-V702 PolarHBondContact O-N 2.98Å; V702-F704 VanDerWaalsContact C-N 3.34Å; V702-F704 PolarHBondContact O-N 2.75Å; V702-S705 PolarHBondContact O-N 3.47Å; V702-L706 HydrophobicContact CG1-CD1 3.76Å; V702-L706 HydrophobicContact CG1-CG 4.3Å; V702-L706 WeakPolarHBondContact O-CG 3.44Å; V702-L706 PolarHBondContact O-N 3.37Å
703Y92.8Very high92.4Very high139 Ų13959.7 Ų59.755%0.54531%0.308SS..Hα-helixtrans-57.1-44.9-176.8176.5-97000112.4F699 M700 S705F699-Y703 HydrophobicContact CZ-CD2 4.34Å; F699-Y703 WeakPolarHBondContact O-CB 3.4Å; F699-Y703 PolarHBondContact O-N 3.29Å; M700-Y703 PolarHBondContact O-N 3.3Å; Y703-S705 VanDerWaalsContact C-N 3.3Å; Y703-S705 PolarHBondContact O-N 2.99Å
704F91Very high92.1Very high15 Ų1563.2 Ų63.27%0.06633%0.325CS..THydrogen-bonded Turntrans-83.5-2.6179.4-78.9-80.7000114.1F77 F84 R249 I250 M310 F311 M700 V702F77-F704 AromaticContact CD2-CD1 3.84Å; F77-F704 HydrophobicContact CD2-CD1 3.84Å; F77-F704 HydrophobicContact CD2-CE1 4.2Å; F77-F704 HydrophobicContact CE2-CD1 4.02Å; F77-F704 AromaticContact CE2-CE1 3.98Å; F77-F704 HydrophobicContact CE2-CE1 3.98Å; F77-F704 HydrophobicContact CG-CD1 4.37Å; F77-F704 HydrophobicContact CZ-CE1 4.24Å; F84-F704 AromaticContact CE2-CD2 3.7Å; F84-F704 HydrophobicContact CE2-CD2 3.7Å; F84-F704 HydrophobicContact CE2-CE2 4.28Å; F84-F704 HydrophobicContact CE2-CG 4.38Å; F84-F704 HydrophobicContact CZ-CD2 4.02Å; F84-F704 HydrophobicContact CZ-CE2 4.14Å; R249-F704 WeakPolarHBondContact CA-O 3.35Å; I250-F704 HydrophobicContact CB-CB 4.47Å; I250-F704 HydrophobicContact CD1-CB 3.3Å; I250-F704 HydrophobicContact CD1-CG 4.05Å; I250-F704 HydrophobicContact CG1-CB 3.67Å; I250-F704 PolarHBondContact N-O 3.15Å; M310-F704 HydrophobicContact CE-CD1 3.69Å; M310-F704 HydrophobicContact CE-CE1 3.64Å; M310-F704 HydrophobicContact CE-CG 4.23Å; M310-F704 HydrophobicContact CE-CZ 4.14Å; M310-F704 HydrophobicContact CG-CZ 4.45Å; F311-F704 HydrophobicContact CE1-CE2 4.5Å; F311-F704 AromaticContact CE1-CZ 3.98Å; F311-F704 HydrophobicContact CE1-CZ 3.98Å; F311-F704 HydrophobicContact CZ-CE2 4.02Å; F311-F704 AromaticContact CZ-CZ 3.97Å; F311-F704 HydrophobicContact CZ-CZ 3.97Å; M700-F704 WeakPolarHBondContact O-CD2 3.48Å; M700-F704 PolarHBondContact O-N 2.75Å; M700-F704 VanDerWaalsContact O-N 3.11Å; M700-F704 HydrophobicContact SD-CE2 4.12Å; V702-F704 VanDerWaalsContact C-N 3.34Å; V702-F704 PolarHBondContact O-N 2.75Å
705S88.1Confident91.8Very high21 Ų2166.1 Ų66.115%0.14734%0.336CS..THydrogen-bonded Turntrans-96.7-23175.4-65.20000113.3L251 F701 V702 Y703L251-S705 WeakPolarHBondContact CG-OG 3.49Å; L251-S705 PolarHBondContact N-OG 3.11Å; F701-S705 VanDerWaalsContact O-CB 3.29Å; F701-S705 WeakPolarHBondContact O-CB 3.37Å; F701-S705 PolarHBondContact O-N 2.98Å; F701-S705 PolarHBondContact O-OG 3.16Å; V702-S705 PolarHBondContact O-N 3.47Å; Y703-S705 VanDerWaalsContact C-N 3.3Å; Y703-S705 PolarHBondContact O-N 2.99Å
706L83.1Confident91.4Very high156 Ų15667.8 Ų67.882%0.81734%0.336SS*.  trans-850177-64.8174.4000110.4R249 V702R249-L706 PolarHBondContact NE-O 3.3Å; R249-L706 PolarHBondContact NH2-O 3.27Å; V702-L706 HydrophobicContact CG1-CD1 3.76Å; V702-L706 HydrophobicContact CG1-CG 4.3Å; V702-L706 WeakPolarHBondContact O-CG 3.44Å; V702-L706 PolarHBondContact O-N 3.37Å

Retrieved 706 of 706 residues in 624.2 ms (Link to these results)

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