A0A077YWT5_TRITR Loading...

Ion trans 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YWT5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 323 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
1M43.6Very low49Very low135 Ų13564.1 Ų64.167%0.66534%0.341SS*.  0146.70-62.5174.3-147.200108.3Y93M1-Y93 HydrophobicContact CB-CE1 4.32Å; M1-Y93 WeakPolarHBondContact O-CE1 3.41Å
2I53.5Low49.5Very low27 Ų2772.4 Ų72.414%0.13837%0.372CS..PPolyproline II helixtrans-99.4126.4177.6-64.9157.7000107.2Y77 R90I2-Y77 HydrophobicContact CD1-CD1 3.24Å; I2-Y77 HydrophobicContact CD1-CE1 3.81Å; I2-Y77 HydrophobicContact CD1-CG 3.84Å; I2-Y77 HydrophobicContact CG1-CD1 3.95Å; I2-Y77 HydrophobicContact CG1-CE1 4.24Å; I2-Y77 HydrophobicContact CG1-CG 4.3Å; I2-Y77 HydrophobicContact CG2-CG 4.26Å; I2-R90 HydrophobicContact CG2-CB 4.04Å; I2-R90 HydrophobicContact CG2-CG 4.23Å
3E48.7Very low49.9Very low79 Ų7975.1 Ų75.137%0.36938%0.382SS..PPolyproline II helixtrans-73.6133.5-177.8-63.3-171.1154.500111.5Y7 R90E3-Y7 HydrophobicContact CB-CD1 3.87Å; E3-Y7 HydrophobicContact CG-CD1 3.7Å; E3-Y7 HydrophobicContact CG-CE1 4.03Å; E3-R90 WeakPolarHBondContact O-CD 3.48Å; E3-R90 WeakPolarHBondContact O-CG 3.44Å
4C51Low50.7Low7 Ų771.6 Ų71.65%0.04736%0.363CS..PPolyproline II helixtrans-69.6153.1165.9-980000110.4T6 Y7 G8 C69C4-T6 VanDerWaalsContact C-N 3.28Å; C4-T6 PolarHBondContact O-N 3.09Å; C4-Y7 VanDerWaalsContact O-CA 3.28Å; C4-Y7 WeakPolarHBondContact O-CA 3.02Å; C4-Y7 WeakPolarHBondContact O-CB 3.23Å; C4-Y7 PolarHBondContact O-N 2.95Å; C4-G8 PolarHBondContact O-N 2.82Å; C4-C69 HydrophobicContact CB-CB 4.47Å; C4-C69 WeakPolarHBondContact CB-SG 3.45Å; C4-C69 WeakPolarHBondContact SG-CB 2.94Å; C4-C69 PolarHBondContact SG-O 3.23Å; C4-C69 CovalentContact SG-SG 2.08Å; C4-C69 PolarHBondContact SG-SG 3.33Å
5P49.3Very low51.6Low41 Ų4175.8 Ų75.827%0.26638%0.378SS..Hα-helixtrans-60.8-37.7175.923-32.1000112.2Y7 T9P5-Y7 VanDerWaalsContact C-N 3.26Å; P5-Y7 PolarHBondContact O-N 3.24Å; P5-T9 PolarHBondContact O-OG1 3.06Å
6T47.7Very low52.8Low82 Ų8277.4 Ų77.450%0.50338%0.384SS..Hα-helixtrans-65.7-29.3167.730.90000111.7C4 R10C4-T6 VanDerWaalsContact C-N 3.28Å; C4-T6 PolarHBondContact O-N 3.09Å; T6-R10 VanDerWaalsContact O-CA 3.29Å; T6-R10 WeakPolarHBondContact O-CA 2.94Å; T6-R10 WeakPolarHBondContact O-CB 3.34Å; T6-R10 PolarHBondContact O-N 3.37Å
7Y45Very low53.5Low54 Ų5477.9 Ų77.921%0.21239%0.385CS..Hα-helixtrans-72.5-35.5-177.2-168.7-100.4000113.3E3 C4 P5 R10 M11E3-Y7 HydrophobicContact CB-CD1 3.87Å; E3-Y7 HydrophobicContact CG-CD1 3.7Å; E3-Y7 HydrophobicContact CG-CE1 4.03Å; C4-Y7 VanDerWaalsContact O-CA 3.28Å; C4-Y7 WeakPolarHBondContact O-CA 3.02Å; C4-Y7 WeakPolarHBondContact O-CB 3.23Å; C4-Y7 PolarHBondContact O-N 2.95Å; P5-Y7 VanDerWaalsContact C-N 3.26Å; P5-Y7 PolarHBondContact O-N 3.24Å; Y7-R10 CarbonylContact O-C 3.56Å; Y7-M11 HydrophobicContact CD1-CB 4.47Å; Y7-M11 HydrophobicContact CD1-CG 3.4Å; Y7-M11 HydrophobicContact CD1-SD 4.47Å; Y7-M11 HydrophobicContact CD2-CG 3.86Å; Y7-M11 HydrophobicContact CD2-SD 4.46Å; Y7-M11 HydrophobicContact CE1-CE 3.85Å; Y7-M11 HydrophobicContact CE1-CG 3.27Å; Y7-M11 HydrophobicContact CE1-SD 3.8Å; Y7-M11 HydrophobicContact CE2-CG 3.71Å; Y7-M11 HydrophobicContact CE2-SD 3.76Å; Y7-M11 HydrophobicContact CG-CG 3.71Å; Y7-M11 VanDerWaalsContact CZ-CG 3.43Å; Y7-M11 VanDerWaalsContact O-CA 3.26Å; Y7-M11 WeakPolarHBondContact O-CA 3.4Å; Y7-M11 WeakPolarHBondContact O-CB 3.33Å; Y7-M11 WeakPolarHBondContact O-CG 3.44Å; Y7-M11 PolarHBondContact O-N 3.1Å; Y7-M11 WeakPolarHBondContact OH-CE 3.35Å; Y7-M11 PolarHBondContact OH-SD 3.14Å; Y7-M11 VanDerWaalsContact OH-SD 3.4Å
8G49.1Very low54.2Low27 Ų2780.2 Ų80.228%0.27839%0.388SS..Hα-helixtrans-67.4-50.2179.200000112.9C4 M11 K12C4-G8 PolarHBondContact O-N 2.82Å; G8-M11 PolarHBondContact O-N 3.26Å; G8-K12 PolarHBondContact O-N 3.39Å
9T50Low55.1Low104 Ų10480.8 Ų80.864%0.63839%0.391SS*.Hα-helixtrans-68.4-41.3172.129.20000111.6P5 M11 K12 H13P5-T9 PolarHBondContact O-OG1 3.06Å; T9-M11 VanDerWaalsContact C-N 3.3Å; T9-M11 PolarHBondContact O-N 2.8Å; T9-K12 PolarHBondContact O-N 3.01Å; T9-H13 WeakPolarHBondContact O-CA 3.32Å; T9-H13 WeakPolarHBondContact O-CB 3.17Å; T9-H13 PolarHBondContact O-N 3.03Å
10R51.1Low56Low87 Ų8781.1 Ų81.133%0.32839%0.393SS..Hα-helixtrans-72.8-15.7174-169.8-180-175.2-167.72.1112.8T6 Y7 H13 Q14 V62T6-R10 VanDerWaalsContact O-CA 3.29Å; T6-R10 WeakPolarHBondContact O-CA 2.94Å; T6-R10 WeakPolarHBondContact O-CB 3.34Å; T6-R10 PolarHBondContact O-N 3.37Å; Y7-R10 CarbonylContact O-C 3.56Å; R10-H13 CarbonylContact O-C 3.56Å; R10-Q14 HydrophobicContact CG-CG 4.09Å; R10-Q14 WeakPolarHBondContact O-CA 3.26Å; R10-Q14 WeakPolarHBondContact O-CB 3.48Å; R10-Q14 WeakPolarHBondContact O-CG 3.21Å; R10-Q14 PolarHBondContact O-N 3.36Å; R10-V62 PolarHBondContact NH2-O 3.42Å
11M50.2Low56.8Low62 Ų6281.1 Ų81.131%0.30539%0.393SS..Hα-helixtrans-87.5-37.5172-83-78-8000110Y7 G8 T9 H13 Q14 K15Y7-M11 HydrophobicContact CD1-CB 4.47Å; Y7-M11 HydrophobicContact CD1-CG 3.4Å; Y7-M11 HydrophobicContact CD1-SD 4.47Å; Y7-M11 HydrophobicContact CD2-CG 3.86Å; Y7-M11 HydrophobicContact CD2-SD 4.46Å; Y7-M11 HydrophobicContact CE1-CE 3.85Å; Y7-M11 HydrophobicContact CE1-CG 3.27Å; Y7-M11 HydrophobicContact CE1-SD 3.8Å; Y7-M11 HydrophobicContact CE2-CG 3.71Å; Y7-M11 HydrophobicContact CE2-SD 3.76Å; Y7-M11 HydrophobicContact CG-CG 3.71Å; Y7-M11 VanDerWaalsContact CZ-CG 3.43Å; Y7-M11 VanDerWaalsContact O-CA 3.26Å; Y7-M11 WeakPolarHBondContact O-CA 3.4Å; Y7-M11 WeakPolarHBondContact O-CB 3.33Å; Y7-M11 WeakPolarHBondContact O-CG 3.44Å; Y7-M11 PolarHBondContact O-N 3.1Å; Y7-M11 WeakPolarHBondContact OH-CE 3.35Å; Y7-M11 PolarHBondContact OH-SD 3.14Å; Y7-M11 VanDerWaalsContact OH-SD 3.4Å; G8-M11 PolarHBondContact O-N 3.26Å; T9-M11 VanDerWaalsContact C-N 3.3Å; T9-M11 PolarHBondContact O-N 2.8Å; M11-H13 VanDerWaalsContact C-N 3.33Å; M11-Q14 CarbonylContact O-C 3.49Å; M11-Q14 PolarHBondContact O-N 3.27Å; M11-K15 WeakPolarHBondContact O-CA 3.37Å; M11-K15 WeakPolarHBondContact O-CB 3.47Å; M11-K15 PolarHBondContact O-N 3.06Å
12K54.6Low58.3Low164 Ų16480.1 Ų80.171%0.71339%0.386SS*.Hα-helixtrans-60.6-49.5164.3-82-173.3177.1-178.70109.7G8 T9 Q14 K15 E16G8-K12 PolarHBondContact O-N 3.39Å; T9-K12 PolarHBondContact O-N 3.01Å; K12-Q14 PolarHBondContact O-N 3.33Å; K12-K15 PolarHBondContact O-N 2.03Å; K12-E16 WeakPolarHBondContact O-CB 3.46Å; K12-E16 PolarHBondContact O-N 3.37Å
13H55.5Low59.5Low107 Ų10783.9 Ų83.950%0.49541%0.407SS..Hα-helixtrans-69.7-29.2177.6-140.848000112T9 R10 M11 E16 Q17T9-H13 WeakPolarHBondContact O-CA 3.32Å; T9-H13 WeakPolarHBondContact O-CB 3.17Å; T9-H13 PolarHBondContact O-N 3.03Å; R10-H13 CarbonylContact O-C 3.56Å; M11-H13 VanDerWaalsContact C-N 3.33Å; H13-E16 IonicContact ND1-OE2 3.48Å; H13-E16 PolarHBondContact ND1-OE2 3.2Å; H13-Q17 VanDerWaalsContact O-CA 3.27Å; H13-Q17 WeakPolarHBondContact O-CA 3.42Å; H13-Q17 WeakPolarHBondContact O-CB 3.28Å; H13-Q17 WeakPolarHBondContact O-CG 3.32Å; H13-Q17 PolarHBondContact O-N 3.25Å
14Q60.5Low61.1Low27 Ų2783 Ų8313%0.12641%0.407CS..Hα-helixtrans-80.6-28.7172-87.7-178.212.300111.2R10 M11 K12 Q17 R18R10-Q14 HydrophobicContact CG-CG 4.09Å; R10-Q14 WeakPolarHBondContact O-CA 3.26Å; R10-Q14 WeakPolarHBondContact O-CB 3.48Å; R10-Q14 WeakPolarHBondContact O-CG 3.21Å; R10-Q14 PolarHBondContact O-N 3.36Å; M11-Q14 CarbonylContact O-C 3.49Å; M11-Q14 PolarHBondContact O-N 3.27Å; K12-Q14 PolarHBondContact O-N 3.33Å; Q14-Q17 CarbonylContact O-C 3.57Å; Q14-R18 VanDerWaalsContact O-CA 3.27Å; Q14-R18 WeakPolarHBondContact O-CA 3.45Å; Q14-R18 WeakPolarHBondContact O-CB 3.23Å; Q14-R18 VanDerWaalsContact O-CD 3.26Å; Q14-R18 WeakPolarHBondContact O-CD 3.34Å; Q14-R18 WeakPolarHBondContact O-CG 3.32Å; Q14-R18 PolarHBondContact O-N 3.03Å
15K64.2Low62.3Low134 Ų13485 Ų8558%0.58342%0.416SS*.Hα-helixtrans-73.1-46.1174.7-175.4-173.8178.2-164.40108.2M11 K12 R18 E19M11-K15 WeakPolarHBondContact O-CA 3.37Å; M11-K15 WeakPolarHBondContact O-CB 3.47Å; M11-K15 PolarHBondContact O-N 3.06Å; K12-K15 PolarHBondContact O-N 2.03Å; K15-R18 CarbonylContact O-C 3.55Å; K15-R18 WeakPolarHBondContact O-CB 3.3Å; K15-R18 PolarHBondContact O-N 2.83Å; K15-E19 VanDerWaalsContact CE-OE1 3.26Å; K15-E19 WeakPolarHBondContact CE-OE1 3.43Å; K15-E19 IonicContact NZ-OE1 3.62Å; K15-E19 VanDerWaalsContact O-CB 3.31Å; K15-E19 WeakPolarHBondContact O-CB 3.37Å; K15-E19 WeakPolarHBondContact O-CG 3.5Å; K15-E19 PolarHBondContact O-N 3.29Å
16E70.5Confident63.9Low101 Ų10186.5 Ų86.547%0.47242%0.424SS..Hα-helixtrans-64.8-42.5171.3-171.9173.2-149.800110.9K12 H13 R18 E19 I20K12-E16 WeakPolarHBondContact O-CB 3.46Å; K12-E16 PolarHBondContact O-N 3.37Å; H13-E16 IonicContact ND1-OE2 3.48Å; H13-E16 PolarHBondContact ND1-OE2 3.2Å; E16-R18 VanDerWaalsContact C-N 3.33Å; E16-E19 CarbonylContact O-C 3.53Å; E16-E19 PolarHBondContact O-N 3.42Å; E16-I20 HydrophobicContact CG-CD1 4.03Å; E16-I20 VanDerWaalsContact O-CB 3.28Å; E16-I20 WeakPolarHBondContact O-CB 3.48Å; E16-I20 WeakPolarHBondContact O-CD1 3.34Å; E16-I20 WeakPolarHBondContact O-CG1 3.15Å; E16-I20 PolarHBondContact O-N 3.27Å
17Q65.6Low65.6Low87 Ų8787.8 Ų87.841%0.40743%0.425SS..Hα-helixtrans-70.6-27.7171.4-72.7-128.4-16.800111.6H13 Q14 H21H13-Q17 VanDerWaalsContact O-CA 3.27Å; H13-Q17 WeakPolarHBondContact O-CA 3.42Å; H13-Q17 WeakPolarHBondContact O-CB 3.28Å; H13-Q17 WeakPolarHBondContact O-CG 3.32Å; H13-Q17 PolarHBondContact O-N 3.25Å; Q14-Q17 CarbonylContact O-C 3.57Å; Q17-H21 WeakPolarHBondContact O-CA 3.34Å; Q17-H21 WeakPolarHBondContact O-CB 2.94Å; Q17-H21 PolarHBondContact O-N 2.67Å; Q17-H21 PolarHBondContact O-ND1 3.17Å; Q17-H21 PolarHBondContact OE1-CE1 3.23Å; Q17-H21 VanDerWaalsContact OE1-CE1 3.31Å
18R65.2Low67.4Low118 Ų11890.4 Ų90.445%0.44544%0.439SS..Hα-helixtrans-73.4-37.8171.8-83.3162.6-172.7-118.24.2109.1Q14 K15 E16 Q22Q14-R18 VanDerWaalsContact O-CA 3.27Å; Q14-R18 WeakPolarHBondContact O-CA 3.45Å; Q14-R18 WeakPolarHBondContact O-CB 3.23Å; Q14-R18 VanDerWaalsContact O-CD 3.26Å; Q14-R18 WeakPolarHBondContact O-CD 3.34Å; Q14-R18 WeakPolarHBondContact O-CG 3.32Å; Q14-R18 PolarHBondContact O-N 3.03Å; K15-R18 CarbonylContact O-C 3.55Å; K15-R18 WeakPolarHBondContact O-CB 3.3Å; K15-R18 PolarHBondContact O-N 2.83Å; E16-R18 VanDerWaalsContact C-N 3.33Å; R18-Q22 WeakPolarHBondContact O-CA 3.34Å; R18-Q22 WeakPolarHBondContact O-CB 3.49Å; R18-Q22 PolarHBondContact O-N 3.24Å
19E72.1Confident68.9Low92 Ų9292.5 Ų92.543%0.4344%0.442SS..Hα-helixtrans-67.9-46.7174.7-76.1167.3-171.300109.7K15 E16 Q22 N23K15-E19 VanDerWaalsContact CE-OE1 3.26Å; K15-E19 WeakPolarHBondContact CE-OE1 3.43Å; K15-E19 IonicContact NZ-OE1 3.62Å; K15-E19 VanDerWaalsContact O-CB 3.31Å; K15-E19 WeakPolarHBondContact O-CB 3.37Å; K15-E19 WeakPolarHBondContact O-CG 3.5Å; K15-E19 PolarHBondContact O-N 3.29Å; E16-E19 CarbonylContact O-C 3.53Å; E16-E19 PolarHBondContact O-N 3.42Å; E19-Q22 PolarHBondContact O-N 3.4Å; E19-N23 WeakPolarHBondContact O-CB 3.28Å; E19-N23 PolarHBondContact O-N 3.42Å; E19-N23 PolarHBondContact O-ND2 3.46Å; E19-N23 PolarHBondContact O-OD1 2.96Å
20I73.7Confident70.5Confident87 Ų8792.8 Ų92.845%0.44644%0.438SS..Hα-helixtrans-62.5-50.6172.3-67.5164.2000109.7E16 Q22 N23 T24E16-I20 HydrophobicContact CG-CD1 4.03Å; E16-I20 VanDerWaalsContact O-CB 3.28Å; E16-I20 WeakPolarHBondContact O-CB 3.48Å; E16-I20 WeakPolarHBondContact O-CD1 3.34Å; E16-I20 WeakPolarHBondContact O-CG1 3.15Å; E16-I20 PolarHBondContact O-N 3.27Å; I20-Q22 VanDerWaalsContact C-N 3.28Å; I20-Q22 PolarHBondContact O-N 3.05Å; I20-N23 CarbonylContact O-C 3.47Å; I20-N23 PolarHBondContact O-N 2.99Å; I20-T24 VanDerWaalsContact O-CB 3.28Å; I20-T24 WeakPolarHBondContact O-CB 3.29Å; I20-T24 PolarHBondContact O-N 3.29Å; I20-T24 PolarHBondContact O-OG1 3.08Å
21H72Confident72.2Confident82 Ų8294.4 Ų94.438%0.3845%0.448SS..Hα-helixtrans-65.4-31.4177.8-84.277.3000111.6Q17 M25 Y55Q17-H21 WeakPolarHBondContact O-CA 3.34Å; Q17-H21 WeakPolarHBondContact O-CB 2.94Å; Q17-H21 PolarHBondContact O-N 2.67Å; Q17-H21 PolarHBondContact O-ND1 3.17Å; Q17-H21 PolarHBondContact OE1-CE1 3.23Å; Q17-H21 VanDerWaalsContact OE1-CE1 3.31Å; H21-M25 WeakPolarHBondContact O-CA 3.46Å; H21-M25 WeakPolarHBondContact O-CB 2.97Å; H21-M25 PolarHBondContact O-N 3.33Å; H21-Y55 HydrophobicContact CB-CE2 4.04Å
22Q74.5Confident73.8Confident113 Ų11392.5 Ų92.553%0.52844%0.439SS..Hα-helixtrans-71.8-41175.3-174.6174.8-0.600109.4R18 E19 I20 M25 V26R18-Q22 WeakPolarHBondContact O-CA 3.34Å; R18-Q22 WeakPolarHBondContact O-CB 3.49Å; R18-Q22 PolarHBondContact O-N 3.24Å; E19-Q22 PolarHBondContact O-N 3.4Å; I20-Q22 VanDerWaalsContact C-N 3.28Å; I20-Q22 PolarHBondContact O-N 3.05Å; Q22-M25 PolarHBondContact O-N 3.03Å; Q22-V26 WeakPolarHBondContact O-CB 3.02Å; Q22-V26 WeakPolarHBondContact O-CG2 2.88Å; Q22-V26 PolarHBondContact O-N 3.46Å
23N80Confident75.1Confident107 Ų10790.9 Ų90.957%0.57243%0.434SS*.Hα-helixtrans-65.1-46.2172.4-68.9-14.3000111.5E19 I20 M25 V26 E27E19-N23 WeakPolarHBondContact O-CB 3.28Å; E19-N23 PolarHBondContact O-N 3.42Å; E19-N23 PolarHBondContact O-ND2 3.46Å; E19-N23 PolarHBondContact O-OD1 2.96Å; I20-N23 CarbonylContact O-C 3.47Å; I20-N23 PolarHBondContact O-N 2.99Å; N23-M25 VanDerWaalsContact C-N 3.34Å; N23-M25 PolarHBondContact O-N 3.46Å; N23-V26 PolarHBondContact O-N 2.99Å; N23-E27 WeakPolarHBondContact O-CG 3.26Å; N23-E27 PolarHBondContact O-N 3.5Å
24T80.8Confident76.5Confident60 Ų6088.7 Ų88.737%0.36843%0.434SS..Hα-helixtrans-65.1-36.2175.2-57.30000111.4I20 E27 H28I20-T24 VanDerWaalsContact O-CB 3.28Å; I20-T24 WeakPolarHBondContact O-CB 3.29Å; I20-T24 PolarHBondContact O-N 3.29Å; I20-T24 PolarHBondContact O-OG1 3.08Å; T24-E27 PolarHBondContact O-N 3.21Å; T24-H28 VanDerWaalsContact O-CB 3.32Å; T24-H28 WeakPolarHBondContact O-CB 2.92Å; T24-H28 PolarHBondContact O-N 2.97Å
25M76.8Confident77.7Confident49 Ų4992.9 Ų92.924%0.24145%0.454CS..Hα-helixtrans-70.4-41175-176.3-175.572.800110H21 Q22 N23 E27 H28 M29 Y55H21-M25 WeakPolarHBondContact O-CA 3.46Å; H21-M25 WeakPolarHBondContact O-CB 2.97Å; H21-M25 PolarHBondContact O-N 3.33Å; Q22-M25 PolarHBondContact O-N 3.03Å; N23-M25 VanDerWaalsContact C-N 3.34Å; N23-M25 PolarHBondContact O-N 3.46Å; M25-E27 VanDerWaalsContact C-N 3.34Å; M25-H28 CarbonylContact O-C 3.6Å; M25-H28 PolarHBondContact O-N 3.42Å; M25-M29 HydrophobicContact CE-CE 3.49Å; M25-M29 VanDerWaalsContact CE-CE 3.49Å; M25-M29 HydrophobicContact CG-CE 3.8Å; M25-M29 HydrophobicContact CG-CG 4.37Å; M25-M29 VanDerWaalsContact O-CB 3.32Å; M25-M29 WeakPolarHBondContact O-CB 3.19Å; M25-M29 VanDerWaalsContact O-CG 3.28Å; M25-M29 WeakPolarHBondContact O-CG 2.94Å; M25-M29 PolarHBondContact O-N 2.78Å; M25-M29 HydrophobicContact SD-CE 3.72Å; M25-Y55 HydrophobicContact CB-CE2 4.47Å; M25-Y55 HydrophobicContact SD-CD1 3.74Å; M25-Y55 HydrophobicContact SD-CD2 4.36Å; M25-Y55 HydrophobicContact SD-CE1 3.59Å; M25-Y55 VanDerWaalsContact SD-CE1 3.59Å; M25-Y55 HydrophobicContact SD-CE2 4.25Å; M25-Y55 HydrophobicContact SD-CG 4.11Å
26V81.9Confident78.6Confident73 Ų7387.1 Ų87.144%0.44243%0.43SS..Hα-helixtrans-60.7-45.2172.2167.60000110Q22 N23 M29 I30Q22-V26 WeakPolarHBondContact O-CB 3.02Å; Q22-V26 WeakPolarHBondContact O-CG2 2.88Å; Q22-V26 PolarHBondContact O-N 3.46Å; N23-V26 PolarHBondContact O-N 2.99Å; V26-M29 PolarHBondContact O-N 3.45Å; V26-I30 HydrophobicContact CG1-CD1 3.85Å; V26-I30 VanDerWaalsContact O-CG1 3.23Å; V26-I30 WeakPolarHBondContact O-CG1 3.47Å; V26-I30 PolarHBondContact O-N 3.33Å
27E84.2Confident79.3Confident108 Ų10888.2 Ų88.251%0.50544%0.444SS..Hα-helixtrans-61.3-44.4173.3-77-172.3-177.600112.7N23 T24 M25 M29 I30 K31N23-E27 WeakPolarHBondContact O-CG 3.26Å; N23-E27 PolarHBondContact O-N 3.5Å; T24-E27 PolarHBondContact O-N 3.21Å; M25-E27 VanDerWaalsContact C-N 3.34Å; E27-M29 VanDerWaalsContact C-N 3.33Å; E27-I30 PolarHBondContact O-N 3.04Å; E27-K31 WeakPolarHBondContact O-CG 3.2Å; E27-K31 PolarHBondContact O-N 3.19Å
28H82.4Confident80.3Confident110 Ų11088.2 Ų88.251%0.50946%0.459SS..Hα-helixtrans-62.7-41.6175.9-107.3-88.6000111.1T24 M25 K31 L32T24-H28 VanDerWaalsContact O-CB 3.32Å; T24-H28 WeakPolarHBondContact O-CB 2.92Å; T24-H28 PolarHBondContact O-N 2.97Å; M25-H28 CarbonylContact O-C 3.6Å; M25-H28 PolarHBondContact O-N 3.42Å; H28-K31 PolarHBondContact O-N 3.26Å; H28-L32 VanDerWaalsContact O-CB 3.26Å; H28-L32 WeakPolarHBondContact O-CB 2.88Å; H28-L32 WeakPolarHBondContact O-CD1 3.2Å; H28-L32 WeakPolarHBondContact O-CG 3.31Å; H28-L32 PolarHBondContact O-N 2.85Å
29M81Confident81.3Confident71 Ų7186.3 Ų86.335%0.3546%0.457SS..Hα-helixtrans-66.4-37175.9-75.7-148.7-130.500111.6M25 V26 E27 Q33 L48M25-M29 HydrophobicContact CE-CE 3.49Å; M25-M29 VanDerWaalsContact CE-CE 3.49Å; M25-M29 HydrophobicContact CG-CE 3.8Å; M25-M29 HydrophobicContact CG-CG 4.37Å; M25-M29 VanDerWaalsContact O-CB 3.32Å; M25-M29 WeakPolarHBondContact O-CB 3.19Å; M25-M29 VanDerWaalsContact O-CG 3.28Å; M25-M29 WeakPolarHBondContact O-CG 2.94Å; M25-M29 PolarHBondContact O-N 2.78Å; M25-M29 HydrophobicContact SD-CE 3.72Å; V26-M29 PolarHBondContact O-N 3.45Å; E27-M29 VanDerWaalsContact C-N 3.33Å; M29-Q33 WeakPolarHBondContact O-CB 3.33Å; M29-Q33 PolarHBondContact O-N 2.82Å; M29-L48 HydrophobicContact CG-CD1 4.37Å; M29-L48 HydrophobicContact SD-CD1 4.21Å
30I84.9Confident82.1Confident109 Ų10986.3 Ų86.356%0.55947%0.465SS*.Hα-helixtrans-65.6-43.5174.1-69.7163.9000110.8V26 E27 Q33 A34V26-I30 HydrophobicContact CG1-CD1 3.85Å; V26-I30 VanDerWaalsContact O-CG1 3.23Å; V26-I30 WeakPolarHBondContact O-CG1 3.47Å; V26-I30 PolarHBondContact O-N 3.33Å; E27-I30 PolarHBondContact O-N 3.04Å; I30-Q33 WeakPolarHBondContact O-CB 2.74Å; I30-Q33 PolarHBondContact O-N 3.37Å; I30-A34 PolarHBondContact O-N 3.11Å
31K86Confident82.7Confident121 Ų12186.1 Ų86.153%0.52648%0.477SS..Hα-helixtrans-63.7-45.5175.6-71174-174.2171.50111.6E27 H28 Q33 A34 E35E27-K31 WeakPolarHBondContact O-CG 3.2Å; E27-K31 PolarHBondContact O-N 3.19Å; H28-K31 PolarHBondContact O-N 3.26Å; K31-Q33 VanDerWaalsContact C-N 3.32Å; K31-Q33 PolarHBondContact O-N 2.92Å; K31-A34 WeakPolarHBondContact O-CB 3.27Å; K31-A34 PolarHBondContact O-N 3.42Å; K31-E35 PolarHBondContact O-N 2.86Å
32L83.4Confident83.4Confident23 Ų2388.2 Ų88.212%0.1249%0.491CS..Hα-helixtrans-62.7-37.7175-74.6166.5000111.8H28 A34 E35 C36 L47 A51H28-L32 VanDerWaalsContact O-CB 3.26Å; H28-L32 WeakPolarHBondContact O-CB 2.88Å; H28-L32 WeakPolarHBondContact O-CD1 3.2Å; H28-L32 WeakPolarHBondContact O-CG 3.31Å; H28-L32 PolarHBondContact O-N 2.85Å; L32-A34 VanDerWaalsContact C-N 3.34Å; L32-E35 PolarHBondContact O-N 3.35Å; L32-C36 VanDerWaalsContact O-CB 3.23Å; L32-C36 WeakPolarHBondContact O-CB 2.92Å; L32-C36 PolarHBondContact O-N 3.02Å; L32-C36 PolarHBondContact O-SG 2.94Å; L32-C36 VanDerWaalsContact O-SG 3.37Å; L32-L47 HydrophobicContact CD2-CD2 3.68Å; L32-L47 HydrophobicContact CD2-CG 3.98Å; L32-A51 HydrophobicContact CD1-CB 3.92Å
33Q82.3Confident84.1Confident130 Ų13084.7 Ų84.761%0.60748%0.481SS*.Hα-helixtrans-61.8-42.8174.6-17385.9-76.700110.7M29 I30 K31 C36 T37M29-Q33 WeakPolarHBondContact O-CB 3.33Å; M29-Q33 PolarHBondContact O-N 2.82Å; I30-Q33 WeakPolarHBondContact O-CB 2.74Å; I30-Q33 PolarHBondContact O-N 3.37Å; K31-Q33 VanDerWaalsContact C-N 3.32Å; K31-Q33 PolarHBondContact O-N 2.92Å; Q33-C36 WeakPolarHBondContact O-CB 2.92Å; Q33-C36 PolarHBondContact O-N 3.48Å; Q33-T37 WeakPolarHBondContact O-CG2 3.27Å; Q33-T37 PolarHBondContact O-N 2.73Å
34A84.9Confident84.6Confident61 Ų6180.7 Ų80.750%0.50446%0.461SS..Hα-helixtrans-63.2-45.6176.400000111.9I30 K31 L32 C36 T37I30-A34 PolarHBondContact O-N 3.11Å; K31-A34 WeakPolarHBondContact O-CB 3.27Å; K31-A34 PolarHBondContact O-N 3.42Å; L32-A34 VanDerWaalsContact C-N 3.34Å; A34-C36 VanDerWaalsContact C-N 3.29Å; A34-C36 PolarHBondContact O-N 3.28Å; A34-T37 PolarHBondContact O-N 3.3Å; A34-T37 PolarHBondContact O-OG1 3.29Å
35E84.7Confident85Confident115 Ų11585.6 Ų85.654%0.53748%0.477SS..Hα-helixtrans-62.3-36.6174.2-71.3172.2-172.400112.3K31 L32 T37 A38K31-E35 PolarHBondContact O-N 2.86Å; L32-E35 PolarHBondContact O-N 3.35Å; E35-T37 VanDerWaalsContact C-N 3.28Å; E35-T37 PolarHBondContact O-N 3.3Å; E35-A38 PolarHBondContact O-N 2.85Å
36C83.6Confident85.6Confident13 Ų1392 Ų929%0.08850%0.499CS..Hα-helixtrans-62.5-29.4176.5-90.90000113.6L32 Q33 A34 A38 L39 C44L32-C36 VanDerWaalsContact O-CB 3.23Å; L32-C36 WeakPolarHBondContact O-CB 2.92Å; L32-C36 PolarHBondContact O-N 3.02Å; L32-C36 PolarHBondContact O-SG 2.94Å; L32-C36 VanDerWaalsContact O-SG 3.37Å; Q33-C36 WeakPolarHBondContact O-CB 2.92Å; Q33-C36 PolarHBondContact O-N 3.48Å; A34-C36 VanDerWaalsContact C-N 3.29Å; A34-C36 PolarHBondContact O-N 3.28Å; C36-A38 PolarHBondContact O-N 3.44Å; C36-L39 PolarHBondContact O-N 2.77Å; C36-L39 VanDerWaalsContact O-N 3.1Å; C36-C44 HydrophobicContact CB-CB 3.78Å; C36-C44 WeakPolarHBondContact CB-SG 3.49Å; C36-C44 VanDerWaalsContact SG-CA 3.51Å; C36-C44 WeakPolarHBondContact SG-CB 3.13Å; C36-C44 CovalentContact SG-SG 2.03Å; C36-C44 PolarHBondContact SG-SG 3.01Å
37T84.7Confident85.9Confident123 Ų12391.9 Ų91.976%0.75550%0.495SS*.THydrogen-bonded Turntrans-64.3-23.1178.663.20000113.6Q33 A34 E35Q33-T37 WeakPolarHBondContact O-CG2 3.27Å; Q33-T37 PolarHBondContact O-N 2.73Å; A34-T37 PolarHBondContact O-N 3.3Å; A34-T37 PolarHBondContact O-OG1 3.29Å; E35-T37 VanDerWaalsContact C-N 3.28Å; E35-T37 PolarHBondContact O-N 3.3Å
38A86.6Confident86Confident88 Ų8890.1 Ų90.173%0.72749%0.489SS*.THydrogen-bonded Turntrans-91.5-9.9176.100000113.4E35 C36E35-A38 PolarHBondContact O-N 2.85Å; C36-A38 PolarHBondContact O-N 3.44Å
39L87.2Confident86.3Confident78 Ų7888.1 Ų88.141%0.40849%0.487SS..SBendtrans-101.7150.8-175.9-100.570.4000111.8C36 A43C36-L39 PolarHBondContact O-N 2.77Å; C36-L39 VanDerWaalsContact O-N 3.1Å; L39-A43 HydrophobicContact CB-CB 4.46Å; L39-A43 HydrophobicContact CD2-CB 3.77Å; L39-A43 HydrophobicContact CG-CB 4.31Å
40P88Confident86.7Confident92 Ų9289.1 Ų89.160%0.59750%0.497SS*.  trans-62.6146.8168.226.3-32.5000111D42 A43 C44P40-D42 PolarHBondContact O-N 3.06Å; P40-A43 HydrophobicContact CG-CB 4.05Å; P40-A43 PolarHBondContact O-N 3.49Å; P40-C44 PolarHBondContact O-N 3.44Å
41A85.9Confident86.7Confident83 Ų8385.9 Ų85.969%0.68649%0.487SS*.Hα-helixtrans-51.1-38.3-170.500000114.3K45A41-K45 PolarHBondContact O-N 2.83Å; A41-K45 VanDerWaalsContact O-N 3.14Å
42D88.4Confident86.6Confident126 Ų12682.7 Ų82.767%0.67448%0.478SS*.Hα-helixtrans-68.2-36.2179.9-67.1-39.7000113.3P40 R46P40-D42 PolarHBondContact O-N 3.06Å; D42-R46 WeakPolarHBondContact O-CG 3.28Å; D42-R46 PolarHBondContact O-N 3.38Å
43A89.2Confident86.7Confident38 Ų3883.8 Ų83.831%0.31449%0.489SS..Hα-helixtrans-72.6-40.5179.400000110.9L39 P40 R46 L47L39-A43 HydrophobicContact CB-CB 4.46Å; L39-A43 HydrophobicContact CD2-CB 3.77Å; L39-A43 HydrophobicContact CG-CB 4.31Å; P40-A43 HydrophobicContact CG-CB 4.05Å; P40-A43 PolarHBondContact O-N 3.49Å; A43-R46 PolarHBondContact O-N 3.18Å; A43-L47 PolarHBondContact O-N 3.36Å; A43-L47 VanDerWaalsContact O-N 3.09Å
44C89.3Confident86.7Confident24 Ų2481 Ų8116%0.16248%0.476CS..Hα-helixtrans-59.4-47.2174.4173.90000112.1C36 P40 R46 L47 L48C36-C44 HydrophobicContact CB-CB 3.78Å; C36-C44 WeakPolarHBondContact CB-SG 3.49Å; C36-C44 VanDerWaalsContact SG-CA 3.51Å; C36-C44 WeakPolarHBondContact SG-CB 3.13Å; C36-C44 CovalentContact SG-SG 2.03Å; C36-C44 PolarHBondContact SG-SG 3.01Å; P40-C44 PolarHBondContact O-N 3.44Å; C44-R46 VanDerWaalsContact C-N 3.31Å; C44-R46 PolarHBondContact O-N 3.2Å; C44-L47 PolarHBondContact O-N 3.37Å; C44-L48 PolarHBondContact O-N 2.67Å
45K89.4Confident86.3Confident162 Ų16280.7 Ų80.770%0.70446%0.463SS*.Hα-helixtrans-58.1-42.5179.5-173-179.7-176.6-178.20112.3A41 S49A41-K45 PolarHBondContact O-N 2.83Å; A41-K45 VanDerWaalsContact O-N 3.14Å; K45-S49 WeakPolarHBondContact O-CB 3.14Å; K45-S49 PolarHBondContact O-N 3.44Å; K45-S49 PolarHBondContact O-OG 2.67Å
46R89.8Confident86Confident185 Ų18581.5 Ų81.570%0.69847%0.467SS*.Hα-helixtrans-64.4-44.5177.5-71.2178.5-175.2-162.52.2111.7D42 A43 C44 S49 T50D42-R46 WeakPolarHBondContact O-CG 3.28Å; D42-R46 PolarHBondContact O-N 3.38Å; A43-R46 PolarHBondContact O-N 3.18Å; C44-R46 VanDerWaalsContact C-N 3.31Å; C44-R46 PolarHBondContact O-N 3.2Å; R46-S49 PolarHBondContact O-N 3.31Å; R46-S49 PolarHBondContact O-OG 3.29Å; R46-T50 PolarHBondContact O-N 2.8Å; R46-T50 PolarHBondContact O-OG1 2.7Å
47L88Confident85.7Confident70 Ų7089.1 Ų89.137%0.36649%0.493SS..Hα-helixtrans-60.2-49.5179.1-171.968.6000111.4L32 A43 C44 S49 T50 A51L32-L47 HydrophobicContact CD2-CD2 3.68Å; L32-L47 HydrophobicContact CD2-CG 3.98Å; A43-L47 PolarHBondContact O-N 3.36Å; A43-L47 VanDerWaalsContact O-N 3.09Å; C44-L47 PolarHBondContact O-N 3.37Å; L47-S49 PolarHBondContact O-N 2.67Å; L47-T50 PolarHBondContact O-N 3.49Å; L47-A51 PolarHBondContact O-N 3.45Å
48L87.1Confident85.1Confident71 Ų7191.2 Ų91.237%0.37249%0.488SS..Hα-helixtrans-62.6-43.7179-17166.1000111.7M29 C44 T50 A51 V52M29-L48 HydrophobicContact CG-CD1 4.37Å; M29-L48 HydrophobicContact SD-CD1 4.21Å; C44-L48 PolarHBondContact O-N 2.67Å; L48-T50 VanDerWaalsContact C-N 3.3Å; L48-T50 PolarHBondContact O-N 3.42Å; L48-A51 PolarHBondContact O-N 3.35Å; L48-V52 WeakPolarHBondContact O-CG2 3.26Å; L48-V52 PolarHBondContact O-N 3.37Å
49S88.1Confident84.3Confident68 Ų6889.9 Ų89.948%0.47647%0.467SS..Hα-helixtrans-62.6-35.4178.167.90000113.2K45 R46 L47 A53K45-S49 WeakPolarHBondContact O-CB 3.14Å; K45-S49 PolarHBondContact O-N 3.44Å; K45-S49 PolarHBondContact O-OG 2.67Å; R46-S49 PolarHBondContact O-N 3.31Å; R46-S49 PolarHBondContact O-OG 3.29Å; L47-S49 PolarHBondContact O-N 2.67Å; S49-A53 WeakPolarHBondContact O-CB 3.42Å; S49-A53 PolarHBondContact O-N 2.8Å
50T89.6Confident82.9Confident92 Ų9287.9 Ų87.956%0.56447%0.466SS*.Hα-helixtrans-71.1-41.4177.8-53.40000110.9R46 L47 L48 A53 E54R46-T50 PolarHBondContact O-N 2.8Å; R46-T50 PolarHBondContact O-OG1 2.7Å; L47-T50 PolarHBondContact O-N 3.49Å; L48-T50 VanDerWaalsContact C-N 3.3Å; L48-T50 PolarHBondContact O-N 3.42Å; T50-A53 PolarHBondContact O-N 3.2Å; T50-E54 WeakPolarHBondContact O-CB 3.43Å; T50-E54 PolarHBondContact O-N 2.99Å
51A83.7Confident81.2Confident41 Ų4186.6 Ų86.634%0.33946%0.463SS..Hα-helixtrans-63.7-43.4176.400000112L32 L47 L48 E54 Y55L32-A51 HydrophobicContact CD1-CB 3.92Å; L47-A51 PolarHBondContact O-N 3.45Å; L48-A51 PolarHBondContact O-N 3.35Å; A51-E54 PolarHBondContact O-N 3.41Å; A51-Y55 PolarHBondContact O-N 3.27Å; A51-Y55 VanDerWaalsContact O-N 3.08Å
52V83.8Confident79.6Confident54 Ų5485.4 Ų85.433%0.32745%0.447SS..Hα-helixtrans-64.2-44.8175.8173.40000111L48 E54 Y55 E56L48-V52 WeakPolarHBondContact O-CG2 3.26Å; L48-V52 PolarHBondContact O-N 3.37Å; V52-E54 VanDerWaalsContact C-N 3.34Å; V52-E54 PolarHBondContact O-N 3.18Å; V52-Y55 WeakPolarHBondContact O-CB 3.21Å; V52-Y55 PolarHBondContact O-N 3.16Å; V52-E56 PolarHBondContact O-N 3.49Å
53A85.7Confident77.8Confident45 Ų4584.2 Ų84.237%0.37244%0.44SS..Hα-helixtrans-63.7-37.1178.600000113.1S49 T50 E56 R57S49-A53 WeakPolarHBondContact O-CB 3.42Å; S49-A53 PolarHBondContact O-N 2.8Å; T50-A53 PolarHBondContact O-N 3.2Å; A53-E56 PolarHBondContact O-N 3.31Å; A53-R57 WeakPolarHBondContact O-CB 3.14Å; A53-R57 PolarHBondContact O-N 2.88Å
54E83.2Confident75.9Confident71 Ų7189.6 Ų89.633%0.33246%0.459SS..Hα-helixtrans-67.4-37.9175.3179.858.3-165.300111.8T50 A51 V52 R57 R58T50-E54 WeakPolarHBondContact O-CB 3.43Å; T50-E54 PolarHBondContact O-N 2.99Å; A51-E54 PolarHBondContact O-N 3.41Å; V52-E54 VanDerWaalsContact C-N 3.34Å; V52-E54 PolarHBondContact O-N 3.18Å; E54-R57 PolarHBondContact O-N 3.14Å; E54-R57 IonicContact OE2-NH1 3.17Å; E54-R57 PolarHBondContact OE2-NH1 2.62Å; E54-R58 WeakPolarHBondContact O-CG 3.49Å; E54-R58 PolarHBondContact O-N 3.26Å; E54-R58 IonicContact OE1-CZ 3.52Å; E54-R58 IonicContact OE1-NE 2.85Å; E54-R58 PolarHBondContact OE1-NE 3.31Å; E54-R58 IonicContact OE1-NH2 3.26Å; E54-R58 PolarHBondContact OE1-NH2 2.76Å
55Y75.5Confident74.1Confident55 Ų5592.2 Ų92.222%0.21648%0.477CS..Hα-helixtrans-63.6-47.3173.7-177.8-104.3000112H21 M25 A51 V52 R57 R58 I59H21-Y55 HydrophobicContact CB-CE2 4.04Å; M25-Y55 HydrophobicContact CB-CE2 4.47Å; M25-Y55 HydrophobicContact SD-CD1 3.74Å; M25-Y55 HydrophobicContact SD-CD2 4.36Å; M25-Y55 HydrophobicContact SD-CE1 3.59Å; M25-Y55 VanDerWaalsContact SD-CE1 3.59Å; M25-Y55 HydrophobicContact SD-CE2 4.25Å; M25-Y55 HydrophobicContact SD-CG 4.11Å; A51-Y55 PolarHBondContact O-N 3.27Å; A51-Y55 VanDerWaalsContact O-N 3.08Å; V52-Y55 WeakPolarHBondContact O-CB 3.21Å; V52-Y55 PolarHBondContact O-N 3.16Å; Y55-R57 VanDerWaalsContact C-N 3.34Å; Y55-R57 PolarHBondContact O-N 2.87Å; Y55-R58 PolarHBondContact O-N 3.19Å; Y55-I59 HydrophobicContact CD1-CD1 3.83Å; Y55-I59 HydrophobicContact CD2-CD1 4.44Å; Y55-I59 HydrophobicContact CE1-CD1 3.22Å; Y55-I59 HydrophobicContact CE1-CG1 4.38Å; Y55-I59 HydrophobicContact CE2-CD1 3.9Å; Y55-I59 HydrophobicContact CG-CD1 4.41Å; Y55-I59 WeakPolarHBondContact O-CG1 3.29Å; Y55-I59 PolarHBondContact O-N 3.45Å; Y55-I59 WeakPolarHBondContact OH-CD1 3.28Å
56E78.6Confident72.7Confident133 Ų13385.2 Ų85.262%0.62145%0.449SS*.Hα-helixtrans-60.3-42.3176-73-173.8156.600111.9V52 A53 R58 I59 G60V52-E56 PolarHBondContact O-N 3.49Å; A53-E56 PolarHBondContact O-N 3.31Å; E56-R58 PolarHBondContact O-N 2.68Å; E56-I59 PolarHBondContact O-N 3.38Å; E56-G60 PolarHBondContact O-N 2.64Å
57R78Confident71.4Confident172 Ų17281 Ų8165%0.64944%0.44SS*.Hα-helixtrans-62.4-42.7177.4-169.9-172.3-79.6117.4-3.3111.8A53 E54 Y55 G60 A61A53-R57 WeakPolarHBondContact O-CB 3.14Å; A53-R57 PolarHBondContact O-N 2.88Å; E54-R57 PolarHBondContact O-N 3.14Å; E54-R57 IonicContact OE2-NH1 3.17Å; E54-R57 PolarHBondContact OE2-NH1 2.62Å; Y55-R57 VanDerWaalsContact C-N 3.34Å; Y55-R57 PolarHBondContact O-N 2.87Å; R57-G60 PolarHBondContact O-N 3.45Å; R57-A61 PolarHBondContact O-N 3.48Å; R57-A61 VanDerWaalsContact O-N 3.11Å
58R72.5Confident70.4Confident168 Ų16882.1 Ų82.163%0.63445%0.454SS*.Hα-helixtrans-64.9-40.7177.4-74.5177.9-177.9-133.2-0.6112.3E54 Y55 E56 V62E54-R58 WeakPolarHBondContact O-CG 3.49Å; E54-R58 PolarHBondContact O-N 3.26Å; E54-R58 IonicContact OE1-CZ 3.52Å; E54-R58 IonicContact OE1-NE 2.85Å; E54-R58 PolarHBondContact OE1-NE 3.31Å; E54-R58 IonicContact OE1-NH2 3.26Å; E54-R58 PolarHBondContact OE1-NH2 2.76Å; Y55-R58 PolarHBondContact O-N 3.19Å; E56-R58 PolarHBondContact O-N 2.68Å; R58-V62 VanDerWaalsContact O-CG2 3.3Å; R58-V62 WeakPolarHBondContact O-CG2 3.17Å
59I69.6Low69.5Low59 Ų5980.1 Ų80.130%0.30345%0.445SS..Hα-helixtrans-69.2-40.6176.3-69-178.7000111.5Y55 E56 V62 L63Y55-I59 HydrophobicContact CD1-CD1 3.83Å; Y55-I59 HydrophobicContact CD2-CD1 4.44Å; Y55-I59 HydrophobicContact CE1-CD1 3.22Å; Y55-I59 HydrophobicContact CE1-CG1 4.38Å; Y55-I59 HydrophobicContact CE2-CD1 3.9Å; Y55-I59 HydrophobicContact CG-CD1 4.41Å; Y55-I59 WeakPolarHBondContact O-CG1 3.29Å; Y55-I59 PolarHBondContact O-N 3.45Å; Y55-I59 WeakPolarHBondContact OH-CD1 3.28Å; E56-I59 PolarHBondContact O-N 3.38Å; I59-V62 PolarHBondContact O-N 2.6Å; I59-L63 PolarHBondContact O-N 3.4Å
60G56.6Low68.9Low36 Ų3679.6 Ų79.637%0.37144%0.435SS..Hα-helixtrans-60.9-47.5179.200000113.1E56 R57 V62 L63 E64E56-G60 PolarHBondContact O-N 2.64Å; R57-G60 PolarHBondContact O-N 3.45Å; G60-V62 PolarHBondContact O-N 2.7Å; G60-L63 WeakPolarHBondContact O-CB 2.98Å; G60-L63 PolarHBondContact O-N 3.24Å; G60-E64 PolarHBondContact O-N 3.4Å
61A53.9Low68.5Low65 Ų6582 Ų8254%0.53744%0.438SS..Hα-helixtrans-61.3-28.1178.700000113.4R57R57-A61 PolarHBondContact O-N 3.48Å; R57-A61 VanDerWaalsContact O-N 3.11Å
62V51.3Low68.4Low58 Ų5882.1 Ų82.135%0.35243%0.433SS..Hα-helixtrans-73.4-29.4176.9173.40000111.5R10 R58 I59 G60 S65R10-V62 PolarHBondContact NH2-O 3.42Å; R58-V62 VanDerWaalsContact O-CG2 3.3Å; R58-V62 WeakPolarHBondContact O-CG2 3.17Å; I59-V62 PolarHBondContact O-N 2.6Å; G60-V62 PolarHBondContact O-N 2.7Å; V62-S65 PolarHBondContact O-OG 3.03Å
63L51.2Low68.3Low101 Ų10179.6 Ų79.653%0.52942%0.418SS..Hα-helixtrans-74.7-43-179.6-151.976000112I59 G60 S65 S66I59-L63 PolarHBondContact O-N 3.4Å; G60-L63 WeakPolarHBondContact O-CB 2.98Å; G60-L63 PolarHBondContact O-N 3.24Å; L63-S65 PolarHBondContact O-N 3.41Å; L63-S66 WeakPolarHBondContact O-CB 2.92Å; L63-S66 PolarHBondContact O-N 2.77Å; L63-S66 PolarHBondContact O-OG 3.05Å
64E48.6Very low68.3Low151 Ų15179.4 Ų79.471%0.70641%0.414SS*.Hα-helixtrans-66.7-31.2-169.3-158.6163.7164.500114.2G60 S66G60-E64 PolarHBondContact O-N 3.4Å; E64-S66 PolarHBondContact O-N 3.32Å
65S52Low68.6Low79 Ų7978.2 Ų78.255%0.55241%0.411SS*.THydrogen-bonded Turntrans-65.9-7.4175.362.50000115.1V62 L63V62-S65 PolarHBondContact O-OG 3.03Å; L63-S65 PolarHBondContact O-N 3.41Å
66S59.1Low69.1Low15 Ų1576 Ų7611%0.10540%0.403CS..THydrogen-bonded Turntrans-88-14.7-174.5-64.10000114.2L63 E64 S68 C69 Q70L63-S66 WeakPolarHBondContact O-CB 2.92Å; L63-S66 PolarHBondContact O-N 2.77Å; L63-S66 PolarHBondContact O-OG 3.05Å; E64-S66 PolarHBondContact O-N 3.32Å; S66-S68 PolarHBondContact O-N 2.08Å; S66-C69 PolarHBondContact O-N 2.64Å; S66-Q70 VanDerWaalsContact C-NE2 3.33Å; S66-Q70 VanDerWaalsContact CB-NE2 3.33Å; S66-Q70 WeakPolarHBondContact O-CB 3.26Å; S66-Q70 WeakPolarHBondContact O-CG 3.3Å; S66-Q70 PolarHBondContact O-N 3.46Å; S66-Q70 PolarHBondContact O-NE2 3.47Å
67D64.1Low69.6Low98 Ų9871.1 Ų71.152%0.52438%0.379SS..Hα-helixtrans-65.4-46.1-167.2-70.9-9.5000113.6C69 Q70 F71D67-C69 VanDerWaalsContact C-N 3.33Å; D67-C69 PolarHBondContact O-N 2.93Å; D67-Q70 PolarHBondContact O-N 2.95Å; D67-Q70 PolarHBondContact OD1-NE2 3.24Å; D67-Q70 VanDerWaalsContact OD1-NE2 3.14Å; D67-F71 PolarHBondContact O-N 3.07Å
68S66.4Low70.2Confident93 Ų9364.2 Ų64.265%0.6536%0.358SS*.Hα-helixtrans-62.6-39.5176.2-60.80000112.1S66 L72S66-S68 PolarHBondContact O-N 2.08Å; S68-L72 WeakPolarHBondContact O-CB 3.26Å; S68-L72 VanDerWaalsContact O-CG 3.29Å; S68-L72 WeakPolarHBondContact O-CG 3.29Å; S68-L72 PolarHBondContact O-N 2.6Å; S68-L72 VanDerWaalsContact O-N 3.16Å
69C68Low71.1Confident29 Ų2956.9 Ų56.920%0.19633%0.333CS..Hα-helixtrans-63.3-46.1174-176.90000110.6C4 S66 D67 F71 L72 G73 I213C4-C69 HydrophobicContact CB-CB 4.47Å; C4-C69 WeakPolarHBondContact CB-SG 3.45Å; C4-C69 WeakPolarHBondContact SG-CB 2.94Å; C4-C69 PolarHBondContact SG-O 3.23Å; C4-C69 CovalentContact SG-SG 2.08Å; C4-C69 PolarHBondContact SG-SG 3.33Å; S66-C69 PolarHBondContact O-N 2.64Å; D67-C69 VanDerWaalsContact C-N 3.33Å; D67-C69 PolarHBondContact O-N 2.93Å; C69-F71 VanDerWaalsContact C-N 3.34Å; C69-F71 PolarHBondContact O-N 3.32Å; C69-L72 PolarHBondContact O-N 3.45Å; C69-G73 PolarHBondContact O-N 3.35Å; C69-I213 VanDerWaalsContact O-CD1 3.29Å; C69-I213 WeakPolarHBondContact O-CD1 3.34Å
70Q75.3Confident72.1Confident56 Ų5654.5 Ų54.526%0.26232%0.321SS..Hα-helixtrans-60.9-43.5-176.9-76.8174.88400111.8S66 D67 G73 S74S66-Q70 VanDerWaalsContact C-NE2 3.33Å; S66-Q70 VanDerWaalsContact CB-NE2 3.33Å; S66-Q70 WeakPolarHBondContact O-CB 3.26Å; S66-Q70 WeakPolarHBondContact O-CG 3.3Å; S66-Q70 PolarHBondContact O-N 3.46Å; S66-Q70 PolarHBondContact O-NE2 3.47Å; D67-Q70 PolarHBondContact O-N 2.95Å; D67-Q70 PolarHBondContact OD1-NE2 3.24Å; D67-Q70 VanDerWaalsContact OD1-NE2 3.14Å; Q70-G73 PolarHBondContact O-N 3.23Å; Q70-S74 WeakPolarHBondContact O-CB 3.43Å; Q70-S74 PolarHBondContact O-N 3.21Å; Q70-S74 PolarHBondContact O-OG 3.43Å
71F81.7Confident73.9Confident144 Ų14454.2 Ų54.263%0.63231%0.311SS*.Hα-helixtrans-62.3-52.9175.8178.6-103.7000111.2D67 C69 G73 S74 V75D67-F71 PolarHBondContact O-N 3.07Å; C69-F71 VanDerWaalsContact C-N 3.34Å; C69-F71 PolarHBondContact O-N 3.32Å; F71-G73 PolarHBondContact O-N 3.44Å; F71-S74 WeakPolarHBondContact O-CA 3.07Å; F71-S74 VanDerWaalsContact O-CB 3.32Å; F71-S74 WeakPolarHBondContact O-CB 3.42Å; F71-S74 PolarHBondContact O-N 3.43Å; F71-V75 HydrophobicContact CD1-CG2 4.29Å; F71-V75 HydrophobicContact CE1-CG2 3.83Å; F71-V75 HydrophobicContact CE2-CG2 4.41Å; F71-V75 HydrophobicContact CZ-CG2 3.9Å; F71-V75 WeakPolarHBondContact O-CG2 3.45Å; F71-V75 PolarHBondContact O-N 3.19Å
72L81.1Confident75.8Confident42 Ų4252.4 Ų52.422%0.2229%0.292CS..Hα-helixtrans-62.6-30.6180-67.7-179.1000112.6S68 C69 V75 F76 I213 L217S68-L72 WeakPolarHBondContact O-CB 3.26Å; S68-L72 VanDerWaalsContact O-CG 3.29Å; S68-L72 WeakPolarHBondContact O-CG 3.29Å; S68-L72 PolarHBondContact O-N 2.6Å; S68-L72 VanDerWaalsContact O-N 3.16Å; C69-L72 PolarHBondContact O-N 3.45Å; L72-V75 PolarHBondContact O-N 2.76Å; L72-F76 PolarHBondContact O-N 2.77Å; L72-I213 HydrophobicContact CB-CD1 3.66Å; L72-I213 HydrophobicContact CB-CG1 3.71Å; L72-I213 HydrophobicContact CB-CG2 4.13Å; L72-I213 HydrophobicContact CD1-CG2 3.72Å; L72-L217 HydrophobicContact CD1-CD1 4.37Å; L72-L217 HydrophobicContact CD2-CD1 3.27Å; L72-L217 HydrophobicContact CD2-CD2 4.43Å; L72-L217 HydrophobicContact CD2-CG 4.21Å; L72-L217 HydrophobicContact CG-CD1 4.32Å
73G82.8Confident77.7Confident1 Ų150 Ų501%0.0128%0.277CS..Hα-helixtrans-72.5-33.5175.500000112.7C69 Q70 F71 Y77 R90 I213C69-G73 PolarHBondContact O-N 3.35Å; Q70-G73 PolarHBondContact O-N 3.23Å; F71-G73 PolarHBondContact O-N 3.44Å; G73-Y77 WeakPolarHBondContact O-CB 3.48Å; G73-Y77 PolarHBondContact O-N 3.21Å; G73-R90 VanDerWaalsContact CA-NH1 3.27Å; G73-I213 VanDerWaalsContact N-CD1 3.28Å
74S85.6Confident79.7Confident41 Ų4148.5 Ų48.529%0.28727%0.272SS..Hα-helixtrans-68.4-39.2171.6-56.10000111.4Q70 F71 Y77 A78Q70-S74 WeakPolarHBondContact O-CB 3.43Å; Q70-S74 PolarHBondContact O-N 3.21Å; Q70-S74 PolarHBondContact O-OG 3.43Å; F71-S74 WeakPolarHBondContact O-CA 3.07Å; F71-S74 VanDerWaalsContact O-CB 3.32Å; F71-S74 WeakPolarHBondContact O-CB 3.42Å; F71-S74 PolarHBondContact O-N 3.43Å; S74-Y77 PolarHBondContact O-N 3.37Å; S74-A78 WeakPolarHBondContact O-CB 3.17Å; S74-A78 PolarHBondContact O-N 2.92Å
75V87.9Confident81.8Confident47 Ų4741.6 Ų41.629%0.28524%0.241SC..Hα-helixtrans-60.6-48.2173.5176.20000110.3F71 L72 Y77 A78 S79 L217F71-V75 HydrophobicContact CD1-CG2 4.29Å; F71-V75 HydrophobicContact CE1-CG2 3.83Å; F71-V75 HydrophobicContact CE2-CG2 4.41Å; F71-V75 HydrophobicContact CZ-CG2 3.9Å; F71-V75 WeakPolarHBondContact O-CG2 3.45Å; F71-V75 PolarHBondContact O-N 3.19Å; L72-V75 PolarHBondContact O-N 2.76Å; V75-Y77 VanDerWaalsContact C-N 3.34Å; V75-Y77 PolarHBondContact O-N 3.4Å; V75-A78 PolarHBondContact O-N 2.71Å; V75-S79 WeakPolarHBondContact O-CB 2.95Å; V75-S79 PolarHBondContact O-N 2.73Å; V75-S79 PolarHBondContact O-OG 3.45Å; V75-L217 HydrophobicContact CB-CD2 4.23Å; V75-L217 HydrophobicContact CG1-CD2 3.67Å
76F87.5Confident83.7Confident9 Ų940 Ų404%0.03924%0.236CC..Hα-helixtrans-61.4-42.5177-178.6-103.8000112.9L72 A78 S79 T80 Y87 H89 R90 T216L72-F76 PolarHBondContact O-N 2.77Å; F76-A78 VanDerWaalsContact C-N 3.32Å; F76-A78 PolarHBondContact O-N 2.85Å; F76-S79 WeakPolarHBondContact O-CB 3.47Å; F76-S79 PolarHBondContact O-N 2.95Å; F76-T80 HydrophobicContact CD1-CG2 3.8Å; F76-T80 HydrophobicContact CD2-CG2 4.25Å; F76-T80 HydrophobicContact CE1-CG2 3.59Å; F76-T80 HydrophobicContact CE2-CG2 4.01Å; F76-T80 HydrophobicContact CG-CG2 4.28Å; F76-T80 HydrophobicContact CZ-CG2 3.77Å; F76-T80 VanDerWaalsContact O-CG2 3.3Å; F76-T80 WeakPolarHBondContact O-CG2 3.44Å; F76-T80 PolarHBondContact O-N 3.48Å; F76-T80 PolarHBondContact O-OG1 3.35Å; F76-Y87 AromaticContact CE1-CD2 3.71Å; F76-Y87 HydrophobicContact CE1-CD2 3.71Å; F76-Y87 AromaticContact CE1-CE2 3.94Å; F76-Y87 HydrophobicContact CE1-CE2 3.94Å; F76-Y87 HydrophobicContact CE2-CE2 4.23Å; F76-Y87 AromaticContact CZ-CD2 3.66Å; F76-Y87 HydrophobicContact CZ-CD2 3.66Å; F76-Y87 AromaticContact CZ-CE2 3.39Å; F76-Y87 HydrophobicContact CZ-CE2 3.39Å; F76-H89 AromaticContact CD1-CE1 3.89Å; F76-H89 AromaticContact CE1-CE1 3.41Å; F76-H89 VanDerWaalsContact CE1-CE1 3.41Å; F76-H89 WeakPolarHBondContact CE1-CE1 3.43Å; F76-H89 AromaticContact CE1-NE2 3.76Å; F76-R90 VanDerWaalsContact CG-NH2 3.27Å; F76-T216 HydrophobicContact CB-CG2 4.02Å; F76-T216 HydrophobicContact CD1-CG2 4.46Å; F76-T216 HydrophobicContact CD2-CG2 2.93Å; F76-T216 HydrophobicContact CE2-CG2 3.17Å; F76-T216 HydrophobicContact CG-CG2 3.57Å; F76-T216 HydrophobicContact CZ-CG2 3.97Å
77Y88.4Confident85.1Confident30 Ų3039.6 Ų39.612%0.11823%0.232CC..Hα-helixtrans-57.3-48.3175.6173.7-107.8000111.2I2 G73 S74 V75 S79 T80 I81 R90 C92 T101I2-Y77 HydrophobicContact CD1-CD1 3.24Å; I2-Y77 HydrophobicContact CD1-CE1 3.81Å; I2-Y77 HydrophobicContact CD1-CG 3.84Å; I2-Y77 HydrophobicContact CG1-CD1 3.95Å; I2-Y77 HydrophobicContact CG1-CE1 4.24Å; I2-Y77 HydrophobicContact CG1-CG 4.3Å; I2-Y77 HydrophobicContact CG2-CG 4.26Å; G73-Y77 WeakPolarHBondContact O-CB 3.48Å; G73-Y77 PolarHBondContact O-N 3.21Å; S74-Y77 PolarHBondContact O-N 3.37Å; V75-Y77 VanDerWaalsContact C-N 3.34Å; V75-Y77 PolarHBondContact O-N 3.4Å; Y77-S79 VanDerWaalsContact C-N 3.33Å; Y77-S79 PolarHBondContact O-N 2.75Å; Y77-T80 PolarHBondContact O-N 2.64Å; Y77-T80 PolarHBondContact O-OG1 3.14Å; Y77-I81 HydrophobicContact CD1-CD1 3.93Å; Y77-I81 HydrophobicContact CD2-CD1 4.46Å; Y77-I81 HydrophobicContact CE1-CD1 3.49Å; Y77-I81 VanDerWaalsContact CE1-CD1 3.49Å; Y77-I81 HydrophobicContact CE2-CD1 4.02Å; Y77-I81 HydrophobicContact CE2-CG1 4.5Å; Y77-I81 HydrophobicContact CG-CD1 4.43Å; Y77-I81 WeakPolarHBondContact O-CG1 3.32Å; Y77-I81 PolarHBondContact O-N 3.07Å; Y77-I81 VanDerWaalsContact O-N 3.16Å; Y77-R90 HydrophobicContact CD2-CB 4.07Å; Y77-R90 VanDerWaalsContact CD2-O 3.23Å; Y77-R90 WeakPolarHBondContact CD2-O 3.44Å; Y77-R90 WeakPolarHBondContact CE2-O 3.46Å; Y77-C92 VanDerWaalsContact CE1-SG 3.58Å; Y77-T101 HydrophobicContact CE1-CG2 3.52Å; Y77-T101 VanDerWaalsContact OH-CG2 3.25Å; Y77-T101 WeakPolarHBondContact OH-CG2 3.19Å
78A90.7Very high86.1Confident26 Ų2637.4 Ų37.422%0.21523%0.233CC..Hα-helixtrans-61-40.2175.800000112.1S74 V75 F76 I81 L82 Y104S74-A78 WeakPolarHBondContact O-CB 3.17Å; S74-A78 PolarHBondContact O-N 2.92Å; V75-A78 PolarHBondContact O-N 2.71Å; F76-A78 VanDerWaalsContact C-N 3.32Å; F76-A78 PolarHBondContact O-N 2.85Å; A78-I81 PolarHBondContact O-N 3.38Å; A78-L82 WeakPolarHBondContact O-CB 3.36Å; A78-L82 WeakPolarHBondContact O-CG 3.41Å; A78-L82 PolarHBondContact O-N 3.27Å; A78-L82 VanDerWaalsContact O-N 3.09Å; A78-Y104 HydrophobicContact CB-CE1 4.12Å; A78-Y104 WeakPolarHBondContact CB-OH 3.38Å; A78-Y104 WeakPolarHBondContact O-CE1 3.4Å; A78-Y104 PolarHBondContact O-OH 3.37Å
79S90.8Very high86.6Confident15 Ų1535.8 Ų35.811%0.10522%0.215CC..Hα-helixtrans-59.2-45173.4-63.20000112.1V75 F76 Y77 I81 L82 T83 F220V75-S79 WeakPolarHBondContact O-CB 2.95Å; V75-S79 PolarHBondContact O-N 2.73Å; V75-S79 PolarHBondContact O-OG 3.45Å; F76-S79 WeakPolarHBondContact O-CB 3.47Å; F76-S79 PolarHBondContact O-N 2.95Å; Y77-S79 VanDerWaalsContact C-N 3.33Å; Y77-S79 PolarHBondContact O-N 2.75Å; S79-I81 VanDerWaalsContact C-N 3.33Å; S79-I81 PolarHBondContact O-N 3.41Å; S79-L82 WeakPolarHBondContact O-CB 3.49Å; S79-L82 PolarHBondContact O-N 3.36Å; S79-T83 WeakPolarHBondContact O-CG2 3.48Å; S79-T83 PolarHBondContact O-N 2.76Å; S79-T83 PolarHBondContact O-OG1 2.92Å; S79-F220 WeakPolarHBondContact OG-CD2 3.47Å
80T91.5Very high87Confident8 Ų834.8 Ų34.85%0.04921%0.207CC..Hα-helixtrans-69.8-27.9-177.859.80000113.8F76 Y77 T83 T84 I85 G86 Y87F76-T80 HydrophobicContact CD1-CG2 3.8Å; F76-T80 HydrophobicContact CD2-CG2 4.25Å; F76-T80 HydrophobicContact CE1-CG2 3.59Å; F76-T80 HydrophobicContact CE2-CG2 4.01Å; F76-T80 HydrophobicContact CG-CG2 4.28Å; F76-T80 HydrophobicContact CZ-CG2 3.77Å; F76-T80 VanDerWaalsContact O-CG2 3.3Å; F76-T80 WeakPolarHBondContact O-CG2 3.44Å; F76-T80 PolarHBondContact O-N 3.48Å; F76-T80 PolarHBondContact O-OG1 3.35Å; Y77-T80 PolarHBondContact O-N 2.64Å; Y77-T80 PolarHBondContact O-OG1 3.14Å; T80-T83 WeakPolarHBondContact CA-OG1 3.44Å; T80-T83 PolarHBondContact O-OG1 3.27Å; T80-T84 PolarHBondContact O-N 2.87Å; T80-I85 PolarHBondContact O-N 3.06Å; T80-G86 PolarHBondContact O-N 3.44Å; T80-Y87 HydrophobicContact CG2-CD2 3.61Å; T80-Y87 HydrophobicContact CG2-CE2 3.71Å
81I93.4Very high87.2Confident31 Ų3136 Ų3616%0.15922%0.219CC..Hα-helixtrans-70.8-47.4171.7-66.6165.7000109.8Y77 A78 S79 T83 T84 T101 Y104 A105Y77-I81 HydrophobicContact CD1-CD1 3.93Å; Y77-I81 HydrophobicContact CD2-CD1 4.46Å; Y77-I81 HydrophobicContact CE1-CD1 3.49Å; Y77-I81 VanDerWaalsContact CE1-CD1 3.49Å; Y77-I81 HydrophobicContact CE2-CD1 4.02Å; Y77-I81 HydrophobicContact CE2-CG1 4.5Å; Y77-I81 HydrophobicContact CG-CD1 4.43Å; Y77-I81 WeakPolarHBondContact O-CG1 3.32Å; Y77-I81 PolarHBondContact O-N 3.07Å; Y77-I81 VanDerWaalsContact O-N 3.16Å; A78-I81 PolarHBondContact O-N 3.38Å; S79-I81 VanDerWaalsContact C-N 3.33Å; S79-I81 PolarHBondContact O-N 3.41Å; I81-T83 VanDerWaalsContact C-N 3.32Å; I81-T83 PolarHBondContact O-N 2.91Å; I81-T84 PolarHBondContact O-N 2.76Å; I81-T101 HydrophobicContact CD1-CG2 3.98Å; I81-Y104 HydrophobicContact CB-CD1 4.34Å; I81-Y104 HydrophobicContact CB-CE1 4.16Å; I81-Y104 HydrophobicContact CG2-CD1 3.88Å; I81-Y104 HydrophobicContact CG2-CE1 4.1Å; I81-A105 HydrophobicContact CG2-CB 3.91Å
82L93.6Very high87.2Confident26 Ų2629.7 Ų29.714%0.13619%0.192CC..Hα-helixtrans-57.3-45.4177.5-82.9-171.5000112.3A78 S79 T84 Y104 M112A78-L82 WeakPolarHBondContact O-CB 3.36Å; A78-L82 WeakPolarHBondContact O-CG 3.41Å; A78-L82 PolarHBondContact O-N 3.27Å; A78-L82 VanDerWaalsContact O-N 3.09Å; S79-L82 WeakPolarHBondContact O-CB 3.49Å; S79-L82 PolarHBondContact O-N 3.36Å; L82-T84 PolarHBondContact O-N 3.06Å; L82-Y104 WeakPolarHBondContact CD1-OH 3.25Å; L82-Y104 HydrophobicContact CD2-CE1 3.84Å; L82-Y104 HydrophobicContact CD2-CE2 4.4Å; L82-Y104 HydrophobicContact CG-CE1 3.75Å; L82-Y104 WeakPolarHBondContact CG-OH 3.41Å; L82-M112 HydrophobicContact CB-CE 4.24Å; L82-M112 HydrophobicContact CB-CG 3.6Å; L82-M112 HydrophobicContact CB-SD 4.03Å; L82-M112 HydrophobicContact CD1-CG 4.29Å; L82-M112 HydrophobicContact CD1-SD 4.15Å; L82-M112 HydrophobicContact CD2-CG 3.84Å; L82-M112 HydrophobicContact CG-CG 4.07Å; L82-M112 VanDerWaalsContact O-CB 3.28Å; L82-M112 WeakPolarHBondContact O-CB 3.5Å; L82-M112 VanDerWaalsContact O-CG 3.29Å; L82-M112 WeakPolarHBondContact O-CG 3.37Å
83T92Very high87.1Confident7 Ų733.2 Ų33.24%0.04320%0.203CC..THydrogen-bonded Turntrans-81.81.317959.10000113.5S79 T80 I81 I85 M112 F220 L227S79-T83 WeakPolarHBondContact O-CG2 3.48Å; S79-T83 PolarHBondContact O-N 2.76Å; S79-T83 PolarHBondContact O-OG1 2.92Å; T80-T83 WeakPolarHBondContact CA-OG1 3.44Å; T80-T83 PolarHBondContact O-OG1 3.27Å; I81-T83 VanDerWaalsContact C-N 3.32Å; I81-T83 PolarHBondContact O-N 2.91Å; T83-I85 PolarHBondContact O-N 2.99Å; T83-I85 VanDerWaalsContact OG1-CD1 3.3Å; T83-I85 WeakPolarHBondContact OG1-CD1 3.5Å; T83-I85 VanDerWaalsContact OG1-CG1 3.31Å; T83-I85 WeakPolarHBondContact OG1-CG1 3.3Å; T83-M112 HydrophobicContact CG2-CE 3.65Å; T83-F220 HydrophobicContact CG2-CE2 4.06Å; T83-L227 HydrophobicContact CG2-CD1 3.83Å
84T93.8Very high87.4Confident70 Ų7035.4 Ų35.443%0.42922%0.217SC..THydrogen-bonded Turntrans52.427.1-176.563.30000114.4T80 I81 L82 I109T80-T84 PolarHBondContact O-N 2.87Å; I81-T84 PolarHBondContact O-N 2.76Å; L82-T84 PolarHBondContact O-N 3.06Å; T84-I109 HydrophobicContact CG2-CD1 4.09Å; T84-I109 HydrophobicContact CG2-CG1 3.9Å; T84-I109 HydrophobicContact CG2-CG2 4.13Å
85I92.9Very high87.5Confident7 Ų739.2 Ų39.24%0.03624%0.239CC..  trans-83-49.4179.2-60.8171.3000109.8T80 T83 Y87 S199 T202T80-I85 PolarHBondContact O-N 3.06Å; T83-I85 PolarHBondContact O-N 2.99Å; T83-I85 VanDerWaalsContact OG1-CD1 3.3Å; T83-I85 WeakPolarHBondContact OG1-CD1 3.5Å; T83-I85 VanDerWaalsContact OG1-CG1 3.31Å; T83-I85 WeakPolarHBondContact OG1-CG1 3.3Å; I85-Y87 HydrophobicContact CG2-CD1 4.09Å; I85-Y87 HydrophobicContact CG2-CD2 4.34Å; I85-Y87 HydrophobicContact CG2-CE1 3.67Å; I85-Y87 HydrophobicContact CG2-CE2 3.91Å; I85-Y87 HydrophobicContact CG2-CG 4.42Å; I85-S199 WeakPolarHBondContact CD1-O 3.1Å; I85-S199 WeakPolarHBondContact CG1-O 3.39Å; I85-T202 HydrophobicContact CG1-CG2 4.33Å
86G91.3Very high87.7Confident44 Ų4447.4 Ų47.445%0.45427%0.265SS..  trans52.863.8172.400000116.8T80 G88T80-G86 PolarHBondContact O-N 3.44Å; G86-G88 PolarHBondContact O-N 2.81Å
87Y88.8Confident87.7Confident7 Ų747.6 Ų47.63%0.02727%0.269CS..  trans-54-17.9179.4-63.1-67000116.8F76 T80 I85 H89 F195 S199 G204 G206 V209F76-Y87 AromaticContact CE1-CD2 3.71Å; F76-Y87 HydrophobicContact CE1-CD2 3.71Å; F76-Y87 AromaticContact CE1-CE2 3.94Å; F76-Y87 HydrophobicContact CE1-CE2 3.94Å; F76-Y87 HydrophobicContact CE2-CE2 4.23Å; F76-Y87 AromaticContact CZ-CD2 3.66Å; F76-Y87 HydrophobicContact CZ-CD2 3.66Å; F76-Y87 AromaticContact CZ-CE2 3.39Å; F76-Y87 HydrophobicContact CZ-CE2 3.39Å; T80-Y87 HydrophobicContact CG2-CD2 3.61Å; T80-Y87 HydrophobicContact CG2-CE2 3.71Å; I85-Y87 HydrophobicContact CG2-CD1 4.09Å; I85-Y87 HydrophobicContact CG2-CD2 4.34Å; I85-Y87 HydrophobicContact CG2-CE1 3.67Å; I85-Y87 HydrophobicContact CG2-CE2 3.91Å; I85-Y87 HydrophobicContact CG2-CG 4.42Å; Y87-H89 PolarHBondContact O-N 3.4Å; Y87-F195 HydrophobicContact CE1-CD2 4.47Å; Y87-F195 AromaticContact CE1-CE2 3.85Å; Y87-F195 HydrophobicContact CE1-CE2 3.85Å; Y87-F195 AromaticContact CZ-CE2 3.77Å; Y87-F195 WeakPolarHBondContact OH-CE2 3.32Å; Y87-S199 WeakPolarHBondContact OH-CB 3.47Å; Y87-S199 PolarHBondContact OH-OG 3.22Å; Y87-G204 VanDerWaalsContact CA-O 3.25Å; Y87-G204 WeakPolarHBondContact CA-O 3.3Å; Y87-G206 WeakPolarHBondContact O-CA 3.34Å; Y87-V209 HydrophobicContact CD1-CG1 3.94Å; Y87-V209 HydrophobicContact CD2-CG1 4.14Å; Y87-V209 HydrophobicContact CE1-CG1 4.31Å; Y87-V209 HydrophobicContact CG-CG1 3.83Å
88G84.2Confident87.8Confident53 Ų5353 Ų5355%0.54629%0.289SS..SBendtrans72.5-9.7179.700000115.9G86 R90 T91G86-G88 PolarHBondContact O-N 2.81Å; G88-R90 VanDerWaalsContact C-N 3.29Å; G88-R90 PolarHBondContact O-N 3.34Å; G88-T91 WeakPolarHBondContact O-CG2 3.47Å
89H77.3Confident87.9Confident59 Ų5953.6 Ų53.627%0.27329%0.294SS..SBendtrans-72.4-20.3175.776.8-43.7000113.5F76 Y87F76-H89 AromaticContact CD1-CE1 3.89Å; F76-H89 AromaticContact CE1-CE1 3.41Å; F76-H89 VanDerWaalsContact CE1-CE1 3.41Å; F76-H89 WeakPolarHBondContact CE1-CE1 3.43Å; F76-H89 AromaticContact CE1-NE2 3.76Å; Y87-H89 PolarHBondContact O-N 3.4Å
90R76Confident88Confident8 Ų855.1 Ų55.13%0.0331%0.308CS..SBendtrans-123.1118.4175.3-78-171.1-94.1-139-8.4109.1I2 E3 G73 F76 Y77 G88I2-R90 HydrophobicContact CG2-CB 4.04Å; I2-R90 HydrophobicContact CG2-CG 4.23Å; E3-R90 WeakPolarHBondContact O-CD 3.48Å; E3-R90 WeakPolarHBondContact O-CG 3.44Å; G73-R90 VanDerWaalsContact CA-NH1 3.27Å; F76-R90 VanDerWaalsContact CG-NH2 3.27Å; Y77-R90 HydrophobicContact CD2-CB 4.07Å; Y77-R90 VanDerWaalsContact CD2-O 3.23Å; Y77-R90 WeakPolarHBondContact CD2-O 3.44Å; Y77-R90 WeakPolarHBondContact CE2-O 3.46Å; G88-R90 VanDerWaalsContact C-N 3.29Å; G88-R90 PolarHBondContact O-N 3.34Å
91T80.5Confident88Confident81 Ų8156.1 Ų56.150%0.49731%0.314SS..  trans-138151.8-178.1640000112.1G88G88-T91 WeakPolarHBondContact O-CG2 3.47Å
92C81.2Confident88.1Confident12 Ų1259.6 Ų59.68%0.08133%0.332CS..  trans-83.4112.8169.7-70.40000109.8Y77 R98Y77-C92 VanDerWaalsContact CE1-SG 3.58Å; C92-R98 HydrophobicContact CB-CG 4.22Å; C92-R98 VanDerWaalsContact O-CG 3.29Å; C92-R98 WeakPolarHBondContact O-CG 3.42Å; C92-R98 PolarHBondContact O-NE 2.88Å
93Y79.9Confident88.2Confident115 Ų11563.6 Ų63.645%0.45135%0.352SS..  trans-82.7-25.7173.460.2-95.1000112.9M1M1-Y93 HydrophobicContact CB-CE1 4.32Å; M1-Y93 WeakPolarHBondContact O-CE1 3.41Å
94T87.7Confident88.3Confident48 Ų4867.3 Ų67.329%0.29437%0.366SS..SBendtrans-74.8136.8178.755.70000111.6W96 G97 R98T94-W96 VanDerWaalsContact C-N 3.3Å; T94-W96 PolarHBondContact O-N 3.09Å; T94-G97 PolarHBondContact O-N 3Å; T94-G97 VanDerWaalsContact O-N 3.13Å; T94-G97 PolarHBondContact OG1-N 3.07Å; T94-R98 PolarHBondContact O-N 3.37Å
95T89.4Confident88.4Confident121 Ų12165 Ų6574%0.74235%0.354SS*.Hα-helixtrans-54.4-43.7176.5-48.30000112.6R98 A99T95-R98 PolarHBondContact O-N 3.02Å; T95-A99 PolarHBondContact O-N 2.91Å
96W91.1Very high88.6Confident219 Ų21970.4 Ų70.483%0.8338%0.381SS*.Hα-helixtrans-63.5-43.4177.8-173.7-108.5000112.8T94 R98 A99 A100T94-W96 VanDerWaalsContact C-N 3.3Å; T94-W96 PolarHBondContact O-N 3.09Å; W96-R98 VanDerWaalsContact C-N 3.32Å; W96-R98 PolarHBondContact O-N 3.36Å; W96-A99 PolarHBondContact O-N 3.31Å; W96-A100 PolarHBondContact O-N 3.34Å
97G88.3Confident88.8Confident12 Ų1274 Ų7412%0.12439%0.389CS..Hα-helixtrans-60-41174.900000112.5T94 A100 T101T94-G97 PolarHBondContact O-N 3Å; T94-G97 VanDerWaalsContact O-N 3.13Å; T94-G97 PolarHBondContact OG1-N 3.07Å; G97-A100 PolarHBondContact O-N 3.41Å; G97-T101 WeakPolarHBondContact O-CG2 3.4Å; G97-T101 PolarHBondContact O-N 3.05Å; G97-T101 PolarHBondContact O-OG1 3.12Å
98R90.2Very high89.1Confident143 Ų14374 Ų7454%0.5439%0.39SS..Hα-helixtrans-62.5-44.2174.9-65.8175.3-179.3179.1-2111.6C92 T94 T95 W96 T101 I102C92-R98 HydrophobicContact CB-CG 4.22Å; C92-R98 VanDerWaalsContact O-CG 3.29Å; C92-R98 WeakPolarHBondContact O-CG 3.42Å; C92-R98 PolarHBondContact O-NE 2.88Å; T94-R98 PolarHBondContact O-N 3.37Å; T95-R98 PolarHBondContact O-N 3.02Å; W96-R98 VanDerWaalsContact C-N 3.32Å; W96-R98 PolarHBondContact O-N 3.36Å; R98-T101 WeakPolarHBondContact CA-OG1 3.41Å; R98-T101 PolarHBondContact O-N 3.24Å; R98-T101 PolarHBondContact O-OG1 3.49Å; R98-I102 WeakPolarHBondContact O-CG1 3.43Å; R98-I102 PolarHBondContact O-N 3.49Å
99A93.1Very high89.6Confident40 Ų4074.3 Ų74.333%0.33138%0.379SS..Hα-helixtrans-60.9-45.9175.700000112.2T95 W96 T101 I102 I103T95-A99 PolarHBondContact O-N 2.91Å; W96-A99 PolarHBondContact O-N 3.31Å; A99-T101 VanDerWaalsContact C-N 3.29Å; A99-T101 PolarHBondContact O-N 3.45Å; A99-I102 PolarHBondContact O-N 2.96Å; A99-I103 PolarHBondContact O-N 3.42Å
100A92.3Very high90.5Very high47 Ų4774.8 Ų74.839%0.38839%0.388SS..Hα-helixtrans-60.4-38.8177.100000112.3W96 G97 I102 I103 Y104W96-A100 PolarHBondContact O-N 3.34Å; G97-A100 PolarHBondContact O-N 3.41Å; A100-I102 VanDerWaalsContact C-N 3.34Å; A100-I102 PolarHBondContact O-N 3.42Å; A100-I103 PolarHBondContact O-N 2.93Å; A100-Y104 VanDerWaalsContact O-CB 3.29Å; A100-Y104 WeakPolarHBondContact O-CB 3.49Å; A100-Y104 PolarHBondContact O-N 3.05Å
101T92.2Very high91.3Very high29 Ų2979.9 Ų79.918%0.17842%0.415CS..Hα-helixtrans-67-33.3178.256.90000113.3Y77 I81 G97 R98 A99 A105Y77-T101 HydrophobicContact CE1-CG2 3.52Å; Y77-T101 VanDerWaalsContact OH-CG2 3.25Å; Y77-T101 WeakPolarHBondContact OH-CG2 3.19Å; I81-T101 HydrophobicContact CD1-CG2 3.98Å; G97-T101 WeakPolarHBondContact O-CG2 3.4Å; G97-T101 PolarHBondContact O-N 3.05Å; G97-T101 PolarHBondContact O-OG1 3.12Å; R98-T101 WeakPolarHBondContact CA-OG1 3.41Å; R98-T101 PolarHBondContact O-N 3.24Å; R98-T101 PolarHBondContact O-OG1 3.49Å; A99-T101 VanDerWaalsContact C-N 3.29Å; A99-T101 PolarHBondContact O-N 3.45Å; T101-A105 VanDerWaalsContact O-CB 3.28Å; T101-A105 WeakPolarHBondContact O-CB 3.29Å; T101-A105 PolarHBondContact O-N 3.3Å
102I94.7Very high92Very high104 Ų10476.6 Ų76.653%0.53339%0.394SS..Hα-helixtrans-65.7-49.4175.3-66163.9000110R98 A99 A100 Y104 A105 I106R98-I102 WeakPolarHBondContact O-CG1 3.43Å; R98-I102 PolarHBondContact O-N 3.49Å; A99-I102 PolarHBondContact O-N 2.96Å; A100-I102 VanDerWaalsContact C-N 3.34Å; A100-I102 PolarHBondContact O-N 3.42Å; I102-Y104 VanDerWaalsContact C-N 3.3Å; I102-Y104 PolarHBondContact O-N 3.33Å; I102-A105 PolarHBondContact O-N 3.13Å; I102-I106 HydrophobicContact CG2-CD1 4.02Å; I102-I106 WeakPolarHBondContact O-CG1 3.07Å; I102-I106 PolarHBondContact O-N 3.23Å
103I95.7Very high92.5Very high109 Ų10980.9 Ų80.956%0.55942%0.415SS*.Hα-helixtrans-59.9-44.4178.3-63169.2000110.4A99 A100 I106 I107A99-I103 PolarHBondContact O-N 3.42Å; A100-I103 PolarHBondContact O-N 2.93Å; I103-I106 PolarHBondContact O-N 3.3Å; I103-I107 PolarHBondContact O-N 3.29Å
104Y94.9Very high93Very high86 Ų8679.8 Ų79.834%0.33742%0.421SS..Hα-helixtrans-61.6-42.4176.9178.3-103.8000112.7A78 I81 L82 A100 I102 G108A78-Y104 HydrophobicContact CB-CE1 4.12Å; A78-Y104 WeakPolarHBondContact CB-OH 3.38Å; A78-Y104 WeakPolarHBondContact O-CE1 3.4Å; A78-Y104 PolarHBondContact O-OH 3.37Å; I81-Y104 HydrophobicContact CB-CD1 4.34Å; I81-Y104 HydrophobicContact CB-CE1 4.16Å; I81-Y104 HydrophobicContact CG2-CD1 3.88Å; I81-Y104 HydrophobicContact CG2-CE1 4.1Å; L82-Y104 WeakPolarHBondContact CD1-OH 3.25Å; L82-Y104 HydrophobicContact CD2-CE1 3.84Å; L82-Y104 HydrophobicContact CD2-CE2 4.4Å; L82-Y104 HydrophobicContact CG-CE1 3.75Å; L82-Y104 WeakPolarHBondContact CG-OH 3.41Å; A100-Y104 VanDerWaalsContact O-CB 3.29Å; A100-Y104 WeakPolarHBondContact O-CB 3.49Å; A100-Y104 PolarHBondContact O-N 3.05Å; I102-Y104 VanDerWaalsContact C-N 3.3Å; I102-Y104 PolarHBondContact O-N 3.33Å; Y104-G108 WeakPolarHBondContact O-CA 3.03Å; Y104-G108 PolarHBondContact O-N 2.99Å
105A95.8Very high93.2Very high21 Ų2181.3 Ų81.317%0.17443%0.427CS..Hα-helixtrans-65.8-40.4179.100000112.5I81 T101 I102 I107 G108 I109I81-A105 HydrophobicContact CG2-CB 3.91Å; T101-A105 VanDerWaalsContact O-CB 3.28Å; T101-A105 WeakPolarHBondContact O-CB 3.29Å; T101-A105 PolarHBondContact O-N 3.3Å; I102-A105 PolarHBondContact O-N 3.13Å; A105-I107 VanDerWaalsContact C-N 3.31Å; A105-I107 PolarHBondContact O-N 2.89Å; A105-G108 PolarHBondContact O-N 2.94Å; A105-I109 HydrophobicContact CB-CD1 3.92Å; A105-I109 HydrophobicContact CB-CG1 4.44Å; A105-I109 WeakPolarHBondContact O-CB 3.42Å; A105-I109 WeakPolarHBondContact O-CD1 3.15Å; A105-I109 WeakPolarHBondContact O-CG1 3.3Å; A105-I109 PolarHBondContact O-N 3.43Å
106I96.4Very high93.3Very high120 Ų12076.2 Ų76.262%0.61540%0.395SS*.Hα-helixtrans-59.9-41.3179.5-69.6166.6000111.6I102 I103 P110I102-I106 HydrophobicContact CG2-CD1 4.02Å; I102-I106 WeakPolarHBondContact O-CG1 3.07Å; I102-I106 PolarHBondContact O-N 3.23Å; I103-I106 PolarHBondContact O-N 3.3Å; I106-P110 WeakPolarHBondContact O-CD 3.5Å; I106-P110 VanDerWaalsContact O-CG 3.3Å; I106-P110 WeakPolarHBondContact O-CG 3.4Å
107I95.7Very high93.2Very high121 Ų12168.8 Ų68.862%0.62137%0.372SS*.Hα-helixtrans-83.7-39.9179.6-59.8172.7000110.8I103 A105 L111I103-I107 PolarHBondContact O-N 3.29Å; A105-I107 VanDerWaalsContact C-N 3.31Å; A105-I107 PolarHBondContact O-N 2.89Å; I107-L111 PolarHBondContact O-N 3.18Å
108G94.7Very high93.1Very high5 Ų569.7 Ų69.75%0.05238%0.382CS..Hα-helixtrans-75-40.7-171.100000114.5Y104 A105 L111 M112Y104-G108 WeakPolarHBondContact O-CA 3.03Å; Y104-G108 PolarHBondContact O-N 2.99Å; A105-G108 PolarHBondContact O-N 2.94Å; G108-L111 WeakPolarHBondContact O-CB 3.23Å; G108-L111 PolarHBondContact O-N 3.45Å; G108-M112 WeakPolarHBondContact O-CG 3.45Å; G108-M112 PolarHBondContact O-N 3.27Å
109I95.2Very high93Very high60 Ų6065.2 Ų65.231%0.30837%0.368SS..Hα-helixtrans-62.1-48.2-178.4-64.6167.5000111.1T84 A105 L111 M112 L113T84-I109 HydrophobicContact CG2-CD1 4.09Å; T84-I109 HydrophobicContact CG2-CG1 3.9Å; T84-I109 HydrophobicContact CG2-CG2 4.13Å; A105-I109 HydrophobicContact CB-CD1 3.92Å; A105-I109 HydrophobicContact CB-CG1 4.44Å; A105-I109 WeakPolarHBondContact O-CB 3.42Å; A105-I109 WeakPolarHBondContact O-CD1 3.15Å; A105-I109 WeakPolarHBondContact O-CG1 3.3Å; A105-I109 PolarHBondContact O-N 3.43Å; I109-L111 VanDerWaalsContact C-N 3.32Å; I109-L111 PolarHBondContact O-N 3.41Å; I109-M112 PolarHBondContact O-N 2.99Å; I109-L113 HydrophobicContact CG2-CD1 4.2Å; I109-L113 HydrophobicContact CG2-CG 4.44Å; I109-L113 WeakPolarHBondContact O-CG 3.36Å; I109-L113 PolarHBondContact O-N 3.21Å
110P95.2Very high92.4Very high70 Ų7063.3 Ų63.346%0.45535%0.352SS..Hα-helixtrans-59.8-40.2174.1-24.534.6000113.4I106 M112 L113 T114I106-P110 WeakPolarHBondContact O-CD 3.5Å; I106-P110 VanDerWaalsContact O-CG 3.3Å; I106-P110 WeakPolarHBondContact O-CG 3.4Å; P110-M112 VanDerWaalsContact C-N 3.3Å; P110-M112 PolarHBondContact O-N 3.42Å; P110-L113 PolarHBondContact O-N 3.09Å; P110-T114 WeakPolarHBondContact O-CG2 3.49Å; P110-T114 PolarHBondContact O-N 3.43Å; P110-T114 PolarHBondContact O-OG1 3.05Å
111L93.7Very high91.8Very high114 Ų11467.5 Ų67.560%0.59736%0.362SS*.Hα-helixtrans-61.9-40.3176.6-170.977.2000111.2I107 G108 I109 T114 L115I107-L111 PolarHBondContact O-N 3.18Å; G108-L111 WeakPolarHBondContact O-CB 3.23Å; G108-L111 PolarHBondContact O-N 3.45Å; I109-L111 VanDerWaalsContact C-N 3.32Å; I109-L111 PolarHBondContact O-N 3.41Å; L111-T114 PolarHBondContact O-OG1 3.33Å; L111-L115 WeakPolarHBondContact O-CB 3.46Å; L111-L115 PolarHBondContact O-N 3.17Å
112M93.5Very high91.2Very high12 Ų1275.3 Ų75.36%0.05939%0.388CS..Hα-helixtrans-71.6-39.1178-72.9-67.8-64.100112.7L82 T83 G108 I109 P110 T114 L115 V116 F220 V224L82-M112 HydrophobicContact CB-CE 4.24Å; L82-M112 HydrophobicContact CB-CG 3.6Å; L82-M112 HydrophobicContact CB-SD 4.03Å; L82-M112 HydrophobicContact CD1-CG 4.29Å; L82-M112 HydrophobicContact CD1-SD 4.15Å; L82-M112 HydrophobicContact CD2-CG 3.84Å; L82-M112 HydrophobicContact CG-CG 4.07Å; L82-M112 VanDerWaalsContact O-CB 3.28Å; L82-M112 WeakPolarHBondContact O-CB 3.5Å; L82-M112 VanDerWaalsContact O-CG 3.29Å; L82-M112 WeakPolarHBondContact O-CG 3.37Å; T83-M112 HydrophobicContact CG2-CE 3.65Å; G108-M112 WeakPolarHBondContact O-CG 3.45Å; G108-M112 PolarHBondContact O-N 3.27Å; I109-M112 PolarHBondContact O-N 2.99Å; P110-M112 VanDerWaalsContact C-N 3.3Å; P110-M112 PolarHBondContact O-N 3.42Å; M112-T114 VanDerWaalsContact C-N 3.34Å; M112-T114 PolarHBondContact O-N 2.77Å; M112-L115 HydrophobicContact CE-CD2 4.46Å; M112-L115 WeakPolarHBondContact O-CB 2.96Å; M112-L115 PolarHBondContact O-N 3.31Å; M112-L115 HydrophobicContact SD-CD2 3.87Å; M112-V116 VanDerWaalsContact O-CB 3.3Å; M112-V116 WeakPolarHBondContact O-CB 3.45Å; M112-V116 WeakPolarHBondContact O-CG2 3.41Å; M112-V116 PolarHBondContact O-N 2.98Å; M112-F220 HydrophobicContact CE-CZ 4.45Å; M112-V224 HydrophobicContact CE-CG2 4.21Å
113L92.1Very high90.4Very high102 Ų10273.8 Ų73.853%0.53438%0.381SS..Hα-helixtrans-60.9-43.3174.1-69.8174.4000111.5I109 P110 N117I109-L113 HydrophobicContact CG2-CD1 4.2Å; I109-L113 HydrophobicContact CG2-CG 4.44Å; I109-L113 WeakPolarHBondContact O-CG 3.36Å; I109-L113 PolarHBondContact O-N 3.21Å; P110-L113 PolarHBondContact O-N 3.09Å; L113-N117 VanDerWaalsContact O-CB 3.27Å; L113-N117 WeakPolarHBondContact O-CB 3.23Å; L113-N117 PolarHBondContact O-N 3.16Å; L113-N117 PolarHBondContact O-ND2 3Å
114T91.2Very high89.3Confident93 Ų9370 Ų7057%0.57136%0.36SS*.Hα-helixtrans-66.5-39175.754.60000112.3P110 L111 M112 G118P110-T114 WeakPolarHBondContact O-CG2 3.49Å; P110-T114 PolarHBondContact O-N 3.43Å; P110-T114 PolarHBondContact O-OG1 3.05Å; L111-T114 PolarHBondContact O-OG1 3.33Å; M112-T114 VanDerWaalsContact C-N 3.34Å; M112-T114 PolarHBondContact O-N 2.77Å; T114-G118 PolarHBondContact O-N 3.43Å
115L91.9Very high87.9Confident79 Ų7970.2 Ų70.241%0.41437%0.367SS..Hα-helixtrans-61-51.1174179.464.5000111.8L111 M112 G118 L119 V224L111-L115 WeakPolarHBondContact O-CB 3.46Å; L111-L115 PolarHBondContact O-N 3.17Å; M112-L115 HydrophobicContact CE-CD2 4.46Å; M112-L115 WeakPolarHBondContact O-CB 2.96Å; M112-L115 PolarHBondContact O-N 3.31Å; M112-L115 HydrophobicContact SD-CD2 3.87Å; L115-G118 PolarHBondContact O-N 2.99Å; L115-L119 HydrophobicContact CD1-CD1 3.88Å; L115-L119 HydrophobicContact CD1-CG 4.18Å; L115-L119 HydrophobicContact CG-CD1 3.9Å; L115-L119 WeakPolarHBondContact O-CB 2.99Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 2.96Å; L115-L119 PolarHBondContact O-N 2.67Å; L115-V224 HydrophobicContact CD2-CG1 4.14Å; L115-V224 HydrophobicContact CG-CG1 4.46Å
116V91.9Very high86.3Confident14 Ų1479.3 Ų79.39%0.08540%0.397CS..Hα-helixtrans-61.6-46.3-179.6165.90000110.9M112 G118 L119 G120 L227 S228M112-V116 VanDerWaalsContact O-CB 3.3Å; M112-V116 WeakPolarHBondContact O-CB 3.45Å; M112-V116 WeakPolarHBondContact O-CG2 3.41Å; M112-V116 PolarHBondContact O-N 2.98Å; V116-G118 PolarHBondContact O-N 3.4Å; V116-L119 PolarHBondContact O-N 2.63Å; V116-G120 PolarHBondContact O-N 2.95Å; V116-L227 HydrophobicContact CG1-CB 4.4Å; V116-L227 WeakPolarHBondContact CG1-O 3.19Å; V116-L227 HydrophobicContact CG2-CB 4.18Å; V116-S228 PolarHBondContact O-OG 3.49Å
117N87.7Confident84.4Confident63 Ų6382.2 Ų82.234%0.33740%0.4SS..Hα-helixtrans-66.1-38.9178.3-68.9-11.9000112.1L113 K121 S231L113-N117 VanDerWaalsContact O-CB 3.27Å; L113-N117 WeakPolarHBondContact O-CB 3.23Å; L113-N117 PolarHBondContact O-N 3.16Å; L113-N117 PolarHBondContact O-ND2 3Å; N117-K121 WeakPolarHBondContact O-CG 3.48Å; N117-K121 PolarHBondContact O-N 3.4Å; N117-K121 VanDerWaalsContact O-N 3.14Å; N117-S231 PolarHBondContact OD1-OG 3.14Å
118G86.9Confident82.6Confident32 Ų3277.2 Ų77.233%0.3338%0.376SS..Hα-helixtrans-67-43.6176.500000112.8T114 L115 V116 R122T114-G118 PolarHBondContact O-N 3.43Å; L115-G118 PolarHBondContact O-N 2.99Å; V116-G118 PolarHBondContact O-N 3.4Å; G118-R122 WeakPolarHBondContact O-CG 3.35Å; G118-R122 PolarHBondContact O-N 3.14Å; G118-R122 VanDerWaalsContact O-N 3.14Å
119L87.8Confident80.6Confident49 Ų4979.5 Ų79.526%0.25739%0.394SS..Hα-helixtrans-66.5-44.2176-73.9173.1000111.5L115 V116 K121 R122 L123 V224 S228L115-L119 HydrophobicContact CD1-CD1 3.88Å; L115-L119 HydrophobicContact CD1-CG 4.18Å; L115-L119 HydrophobicContact CG-CD1 3.9Å; L115-L119 WeakPolarHBondContact O-CB 2.99Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 2.96Å; L115-L119 PolarHBondContact O-N 2.67Å; V116-L119 PolarHBondContact O-N 2.63Å; L119-K121 PolarHBondContact O-N 3.2Å; L119-R122 PolarHBondContact O-N 3.42Å; L119-R122 VanDerWaalsContact O-N 3.15Å; L119-L123 WeakPolarHBondContact O-CB 3.44Å; L119-L123 VanDerWaalsContact O-CG 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.26Å; L119-L123 PolarHBondContact O-N 3.29Å; L119-V224 HydrophobicContact CD1-CG1 3.46Å; L119-V224 VanDerWaalsContact CD1-CG1 3.46Å; L119-S228 VanDerWaalsContact CB-OG 3.31Å; L119-S228 WeakPolarHBondContact CB-OG 3.32Å
120G81.9Confident78.5Confident0 Ų085.8 Ų85.80%042%0.415CS..Hα-helixtrans-57.5-47.7178.200000111.8V116 R122 L123 F124 V232V116-G120 PolarHBondContact O-N 2.95Å; G120-R122 PolarHBondContact O-N 2.89Å; G120-L123 PolarHBondContact O-N 3.45Å; G120-F124 WeakPolarHBondContact O-CD2 3.31Å; G120-F124 PolarHBondContact O-N 3.49Å; G120-F124 VanDerWaalsContact O-N 3.11Å; G120-V232 VanDerWaalsContact C-CG2 3.41Å
121K78Confident76.3Confident135 Ų13588.4 Ų88.459%0.58742%0.421SS*.Hα-helixtrans-58-48174-73.5178.5-177.1-176.10111.6N117 L119 L123 L125N117-K121 WeakPolarHBondContact O-CG 3.48Å; N117-K121 PolarHBondContact O-N 3.4Å; N117-K121 VanDerWaalsContact O-N 3.14Å; L119-K121 PolarHBondContact O-N 3.2Å; K121-L123 PolarHBondContact O-N 2.92Å; K121-L125 HydrophobicContact CB-CD1 4.05Å; K121-L125 WeakPolarHBondContact O-CA 3.34Å; K121-L125 WeakPolarHBondContact O-CB 3.28Å; K121-L125 WeakPolarHBondContact O-CD1 3.29Å; K121-L125 WeakPolarHBondContact O-CG 3.23Å; K121-L125 PolarHBondContact O-N 3.48Å
122R81Confident74.6Confident192 Ų19285.9 Ų85.973%0.72541%0.407SS*.Hα-helixtrans-63.7-39.7180-72.7178.6-173.4172.73.1113.2G118 L119 G120 R126G118-R122 WeakPolarHBondContact O-CG 3.35Å; G118-R122 PolarHBondContact O-N 3.14Å; G118-R122 VanDerWaalsContact O-N 3.14Å; L119-R122 PolarHBondContact O-N 3.42Å; L119-R122 VanDerWaalsContact O-N 3.15Å; G120-R122 PolarHBondContact O-N 2.89Å; R122-R126 VanDerWaalsContact O-CB 3.29Å; R122-R126 WeakPolarHBondContact O-CB 3.36Å; R122-R126 PolarHBondContact O-N 3.37Å
123L78.3Confident72.7Confident73 Ų7391.1 Ų91.138%0.38243%0.431SS..Hα-helixtrans-65.9-46.7-179.3-70.9170.8000111.6L119 G120 K121 V225 L229L119-L123 WeakPolarHBondContact O-CB 3.44Å; L119-L123 VanDerWaalsContact O-CG 3.28Å; L119-L123 WeakPolarHBondContact O-CG 3.26Å; L119-L123 PolarHBondContact O-N 3.29Å; G120-L123 PolarHBondContact O-N 3.45Å; K121-L123 PolarHBondContact O-N 2.92Å; L123-V225 HydrophobicContact CD1-CG1 4.01Å; L123-L229 HydrophobicContact CD1-CD2 4.26Å
124F71.4Confident71.1Confident29 Ų2990.3 Ų90.313%0.12743%0.428CS..Hα-helixtrans-76.9-42.5178.9-80.9-94.5000112.5G120 R126 R127 S128 F160 I168 L229 V232G120-F124 WeakPolarHBondContact O-CD2 3.31Å; G120-F124 PolarHBondContact O-N 3.49Å; G120-F124 VanDerWaalsContact O-N 3.11Å; F124-R126 VanDerWaalsContact C-N 3.27Å; F124-R126 PolarHBondContact O-N 2.58Å; F124-R127 PolarHBondContact O-N 2.87Å; F124-S128 VanDerWaalsContact O-CB 3.29Å; F124-S128 WeakPolarHBondContact O-CB 3.36Å; F124-S128 PolarHBondContact O-N 3Å; F124-F160 HydrophobicContact CD1-CE1 4.13Å; F124-F160 HydrophobicContact CD1-CZ 4.08Å; F124-F160 AromaticContact CE1-CE1 3.75Å; F124-F160 HydrophobicContact CE1-CE1 3.75Å; F124-F160 AromaticContact CE1-CZ 3.92Å; F124-F160 HydrophobicContact CE1-CZ 3.92Å; F124-I168 HydrophobicContact CE1-CD1 4Å; F124-L229 HydrophobicContact CD2-CD2 4.24Å; F124-L229 HydrophobicContact CE2-CD2 3.47Å; F124-L229 VanDerWaalsContact CE2-CD2 3.47Å; F124-L229 HydrophobicContact CZ-CD2 4.07Å; F124-V232 HydrophobicContact CD1-CG1 4.13Å; F124-V232 HydrophobicContact CD2-CB 3.7Å; F124-V232 HydrophobicContact CD2-CG1 3.5Å; F124-V232 HydrophobicContact CD2-CG2 3.49Å; F124-V232 VanDerWaalsContact CD2-CG2 3.49Å; F124-V232 HydrophobicContact CE1-CG1 4.15Å; F124-V232 HydrophobicContact CE2-CB 3.46Å; F124-V232 VanDerWaalsContact CE2-CB 3.46Å; F124-V232 HydrophobicContact CE2-CG1 3.5Å; F124-V232 VanDerWaalsContact CE2-CG1 3.5Å; F124-V232 HydrophobicContact CE2-CG2 3.67Å; F124-V232 HydrophobicContact CG-CB 4.5Å; F124-V232 HydrophobicContact CG-CG1 3.81Å; F124-V232 HydrophobicContact CG-CG2 4.42Å; F124-V232 HydrophobicContact CZ-CB 4.12Å; F124-V232 HydrophobicContact CZ-CG1 3.84Å
125L65.7Low69.1Low91 Ų9191.5 Ų91.548%0.47643%0.425SS..Hα-helixtrans-65.7-26.8178.4-68.8169000112.2K121 A129K121-L125 HydrophobicContact CB-CD1 4.05Å; K121-L125 WeakPolarHBondContact O-CA 3.34Å; K121-L125 WeakPolarHBondContact O-CB 3.28Å; K121-L125 WeakPolarHBondContact O-CD1 3.29Å; K121-L125 WeakPolarHBondContact O-CG 3.23Å; K121-L125 PolarHBondContact O-N 3.48Å; L125-A129 WeakPolarHBondContact O-CA 3.29Å; L125-A129 WeakPolarHBondContact O-CB 3.38Å; L125-A129 PolarHBondContact O-N 2.94Å
126R62.2Low67.1Low212 Ų21295.2 Ų95.280%0.844%0.435SS*.Hα-helixtrans-69.2-37.1175.5-167.215977.2118.8-2.6112.3R122 F124R122-R126 VanDerWaalsContact O-CB 3.29Å; R122-R126 WeakPolarHBondContact O-CB 3.36Å; R122-R126 PolarHBondContact O-N 3.37Å; F124-R126 VanDerWaalsContact C-N 3.27Å; F124-R126 PolarHBondContact O-N 2.58Å
127R57.1Low65.4Low180 Ų180100 Ų10068%0.67946%0.459SS*.Hα-helixtrans-78.8-35.4174.7-169.9165.9170.282-2.2111.7F124 Y130 H131F124-R127 PolarHBondContact O-N 2.87Å; R127-Y130 WeakPolarHBondContact O-CB 3.45Å; R127-Y130 PolarHBondContact O-N 3.38Å; R127-H131 PolarHBondContact O-N 3.2Å
128S56.6Low63.8Low17 Ų17102.5 Ų102.512%0.11947%0.471CS..Hα-helixtrans-70.2-40.3175.3-152.50000111F124 Y130 H131 I132 V158F124-S128 VanDerWaalsContact O-CB 3.29Å; F124-S128 WeakPolarHBondContact O-CB 3.36Å; F124-S128 PolarHBondContact O-N 3Å; S128-Y130 PolarHBondContact O-N 3.48Å; S128-Y130 VanDerWaalsContact O-N 3.15Å; S128-H131 CarbonylContact O-C 3.47Å; S128-H131 WeakPolarHBondContact O-CA 3.41Å; S128-H131 PolarHBondContact O-N 2.92Å; S128-I132 VanDerWaalsContact O-CB 3.31Å; S128-I132 WeakPolarHBondContact O-CB 3.34Å; S128-I132 PolarHBondContact O-N 3.23Å; S128-V158 WeakPolarHBondContact OG-CG1 3.28Å
129A54Low62.3Low52 Ų52103.8 Ų103.843%0.4348%0.475SS..Hα-helixtrans-56.9-32.5174.100000112.1L125 H133L125-A129 WeakPolarHBondContact O-CA 3.29Å; L125-A129 WeakPolarHBondContact O-CB 3.38Å; L125-A129 PolarHBondContact O-N 2.94Å; A129-H133 WeakPolarHBondContact O-CA 3.29Å; A129-H133 WeakPolarHBondContact O-CB 3.3Å; A129-H133 PolarHBondContact O-N 3.46Å
130Y49.8Very low60.7Low192 Ų192105 Ų10575%0.75349%0.493SS*.Hα-helixtrans-66-43.1171.3-175.9-97.3000112.1R127 S128 N134R127-Y130 WeakPolarHBondContact O-CB 3.45Å; R127-Y130 PolarHBondContact O-N 3.38Å; S128-Y130 PolarHBondContact O-N 3.48Å; S128-Y130 VanDerWaalsContact O-N 3.15Å; Y130-N134 WeakPolarHBondContact O-CB 3.34Å; Y130-N134 PolarHBondContact O-N 3.18Å; Y130-N134 VanDerWaalsContact O-N 3.12Å
131H50Low59.4Low126 Ų126112 Ų11258%0.58353%0.53SS*.Hα-helixtrans-79.1-34.2-179.4-151-60.9000113.5R127 S128 N134 K135R127-H131 PolarHBondContact O-N 3.2Å; S128-H131 CarbonylContact O-C 3.47Å; S128-H131 WeakPolarHBondContact O-CA 3.41Å; S128-H131 PolarHBondContact O-N 2.92Å; H131-N134 PolarHBondContact O-N 3.49Å; H131-K135 WeakPolarHBondContact O-CB 3.49Å; H131-K135 PolarHBondContact O-N 3.37Å
132I57.9Low58.2Low60 Ų60115.8 Ų115.831%0.30854%0.54SS..Hα-helixtrans-70.6-42.7173.2-107.5163.6000108.9S128 N134 K135 Y136S128-I132 VanDerWaalsContact O-CB 3.31Å; S128-I132 WeakPolarHBondContact O-CB 3.34Å; S128-I132 PolarHBondContact O-N 3.23Å; I132-N134 VanDerWaalsContact C-N 3.29Å; I132-N134 PolarHBondContact O-N 2.68Å; I132-K135 CarbonylContact O-C 3.6Å; I132-K135 PolarHBondContact O-N 3Å; I132-K135 VanDerWaalsContact O-N 3.16Å; I132-Y136 HydrophobicContact CG2-CD2 3.92Å; I132-Y136 HydrophobicContact CG2-CE2 4.2Å; I132-Y136 VanDerWaalsContact O-CB 3.28Å; I132-Y136 WeakPolarHBondContact O-CB 3.28Å; I132-Y136 VanDerWaalsContact O-CD2 3.31Å; I132-Y136 WeakPolarHBondContact O-CD2 3.21Å; I132-Y136 PolarHBondContact O-N 3.03Å
133H54.6Low56.7Low122 Ų122113 Ų11357%0.56554%0.54SS*.Hα-helixtrans-60.3-42.8172.6-176.5-88.5000110.4A129 Y136 L137A129-H133 WeakPolarHBondContact O-CA 3.29Å; A129-H133 WeakPolarHBondContact O-CB 3.3Å; A129-H133 PolarHBondContact O-N 3.46Å; H133-Y136 PolarHBondContact O-N 3.29Å; H133-L137 WeakPolarHBondContact O-CG 3.44Å; H133-L137 PolarHBondContact O-N 2.89Å
134N56.6Low55.4Low85 Ų85115 Ų11546%0.45556%0.56SS.*Hα-helixtrans-64-40.8174.2-165.842.5000112.8Y130 H131 I132 I138Y130-N134 WeakPolarHBondContact O-CB 3.34Å; Y130-N134 PolarHBondContact O-N 3.18Å; Y130-N134 VanDerWaalsContact O-N 3.12Å; H131-N134 PolarHBondContact O-N 3.49Å; I132-N134 VanDerWaalsContact C-N 3.29Å; I132-N134 PolarHBondContact O-N 2.68Å; N134-I138 WeakPolarHBondContact O-CG1 3.29Å; N134-I138 PolarHBondContact O-N 2.8Å
135K50.7Low54.4Low119 Ų119121.9 Ų121.952%0.51759%0.592SS.*Hα-helixtrans-69.7-34.9176.4-129.9-174.7-178.6-172.90112.1H131 I132 I138 S139 D159H131-K135 WeakPolarHBondContact O-CB 3.49Å; H131-K135 PolarHBondContact O-N 3.37Å; I132-K135 CarbonylContact O-C 3.6Å; I132-K135 PolarHBondContact O-N 3Å; I132-K135 VanDerWaalsContact O-N 3.16Å; K135-I138 CarbonylContact O-C 3.56Å; K135-I138 PolarHBondContact O-N 3.4Å; K135-S139 VanDerWaalsContact O-CB 3.27Å; K135-S139 WeakPolarHBondContact O-CB 3.43Å; K135-S139 PolarHBondContact O-N 2.95Å; K135-D159 IonicContact NZ-OD2 4Å
136Y50.3Low53.6Low156 Ų156128.1 Ų128.161%0.61261%0.61SS**Hα-helixtrans-71.6-35.9176-96.2-91.2000111.7I132 H133 I138 S139 A140I132-Y136 HydrophobicContact CG2-CD2 3.92Å; I132-Y136 HydrophobicContact CG2-CE2 4.2Å; I132-Y136 VanDerWaalsContact O-CB 3.28Å; I132-Y136 WeakPolarHBondContact O-CB 3.28Å; I132-Y136 VanDerWaalsContact O-CD2 3.31Å; I132-Y136 WeakPolarHBondContact O-CD2 3.21Å; I132-Y136 PolarHBondContact O-N 3.03Å; H133-Y136 PolarHBondContact O-N 3.29Å; Y136-I138 PolarHBondContact O-N 3.43Å; Y136-S139 PolarHBondContact O-N 3.22Å; Y136-A140 WeakPolarHBondContact O-CB 3.27Å; Y136-A140 PolarHBondContact O-N 3.4Å
137L54.9Low52.9Low116 Ų116122.9 Ų122.961%0.60760%0.603SS**Hα-helixtrans-60.2-34.9169.2-71.9173.9000111.7H133H133-L137 WeakPolarHBondContact O-CG 3.44Å; H133-L137 PolarHBondContact O-N 2.89Å
138I54.8Low52.4Low115 Ų115119.5 Ų119.559%0.5960%0.604SS**Hα-helixtrans-79.5-36.1176.4-63.1168000111.8N134 K135 Y136 N141N134-I138 WeakPolarHBondContact O-CG1 3.29Å; N134-I138 PolarHBondContact O-N 2.8Å; K135-I138 CarbonylContact O-C 3.56Å; K135-I138 PolarHBondContact O-N 3.4Å; Y136-I138 PolarHBondContact O-N 3.43Å; I138-N141 WeakPolarHBondContact O-CB 3.28Å
139S55.2Low52.7Low59 Ų59124.5 Ų124.541%0.41363%0.634SS.*Hα-helixtrans-84.6-24.4-176.5-1520000113.8K135 Y136 N141 R142K135-S139 VanDerWaalsContact O-CB 3.27Å; K135-S139 WeakPolarHBondContact O-CB 3.43Å; K135-S139 PolarHBondContact O-N 2.95Å; Y136-S139 PolarHBondContact O-N 3.22Å; S139-N141 PolarHBondContact O-N 3.22Å; S139-N141 VanDerWaalsContact O-N 3.08Å; S139-R142 PolarHBondContact O-N 3.45Å
140A54.2Low51.9Low75 Ų75128.3 Ų128.362%0.6266%0.656SS**THydrogen-bonded Turntrans-59.4-18.2169.800000112.1Y136 R142Y136-A140 WeakPolarHBondContact O-CB 3.27Å; Y136-A140 PolarHBondContact O-N 3.4Å; A140-R142 VanDerWaalsContact C-N 3.32Å
141N54.8Low51.5Low146 Ų146126.8 Ų126.878%0.78165%0.649SS**THydrogen-bonded Turntrans-80.2-4.3170.6-165.564.4000114I138 S139I138-N141 WeakPolarHBondContact O-CB 3.28Å; S139-N141 PolarHBondContact O-N 3.22Å; S139-N141 VanDerWaalsContact O-N 3.08Å
142R51.8Low51Low214 Ų214126.2 Ų126.281%0.80866%0.655SS**THydrogen-bonded Turntrans-120-4.8-175.4-106.2-171.7-150.8-164.96.4115.9S139 A140 S144S139-R142 PolarHBondContact O-N 3.45Å; A140-R142 VanDerWaalsContact C-N 3.32Å; R142-S144 PolarHBondContact O-N 3.06Å
143D49.1Very low50.2Low135 Ų135131.9 Ų131.972%0.72268%0.682SS**  trans-76.656.2-178.8-80.7-19.6000113.8
144S52.3Low49.8Very low113 Ų113127.6 Ų127.679%0.7967%0.665SS**  trans-94.67.2162-173.10000113.3R142R142-S144 PolarHBondContact O-N 3.06Å
145Q49.5Very low49.6Very low174 Ų174127.1 Ų127.181%0.81367%0.666SS**SBendtrans-135.9100.8-174.7-15778.241.400113
146W48.6Very low49.4Very low223 Ų223124.8 Ų124.885%0.84566%0.659SS**  trans-51.7164.1166.9-103.279.5000114.8
147P48.6Very low49.4Very low101 Ų101121.7 Ų121.766%0.65665%0.653SS**  cis-115166.6-7.3-2.226.8000116.1
148P45.4Very low49.3Very low109 Ų109118.8 Ų118.871%0.70864%0.64SS**  trans-86.5116.3169.833.3-29.1000112.4
149V62.9Low49.4Very low123 Ų123118.8 Ų118.875%0.74564%0.641SS**  trans-70.7143.1162.6173.20000108.4R151V149-R151 PolarHBondContact O-N 3.46Å
150C36.9Very low49.8Very low131 Ų131118.1 Ų118.189%0.88563%0.631SS**  trans-61.873167.2-68.30000109.9T152C150-T152 PolarHBondContact O-N 3.18Å; C150-T152 VanDerWaalsContact O-N 3.17Å
151R41.7Very low50.9Low160 Ų160118 Ų11860%0.60462%0.624SS**  trans-71.1109.3165.8-151.5176.5-66.6-129-2.6103.6V149 M153V149-R151 PolarHBondContact O-N 3.46Å; R151-M153 PolarHBondContact O-N 3.21Å; R151-M153 VanDerWaalsContact O-N 3.16Å
152T40.1Very low52.2Low115 Ų115114 Ų11471%0.70660%0.602SS**  trans-40.5129.1150.351.70000105.1C150 S154C150-T152 PolarHBondContact O-N 3.18Å; C150-T152 VanDerWaalsContact O-N 3.17Å; T152-S154 PolarHBondContact O-N 2.67Å
153M42Very low53.8Low179 Ų179107.5 Ų107.588%0.88259%0.594SS**  trans-6182.4178.5-162.3167.7-165.500107.4R151R151-M153 PolarHBondContact O-N 3.21Å; R151-M153 VanDerWaalsContact O-N 3.16Å
154S46.2Very low55.6Low31 Ų31104.7 Ų104.722%0.21758%0.578CS.*  trans-81.5151.4-17759.50000104.7T152 D156T152-S154 PolarHBondContact O-N 2.67Å; S154-D156 WeakPolarHBondContact CB-OD2 3.49Å; S154-D156 PolarHBondContact O-N 2.94Å; S154-D156 WeakPolarHBondContact OG-CB 3.36Å; S154-D156 PolarHBondContact OG-OD2 3.36Å
155V51.1Low57.2Low76 Ų7699.3 Ų99.346%0.46154%0.54SS..G310 helixtrans-59.2-7.2-179.7-179.40000111.4D157 V158 A239V155-D157 PolarHBondContact O-N 3.14Å; V155-V158 PolarHBondContact O-N 3.29Å; V155-A239 HydrophobicContact CB-CB 4.4Å; V155-A239 HydrophobicContact CG1-CB 4.43Å
156D47.8Very low59.1Low69 Ų6994.4 Ų94.437%0.36952%0.519SS..G310 helixtrans-65.3-25-178.7-55.5-47.9000116S154 V158S154-D156 WeakPolarHBondContact CB-OD2 3.49Å; S154-D156 PolarHBondContact O-N 2.94Å; S154-D156 WeakPolarHBondContact OG-CB 3.36Å; S154-D156 PolarHBondContact OG-OD2 3.36Å; D156-V158 PolarHBondContact O-N 2.85Å
157D50.4Low61.2Low92 Ų9285.4 Ų85.449%0.49250%0.496SS..G310 helixtrans-76.6-4-180-71.7-27.5000113.1V155V155-D157 PolarHBondContact O-N 3.14Å
158V52.8Low63.2Low54 Ų5482.6 Ų82.633%0.32748%0.475SS..  trans-102.797.4166.9-1370000106.9S128 V155 D156 F160S128-V158 WeakPolarHBondContact OG-CG1 3.28Å; V155-V158 PolarHBondContact O-N 3.29Å; D156-V158 PolarHBondContact O-N 2.85Å; V158-F160 HydrophobicContact CB-CB 4.05Å; V158-F160 HydrophobicContact CG1-CB 3.75Å; V158-F160 HydrophobicContact CG1-CD2 4.46Å; V158-F160 PolarHBondContact O-N 3.39Å
159D56.9Low65.4Low115 Ų11578.2 Ų78.262%0.61545%0.446SS*.  trans-62.342156.9-62.4-60.3000110.5K135 P161K135-D159 IonicContact NZ-OD2 4Å; D159-P161 VanDerWaalsContact O-CD 3.24Å; D159-P161 WeakPolarHBondContact O-CD 3.31Å
160F63.5Low67Low46 Ų4677.1 Ų77.120%0.20244%0.435CS..  trans-72.5113.4179.4-163.9-105.8000106.4F124 V158 L162 L164 S165 I168F124-F160 HydrophobicContact CD1-CE1 4.13Å; F124-F160 HydrophobicContact CD1-CZ 4.08Å; F124-F160 AromaticContact CE1-CE1 3.75Å; F124-F160 HydrophobicContact CE1-CE1 3.75Å; F124-F160 AromaticContact CE1-CZ 3.92Å; F124-F160 HydrophobicContact CE1-CZ 3.92Å; V158-F160 HydrophobicContact CB-CB 4.05Å; V158-F160 HydrophobicContact CG1-CB 3.75Å; V158-F160 HydrophobicContact CG1-CD2 4.46Å; V158-F160 PolarHBondContact O-N 3.39Å; F160-L162 PolarHBondContact O-N 3.24Å; F160-L162 VanDerWaalsContact O-N 3.14Å; F160-L164 HydrophobicContact CD1-CB 4.48Å; F160-L164 HydrophobicContact CD2-CD2 3.97Å; F160-L164 HydrophobicContact CE1-CB 3.92Å; F160-L164 HydrophobicContact CE1-CD2 4.21Å; F160-L164 HydrophobicContact CE1-CG 3.93Å; F160-L164 HydrophobicContact CE2-CB 4.41Å; F160-L164 HydrophobicContact CE2-CD2 3.22Å; F160-L164 HydrophobicContact CE2-CG 3.81Å; F160-L164 HydrophobicContact CZ-CB 3.88Å; F160-L164 HydrophobicContact CZ-CD2 3.38Å; F160-L164 HydrophobicContact CZ-CG 3.36Å; F160-S165 VanDerWaalsContact CE1-N 3.27Å; F160-I168 HydrophobicContact CE1-CD1 4.48Å; F160-I168 HydrophobicContact CZ-CD1 3.81Å
161P76.3Confident69.7Low73 Ų7376 Ų7647%0.47442%0.42SS..  trans-60.6128.4-177.823.2-29.9000107.8D159 A163 L164 S165D159-P161 VanDerWaalsContact O-CD 3.24Å; D159-P161 WeakPolarHBondContact O-CD 3.31Å; P161-A163 PolarHBondContact O-N 2.87Å; P161-L164 HydrophobicContact CG-CB 3.76Å; P161-L164 HydrophobicContact CG-CD2 4.47Å; P161-L164 WeakPolarHBondContact O-CB 3.33Å; P161-L164 PolarHBondContact O-N 3.41Å; P161-S165 PolarHBondContact O-N 3.26Å
162L82.9Confident72.2Confident62 Ų6270.3 Ų70.333%0.32540%0.399SS..Hα-helixtrans-46.9-37.8176.1173.662.3000111.2F160 L164 S165 L166 V236 I237F160-L162 PolarHBondContact O-N 3.24Å; F160-L162 VanDerWaalsContact O-N 3.14Å; L162-L164 VanDerWaalsContact C-N 3.32Å; L162-L164 PolarHBondContact O-N 2.93Å; L162-S165 WeakPolarHBondContact O-CB 3.48Å; L162-S165 PolarHBondContact O-N 2.96Å; L162-S165 VanDerWaalsContact O-N 3.13Å; L162-L166 HydrophobicContact CD1-CD1 4.18Å; L162-L166 HydrophobicContact CD1-CG 4.15Å; L162-L166 HydrophobicContact CG-CD1 3.98Å; L162-L166 HydrophobicContact CG-CG 4.37Å; L162-L166 WeakPolarHBondContact O-CG 3.42Å; L162-L166 PolarHBondContact O-N 2.93Å; L162-V236 HydrophobicContact CD1-CG1 4.04Å; L162-I237 HydrophobicContact CD1-CD1 4.34Å; L162-I237 HydrophobicContact CD1-CG1 3.48Å; L162-I237 VanDerWaalsContact CD1-CG1 3.48Å; L162-I237 HydrophobicContact CD2-CG1 4.48Å
163A85.3Confident74.9Confident76 Ų7665.9 Ų65.963%0.62837%0.37SS*.Hα-helixtrans-56-39174.900000114P161 G167P161-A163 PolarHBondContact O-N 2.87Å; A163-G167 PolarHBondContact O-N 3.06Å
164L85.5Confident77.5Confident76 Ų7660.6 Ų60.640%0.39835%0.345SS..Hα-helixtrans-72.8-34.6177.5-176.262.4000111.4F160 P161 L162 G167 I168F160-L164 HydrophobicContact CD1-CB 4.48Å; F160-L164 HydrophobicContact CD2-CD2 3.97Å; F160-L164 HydrophobicContact CE1-CB 3.92Å; F160-L164 HydrophobicContact CE1-CD2 4.21Å; F160-L164 HydrophobicContact CE1-CG 3.93Å; F160-L164 HydrophobicContact CE2-CB 4.41Å; F160-L164 HydrophobicContact CE2-CD2 3.22Å; F160-L164 HydrophobicContact CE2-CG 3.81Å; F160-L164 HydrophobicContact CZ-CB 3.88Å; F160-L164 HydrophobicContact CZ-CD2 3.38Å; F160-L164 HydrophobicContact CZ-CG 3.36Å; P161-L164 HydrophobicContact CG-CB 3.76Å; P161-L164 HydrophobicContact CG-CD2 4.47Å; P161-L164 WeakPolarHBondContact O-CB 3.33Å; P161-L164 PolarHBondContact O-N 3.41Å; L162-L164 VanDerWaalsContact C-N 3.32Å; L162-L164 PolarHBondContact O-N 2.93Å; L164-G167 PolarHBondContact O-N 2.83Å; L164-I168 HydrophobicContact CG-CD1 4.28Å; L164-I168 VanDerWaalsContact O-CG1 3.26Å; L164-I168 WeakPolarHBondContact O-CG1 3.49Å; L164-I168 PolarHBondContact O-N 3.21Å
165S86.2Confident79.9Confident0 Ų063 Ų630%036%0.359CS..Hα-helixtrans-64.2-50.1175-160.90000111.2F160 P161 L162 G167 I168 V169 C233F160-S165 VanDerWaalsContact CE1-N 3.27Å; P161-S165 PolarHBondContact O-N 3.26Å; L162-S165 WeakPolarHBondContact O-CB 3.48Å; L162-S165 PolarHBondContact O-N 2.96Å; L162-S165 VanDerWaalsContact O-N 3.13Å; S165-G167 VanDerWaalsContact C-N 3.33Å; S165-G167 PolarHBondContact O-N 3.46Å; S165-I168 PolarHBondContact O-N 3.43Å; S165-V169 PolarHBondContact O-N 3.39Å; S165-V169 VanDerWaalsContact O-N 3.16Å; S165-C233 PolarHBondContact O-SG 3.17Å; S165-C233 PolarHBondContact OG-SG 3.16Å
166L90.4Very high82Confident71 Ų7159.6 Ų59.637%0.37234%0.338SS..Hα-helixtrans-62.4-41.9175.5-65.2175.9000111.2L162 I168 V169 I170L162-L166 HydrophobicContact CD1-CD1 4.18Å; L162-L166 HydrophobicContact CD1-CG 4.15Å; L162-L166 HydrophobicContact CG-CD1 3.98Å; L162-L166 HydrophobicContact CG-CG 4.37Å; L162-L166 WeakPolarHBondContact O-CG 3.42Å; L162-L166 PolarHBondContact O-N 2.93Å; L166-I168 PolarHBondContact O-N 2.96Å; L166-V169 PolarHBondContact O-N 3.42Å; L166-I170 WeakPolarHBondContact O-CB 3.31Å; L166-I170 VanDerWaalsContact O-CG1 3.25Å; L166-I170 WeakPolarHBondContact O-CG1 3.3Å; L166-I170 PolarHBondContact O-N 3.14Å
167G91.9Very high84.2Confident34 Ų3456.3 Ų56.335%0.35132%0.32SS..Hα-helixtrans-60.1-40.8177.100000113.3A163 L164 S165 I170 L171A163-G167 PolarHBondContact O-N 3.06Å; L164-G167 PolarHBondContact O-N 2.83Å; S165-G167 VanDerWaalsContact C-N 3.33Å; S165-G167 PolarHBondContact O-N 3.46Å; G167-I170 PolarHBondContact O-N 3.46Å; G167-L171 VanDerWaalsContact O-CB 3.29Å; G167-L171 WeakPolarHBondContact O-CB 3.25Å; G167-L171 PolarHBondContact O-N 3.15Å
168I90.9Very high86.4Confident43 Ų4353.6 Ų53.622%0.22131%0.311CS..Hα-helixtrans-64.7-43.2175-70.5166000110.9F124 F160 L164 S165 L166 Y172 L229F124-I168 HydrophobicContact CE1-CD1 4Å; F160-I168 HydrophobicContact CE1-CD1 4.48Å; F160-I168 HydrophobicContact CZ-CD1 3.81Å; L164-I168 HydrophobicContact CG-CD1 4.28Å; L164-I168 VanDerWaalsContact O-CG1 3.26Å; L164-I168 WeakPolarHBondContact O-CG1 3.49Å; L164-I168 PolarHBondContact O-N 3.21Å; S165-I168 PolarHBondContact O-N 3.43Å; L166-I168 PolarHBondContact O-N 2.96Å; I168-Y172 VanDerWaalsContact O-CB 3.24Å; I168-Y172 WeakPolarHBondContact O-CB 3.34Å; I168-Y172 PolarHBondContact O-N 2.89Å; I168-L229 HydrophobicContact CG2-CD1 4.49Å; I168-L229 HydrophobicContact CG2-CD2 4.32Å
169V92.7Very high88.3Confident16 Ų1652.5 Ų52.510%0.09730%0.304CS..Hα-helixtrans-64-45.2176.9168.90000111.4S165 L166 Y172 I173 L229 V230 C233S165-V169 PolarHBondContact O-N 3.39Å; S165-V169 VanDerWaalsContact O-N 3.16Å; L166-V169 PolarHBondContact O-N 3.42Å; V169-Y172 WeakPolarHBondContact O-CB 3.03Å; V169-Y172 PolarHBondContact O-N 3.45Å; V169-I173 HydrophobicContact CG1-CD1 3.84Å; V169-I173 HydrophobicContact CG1-CG1 4.49Å; V169-I173 WeakPolarHBondContact O-CG1 3.42Å; V169-I173 PolarHBondContact O-N 3.24Å; V169-L229 HydrophobicContact CG2-CB 3.78Å; V169-V230 HydrophobicContact CG1-CG2 4.41Å; V169-C233 WeakPolarHBondContact CG2-SG 3.48Å
170I94.7Very high90Very high101 Ų10147.2 Ų47.252%0.51828%0.276SS..Hα-helixtrans-61.3-48.7178.1-68.6164.8000110.2L166 G167 Y172 I173 L174L166-I170 WeakPolarHBondContact O-CB 3.31Å; L166-I170 VanDerWaalsContact O-CG1 3.25Å; L166-I170 WeakPolarHBondContact O-CG1 3.3Å; L166-I170 PolarHBondContact O-N 3.14Å; G167-I170 PolarHBondContact O-N 3.46Å; I170-Y172 VanDerWaalsContact C-N 3.3Å; I170-Y172 PolarHBondContact O-N 2.88Å; I170-I173 PolarHBondContact O-N 3.49Å; I170-L174 HydrophobicContact CG2-CD1 4.17Å; I170-L174 WeakPolarHBondContact O-CG 3.42Å; I170-L174 PolarHBondContact O-N 3.33Å
171L94.7Very high91.3Very high107 Ų10748.7 Ų48.756%0.5628%0.284SS*.Hα-helixtrans-59.1-42.9176.6179.463.6000111.6G167 I173 L174 V175G167-L171 VanDerWaalsContact O-CB 3.29Å; G167-L171 WeakPolarHBondContact O-CB 3.25Å; G167-L171 PolarHBondContact O-N 3.15Å; L171-I173 PolarHBondContact O-N 2.85Å; L171-L174 PolarHBondContact O-N 3.42Å; L171-V175 HydrophobicContact CD1-CG2 4.16Å; L171-V175 HydrophobicContact CG-CG2 4.42Å; L171-V175 WeakPolarHBondContact O-CG2 3.49Å; L171-V175 PolarHBondContact O-N 3.02Å
172Y94.8Very high92.1Very high41 Ų4151.9 Ų51.916%0.16129%0.294CS..Hα-helixtrans-61.6-43.1177.6-175.9-99.1000112I168 V169 I170 V175 C176 F196 L200 F222 V225 L229I168-Y172 VanDerWaalsContact O-CB 3.24Å; I168-Y172 WeakPolarHBondContact O-CB 3.34Å; I168-Y172 PolarHBondContact O-N 2.89Å; V169-Y172 WeakPolarHBondContact O-CB 3.03Å; V169-Y172 PolarHBondContact O-N 3.45Å; I170-Y172 VanDerWaalsContact C-N 3.3Å; I170-Y172 PolarHBondContact O-N 2.88Å; Y172-V175 PolarHBondContact O-N 3.06Å; Y172-C176 VanDerWaalsContact CE1-SG 3.52Å; Y172-C176 VanDerWaalsContact CE2-SG 3.57Å; Y172-C176 VanDerWaalsContact O-CB 3.31Å; Y172-C176 WeakPolarHBondContact O-CB 3.46Å; Y172-C176 PolarHBondContact O-N 3.03Å; Y172-C176 PolarHBondContact O-SG 3.36Å; Y172-F196 AromaticContact CD1-CE1 3.95Å; Y172-F196 HydrophobicContact CD1-CE1 3.95Å; Y172-F196 HydrophobicContact CD1-CZ 4.28Å; Y172-F196 AromaticContact CE1-CE1 3.82Å; Y172-F196 HydrophobicContact CE1-CE1 3.82Å; Y172-F196 AromaticContact CE1-CZ 3.67Å; Y172-F196 HydrophobicContact CE1-CZ 3.67Å; Y172-L200 HydrophobicContact CD1-CD1 4.29Å; Y172-L200 HydrophobicContact CE1-CD1 4.4Å; Y172-F222 PolarHBondContact OH-O 2.83Å; Y172-V225 HydrophobicContact CE2-CG1 3.87Å; Y172-V225 WeakPolarHBondContact OH-CB 3.44Å; Y172-V225 WeakPolarHBondContact OH-CG1 3.48Å; Y172-L229 HydrophobicContact CD1-CD1 3.79Å; Y172-L229 HydrophobicContact CD2-CD1 3.74Å; Y172-L229 HydrophobicContact CE1-CD1 4.32Å; Y172-L229 HydrophobicContact CE2-CD1 4.27Å; Y172-L229 HydrophobicContact CG-CD1 3.47Å; Y172-L229 VanDerWaalsContact CG-CD1 3.47Å
173I95.9Very high92.4Very high21 Ų2151.8 Ų51.811%0.10829%0.29CS..Hα-helixtrans-58.7-49.1174.4-70.7164.1000110V169 I170 L171 V175 C176 S177 F196 F197 L200V169-I173 HydrophobicContact CG1-CD1 3.84Å; V169-I173 HydrophobicContact CG1-CG1 4.49Å; V169-I173 WeakPolarHBondContact O-CG1 3.42Å; V169-I173 PolarHBondContact O-N 3.24Å; I170-I173 PolarHBondContact O-N 3.49Å; L171-I173 PolarHBondContact O-N 2.85Å; I173-V175 PolarHBondContact O-N 2.92Å; I173-C176 PolarHBondContact O-N 2.69Å; I173-S177 VanDerWaalsContact O-CB 3.28Å; I173-S177 WeakPolarHBondContact O-CB 3.29Å; I173-S177 PolarHBondContact O-N 3.1Å; I173-S177 PolarHBondContact O-OG 3.43Å; I173-F196 HydrophobicContact CB-CD1 4.26Å; I173-F196 HydrophobicContact CG1-CD1 4.11Å; I173-F196 HydrophobicContact CG1-CE1 4.32Å; I173-F196 HydrophobicContact CG2-CD1 4.24Å; I173-F197 HydrophobicContact CD1-CD2 4.39Å; I173-L200 HydrophobicContact CG1-CD1 3.92Å
174L96.8Very high92.6Very high69 Ų6949.2 Ų49.236%0.36127%0.265SS..Hα-helixtrans-61.5-46.6-179-64.5172.3000112.2I170 L171 S177 A178 Y189 L193I170-L174 HydrophobicContact CG2-CD1 4.17Å; I170-L174 WeakPolarHBondContact O-CG 3.42Å; I170-L174 PolarHBondContact O-N 3.33Å; L171-L174 PolarHBondContact O-N 3.42Å; L174-S177 PolarHBondContact O-N 3.05Å; L174-A178 PolarHBondContact O-N 3.49Å; L174-A178 VanDerWaalsContact O-N 3.14Å; L174-Y189 VanDerWaalsContact CD2-OH 3.29Å; L174-Y189 WeakPolarHBondContact CD2-OH 3.45Å; L174-Y189 PolarHBondContact O-OH 2.66Å; L174-L193 HydrophobicContact CD2-CD1 3.83Å
175V96.1Very high92.5Very high82 Ų8256.9 Ų56.950%0.49729%0.288SS..Hα-helixtrans-64.8-46.7179.4173.20000111.2L171 Y172 I173 S177 A178 V179L171-V175 HydrophobicContact CD1-CG2 4.16Å; L171-V175 HydrophobicContact CG-CG2 4.42Å; L171-V175 WeakPolarHBondContact O-CG2 3.49Å; L171-V175 PolarHBondContact O-N 3.02Å; Y172-V175 PolarHBondContact O-N 3.06Å; I173-V175 PolarHBondContact O-N 2.92Å; V175-S177 VanDerWaalsContact C-N 3.32Å; V175-S177 PolarHBondContact O-N 3.27Å; V175-A178 WeakPolarHBondContact O-CB 3.29Å; V175-A178 PolarHBondContact O-N 3.33Å; V175-V179 WeakPolarHBondContact O-CG2 3.44Å; V175-V179 PolarHBondContact O-N 3.34Å; V175-V179 VanDerWaalsContact O-N 3.12Å
176C94.7Very high92.6Very high3 Ų362.3 Ų62.32%0.0231%0.309CS..Hα-helixtrans-65.3-38.1179.3-67.40000111.7Y172 I173 A178 V179 F180 F196Y172-C176 VanDerWaalsContact CE1-SG 3.52Å; Y172-C176 VanDerWaalsContact CE2-SG 3.57Å; Y172-C176 VanDerWaalsContact O-CB 3.31Å; Y172-C176 WeakPolarHBondContact O-CB 3.46Å; Y172-C176 PolarHBondContact O-N 3.03Å; Y172-C176 PolarHBondContact O-SG 3.36Å; I173-C176 PolarHBondContact O-N 2.69Å; C176-A178 VanDerWaalsContact C-N 3.28Å; C176-A178 PolarHBondContact O-N 3.11Å; C176-V179 WeakPolarHBondContact O-CA 3.28Å; C176-V179 WeakPolarHBondContact O-CB 2.92Å; C176-V179 PolarHBondContact O-N 3.18Å; C176-F180 WeakPolarHBondContact O-CD2 3.44Å; C176-F180 PolarHBondContact O-N 3.45Å; C176-F196 HydrophobicContact CB-CD1 3.85Å; C176-F196 HydrophobicContact CB-CD2 4.09Å; C176-F196 HydrophobicContact CB-CE1 3.38Å; C176-F196 HydrophobicContact CB-CE2 3.69Å; C176-F196 HydrophobicContact CB-CG 4.17Å; C176-F196 HydrophobicContact CB-CZ 3.3Å
177S95.5Very high92.6Very high0 Ų059.8 Ų59.80%029%0.294CS..Hα-helixtrans-59.6-40175.8-55.40000111.6I173 L174 V175 F180 M181 A192 L193I173-S177 VanDerWaalsContact O-CB 3.28Å; I173-S177 WeakPolarHBondContact O-CB 3.29Å; I173-S177 PolarHBondContact O-N 3.1Å; I173-S177 PolarHBondContact O-OG 3.43Å; L174-S177 PolarHBondContact O-N 3.05Å; V175-S177 VanDerWaalsContact C-N 3.32Å; V175-S177 PolarHBondContact O-N 3.27Å; S177-F180 PolarHBondContact O-N 2.83Å; S177-M181 WeakPolarHBondContact O-CB 3.49Å; S177-M181 PolarHBondContact O-N 2.98Å; S177-A192 WeakPolarHBondContact O-CB 3.46Å; S177-L193 VanDerWaalsContact OG-CA 3.29Å; S177-L193 WeakPolarHBondContact OG-CA 3.46Å
178A95.4Very high92.7Very high35 Ų3562.3 Ų62.329%0.28930%0.3SS..Hα-helixtrans-64.4-38.5173.200000112.4L174 V175 C176 M181 M182 Y189L174-A178 PolarHBondContact O-N 3.49Å; L174-A178 VanDerWaalsContact O-N 3.14Å; V175-A178 WeakPolarHBondContact O-CB 3.29Å; V175-A178 PolarHBondContact O-N 3.33Å; C176-A178 VanDerWaalsContact C-N 3.28Å; C176-A178 PolarHBondContact O-N 3.11Å; A178-M181 PolarHBondContact O-N 3.14Å; A178-M182 WeakPolarHBondContact O-CG 3.34Å; A178-M182 PolarHBondContact O-N 2.96Å; A178-Y189 HydrophobicContact CB-CE2 4.03Å
179V93.7Very high92.9Very high32 Ų3264.6 Ų64.619%0.19431%0.306CS..Hα-helixtrans-64.3-45.5175176.80000111.8V175 C176 M181 M182 W183V175-V179 WeakPolarHBondContact O-CG2 3.44Å; V175-V179 PolarHBondContact O-N 3.34Å; V175-V179 VanDerWaalsContact O-N 3.12Å; C176-V179 WeakPolarHBondContact O-CA 3.28Å; C176-V179 WeakPolarHBondContact O-CB 2.92Å; C176-V179 PolarHBondContact O-N 3.18Å; V179-M181 PolarHBondContact O-N 3.37Å; V179-M182 HydrophobicContact CG2-CE 4.4Å; V179-M182 WeakPolarHBondContact O-CB 3.32Å; V179-M182 PolarHBondContact O-N 2.62Å; V179-M182 VanDerWaalsContact O-N 3.14Å; V179-W183 HydrophobicContact CG1-CD2 4.2Å; V179-W183 HydrophobicContact CG1-CH2 4.08Å; V179-W183 HydrophobicContact CG1-CZ2 3.71Å; V179-W183 HydrophobicContact CG1-CZ3 4.48Å; V179-W183 PolarHBondContact O-N 3.29Å
180F91.8Very high93.1Very high3 Ų370.9 Ų70.91%0.01333%0.333CS..Hα-helixtrans-65.9-37.2177.6-85.4-80.9000112.6C176 S177 M182 W183 E184 A192 F195 F196 Y223C176-F180 WeakPolarHBondContact O-CD2 3.44Å; C176-F180 PolarHBondContact O-N 3.45Å; S177-F180 PolarHBondContact O-N 2.83Å; F180-M182 VanDerWaalsContact C-N 3.28Å; F180-M182 PolarHBondContact O-N 3.18Å; F180-W183 AromaticContact CD1-CE3 3.95Å; F180-W183 HydrophobicContact CD1-CE3 3.95Å; F180-W183 HydrophobicContact CD1-CZ3 4.28Å; F180-W183 AromaticContact CE1-CE3 3.91Å; F180-W183 HydrophobicContact CE1-CE3 3.91Å; F180-W183 AromaticContact CE1-CZ3 3.85Å; F180-W183 HydrophobicContact CE1-CZ3 3.85Å; F180-W183 HydrophobicContact CE2-CZ3 4.39Å; F180-W183 HydrophobicContact CG-CE3 4.48Å; F180-W183 HydrophobicContact CZ-CE3 4.4Å; F180-W183 AromaticContact CZ-CZ3 3.9Å; F180-W183 HydrophobicContact CZ-CZ3 3.9Å; F180-W183 PolarHBondContact O-N 3.4Å; F180-E184 PolarHBondContact O-N 3.1Å; F180-A192 HydrophobicContact CB-CB 4.47Å; F180-F195 HydrophobicContact CD1-CE1 4.05Å; F180-F195 HydrophobicContact CE1-CE1 4.09Å; F180-F196 AromaticContact CD2-CD2 3.84Å; F180-F196 HydrophobicContact CD2-CD2 3.84Å; F180-F196 HydrophobicContact CD2-CE2 4.16Å; F180-F196 AromaticContact CE2-CD2 3.69Å; F180-F196 HydrophobicContact CE2-CD2 3.69Å; F180-F196 AromaticContact CE2-CE2 3.63Å; F180-F196 HydrophobicContact CE2-CE2 3.63Å; F180-Y223 VanDerWaalsContact CE1-OH 3.23Å; F180-Y223 WeakPolarHBondContact CE1-OH 3.31Å; F180-Y223 HydrophobicContact CE2-CE1 4.31Å; F180-Y223 AromaticContact CZ-CE1 3.98Å; F180-Y223 HydrophobicContact CZ-CE1 3.98Å; F180-Y223 HydrophobicContact CZ-CE2 4.12Å; F180-Y223 AromaticContact CZ-CZ 3.51Å; F180-Y223 WeakPolarHBondContact CZ-OH 3.4Å
181M91.9Very high93.1Very high78 Ų7867.7 Ų67.738%0.38432%0.318SS..Hα-helixtrans-61.5-36.9171.9-175-135.3160.300111.7S177 A178 V179 E184 W187 A192S177-M181 WeakPolarHBondContact O-CB 3.49Å; S177-M181 PolarHBondContact O-N 2.98Å; A178-M181 PolarHBondContact O-N 3.14Å; V179-M181 PolarHBondContact O-N 3.37Å; M181-E184 CarbonylContact O-C 3.59Å; M181-W187 WeakPolarHBondContact CG-O 3.24Å; M181-A192 HydrophobicContact CB-CB 4.02Å
182M91.5Very high93.1Very high139 Ų13962.6 Ų62.669%0.68529%0.291SS*.Hα-helixtrans-68.5-37.3175.3-76.5-171.7-88.300113A178 V179 F180A178-M182 WeakPolarHBondContact O-CG 3.34Å; A178-M182 PolarHBondContact O-N 2.96Å; V179-M182 HydrophobicContact CG2-CE 4.4Å; V179-M182 WeakPolarHBondContact O-CB 3.32Å; V179-M182 PolarHBondContact O-N 2.62Å; V179-M182 VanDerWaalsContact O-N 3.14Å; F180-M182 VanDerWaalsContact C-N 3.28Å; F180-M182 PolarHBondContact O-N 3.18Å
183W90.9Very high93.2Very high61 Ų6162.6 Ų62.623%0.23129%0.294CS..Hα-helixtrans-72.2-43.2177.3-70.2-15.2000112.7V179 F180 F215 I218 F222V179-W183 HydrophobicContact CG1-CD2 4.2Å; V179-W183 HydrophobicContact CG1-CH2 4.08Å; V179-W183 HydrophobicContact CG1-CZ2 3.71Å; V179-W183 HydrophobicContact CG1-CZ3 4.48Å; V179-W183 PolarHBondContact O-N 3.29Å; F180-W183 AromaticContact CD1-CE3 3.95Å; F180-W183 HydrophobicContact CD1-CE3 3.95Å; F180-W183 HydrophobicContact CD1-CZ3 4.28Å; F180-W183 AromaticContact CE1-CE3 3.91Å; F180-W183 HydrophobicContact CE1-CE3 3.91Å; F180-W183 AromaticContact CE1-CZ3 3.85Å; F180-W183 HydrophobicContact CE1-CZ3 3.85Å; F180-W183 HydrophobicContact CE2-CZ3 4.39Å; F180-W183 HydrophobicContact CG-CE3 4.48Å; F180-W183 HydrophobicContact CZ-CE3 4.4Å; F180-W183 AromaticContact CZ-CZ3 3.9Å; F180-W183 HydrophobicContact CZ-CZ3 3.9Å; F180-W183 PolarHBondContact O-N 3.4Å; W183-F215 HydrophobicContact CB-CB 4.26Å; W183-F215 HydrophobicContact CB-CD1 4.46Å; W183-F215 HydrophobicContact CB-CD2 3.84Å; W183-F215 HydrophobicContact CB-CE2 4.36Å; W183-F215 HydrophobicContact CB-CG 3.96Å; W183-F215 HydrophobicContact CD2-CB 4.37Å; W183-F215 HydrophobicContact CE3-CB 4.16Å; W183-F215 HydrophobicContact CG-CB 4.46Å; W183-F215 HydrophobicContact CG-CD1 4.29Å; W183-F215 HydrophobicContact CG-CD2 4.49Å; W183-F215 HydrophobicContact CG-CG 4.19Å; W183-F215 VanDerWaalsContact O-CE2 3.26Å; W183-F215 WeakPolarHBondContact O-CE2 3.46Å; W183-I218 HydrophobicContact CH2-CB 4.23Å; W183-I218 HydrophobicContact CH2-CG2 3.55Å; W183-I218 HydrophobicContact CZ2-CG2 3.65Å; W183-I218 HydrophobicContact CZ3-CG2 4.4Å; W183-F222 AromaticContact CH2-CD2 3.91Å; W183-F222 HydrophobicContact CH2-CD2 3.91Å; W183-F222 AromaticContact CH2-CE2 3.63Å; W183-F222 HydrophobicContact CH2-CE2 3.63Å; W183-F222 HydrophobicContact CH2-CZ 4.23Å; W183-F222 HydrophobicContact CZ2-CE2 4.2Å; W183-F222 HydrophobicContact CZ2-CZ 4.5Å
184E89Confident93.2Very high21 Ų2165 Ų6510%0.09830%0.302CS..SBendtrans-108.278.5-175.8-15863-122.300109.1F180 M181 R186 W187 E211 S212F180-E184 PolarHBondContact O-N 3.1Å; M181-E184 CarbonylContact O-C 3.59Å; E184-R186 HydrophobicContact CG-CG 3.93Å; E184-R186 PolarHBondContact O-N 3.04Å; E184-R186 IonicContact OE1-CZ 3.61Å; E184-R186 IonicContact OE1-NE 3.45Å; E184-R186 PolarHBondContact OE1-NE 3.28Å; E184-R186 IonicContact OE1-NH2 2.76Å; E184-W187 HydrophobicContact CB-CD2 3.75Å; E184-W187 HydrophobicContact CB-CE3 3.78Å; E184-W187 HydrophobicContact CB-CG 4.16Å; E184-W187 HydrophobicContact CB-CZ3 4.28Å; E184-W187 HydrophobicContact CG-CD2 3.59Å; E184-W187 HydrophobicContact CG-CE3 4.05Å; E184-W187 HydrophobicContact CG-CG 3.95Å; E184-W187 HydrophobicContact CG-CH2 4.47Å; E184-W187 HydrophobicContact CG-CZ2 4.03Å; E184-W187 HydrophobicContact CG-CZ3 4.47Å; E184-W187 WeakPolarHBondContact O-CB 3.18Å; E184-W187 PolarHBondContact O-N 3.48Å; E184-E211 PolarHBondContact OE2-N 3.06Å; E184-S212 PolarHBondContact OE2-OG 3.38Å
185R82.4Confident93.1Very high237 Ų23761.8 Ų61.889%0.89429%0.285SS*.THydrogen-bonded Turntrans-56.8-17.7-171.1-162.2179.8-176.7165.12.6115W187R185-W187 VanDerWaalsContact C-N 3.3Å
186R88.2Confident93Very high115 Ų11557.9 Ų57.943%0.43426%0.261SS..THydrogen-bonded Turntrans-78.4-10.7175.859.8176.6179.4119.38.3113.6E184 V209 E211E184-R186 HydrophobicContact CG-CG 3.93Å; E184-R186 PolarHBondContact O-N 3.04Å; E184-R186 IonicContact OE1-CZ 3.61Å; E184-R186 IonicContact OE1-NE 3.45Å; E184-R186 PolarHBondContact OE1-NE 3.28Å; E184-R186 IonicContact OE1-NH2 2.76Å; R186-V209 PolarHBondContact NH2-O 3.32Å; R186-E211 IonicContact CZ-OE1 3.48Å; R186-E211 IonicContact CZ-OE2 3.81Å; R186-E211 IonicContact NE-OE1 3.07Å; R186-E211 IonicContact NE-OE2 3.42Å; R186-E211 PolarHBondContact NE-OE2 2.91Å; R186-E211 IonicContact NH1-OE1 3.76Å; R186-E211 PolarHBondContact NH1-OE1 2.72Å; R186-E211 IonicContact NH1-OE2 3.79Å; R186-E211 VanDerWaalsContact NH2-CB 3.31Å; R186-E211 VanDerWaalsContact NH2-CD 3.28Å; R186-E211 IonicContact NH2-OE1 2.64Å; R186-E211 PolarHBondContact NH2-OE1 3.1Å; R186-E211 IonicContact NH2-OE2 3.73Å
187W90.3Very high93.1Very high17 Ų1762.8 Ų62.86%0.06428%0.282CS..SBendtrans-94.1133.4179.1-65.4-10.9000111.5M181 E184 R185 T191 A192 F195 V208 V209 P210M181-W187 WeakPolarHBondContact CG-O 3.24Å; E184-W187 HydrophobicContact CB-CD2 3.75Å; E184-W187 HydrophobicContact CB-CE3 3.78Å; E184-W187 HydrophobicContact CB-CG 4.16Å; E184-W187 HydrophobicContact CB-CZ3 4.28Å; E184-W187 HydrophobicContact CG-CD2 3.59Å; E184-W187 HydrophobicContact CG-CE3 4.05Å; E184-W187 HydrophobicContact CG-CG 3.95Å; E184-W187 HydrophobicContact CG-CH2 4.47Å; E184-W187 HydrophobicContact CG-CZ2 4.03Å; E184-W187 HydrophobicContact CG-CZ3 4.47Å; E184-W187 WeakPolarHBondContact O-CB 3.18Å; E184-W187 PolarHBondContact O-N 3.48Å; R185-W187 VanDerWaalsContact C-N 3.3Å; W187-T191 HydrophobicContact CB-CG2 4.43Å; W187-T191 HydrophobicContact CG-CG2 4.24Å; W187-A192 HydrophobicContact CE3-CB 4.31Å; W187-F195 AromaticContact CH2-CD1 3.86Å; W187-F195 HydrophobicContact CH2-CD1 3.86Å; W187-F195 HydrophobicContact CH2-CE1 4.02Å; W187-F195 HydrophobicContact CH2-CG 4.11Å; W187-F195 HydrophobicContact CH2-CZ 4.44Å; W187-F195 AromaticContact CZ3-CD1 3.62Å; W187-F195 HydrophobicContact CZ3-CD1 3.62Å; W187-F195 AromaticContact CZ3-CE1 4Å; W187-F195 HydrophobicContact CZ3-CE1 4Å; W187-F195 HydrophobicContact CZ3-CG 4.14Å; W187-V208 HydrophobicContact CD2-CG1 4.38Å; W187-V208 HydrophobicContact CH2-CG1 3.92Å; W187-V208 HydrophobicContact CZ2-CG1 3.5Å; W187-V209 WeakPolarHBondContact CZ2-O 3.49Å; W187-P210 HydrophobicContact CH2-CB 4.26Å
188D94.1Very high93.1Very high87 Ų8762.9 Ų62.947%0.46528%0.283SS..  trans-68.5154.4160.448.6-74.4000111F190 T191 A192D188-F190 PolarHBondContact O-N 3.06Å; D188-T191 PolarHBondContact O-N 3.32Å; D188-T191 PolarHBondContact OD1-OG1 2.8Å; D188-T191 VanDerWaalsContact OD2-CB 3.23Å; D188-T191 WeakPolarHBondContact OD2-CB 3.36Å; D188-T191 PolarHBondContact OD2-N 3.15Å; D188-T191 PolarHBondContact OD2-OG1 3.41Å; D188-A192 PolarHBondContact O-N 3.23Å
189Y96.3Very high93Very high92 Ų9261.2 Ų61.236%0.36127%0.269SS..Hα-helixtrans-58-36-177.7176.2-100.2000112.5L174 A178 A192 L193L174-Y189 VanDerWaalsContact CD2-OH 3.29Å; L174-Y189 WeakPolarHBondContact CD2-OH 3.45Å; L174-Y189 PolarHBondContact O-OH 2.66Å; A178-Y189 HydrophobicContact CB-CE2 4.03Å; Y189-A192 PolarHBondContact O-N 2.94Å; Y189-L193 HydrophobicContact CE1-CD1 4.01Å; Y189-L193 WeakPolarHBondContact O-CB 3.15Å; Y189-L193 PolarHBondContact O-N 3.29Å
190F96.1Very high93Very high148 Ų14860 Ų6065%0.64926%0.262SS*.Hα-helixtrans-69.5-41.6178.9-172.5-98.3000111.9D188 A192 L193 Y194D188-F190 PolarHBondContact O-N 3.06Å; F190-A192 VanDerWaalsContact C-N 3.32Å; F190-A192 PolarHBondContact O-N 2.91Å; F190-L193 PolarHBondContact O-N 2.93Å; F190-Y194 WeakPolarHBondContact O-CB 3.47Å; F190-Y194 PolarHBondContact O-N 3.47Å
191T95.4Very high93.1Very high34 Ų3461.8 Ų61.821%0.20927%0.274CS..Hα-helixtrans-59.8-41.9171.5-670000111.9W187 D188 Y194 F195 V208W187-T191 HydrophobicContact CB-CG2 4.43Å; W187-T191 HydrophobicContact CG-CG2 4.24Å; D188-T191 PolarHBondContact O-N 3.32Å; D188-T191 PolarHBondContact OD1-OG1 2.8Å; D188-T191 VanDerWaalsContact OD2-CB 3.23Å; D188-T191 WeakPolarHBondContact OD2-CB 3.36Å; D188-T191 PolarHBondContact OD2-N 3.15Å; D188-T191 PolarHBondContact OD2-OG1 3.41Å; T191-Y194 PolarHBondContact O-N 3.41Å; T191-F195 WeakPolarHBondContact O-CB 3.29Å; T191-F195 PolarHBondContact O-N 3.48Å; T191-V208 HydrophobicContact CG2-CG1 3.68Å; T191-V208 HydrophobicContact CG2-CG2 4.07Å
192A95.3Very high93.2Very high0 Ų061 Ų610%027%0.274CS..Hα-helixtrans-64.8-38.8174.600000112.4S177 F180 M181 W187 D188 Y189 F190 F195 F196S177-A192 WeakPolarHBondContact O-CB 3.46Å; F180-A192 HydrophobicContact CB-CB 4.47Å; M181-A192 HydrophobicContact CB-CB 4.02Å; W187-A192 HydrophobicContact CE3-CB 4.31Å; D188-A192 PolarHBondContact O-N 3.23Å; Y189-A192 PolarHBondContact O-N 2.94Å; F190-A192 VanDerWaalsContact C-N 3.32Å; F190-A192 PolarHBondContact O-N 2.91Å; A192-F195 PolarHBondContact O-N 2.77Å; A192-F196 WeakPolarHBondContact O-CB 3.37Å; A192-F196 PolarHBondContact O-N 3.26Å
193L96.4Very high93.4Very high40 Ų4058.4 Ų58.421%0.20926%0.262CS..Hα-helixtrans-65.1-47.7175.5-174.8158.2000112.1L174 S177 Y189 F190 F195 F196 F197L174-L193 HydrophobicContact CD2-CD1 3.83Å; S177-L193 VanDerWaalsContact OG-CA 3.29Å; S177-L193 WeakPolarHBondContact OG-CA 3.46Å; Y189-L193 HydrophobicContact CE1-CD1 4.01Å; Y189-L193 WeakPolarHBondContact O-CB 3.15Å; Y189-L193 PolarHBondContact O-N 3.29Å; F190-L193 PolarHBondContact O-N 2.93Å; L193-F195 VanDerWaalsContact C-N 3.33Å; L193-F195 PolarHBondContact O-N 3.12Å; L193-F196 PolarHBondContact O-N 2.88Å; L193-F197 WeakPolarHBondContact O-CB 3.36Å; L193-F197 PolarHBondContact O-N 3.27Å
194Y96.2Very high93.5Very high73 Ų7355.8 Ų55.829%0.28625%0.254SS..Hα-helixtrans-55.2-51.3174.4169-101.8000110.3F190 T191 F196 F197 I198 F205 D207 V208F190-Y194 WeakPolarHBondContact O-CB 3.47Å; F190-Y194 PolarHBondContact O-N 3.47Å; T191-Y194 PolarHBondContact O-N 3.41Å; Y194-F196 PolarHBondContact O-N 3.38Å; Y194-F197 PolarHBondContact O-N 3.49Å; Y194-I198 HydrophobicContact CD1-CD1 4.24Å; Y194-I198 HydrophobicContact CD2-CG2 4.08Å; Y194-I198 HydrophobicContact CE1-CD1 3.77Å; Y194-I198 HydrophobicContact CE2-CG2 3.74Å; Y194-I198 WeakPolarHBondContact O-CG1 3.1Å; Y194-I198 WeakPolarHBondContact O-CG2 3.3Å; Y194-I198 PolarHBondContact O-N 2.9Å; Y194-F205 WeakPolarHBondContact OH-CD2 3.47Å; Y194-D207 WeakPolarHBondContact CE1-OD2 3.27Å; Y194-D207 PolarHBondContact OH-OD2 2.88Å; Y194-V208 HydrophobicContact CD1-CG2 4.28Å; Y194-V208 HydrophobicContact CE1-CG2 4.21Å
195F94.3Very high93.6Very high0 Ų061 Ų610%028%0.277CS..Hα-helixtrans-56.5-47.7177.4170.1-115.3000112.8Y87 F180 W187 T191 A192 L193 I198 S199 V208 V209 P210 Y223Y87-F195 HydrophobicContact CE1-CD2 4.47Å; Y87-F195 AromaticContact CE1-CE2 3.85Å; Y87-F195 HydrophobicContact CE1-CE2 3.85Å; Y87-F195 AromaticContact CZ-CE2 3.77Å; Y87-F195 WeakPolarHBondContact OH-CE2 3.32Å; F180-F195 HydrophobicContact CD1-CE1 4.05Å; F180-F195 HydrophobicContact CE1-CE1 4.09Å; W187-F195 AromaticContact CH2-CD1 3.86Å; W187-F195 HydrophobicContact CH2-CD1 3.86Å; W187-F195 HydrophobicContact CH2-CE1 4.02Å; W187-F195 HydrophobicContact CH2-CG 4.11Å; W187-F195 HydrophobicContact CH2-CZ 4.44Å; W187-F195 AromaticContact CZ3-CD1 3.62Å; W187-F195 HydrophobicContact CZ3-CD1 3.62Å; W187-F195 AromaticContact CZ3-CE1 4Å; W187-F195 HydrophobicContact CZ3-CE1 4Å; W187-F195 HydrophobicContact CZ3-CG 4.14Å; T191-F195 WeakPolarHBondContact O-CB 3.29Å; T191-F195 PolarHBondContact O-N 3.48Å; A192-F195 PolarHBondContact O-N 2.77Å; L193-F195 VanDerWaalsContact C-N 3.33Å; L193-F195 PolarHBondContact O-N 3.12Å; F195-I198 WeakPolarHBondContact O-CG1 3.34Å; F195-S199 VanDerWaalsContact O-CB 3.28Å; F195-S199 WeakPolarHBondContact O-CB 3.45Å; F195-S199 PolarHBondContact O-N 3.01Å; F195-S199 VanDerWaalsContact O-N 3.1Å; F195-S199 PolarHBondContact O-OG 3.18Å; F195-V208 HydrophobicContact CB-CB 4.43Å; F195-V208 HydrophobicContact CB-CG1 4.01Å; F195-V208 HydrophobicContact CD2-CG1 4.5Å; F195-V208 WeakPolarHBondContact CD2-O 3.41Å; F195-V208 VanDerWaalsContact CE2-O 3.26Å; F195-V208 WeakPolarHBondContact CE2-O 3.35Å; F195-V208 HydrophobicContact CG-CG1 4.41Å; F195-V209 HydrophobicContact CE2-CG1 4.35Å; F195-P210 VanDerWaalsContact CZ-CD 3.43Å; F195-P210 HydrophobicContact CZ-CG 4.32Å; F195-Y223 HydrophobicContact CE1-CE1 4.39Å; F195-Y223 WeakPolarHBondContact CE1-OH 3.44Å; F195-Y223 HydrophobicContact CZ-CE1 4.47Å; F195-Y223 WeakPolarHBondContact CZ-OH 3.29Å
196F94.8Very high93.9Very high0 Ų050.4 Ų50.40%024%0.24CC..Hα-helixtrans-69-37.6-177.8-159.9-105.5000111.9Y172 I173 C176 F180 A192 L193 Y194 S199 L200 Y223Y172-F196 AromaticContact CD1-CE1 3.95Å; Y172-F196 HydrophobicContact CD1-CE1 3.95Å; Y172-F196 HydrophobicContact CD1-CZ 4.28Å; Y172-F196 AromaticContact CE1-CE1 3.82Å; Y172-F196 HydrophobicContact CE1-CE1 3.82Å; Y172-F196 AromaticContact CE1-CZ 3.67Å; Y172-F196 HydrophobicContact CE1-CZ 3.67Å; I173-F196 HydrophobicContact CB-CD1 4.26Å; I173-F196 HydrophobicContact CG1-CD1 4.11Å; I173-F196 HydrophobicContact CG1-CE1 4.32Å; I173-F196 HydrophobicContact CG2-CD1 4.24Å; C176-F196 HydrophobicContact CB-CD1 3.85Å; C176-F196 HydrophobicContact CB-CD2 4.09Å; C176-F196 HydrophobicContact CB-CE1 3.38Å; C176-F196 HydrophobicContact CB-CE2 3.69Å; C176-F196 HydrophobicContact CB-CG 4.17Å; C176-F196 HydrophobicContact CB-CZ 3.3Å; F180-F196 AromaticContact CD2-CD2 3.84Å; F180-F196 HydrophobicContact CD2-CD2 3.84Å; F180-F196 HydrophobicContact CD2-CE2 4.16Å; F180-F196 AromaticContact CE2-CD2 3.69Å; F180-F196 HydrophobicContact CE2-CD2 3.69Å; F180-F196 AromaticContact CE2-CE2 3.63Å; F180-F196 HydrophobicContact CE2-CE2 3.63Å; A192-F196 WeakPolarHBondContact O-CB 3.37Å; A192-F196 PolarHBondContact O-N 3.26Å; L193-F196 PolarHBondContact O-N 2.88Å; Y194-F196 PolarHBondContact O-N 3.38Å; F196-S199 PolarHBondContact O-N 3.38Å; F196-L200 HydrophobicContact CD1-CD1 3.94Å; F196-L200 HydrophobicContact CD1-CG 4.15Å; F196-L200 HydrophobicContact CE1-CD1 3.39Å; F196-L200 HydrophobicContact CE1-CD2 4.47Å; F196-L200 HydrophobicContact CE1-CG 3.84Å; F196-L200 HydrophobicContact CZ-CD1 3.99Å; F196-L200 HydrophobicContact CZ-CD2 4.32Å; F196-L200 HydrophobicContact CZ-CG 4.15Å; F196-L200 PolarHBondContact O-N 3.33Å; F196-Y223 HydrophobicContact CD2-CD1 4.34Å; F196-Y223 AromaticContact CD2-CE1 3.9Å; F196-Y223 HydrophobicContact CD2-CE1 3.9Å; F196-Y223 AromaticContact CE2-CD1 3.88Å; F196-Y223 HydrophobicContact CE2-CD1 3.88Å; F196-Y223 AromaticContact CE2-CE1 3.83Å; F196-Y223 HydrophobicContact CE2-CE1 3.83Å
197F95.6Very high94Very high106 Ų10649.6 Ų49.647%0.46525%0.245SC..Hα-helixtrans-65-48.4175.9178.5-97.6000112.8I173 L193 Y194 S199 L200 S201I173-F197 HydrophobicContact CD1-CD2 4.39Å; L193-F197 WeakPolarHBondContact O-CB 3.36Å; L193-F197 PolarHBondContact O-N 3.27Å; Y194-F197 PolarHBondContact O-N 3.49Å; F197-S199 PolarHBondContact O-N 3.44Å; F197-L200 PolarHBondContact O-N 2.94Å; F197-S201 WeakPolarHBondContact O-CB 3.38Å; F197-S201 PolarHBondContact O-N 2.67Å; F197-S201 PolarHBondContact O-OG 3.39Å
198I95.1Very high94Very high3 Ų350 Ų502%0.01525%0.249CC..Hα-helixtrans-64.4-28.3177.965.2177.8000112Y194 F195 S201 T202 I203 G204 F205Y194-I198 HydrophobicContact CD1-CD1 4.24Å; Y194-I198 HydrophobicContact CD2-CG2 4.08Å; Y194-I198 HydrophobicContact CE1-CD1 3.77Å; Y194-I198 HydrophobicContact CE2-CG2 3.74Å; Y194-I198 WeakPolarHBondContact O-CG1 3.1Å; Y194-I198 WeakPolarHBondContact O-CG2 3.3Å; Y194-I198 PolarHBondContact O-N 2.9Å; F195-I198 WeakPolarHBondContact O-CG1 3.34Å; I198-S201 WeakPolarHBondContact CA-OG 3.32Å; I198-S201 PolarHBondContact O-OG 2.89Å; I198-T202 PolarHBondContact O-N 3Å; I198-I203 PolarHBondContact O-N 3.22Å; I198-G204 PolarHBondContact O-N 2.81Å; I198-F205 HydrophobicContact CG2-CD2 4.2Å
199S93.8Very high93.7Very high0 Ų047 Ų470%023%0.234CC..Hα-helixtrans-74.8-46.6177.8-57.60000111.4I85 Y87 F195 F196 F197 T202I85-S199 WeakPolarHBondContact CD1-O 3.1Å; I85-S199 WeakPolarHBondContact CG1-O 3.39Å; Y87-S199 WeakPolarHBondContact OH-CB 3.47Å; Y87-S199 PolarHBondContact OH-OG 3.22Å; F195-S199 VanDerWaalsContact O-CB 3.28Å; F195-S199 WeakPolarHBondContact O-CB 3.45Å; F195-S199 PolarHBondContact O-N 3.01Å; F195-S199 VanDerWaalsContact O-N 3.1Å; F195-S199 PolarHBondContact O-OG 3.18Å; F196-S199 PolarHBondContact O-N 3.38Å; F197-S199 PolarHBondContact O-N 3.44Å; S199-T202 PolarHBondContact O-N 2.92Å
200L94.3Very high93.2Very high6 Ų642.8 Ų42.83%0.03122%0.218CC..Hα-helixtrans-73.2-30.2178.7-72.6-163.9000113.8Y172 I173 F196 F197 T202 L227 V230Y172-L200 HydrophobicContact CD1-CD1 4.29Å; Y172-L200 HydrophobicContact CE1-CD1 4.4Å; I173-L200 HydrophobicContact CG1-CD1 3.92Å; F196-L200 HydrophobicContact CD1-CD1 3.94Å; F196-L200 HydrophobicContact CD1-CG 4.15Å; F196-L200 HydrophobicContact CE1-CD1 3.39Å; F196-L200 HydrophobicContact CE1-CD2 4.47Å; F196-L200 HydrophobicContact CE1-CG 3.84Å; F196-L200 HydrophobicContact CZ-CD1 3.99Å; F196-L200 HydrophobicContact CZ-CD2 4.32Å; F196-L200 HydrophobicContact CZ-CG 4.15Å; F196-L200 PolarHBondContact O-N 3.33Å; F197-L200 PolarHBondContact O-N 2.94Å; L200-T202 PolarHBondContact O-N 3.14Å; L200-L227 HydrophobicContact CD2-CD2 4.3Å; L200-L227 HydrophobicContact CD2-CG 4.19Å; L200-L227 WeakPolarHBondContact O-CD2 3.47Å; L200-V230 HydrophobicContact CB-CG2 4.32Å
201S93.2Very high92.3Very high40 Ų4041.2 Ų41.228%0.2821%0.213SC..THydrogen-bonded Turntrans-74.8-1.1171.557.80000112.9F197 I198 I203F197-S201 WeakPolarHBondContact O-CB 3.38Å; F197-S201 PolarHBondContact O-N 2.67Å; F197-S201 PolarHBondContact O-OG 3.39Å; I198-S201 WeakPolarHBondContact CA-OG 3.32Å; I198-S201 PolarHBondContact O-OG 2.89Å; S201-I203 PolarHBondContact O-N 2.79Å; S201-I203 VanDerWaalsContact O-N 3.1Å; S201-I203 WeakPolarHBondContact OG-CD1 3.21Å; S201-I203 WeakPolarHBondContact OG-CG1 3.49Å
202T93.6Very high91.6Very high61 Ų6141.1 Ų41.137%0.37421%0.213SC..THydrogen-bonded Turntrans56.122.3-177.358.90000113.7I85 I198 S199 L200 L227I85-T202 HydrophobicContact CG1-CG2 4.33Å; I198-T202 PolarHBondContact O-N 3Å; S199-T202 PolarHBondContact O-N 2.92Å; L200-T202 PolarHBondContact O-N 3.14Å; T202-L227 HydrophobicContact CG2-CD2 3.74Å
203I95.5Very high90.7Very high86 Ų8642.3 Ų42.344%0.44122%0.219SC..  trans-75.3-47.4174.6-64.2172.5000109.7I198 S201 F205I198-I203 PolarHBondContact O-N 3.22Å; S201-I203 PolarHBondContact O-N 2.79Å; S201-I203 VanDerWaalsContact O-N 3.1Å; S201-I203 WeakPolarHBondContact OG-CD1 3.21Å; S201-I203 WeakPolarHBondContact OG-CG1 3.49Å; I203-F205 HydrophobicContact CG2-CD1 4.05Å; I203-F205 HydrophobicContact CG2-CD2 3.92Å; I203-F205 HydrophobicContact CG2-CE1 3.7Å; I203-F205 HydrophobicContact CG2-CE2 3.57Å; I203-F205 HydrophobicContact CG2-CG 4.15Å; I203-F205 HydrophobicContact CG2-CZ 3.45Å; I203-F205 VanDerWaalsContact CG2-CZ 3.45Å
204G92.9Very high90Very high5 Ų544.6 Ų44.65%0.05224%0.235CC..  trans54.857.1170.300000115.3Y87 I198 G206Y87-G204 VanDerWaalsContact CA-O 3.25Å; Y87-G204 WeakPolarHBondContact CA-O 3.3Å; I198-G204 PolarHBondContact O-N 2.81Å; G204-G206 PolarHBondContact O-N 3.3Å
205F91.8Very high89.4Confident132 Ų13244.7 Ų44.758%0.57924%0.237SC*.  trans-61.1-31.1177.2-68.8-54.6000114.1Y194 I198 I203 D207Y194-F205 WeakPolarHBondContact OH-CD2 3.47Å; I198-F205 HydrophobicContact CG2-CD2 4.2Å; I203-F205 HydrophobicContact CG2-CD1 4.05Å; I203-F205 HydrophobicContact CG2-CD2 3.92Å; I203-F205 HydrophobicContact CG2-CE1 3.7Å; I203-F205 HydrophobicContact CG2-CE2 3.57Å; I203-F205 HydrophobicContact CG2-CG 4.15Å; I203-F205 HydrophobicContact CG2-CZ 3.45Å; I203-F205 VanDerWaalsContact CG2-CZ 3.45Å; F205-D207 PolarHBondContact O-N 3.23Å
206G88.9Confident88.9Confident13 Ų1344.8 Ų44.813%0.13424%0.238CC..  trans73.511.7175.600000115.8Y87 G204Y87-G206 WeakPolarHBondContact O-CA 3.34Å; G204-G206 PolarHBondContact O-N 3.3Å
207D90Very high88.4Confident99 Ų9947.5 Ų47.553%0.52925%0.252SS..SBendtrans-66-37.7169.657.2-27.3000112.1Y194 F205Y194-D207 WeakPolarHBondContact CE1-OD2 3.27Å; Y194-D207 PolarHBondContact OH-OD2 2.88Å; F205-D207 PolarHBondContact O-N 3.23Å
208V89.9Confident88.1Confident26 Ų2646.3 Ų46.316%0.15825%0.25CC..SBendtrans-118.2118.9175.4-177.40000108.9W187 T191 Y194 F195W187-V208 HydrophobicContact CD2-CG1 4.38Å; W187-V208 HydrophobicContact CH2-CG1 3.92Å; W187-V208 HydrophobicContact CZ2-CG1 3.5Å; T191-V208 HydrophobicContact CG2-CG1 3.68Å; T191-V208 HydrophobicContact CG2-CG2 4.07Å; Y194-V208 HydrophobicContact CD1-CG2 4.28Å; Y194-V208 HydrophobicContact CE1-CG2 4.21Å; F195-V208 HydrophobicContact CB-CB 4.43Å; F195-V208 HydrophobicContact CB-CG1 4.01Å; F195-V208 HydrophobicContact CD2-CG1 4.5Å; F195-V208 WeakPolarHBondContact CD2-O 3.41Å; F195-V208 VanDerWaalsContact CE2-O 3.26Å; F195-V208 WeakPolarHBondContact CE2-O 3.35Å; F195-V208 HydrophobicContact CG-CG1 4.41Å
209V88.5Confident87.8Confident23 Ų2346.2 Ų46.214%0.13925%0.249CC..  trans-146.2146.4176.4-68.30000110.6Y87 R186 W187 F195 E211Y87-V209 HydrophobicContact CD1-CG1 3.94Å; Y87-V209 HydrophobicContact CD2-CG1 4.14Å; Y87-V209 HydrophobicContact CE1-CG1 4.31Å; Y87-V209 HydrophobicContact CG-CG1 3.83Å; R186-V209 PolarHBondContact NH2-O 3.32Å; W187-V209 WeakPolarHBondContact CZ2-O 3.49Å; F195-V209 HydrophobicContact CE2-CG1 4.35Å; V209-E211 PolarHBondContact O-N 3.31Å
210P85.5Confident87.7Confident3 Ų349 Ų492%0.01926%0.261CS..  trans-58.8133.1178.723.2-32.9000110.3W187 F195 T216W187-P210 HydrophobicContact CH2-CB 4.26Å; F195-P210 VanDerWaalsContact CZ-CD 3.43Å; F195-P210 HydrophobicContact CZ-CG 4.32Å; P210-T216 HydrophobicContact CG-CG2 4.29Å; P210-T216 VanDerWaalsContact CG-OG1 3.3Å; P210-T216 WeakPolarHBondContact CG-OG1 3.43Å
211E78.3Confident87.6Confident116 Ų11652.1 Ų52.154%0.54228%0.282SS..SBendtrans-79.4-38.3178.7-95.9169.4-157.100110.2E184 R186 V209 I213E184-E211 PolarHBondContact OE2-N 3.06Å; R186-E211 IonicContact CZ-OE1 3.48Å; R186-E211 IonicContact CZ-OE2 3.81Å; R186-E211 IonicContact NE-OE1 3.07Å; R186-E211 IonicContact NE-OE2 3.42Å; R186-E211 PolarHBondContact NE-OE2 2.91Å; R186-E211 IonicContact NH1-OE1 3.76Å; R186-E211 PolarHBondContact NH1-OE1 2.72Å; R186-E211 IonicContact NH1-OE2 3.79Å; R186-E211 VanDerWaalsContact NH2-CB 3.31Å; R186-E211 VanDerWaalsContact NH2-CD 3.28Å; R186-E211 IonicContact NH2-OE1 2.64Å; R186-E211 PolarHBondContact NH2-OE1 3.1Å; R186-E211 IonicContact NH2-OE2 3.73Å; V209-E211 PolarHBondContact O-N 3.31Å; E211-I213 PolarHBondContact O-N 2.71Å
212S80.6Confident87.6Confident32 Ų3253.6 Ų53.622%0.22428%0.283CS..  trans-72.4111.917955.60000110.7E184 T214 F215 T216E184-S212 PolarHBondContact OE2-OG 3.38Å; S212-T214 PolarHBondContact O-N 3.4Å; S212-F215 PolarHBondContact O-N 2.65Å; S212-F215 WeakPolarHBondContact OG-CB 3.04Å; S212-F215 WeakPolarHBondContact OG-CD2 3.4Å; S212-T216 PolarHBondContact O-N 2.77Å; S212-T216 PolarHBondContact O-OG1 2.91Å
213I75.7Confident87.5Confident25 Ų2551 Ų5113%0.12827%0.267CS..Hα-helixtrans-68.2-28-177.5-147.1157.2000112.7C69 L72 G73 E211 T216 L217C69-I213 VanDerWaalsContact O-CD1 3.29Å; C69-I213 WeakPolarHBondContact O-CD1 3.34Å; L72-I213 HydrophobicContact CB-CD1 3.66Å; L72-I213 HydrophobicContact CB-CG1 3.71Å; L72-I213 HydrophobicContact CB-CG2 4.13Å; L72-I213 HydrophobicContact CD1-CG2 3.72Å; G73-I213 VanDerWaalsContact N-CD1 3.28Å; E211-I213 PolarHBondContact O-N 2.71Å; I213-T216 VanDerWaalsContact O-CB 3.3Å; I213-T216 WeakPolarHBondContact O-CB 3.08Å; I213-T216 PolarHBondContact O-N 3.16Å; I213-L217 PolarHBondContact O-N 3.26Å
214T81.7Confident87.4Confident88 Ų8847.5 Ų47.554%0.5425%0.249SC..Hα-helixtrans-66.2-49.5175.5-49.20000111.5S212 T216 L217 I218S212-T214 PolarHBondContact O-N 3.4Å; T214-T216 PolarHBondContact O-N 3.05Å; T214-L217 PolarHBondContact O-N 3.3Å; T214-I218 HydrophobicContact CG2-CD1 4.34Å; T214-I218 WeakPolarHBondContact O-CG1 3.3Å; T214-I218 PolarHBondContact O-N 3.34Å
215F83.8Confident87.5Confident74 Ų7449.5 Ų49.533%0.32526%0.26SS..Hα-helixtrans-67.5-29177.3-57.9-36.7000111.7W183 S212 L217 I218 G219W183-F215 HydrophobicContact CB-CB 4.26Å; W183-F215 HydrophobicContact CB-CD1 4.46Å; W183-F215 HydrophobicContact CB-CD2 3.84Å; W183-F215 HydrophobicContact CB-CE2 4.36Å; W183-F215 HydrophobicContact CB-CG 3.96Å; W183-F215 HydrophobicContact CD2-CB 4.37Å; W183-F215 HydrophobicContact CE3-CB 4.16Å; W183-F215 HydrophobicContact CG-CB 4.46Å; W183-F215 HydrophobicContact CG-CD1 4.29Å; W183-F215 HydrophobicContact CG-CD2 4.49Å; W183-F215 HydrophobicContact CG-CG 4.19Å; W183-F215 VanDerWaalsContact O-CE2 3.26Å; W183-F215 WeakPolarHBondContact O-CE2 3.46Å; S212-F215 PolarHBondContact O-N 2.65Å; S212-F215 WeakPolarHBondContact OG-CB 3.04Å; S212-F215 WeakPolarHBondContact OG-CD2 3.4Å; F215-L217 PolarHBondContact O-N 2.87Å; F215-I218 HydrophobicContact CD1-CD1 4.39Å; F215-I218 PolarHBondContact O-N 2.94Å; F215-G219 PolarHBondContact O-N 2.87Å
216T83.2Confident87.6Confident2 Ų243.2 Ų43.21%0.01223%0.233CC..Hα-helixtrans-58.3-45.4172.3-57.10000112.5F76 P210 S212 I213 T214 G219 F220F76-T216 HydrophobicContact CB-CG2 4.02Å; F76-T216 HydrophobicContact CD1-CG2 4.46Å; F76-T216 HydrophobicContact CD2-CG2 2.93Å; F76-T216 HydrophobicContact CE2-CG2 3.17Å; F76-T216 HydrophobicContact CG-CG2 3.57Å; F76-T216 HydrophobicContact CZ-CG2 3.97Å; P210-T216 HydrophobicContact CG-CG2 4.29Å; P210-T216 VanDerWaalsContact CG-OG1 3.3Å; P210-T216 WeakPolarHBondContact CG-OG1 3.43Å; S212-T216 PolarHBondContact O-N 2.77Å; S212-T216 PolarHBondContact O-OG1 2.91Å; I213-T216 VanDerWaalsContact O-CB 3.3Å; I213-T216 WeakPolarHBondContact O-CB 3.08Å; I213-T216 PolarHBondContact O-N 3.16Å; T214-T216 PolarHBondContact O-N 3.05Å; T216-G219 PolarHBondContact O-N 3.45Å; T216-F220 PolarHBondContact O-N 3.16Å
217L83.9Confident87.9Confident58 Ų5843.3 Ų43.330%0.30423%0.23SC..Hα-helixtrans-67.5-42.8176.8-71-179.4000112.5L72 V75 I213 T214 F215 G219 F220 P221L72-L217 HydrophobicContact CD1-CD1 4.37Å; L72-L217 HydrophobicContact CD2-CD1 3.27Å; L72-L217 HydrophobicContact CD2-CD2 4.43Å; L72-L217 HydrophobicContact CD2-CG 4.21Å; L72-L217 HydrophobicContact CG-CD1 4.32Å; V75-L217 HydrophobicContact CB-CD2 4.23Å; V75-L217 HydrophobicContact CG1-CD2 3.67Å; I213-L217 PolarHBondContact O-N 3.26Å; T214-L217 PolarHBondContact O-N 3.3Å; F215-L217 PolarHBondContact O-N 2.87Å; L217-G219 PolarHBondContact O-N 3.47Å; L217-F220 WeakPolarHBondContact O-CB 3.39Å; L217-F220 PolarHBondContact O-N 3.48Å; L217-F220 VanDerWaalsContact O-N 3.09Å; L217-P221 WeakPolarHBondContact O-CD 3.32Å
218I89.4Confident88Confident81 Ų8138.6 Ų38.642%0.41521%0.205SC..Hα-helixtrans-63.1-30.4177.5-61.2170.5000110.1W183 T214 F215 P221 F222W183-I218 HydrophobicContact CH2-CB 4.23Å; W183-I218 HydrophobicContact CH2-CG2 3.55Å; W183-I218 HydrophobicContact CZ2-CG2 3.65Å; W183-I218 HydrophobicContact CZ3-CG2 4.4Å; T214-I218 HydrophobicContact CG2-CD1 4.34Å; T214-I218 WeakPolarHBondContact O-CG1 3.3Å; T214-I218 PolarHBondContact O-N 3.34Å; F215-I218 HydrophobicContact CD1-CD1 4.39Å; F215-I218 PolarHBondContact O-N 2.94Å; I218-P221 WeakPolarHBondContact O-CD 3.32Å; I218-F222 VanDerWaalsContact O-CD2 3.3Å; I218-F222 WeakPolarHBondContact O-CD2 3.31Å
219G90.1Very high88.1Confident0 Ų038 Ų380%020%0.201CC..Hα-helixtrans-70.1-23174.100000115F215 T216 L217 F222 Y223F215-G219 PolarHBondContact O-N 2.87Å; T216-G219 PolarHBondContact O-N 3.45Å; L217-G219 PolarHBondContact O-N 3.47Å; G219-F222 WeakPolarHBondContact O-CA 3.33Å; G219-F222 WeakPolarHBondContact O-CB 3.28Å; G219-F222 PolarHBondContact O-N 3.2Å; G219-Y223 WeakPolarHBondContact O-CD2 3.37Å; G219-Y223 PolarHBondContact O-N 3.42Å; G219-Y223 VanDerWaalsContact O-N 3.07Å
220F91.1Very high88.3Confident58 Ų5838.6 Ų38.625%0.25421%0.205SC..Hα-helixtrans-55.6-50.3-176.5177.5-102.6000113.7S79 T83 M112 T216 L217 F222 Y223 V224S79-F220 WeakPolarHBondContact OG-CD2 3.47Å; T83-F220 HydrophobicContact CG2-CE2 4.06Å; M112-F220 HydrophobicContact CE-CZ 4.45Å; T216-F220 PolarHBondContact O-N 3.16Å; L217-F220 WeakPolarHBondContact O-CB 3.39Å; L217-F220 PolarHBondContact O-N 3.48Å; L217-F220 VanDerWaalsContact O-N 3.09Å; F220-F222 VanDerWaalsContact C-N 3.29Å; F220-F222 PolarHBondContact O-N 3.43Å; F220-Y223 PolarHBondContact O-N 3.47Å; F220-V224 HydrophobicContact CD1-CG2 4.32Å; F220-V224 HydrophobicContact CD2-CG2 4.43Å; F220-V224 HydrophobicContact CE1-CG2 3.88Å; F220-V224 HydrophobicContact CE2-CG2 4.01Å; F220-V224 HydrophobicContact CZ-CG2 3.71Å; F220-V224 WeakPolarHBondContact O-CG2 3.4Å; F220-V224 PolarHBondContact O-N 2.93Å
221P91.9Very high88.6Confident73 Ų7339.2 Ų39.247%0.47421%0.209SC..Hα-helixtrans-56.4-37.5172.7-26.834.7000114.4L217 I218 Y223 V224 V225L217-P221 WeakPolarHBondContact O-CD 3.32Å; I218-P221 WeakPolarHBondContact O-CD 3.32Å; P221-Y223 VanDerWaalsContact C-N 3.34Å; P221-Y223 PolarHBondContact O-N 2.86Å; P221-V224 PolarHBondContact O-N 3.44Å; P221-V225 WeakPolarHBondContact O-CG2 3.25Å; P221-V225 PolarHBondContact O-N 3.21Å
222F92.7Very high89.1Confident70 Ų7034.6 Ų34.631%0.30719%0.188SC..Hα-helixtrans-65.6-37.3178.1-70.6-96.5000111.8Y172 W183 I218 G219 F220 G226Y172-F222 PolarHBondContact OH-O 2.83Å; W183-F222 AromaticContact CH2-CD2 3.91Å; W183-F222 HydrophobicContact CH2-CD2 3.91Å; W183-F222 AromaticContact CH2-CE2 3.63Å; W183-F222 HydrophobicContact CH2-CE2 3.63Å; W183-F222 HydrophobicContact CH2-CZ 4.23Å; W183-F222 HydrophobicContact CZ2-CE2 4.2Å; W183-F222 HydrophobicContact CZ2-CZ 4.5Å; I218-F222 VanDerWaalsContact O-CD2 3.3Å; I218-F222 WeakPolarHBondContact O-CD2 3.31Å; G219-F222 WeakPolarHBondContact O-CA 3.33Å; G219-F222 WeakPolarHBondContact O-CB 3.28Å; G219-F222 PolarHBondContact O-N 3.2Å; F220-F222 VanDerWaalsContact C-N 3.29Å; F220-F222 PolarHBondContact O-N 3.43Å; F222-G226 PolarHBondContact O-N 3.11Å
223Y92.7Very high89.5Confident8 Ų833.4 Ų33.43%0.03118%0.18CC..Hα-helixtrans-67.5-44.7173.4-60.1-57.5000111.9F180 F195 F196 G219 F220 P221 V225 G226 L227F180-Y223 VanDerWaalsContact CE1-OH 3.23Å; F180-Y223 WeakPolarHBondContact CE1-OH 3.31Å; F180-Y223 HydrophobicContact CE2-CE1 4.31Å; F180-Y223 AromaticContact CZ-CE1 3.98Å; F180-Y223 HydrophobicContact CZ-CE1 3.98Å; F180-Y223 HydrophobicContact CZ-CE2 4.12Å; F180-Y223 AromaticContact CZ-CZ 3.51Å; F180-Y223 WeakPolarHBondContact CZ-OH 3.4Å; F195-Y223 HydrophobicContact CE1-CE1 4.39Å; F195-Y223 WeakPolarHBondContact CE1-OH 3.44Å; F195-Y223 HydrophobicContact CZ-CE1 4.47Å; F195-Y223 WeakPolarHBondContact CZ-OH 3.29Å; F196-Y223 HydrophobicContact CD2-CD1 4.34Å; F196-Y223 AromaticContact CD2-CE1 3.9Å; F196-Y223 HydrophobicContact CD2-CE1 3.9Å; F196-Y223 AromaticContact CE2-CD1 3.88Å; F196-Y223 HydrophobicContact CE2-CD1 3.88Å; F196-Y223 AromaticContact CE2-CE1 3.83Å; F196-Y223 HydrophobicContact CE2-CE1 3.83Å; G219-Y223 WeakPolarHBondContact O-CD2 3.37Å; G219-Y223 PolarHBondContact O-N 3.42Å; G219-Y223 VanDerWaalsContact O-N 3.07Å; F220-Y223 PolarHBondContact O-N 3.47Å; P221-Y223 VanDerWaalsContact C-N 3.34Å; P221-Y223 PolarHBondContact O-N 2.86Å; Y223-V225 VanDerWaalsContact C-N 3.32Å; Y223-V225 PolarHBondContact O-N 3.43Å; Y223-G226 PolarHBondContact O-N 3.45Å; Y223-G226 VanDerWaalsContact O-N 3.14Å; Y223-L227 WeakPolarHBondContact O-CB 3.46Å; Y223-L227 WeakPolarHBondContact O-CG 3.21Å; Y223-L227 PolarHBondContact O-N 3.25Å
224V93.5Very high90.2Very high11 Ų1136.9 Ų36.97%0.06720%0.198CC..Hα-helixtrans-60.1-43.8179.3175.10000111M112 L115 L119 F220 P221 S228M112-V224 HydrophobicContact CE-CG2 4.21Å; L115-V224 HydrophobicContact CD2-CG1 4.14Å; L115-V224 HydrophobicContact CG-CG1 4.46Å; L119-V224 HydrophobicContact CD1-CG1 3.46Å; L119-V224 VanDerWaalsContact CD1-CG1 3.46Å; F220-V224 HydrophobicContact CD1-CG2 4.32Å; F220-V224 HydrophobicContact CD2-CG2 4.43Å; F220-V224 HydrophobicContact CE1-CG2 3.88Å; F220-V224 HydrophobicContact CE2-CG2 4.01Å; F220-V224 HydrophobicContact CZ-CG2 3.71Å; F220-V224 WeakPolarHBondContact O-CG2 3.4Å; F220-V224 PolarHBondContact O-N 2.93Å; P221-V224 PolarHBondContact O-N 3.44Å; V224-S228 WeakPolarHBondContact O-CB 3.35Å; V224-S228 PolarHBondContact O-N 3.31Å; V224-S228 PolarHBondContact O-OG 3.45Å
225V93.4Very high90.4Very high47 Ų4735.6 Ų35.629%0.28519%0.188SC..Hα-helixtrans-63.5-43.5174.7171.40000111.2L123 Y172 P221 Y223 S228 L229L123-V225 HydrophobicContact CD1-CG1 4.01Å; Y172-V225 HydrophobicContact CE2-CG1 3.87Å; Y172-V225 WeakPolarHBondContact OH-CB 3.44Å; Y172-V225 WeakPolarHBondContact OH-CG1 3.48Å; P221-V225 WeakPolarHBondContact O-CG2 3.25Å; P221-V225 PolarHBondContact O-N 3.21Å; Y223-V225 VanDerWaalsContact C-N 3.32Å; Y223-V225 PolarHBondContact O-N 3.43Å; V225-S228 VanDerWaalsContact O-CB 3.29Å; V225-S228 WeakPolarHBondContact O-CB 3.39Å; V225-S228 PolarHBondContact O-N 2.94Å; V225-L229 WeakPolarHBondContact O-CG 3.26Å; V225-L229 PolarHBondContact O-N 3.13Å
226G94.5Very high90.5Very high0 Ų033.1 Ų33.10%018%0.179CC..Hα-helixtrans-63.3-44.9178.500000113.4F222 Y223 S228 L229 V230F222-G226 PolarHBondContact O-N 3.11Å; Y223-G226 PolarHBondContact O-N 3.45Å; Y223-G226 VanDerWaalsContact O-N 3.14Å; G226-S228 PolarHBondContact O-N 2.92Å; G226-L229 WeakPolarHBondContact O-CB 3.37Å; G226-L229 PolarHBondContact O-N 3.08Å; G226-L229 VanDerWaalsContact O-N 3.1Å; G226-V230 WeakPolarHBondContact O-CG2 3.41Å; G226-V230 PolarHBondContact O-N 2.97Å
227L94.5Very high90.8Very high16 Ų1636.3 Ų36.38%0.08420%0.195CC..Hα-helixtrans-61.5-35.1174.5-68.9172.5000111.2T83 V116 L200 T202 Y223 L229 V230 S231T83-L227 HydrophobicContact CG2-CD1 3.83Å; V116-L227 HydrophobicContact CG1-CB 4.4Å; V116-L227 WeakPolarHBondContact CG1-O 3.19Å; V116-L227 HydrophobicContact CG2-CB 4.18Å; L200-L227 HydrophobicContact CD2-CD2 4.3Å; L200-L227 HydrophobicContact CD2-CG 4.19Å; L200-L227 WeakPolarHBondContact O-CD2 3.47Å; T202-L227 HydrophobicContact CG2-CD2 3.74Å; Y223-L227 WeakPolarHBondContact O-CB 3.46Å; Y223-L227 WeakPolarHBondContact O-CG 3.21Å; Y223-L227 PolarHBondContact O-N 3.25Å; L227-L229 VanDerWaalsContact C-N 3.34Å; L227-L229 PolarHBondContact O-N 2.78Å; L227-V230 PolarHBondContact O-N 3.3Å; L227-S231 WeakPolarHBondContact O-CB 3.27Å; L227-S231 PolarHBondContact O-N 3.35Å
228S93Very high91Very high0 Ų038.5 Ų38.50%020%0.204CC..Hα-helixtrans-63.8-38.3174.7-55.70000112.3V116 L119 V224 V225 G226 V232V116-S228 PolarHBondContact O-OG 3.49Å; L119-S228 VanDerWaalsContact CB-OG 3.31Å; L119-S228 WeakPolarHBondContact CB-OG 3.32Å; V224-S228 WeakPolarHBondContact O-CB 3.35Å; V224-S228 PolarHBondContact O-N 3.31Å; V224-S228 PolarHBondContact O-OG 3.45Å; V225-S228 VanDerWaalsContact O-CB 3.29Å; V225-S228 WeakPolarHBondContact O-CB 3.39Å; V225-S228 PolarHBondContact O-N 2.94Å; G226-S228 PolarHBondContact O-N 2.92Å; S228-V232 VanDerWaalsContact O-CG2 3.3Å; S228-V232 WeakPolarHBondContact O-CG2 3.48Å; S228-V232 PolarHBondContact O-N 2.69Å
229L92.3Very high90.8Very high12 Ų1235.4 Ų35.46%0.06319%0.191CC..Hα-helixtrans-69.9-40.8174.8-62.2173.9000111.7L123 F124 I168 V169 Y172 V225 G226 L227 V232 C233L123-L229 HydrophobicContact CD1-CD2 4.26Å; F124-L229 HydrophobicContact CD2-CD2 4.24Å; F124-L229 HydrophobicContact CE2-CD2 3.47Å; F124-L229 VanDerWaalsContact CE2-CD2 3.47Å; F124-L229 HydrophobicContact CZ-CD2 4.07Å; I168-L229 HydrophobicContact CG2-CD1 4.49Å; I168-L229 HydrophobicContact CG2-CD2 4.32Å; V169-L229 HydrophobicContact CG2-CB 3.78Å; Y172-L229 HydrophobicContact CD1-CD1 3.79Å; Y172-L229 HydrophobicContact CD2-CD1 3.74Å; Y172-L229 HydrophobicContact CE1-CD1 4.32Å; Y172-L229 HydrophobicContact CE2-CD1 4.27Å; Y172-L229 HydrophobicContact CG-CD1 3.47Å; Y172-L229 VanDerWaalsContact CG-CD1 3.47Å; V225-L229 WeakPolarHBondContact O-CG 3.26Å; V225-L229 PolarHBondContact O-N 3.13Å; G226-L229 WeakPolarHBondContact O-CB 3.37Å; G226-L229 PolarHBondContact O-N 3.08Å; G226-L229 VanDerWaalsContact O-N 3.1Å; L227-L229 VanDerWaalsContact C-N 3.34Å; L227-L229 PolarHBondContact O-N 2.78Å; L229-V232 PolarHBondContact O-N 2.76Å; L229-C233 PolarHBondContact O-N 2.8Å
230V93.2Very high90.6Very high37 Ų3741.5 Ų41.522%0.22422%0.217CC..Hα-helixtrans-62.1-44.2175.71740000111.1V169 L200 G226 L227 V232 C233 I234V169-V230 HydrophobicContact CG1-CG2 4.41Å; L200-V230 HydrophobicContact CB-CG2 4.32Å; G226-V230 WeakPolarHBondContact O-CG2 3.41Å; G226-V230 PolarHBondContact O-N 2.97Å; L227-V230 PolarHBondContact O-N 3.3Å; V230-V232 VanDerWaalsContact C-N 3.33Å; V230-V232 PolarHBondContact O-N 3.13Å; V230-C233 WeakPolarHBondContact O-CB 3.15Å; V230-C233 PolarHBondContact O-N 2.79Å; V230-C233 VanDerWaalsContact O-N 3.13Å; V230-I234 HydrophobicContact CG1-CD1 4Å; V230-I234 HydrophobicContact CG1-CG1 4.48Å; V230-I234 WeakPolarHBondContact O-CG1 3.13Å; V230-I234 PolarHBondContact O-N 2.62Å
231S90.8Very high90.6Very high16 Ų1642.6 Ų42.611%0.11223%0.228CC..Hα-helixtrans-57.5-43.5175.2166.20000112.2N117 L227 C233 I234 N235N117-S231 PolarHBondContact OD1-OG 3.14Å; L227-S231 WeakPolarHBondContact O-CB 3.27Å; L227-S231 PolarHBondContact O-N 3.35Å; S231-C233 VanDerWaalsContact C-N 3.34Å; S231-C233 PolarHBondContact O-N 3.01Å; S231-I234 PolarHBondContact O-N 2.55Å; S231-N235 PolarHBondContact O-N 2.83Å; S231-N235 PolarHBondContact O-ND2 3.39Å; S231-N235 VanDerWaalsContact O-ND2 3.11Å
232V88.4Confident90.4Very high18 Ų1843.8 Ų43.811%0.10923%0.227CC..Hα-helixtrans-62.5-42.8175.91780000111.4G120 F124 S228 L229 V230 I234 N235 V236G120-V232 VanDerWaalsContact C-CG2 3.41Å; F124-V232 HydrophobicContact CD1-CG1 4.13Å; F124-V232 HydrophobicContact CD2-CB 3.7Å; F124-V232 HydrophobicContact CD2-CG1 3.5Å; F124-V232 HydrophobicContact CD2-CG2 3.49Å; F124-V232 VanDerWaalsContact CD2-CG2 3.49Å; F124-V232 HydrophobicContact CE1-CG1 4.15Å; F124-V232 HydrophobicContact CE2-CB 3.46Å; F124-V232 VanDerWaalsContact CE2-CB 3.46Å; F124-V232 HydrophobicContact CE2-CG1 3.5Å; F124-V232 VanDerWaalsContact CE2-CG1 3.5Å; F124-V232 HydrophobicContact CE2-CG2 3.67Å; F124-V232 HydrophobicContact CG-CB 4.5Å; F124-V232 HydrophobicContact CG-CG1 3.81Å; F124-V232 HydrophobicContact CG-CG2 4.42Å; F124-V232 HydrophobicContact CZ-CB 4.12Å; F124-V232 HydrophobicContact CZ-CG1 3.84Å; S228-V232 VanDerWaalsContact O-CG2 3.3Å; S228-V232 WeakPolarHBondContact O-CG2 3.48Å; S228-V232 PolarHBondContact O-N 2.69Å; L229-V232 PolarHBondContact O-N 2.76Å; V230-V232 VanDerWaalsContact C-N 3.33Å; V230-V232 PolarHBondContact O-N 3.13Å; V232-I234 VanDerWaalsContact C-N 3.33Å; V232-I234 PolarHBondContact O-N 3.38Å; V232-N235 PolarHBondContact O-N 3.35Å; V232-V236 HydrophobicContact CG1-CG2 4.23Å; V232-V236 WeakPolarHBondContact O-CG2 3.44Å; V232-V236 PolarHBondContact O-N 3.48Å
233C88.7Confident90.1Very high8 Ų846.4 Ų46.45%0.05424%0.235CC..Hα-helixtrans-58.5-44.5175.3-76.10000112.1S165 V169 L229 V230 S231 N235 V236 I237S165-C233 PolarHBondContact O-SG 3.17Å; S165-C233 PolarHBondContact OG-SG 3.16Å; V169-C233 WeakPolarHBondContact CG2-SG 3.48Å; L229-C233 PolarHBondContact O-N 2.8Å; V230-C233 WeakPolarHBondContact O-CB 3.15Å; V230-C233 PolarHBondContact O-N 2.79Å; V230-C233 VanDerWaalsContact O-N 3.13Å; S231-C233 VanDerWaalsContact C-N 3.34Å; S231-C233 PolarHBondContact O-N 3.01Å; C233-N235 VanDerWaalsContact C-N 3.32Å; C233-N235 PolarHBondContact O-N 3.4Å; C233-V236 PolarHBondContact O-N 3.02Å; C233-I237 WeakPolarHBondContact O-CB 3.45Å; C233-I237 WeakPolarHBondContact O-CD1 3.42Å; C233-I237 WeakPolarHBondContact O-CG1 3.24Å; C233-I237 PolarHBondContact O-N 2.97Å
234I90.4Very high89.9Confident98 Ų9849.4 Ų49.450%0.50326%0.257SS..Hα-helixtrans-59.4-45.9176.6-66.6167.7000110.2V230 S231 V232 V236 I237 Q238V230-I234 HydrophobicContact CG1-CD1 4Å; V230-I234 HydrophobicContact CG1-CG1 4.48Å; V230-I234 WeakPolarHBondContact O-CG1 3.13Å; V230-I234 PolarHBondContact O-N 2.62Å; S231-I234 PolarHBondContact O-N 2.55Å; V232-I234 VanDerWaalsContact C-N 3.33Å; V232-I234 PolarHBondContact O-N 3.38Å; I234-V236 PolarHBondContact O-N 3.49Å; I234-I237 PolarHBondContact O-N 2.94Å; I234-Q238 WeakPolarHBondContact O-CB 3.42Å; I234-Q238 PolarHBondContact O-N 3.47Å
235N87.1Confident89.8Confident60 Ų6052.1 Ų52.132%0.32128%0.276SS..Hα-helixtrans-63.2-40.3179.3-64.1-31000112.6S231 V232 C233 Q238 A239S231-N235 PolarHBondContact O-N 2.83Å; S231-N235 PolarHBondContact O-ND2 3.39Å; S231-N235 VanDerWaalsContact O-ND2 3.11Å; V232-N235 PolarHBondContact O-N 3.35Å; C233-N235 VanDerWaalsContact C-N 3.32Å; C233-N235 PolarHBondContact O-N 3.4Å; N235-Q238 PolarHBondContact O-N 2.84Å; N235-A239 PolarHBondContact O-N 2.84Å
236V85.7Confident89.7Confident22 Ų2255.1 Ų55.113%0.13329%0.29CS..Hα-helixtrans-67.8-41.4177.1171.80000111.2L162 V232 C233 I234 A239 K240L162-V236 HydrophobicContact CD1-CG1 4.04Å; V232-V236 HydrophobicContact CG1-CG2 4.23Å; V232-V236 WeakPolarHBondContact O-CG2 3.44Å; V232-V236 PolarHBondContact O-N 3.48Å; C233-V236 PolarHBondContact O-N 3.02Å; I234-V236 PolarHBondContact O-N 3.49Å; V236-A239 PolarHBondContact O-N 3.24Å; V236-K240 WeakPolarHBondContact O-CB 3.36Å; V236-K240 PolarHBondContact O-N 3.12Å
237I88.6Confident89.5Confident70 Ų7059.4 Ų59.436%0.35931%0.313SS..Hα-helixtrans-61.5-47.3175.4-68.9164.5000109.7L162 C233 I234 A239 K240 V241L162-I237 HydrophobicContact CD1-CD1 4.34Å; L162-I237 HydrophobicContact CD1-CG1 3.48Å; L162-I237 VanDerWaalsContact CD1-CG1 3.48Å; L162-I237 HydrophobicContact CD2-CG1 4.48Å; C233-I237 WeakPolarHBondContact O-CB 3.45Å; C233-I237 WeakPolarHBondContact O-CD1 3.42Å; C233-I237 WeakPolarHBondContact O-CG1 3.24Å; C233-I237 PolarHBondContact O-N 2.97Å; I234-I237 PolarHBondContact O-N 2.94Å; I237-A239 PolarHBondContact O-N 2.68Å; I237-K240 PolarHBondContact O-N 3.19Å; I237-V241 HydrophobicContact CG2-CG2 4.35Å; I237-V241 WeakPolarHBondContact O-CG2 3.33Å; I237-V241 PolarHBondContact O-N 3.31Å
238Q89.8Confident89.3Confident103 Ų10362.4 Ų62.448%0.48133%0.332SS..Hα-helixtrans-57.6-50.4178.6-173.1-173.7-50.400111.4I234 N235 K240 V241 E242I234-Q238 WeakPolarHBondContact O-CB 3.42Å; I234-Q238 PolarHBondContact O-N 3.47Å; N235-Q238 PolarHBondContact O-N 2.84Å; Q238-K240 VanDerWaalsContact C-N 3.27Å; Q238-K240 PolarHBondContact O-N 3.3Å; Q238-V241 PolarHBondContact O-N 3.09Å; Q238-V241 VanDerWaalsContact O-N 3.12Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.43Å; Q238-E242 PolarHBondContact NE2-OE1 2.88Å; Q238-E242 WeakPolarHBondContact O-CG 3.49Å; Q238-E242 PolarHBondContact O-N 3.08Å
239A85.4Confident89.3Confident17 Ų1765.6 Ų65.614%0.1435%0.351CS..Hα-helixtrans-59.6-38.3178.100000112.3V155 N235 V236 I237 R243V155-A239 HydrophobicContact CB-CB 4.4Å; V155-A239 HydrophobicContact CG1-CB 4.43Å; N235-A239 PolarHBondContact O-N 2.84Å; V236-A239 PolarHBondContact O-N 3.24Å; I237-A239 PolarHBondContact O-N 2.68Å; A239-R243 WeakPolarHBondContact O-CB 3.4Å; A239-R243 PolarHBondContact O-N 2.93Å; A239-R243 VanDerWaalsContact O-N 3.09Å
240K85.2Confident89.2Confident128 Ų12870 Ų7056%0.55737%0.372SS*.Hα-helixtrans-67.5-38.2177.4-172.360.7176.1174.70112.2V236 I237 Q238 S244V236-K240 WeakPolarHBondContact O-CB 3.36Å; V236-K240 PolarHBondContact O-N 3.12Å; I237-K240 PolarHBondContact O-N 3.19Å; Q238-K240 VanDerWaalsContact C-N 3.27Å; Q238-K240 PolarHBondContact O-N 3.3Å; K240-S244 WeakPolarHBondContact O-CB 3.43Å; K240-S244 PolarHBondContact O-N 3.02Å; K240-S244 VanDerWaalsContact O-N 3.12Å
241V89.8Confident89.1Confident81 Ų8174.3 Ų74.349%0.49139%0.389SS..Hα-helixtrans-66.6-48.4176.6170.80000110.4I237 Q238 R243 S244 C245I237-V241 HydrophobicContact CG2-CG2 4.35Å; I237-V241 WeakPolarHBondContact O-CG2 3.33Å; I237-V241 PolarHBondContact O-N 3.31Å; Q238-V241 PolarHBondContact O-N 3.09Å; Q238-V241 VanDerWaalsContact O-N 3.12Å; V241-R243 PolarHBondContact O-N 3.41Å; V241-S244 WeakPolarHBondContact O-CB 3.48Å; V241-S244 PolarHBondContact O-N 3.12Å; V241-S244 VanDerWaalsContact O-N 3.09Å; V241-C245 PolarHBondContact O-N 3.44Å; V241-C245 PolarHBondContact O-SG 2.97Å
242E88.8Confident89.1Confident97 Ų9778 Ų7845%0.45341%0.407SS..Hα-helixtrans-55.3-50.1177.6-72.2169.9-173.400111.2Q238 S244 C245 D246Q238-E242 WeakPolarHBondContact CG-OE1 3.43Å; Q238-E242 PolarHBondContact NE2-OE1 2.88Å; Q238-E242 WeakPolarHBondContact O-CG 3.49Å; Q238-E242 PolarHBondContact O-N 3.08Å; E242-S244 VanDerWaalsContact C-N 3.29Å; E242-S244 PolarHBondContact O-N 2.96Å; E242-C245 WeakPolarHBondContact O-CB 3.43Å; E242-C245 PolarHBondContact O-N 2.79Å; E242-C245 VanDerWaalsContact O-N 3.08Å; E242-D246 PolarHBondContact O-N 3.23Å
243R86.7Confident89.2Confident126 Ų12685 Ų8548%0.47543%0.432SS..Hα-helixtrans-61-36.2176.9-174.4173.2-179.8176.41.9113.4A239 V241 C245 L247A239-R243 WeakPolarHBondContact O-CB 3.4Å; A239-R243 PolarHBondContact O-N 2.93Å; A239-R243 VanDerWaalsContact O-N 3.09Å; V241-R243 PolarHBondContact O-N 3.41Å; R243-C245 VanDerWaalsContact C-N 3.34Å; R243-L247 WeakPolarHBondContact O-CG 3.4Å; R243-L247 PolarHBondContact O-N 3.22Å
244S88.9Confident89.3Confident70 Ų7088.2 Ų88.249%0.4945%0.449SS..Hα-helixtrans-68-37.7176.6-1670000111.6K240 V241 E242 T248K240-S244 WeakPolarHBondContact O-CB 3.43Å; K240-S244 PolarHBondContact O-N 3.02Å; K240-S244 VanDerWaalsContact O-N 3.12Å; V241-S244 WeakPolarHBondContact O-CB 3.48Å; V241-S244 PolarHBondContact O-N 3.12Å; V241-S244 VanDerWaalsContact O-N 3.09Å; E242-S244 VanDerWaalsContact C-N 3.29Å; E242-S244 PolarHBondContact O-N 2.96Å; S244-T248 PolarHBondContact O-N 3.29Å; S244-T248 PolarHBondContact O-OG1 3.09Å
245C91.5Very high89.3Confident68 Ų6885.4 Ų85.446%0.45944%0.443SS..Hα-helixtrans-65.4-45.8175.7-71.30000111.3V241 E242 R243 L247 T248 V249V241-C245 PolarHBondContact O-N 3.44Å; V241-C245 PolarHBondContact O-SG 2.97Å; E242-C245 WeakPolarHBondContact O-CB 3.43Å; E242-C245 PolarHBondContact O-N 2.79Å; E242-C245 VanDerWaalsContact O-N 3.08Å; R243-C245 VanDerWaalsContact C-N 3.34Å; C245-L247 PolarHBondContact O-N 2.91Å; C245-T248 WeakPolarHBondContact O-CB 3.33Å; C245-T248 PolarHBondContact O-N 3.19Å; C245-T248 VanDerWaalsContact O-N 3.09Å; C245-V249 WeakPolarHBondContact O-CG2 3.16Å; C245-V249 PolarHBondContact O-N 3.09Å
246D90Very high89.3Confident110 Ų11085.9 Ų85.959%0.58845%0.446SS*.Hα-helixtrans-60.2-44.2-180-68.7-22.8000112.2E242 T248 V249 E250E242-D246 PolarHBondContact O-N 3.23Å; D246-T248 VanDerWaalsContact C-N 3.29Å; D246-T248 PolarHBondContact O-N 3.41Å; D246-V249 PolarHBondContact O-N 2.89Å; D246-E250 PolarHBondContact O-N 3.39Å
247L89.8Confident89.2Confident91 Ų9190.6 Ų90.648%0.47647%0.467SS..Hα-helixtrans-61.2-40.5175.3-68.9173.2000111.6R243 C245 V249 E250 Q251R243-L247 WeakPolarHBondContact O-CG 3.4Å; R243-L247 PolarHBondContact O-N 3.22Å; C245-L247 PolarHBondContact O-N 2.91Å; L247-V249 VanDerWaalsContact C-N 3.33Å; L247-V249 PolarHBondContact O-N 3.06Å; L247-E250 PolarHBondContact O-N 3.44Å; L247-Q251 VanDerWaalsContact O-CG 3.25Å; L247-Q251 WeakPolarHBondContact O-CG 3.36Å; L247-Q251 PolarHBondContact O-N 3.5Å
248T91Very high88.9Confident79 Ų7991.7 Ų91.749%0.48548%0.476SS..Hα-helixtrans-64.6-41.6178.2-54.20000110.9S244 C245 D246 Q251 I252S244-T248 PolarHBondContact O-N 3.29Å; S244-T248 PolarHBondContact O-OG1 3.09Å; C245-T248 WeakPolarHBondContact O-CB 3.33Å; C245-T248 PolarHBondContact O-N 3.19Å; C245-T248 VanDerWaalsContact O-N 3.09Å; D246-T248 VanDerWaalsContact C-N 3.29Å; D246-T248 PolarHBondContact O-N 3.41Å; T248-Q251 PolarHBondContact O-N 3.44Å; T248-I252 HydrophobicContact CG2-CD1 4.32Å; T248-I252 VanDerWaalsContact O-CG1 3.32Å; T248-I252 WeakPolarHBondContact O-CG1 3.32Å; T248-I252 PolarHBondContact O-N 3.14Å; T248-I252 VanDerWaalsContact O-N 3.14Å
249V92.8Very high88.2Confident66 Ų6690.9 Ų90.940%0.448%0.479SS..Hα-helixtrans-65.1-43.9178169.40000111.2C245 D246 L247 Q251 I252 Y253C245-V249 WeakPolarHBondContact O-CG2 3.16Å; C245-V249 PolarHBondContact O-N 3.09Å; D246-V249 PolarHBondContact O-N 2.89Å; L247-V249 VanDerWaalsContact C-N 3.33Å; L247-V249 PolarHBondContact O-N 3.06Å; V249-Q251 PolarHBondContact O-N 2.92Å; V249-I252 WeakPolarHBondContact O-CB 3.25Å; V249-I252 PolarHBondContact O-N 3.21Å; V249-I252 VanDerWaalsContact O-N 3.15Å; V249-Y253 HydrophobicContact CG1-CD2 3.62Å; V249-Y253 HydrophobicContact CG1-CE2 3.29Å; V249-Y253 WeakPolarHBondContact O-CD2 3.4Å; V249-Y253 PolarHBondContact O-N 3.36Å
250E90.6Very high87.9Confident105 Ų10594.5 Ų94.549%0.49150%0.495SS..Hα-helixtrans-60.8-42.9176.5-172.3-179.6176.500112D246 L247 I252 Y253 L254D246-E250 PolarHBondContact O-N 3.39Å; L247-E250 PolarHBondContact O-N 3.44Å; E250-I252 VanDerWaalsContact C-N 3.28Å; E250-I252 PolarHBondContact O-N 3.01Å; E250-Y253 PolarHBondContact O-N 3.46Å; E250-L254 HydrophobicContact CG-CD1 4.19Å; E250-L254 WeakPolarHBondContact O-CG 3.41Å; E250-L254 PolarHBondContact O-N 3.15Å
251Q91Very high87.7Confident128 Ų12893.4 Ų93.460%0.59850%0.495SS*.Hα-helixtrans-62.1-35.4175.4-66.6-60.2-49.600112.3L247 T248 V249 G255L247-Q251 VanDerWaalsContact O-CG 3.25Å; L247-Q251 WeakPolarHBondContact O-CG 3.36Å; L247-Q251 PolarHBondContact O-N 3.5Å; T248-Q251 PolarHBondContact O-N 3.44Å; V249-Q251 PolarHBondContact O-N 2.92Å; Q251-G255 PolarHBondContact O-N 3.5Å
252I90.9Very high87Confident93 Ų9393 Ų9348%0.47750%0.496SS..Hα-helixtrans-66.9-44.5174.9-67.5164.3000110.8T248 V249 E250 G255 N256T248-I252 HydrophobicContact CG2-CD1 4.32Å; T248-I252 VanDerWaalsContact O-CG1 3.32Å; T248-I252 WeakPolarHBondContact O-CG1 3.32Å; T248-I252 PolarHBondContact O-N 3.14Å; T248-I252 VanDerWaalsContact O-N 3.14Å; V249-I252 WeakPolarHBondContact O-CB 3.25Å; V249-I252 PolarHBondContact O-N 3.21Å; V249-I252 VanDerWaalsContact O-N 3.15Å; E250-I252 VanDerWaalsContact C-N 3.28Å; E250-I252 PolarHBondContact O-N 3.01Å; I252-G255 PolarHBondContact O-N 3.15Å; I252-N256 WeakPolarHBondContact O-CB 3.46Å; I252-N256 PolarHBondContact O-N 3.4Å
253Y91.4Very high85.8Confident164 Ų16491 Ų9164%0.64350%0.501SS*.Hα-helixtrans-63.6-45.2177.7-77.7-68.2000112V249 E250 G255 N256 E257V249-Y253 HydrophobicContact CG1-CD2 3.62Å; V249-Y253 HydrophobicContact CG1-CE2 3.29Å; V249-Y253 WeakPolarHBondContact O-CD2 3.4Å; V249-Y253 PolarHBondContact O-N 3.36Å; E250-Y253 PolarHBondContact O-N 3.46Å; Y253-G255 PolarHBondContact O-N 2.94Å; Y253-N256 WeakPolarHBondContact O-CB 3.5Å; Y253-N256 PolarHBondContact O-N 3.29Å; Y253-N256 VanDerWaalsContact O-N 3.15Å; Y253-E257 PolarHBondContact O-N 3.38Å
254L90.8Very high84.1Confident77 Ų7790 Ų9040%0.40351%0.509SS..Hα-helixtrans-63.6-41.2176.2-69.6173.3000111.8E250 N256 E257 V258E250-L254 HydrophobicContact CG-CD1 4.19Å; E250-L254 WeakPolarHBondContact O-CG 3.41Å; E250-L254 PolarHBondContact O-N 3.15Å; L254-N256 VanDerWaalsContact C-N 3.26Å; L254-N256 PolarHBondContact O-N 3.27Å; L254-E257 PolarHBondContact O-N 3.48Å; L254-V258 WeakPolarHBondContact O-CG2 3.47Å; L254-V258 PolarHBondContact O-N 2.96Å; L254-V258 VanDerWaalsContact O-N 3.11Å
255G88.9Confident82.1Confident38 Ų3892 Ų9239%0.39252%0.518SS..Hα-helixtrans-61.3-35.2173.400000112.9Q251 I252 Y253 T259Q251-G255 PolarHBondContact O-N 3.5Å; I252-G255 PolarHBondContact O-N 3.15Å; Y253-G255 PolarHBondContact O-N 2.94Å; G255-T259 PolarHBondContact O-N 3.05Å; G255-T259 PolarHBondContact O-OG1 3.18Å
256N87.9Confident79.8Confident71 Ų7194.2 Ų94.238%0.3853%0.53SS..Hα-helixtrans-73.2-37.8177.1-168.266.9000112.6I252 Y253 L254 T259 I260I252-N256 WeakPolarHBondContact O-CB 3.46Å; I252-N256 PolarHBondContact O-N 3.4Å; Y253-N256 WeakPolarHBondContact O-CB 3.5Å; Y253-N256 PolarHBondContact O-N 3.29Å; Y253-N256 VanDerWaalsContact O-N 3.15Å; L254-N256 VanDerWaalsContact C-N 3.26Å; L254-N256 PolarHBondContact O-N 3.27Å; N256-T259 VanDerWaalsContact CA-OG1 3.32Å; N256-T259 WeakPolarHBondContact CA-OG1 3.36Å; N256-T259 PolarHBondContact O-N 2.91Å; N256-T259 PolarHBondContact O-OG1 3.11Å; N256-I260 WeakPolarHBondContact ND2-CD1 3.29Å; N256-I260 VanDerWaalsContact O-CG1 3.29Å; N256-I260 WeakPolarHBondContact O-CG1 3.47Å; N256-I260 PolarHBondContact O-N 3.13Å
257E83.3Confident77.3Confident120 Ų12095.5 Ų95.556%0.56154%0.542SS*.Hα-helixtrans-64.7-41.2174.4-73.1-168.4148.600112.2Y253 L254 T259 I260 N261Y253-E257 PolarHBondContact O-N 3.38Å; L254-E257 PolarHBondContact O-N 3.48Å; E257-T259 VanDerWaalsContact C-N 3.32Å; E257-T259 PolarHBondContact O-N 3.09Å; E257-I260 PolarHBondContact O-N 3.14Å; E257-N261 WeakPolarHBondContact O-CB 3.42Å; E257-N261 PolarHBondContact O-N 3.49Å; E257-N261 PolarHBondContact O-ND2 3.01Å
258V83.5Confident75Confident93 Ų9395.4 Ų95.456%0.56456%0.555SS**Hα-helixtrans-62.9-39.8177174.40000111.2L254 S262L254-V258 WeakPolarHBondContact O-CG2 3.47Å; L254-V258 PolarHBondContact O-N 2.96Å; L254-V258 VanDerWaalsContact O-N 3.11Å; V258-S262 VanDerWaalsContact O-CB 3.28Å; V258-S262 WeakPolarHBondContact O-CB 3.32Å; V258-S262 PolarHBondContact O-N 3.38Å; V258-S262 PolarHBondContact O-OG 3.34Å
259T75.1Confident72.3Confident87 Ų8799.5 Ų99.553%0.53457%0.573SS.*Hα-helixtrans-70.7-39.117844.40000112.7G255 N256 E257 S262 G263G255-T259 PolarHBondContact O-N 3.05Å; G255-T259 PolarHBondContact O-OG1 3.18Å; N256-T259 VanDerWaalsContact CA-OG1 3.32Å; N256-T259 WeakPolarHBondContact CA-OG1 3.36Å; N256-T259 PolarHBondContact O-N 2.91Å; N256-T259 PolarHBondContact O-OG1 3.11Å; E257-T259 VanDerWaalsContact C-N 3.32Å; E257-T259 PolarHBondContact O-N 3.09Å; T259-S262 PolarHBondContact O-N 3.43Å; T259-G263 PolarHBondContact O-N 3.12Å
260I78.3Confident69.4Low93 Ų93104.4 Ų104.448%0.47759%0.592SS.*Hα-helixtrans-62-48.6174.9-69.1168.7000110.8N256 E257 S262 G263 T264N256-I260 WeakPolarHBondContact ND2-CD1 3.29Å; N256-I260 VanDerWaalsContact O-CG1 3.29Å; N256-I260 WeakPolarHBondContact O-CG1 3.47Å; N256-I260 PolarHBondContact O-N 3.13Å; E257-I260 PolarHBondContact O-N 3.14Å; I260-S262 VanDerWaalsContact C-N 3.32Å; I260-S262 PolarHBondContact O-N 3.06Å; I260-G263 PolarHBondContact O-N 3.05Å; I260-T264 PolarHBondContact O-N 3.26Å; I260-T264 PolarHBondContact O-OG1 3.29Å
261N80.3Confident66.7Low105 Ų105105.6 Ų105.656%0.56161%0.609SS**Hα-helixtrans-67.7-33.5-178.1-68.2-18.9000112.3E257 T264 T265E257-N261 WeakPolarHBondContact O-CB 3.42Å; E257-N261 PolarHBondContact O-N 3.49Å; E257-N261 PolarHBondContact O-ND2 3.01Å; N261-T264 PolarHBondContact O-OG1 2.89Å; N261-T265 PolarHBondContact O-OG1 3.4Å; N261-T265 VanDerWaalsContact O-OG1 3.1Å
262S76.1Confident63.8Low73 Ų73108 Ų10851%0.5162%0.62SS.*Hα-helixtrans-72.1-33.7176-55.60000112.4V258 T259 I260V258-S262 VanDerWaalsContact O-CB 3.28Å; V258-S262 WeakPolarHBondContact O-CB 3.32Å; V258-S262 PolarHBondContact O-N 3.38Å; V258-S262 PolarHBondContact O-OG 3.34Å; T259-S262 PolarHBondContact O-N 3.43Å; I260-S262 VanDerWaalsContact C-N 3.32Å; I260-S262 PolarHBondContact O-N 3.06Å
263G62.5Low60.9Low55 Ų55108.9 Ų108.957%0.56764%0.642SS**Hα-helixtrans-74.9-30-179.500000114.8T259 I260 T265T259-G263 PolarHBondContact O-N 3.12Å; I260-G263 PolarHBondContact O-N 3.05Å; G263-T265 PolarHBondContact O-N 3.01Å
264T52.5Low57.8Low104 Ų104104.4 Ų104.464%0.63865%0.645SS**THydrogen-bonded Turntrans-74.5-9.9175.438.50000114.1I260 N261I260-T264 PolarHBondContact O-N 3.26Å; I260-T264 PolarHBondContact O-OG1 3.29Å; N261-T264 PolarHBondContact O-OG1 2.89Å
265T46.9Very low54.9Low111 Ų111108.2 Ų108.268%0.68167%0.666SS**THydrogen-bonded Turntrans-90.9-2.6-175.7-50.60000113.4N261 G263N261-T265 PolarHBondContact O-OG1 3.4Å; N261-T265 VanDerWaalsContact O-OG1 3.1Å; G263-T265 PolarHBondContact O-N 3.01Å
266T42.5Very low52.1Low116 Ų116114.8 Ų114.871%0.71269%0.686SS**SBendtrans-112.427.3-174.3-31.50000115.5
267T37.1Very low49.1Very low136 Ų136119.6 Ų119.683%0.83471%0.707SS**SBendtrans-14872.1157.8560000110.2
268A41.3Very low46.5Very low90 Ų90124.8 Ų124.874%0.74472%0.721SS**  trans-135.312161.900000112.8E270A268-E270 VanDerWaalsContact C-N 3.34Å; A268-E270 PolarHBondContact O-N 3.4Å
269D34.4Very low43.9Very low164 Ų164126.2 Ų126.288%0.87773%0.732SS**  trans-89.975.5165.1-71.1-33.6000108.9
270E32.1Very low41.7Very low169 Ų169128.8 Ų128.879%0.7975%0.748SS**SBend-179.9128126.9-102179.6113.200110.1A268 Q272A268-E270 VanDerWaalsContact C-N 3.34Å; A268-E270 PolarHBondContact O-N 3.4Å; E270-Q272 PolarHBondContact O-N 3.24Å
271P34.4Very low39.3Very low131 Ų131132.1 Ų132.185%0.85176%0.761SS**  trans-79.2105.9-175.231.2-30.9000109.6
272Q30.1Very low37Very low178 Ų178131 Ų13183%0.83277%0.767SS**  trans-119.7105.4161.9-66-154.8-12.900110.1E270 G274E270-Q272 PolarHBondContact O-N 3.24Å; Q272-G274 PolarHBondContact O-N 2.91Å
273A29.8Very low34.9Very low112 Ų112133.2 Ų133.293%0.92678%0.78SS**  trans-64.2120.6169.100000109.6
274G26.9Very low33.4Very low69 Ų69135.3 Ų135.371%0.71178%0.782SS**  trans140.5119.2161.700000116.1Q272Q272-G274 PolarHBondContact O-N 2.91Å
275N28.4Very low33.2Very low158 Ų158137 Ų13785%0.84579%0.786SS**  trans77.993.4155.4-70.9-1.5000121
276E30.3Very low32.7Very low175 Ų175136.7 Ų136.782%0.81878%0.78SS**  44.3113.3116.5-125.9143.595.800121.4
277Q24.9Very low32.9Very low173 Ų173136.1 Ų136.181%0.80878%0.776SS**  trans18.4125.8153.9-84.496-31.300122.2
278R29Very low33.2Very low229 Ų229135.9 Ų135.986%0.86477%0.769SS**  -159.8139.3110.9-172.8165.1-78.1-121-1.8110.7T280R278-T280 PolarHBondContact O-N 3Å
279P29.2Very low33.2Very low123 Ų123138.6 Ų138.680%0.79977%0.766SS**PPolyproline II helixtrans-79.7119.1-167.82.114.5000111.8
280T28.7Very low33.8Very low141 Ų141136 Ų13687%0.86575%0.751SS**PPolyproline II helixtrans-81.6130.8170.9-46.60000109.5R278R278-T280 PolarHBondContact O-N 3Å
281E28Very low34.3Very low162 Ų162136.9 Ų136.976%0.75775%0.753SS**PPolyproline II helixtrans-49.6137.1-173.8-76.5173.4134.200114.4
282A31.3Very low34.2Very low83 Ų83139.7 Ų139.769%0.68675%0.746SS**PPolyproline II helixtrans-57.7138.1179.800000112.5T284A282-T284 PolarHBondContact O-N 3.21Å
283P32.1Very low34.6Very low119 Ų119135.5 Ų135.577%0.77374%0.737SS**PPolyproline II helixtrans-65.1128.2-178.925.9-31.7000110.2L285P283-L285 PolarHBondContact O-N 3.16Å
284T32.1Very low35Very low99 Ų99136.3 Ų136.361%0.60773%0.732SS**  trans-64.599.9169.542.30000109.3A282 D286A282-T284 PolarHBondContact O-N 3.21Å; T284-D286 PolarHBondContact O-N 3.16Å
285L48.8Very low35.4Very low138 Ų138136.6 Ų136.672%0.72374%0.735SS**  trans-71.6116.6171.8-153.378.6000108.5P283 V287P283-L285 PolarHBondContact O-N 3.16Å; L285-V287 PolarHBondContact O-N 3.04Å
286D36Very low35.6Very low106 Ų106137.7 Ų137.757%0.56774%0.735SS**  trans-77.2108.1-178.7-148.1-8.7000108.7T284 I288 Q289T284-D286 PolarHBondContact O-N 3.16Å; D286-I288 PolarHBondContact O-N 3.38Å; D286-Q289 PolarHBondContact O-N 2.95Å
287V46.2Very low35.8Very low103 Ų103135 Ų13562%0.62473%0.733SS**G310 helixtrans-54.4-18.7-172.5176.30000113L285 Q289 I290L285-V287 PolarHBondContact O-N 3.04Å; V287-Q289 VanDerWaalsContact C-N 3.27Å; V287-Q289 PolarHBondContact O-N 3.25Å; V287-I290 HydrophobicContact CG1-CD1 4.32Å; V287-I290 WeakPolarHBondContact O-CB 3.28Å; V287-I290 PolarHBondContact O-N 2.98Å
288I43.3Very low36.6Very low132 Ų132134.6 Ų134.668%0.67774%0.736SS**G310 helixtrans-67.6-23.5-176.7-55.2178.5000112.5D286 I290 F291D286-I288 PolarHBondContact O-N 3.38Å; I288-I290 PolarHBondContact O-N 3.26Å; I288-I290 VanDerWaalsContact O-N 3.16Å; I288-F291 PolarHBondContact O-N 3.2Å
289Q42.1Very low36.9Very low146 Ų146130.9 Ų130.968%0.68273%0.732SS**G310 helixtrans-68.1-12.4177.1-74.5-163.2-6.500114.4D286 V287D286-Q289 PolarHBondContact O-N 2.95Å; V287-Q289 VanDerWaalsContact C-N 3.27Å; V287-Q289 PolarHBondContact O-N 3.25Å
290I45.7Very low36.9Very low110 Ų110132.3 Ų132.356%0.56473%0.733SS**G310 helixtrans-74.7-26.3-177.9-61.3173.7000112.1V287 I288 R292V287-I290 HydrophobicContact CG1-CD1 4.32Å; V287-I290 WeakPolarHBondContact O-CB 3.28Å; V287-I290 PolarHBondContact O-N 2.98Å; I288-I290 PolarHBondContact O-N 3.26Å; I288-I290 VanDerWaalsContact O-N 3.16Å; I290-R292 PolarHBondContact O-N 3.27Å; I290-R292 VanDerWaalsContact O-N 3.13Å
291F43.2Very low37.2Very low188 Ų188132.5 Ų132.583%0.82573%0.728SS**G310 helixtrans-80.815.4-178.9-76.5-76.4000114.5I288 S293I288-F291 PolarHBondContact O-N 3.2Å; F291-S293 PolarHBondContact O-N 3.43Å; F291-S293 VanDerWaalsContact O-N 3.09Å
292R31.8Very low37.3Very low190 Ų190130.3 Ų130.372%0.71773%0.728SS**  trans-70.7104.5178.8-170.8-170.5-68-173.80.2110.7I290I290-R292 PolarHBondContact O-N 3.27Å; I290-R292 VanDerWaalsContact O-N 3.13Å
293S38.4Very low37.4Very low90 Ų90137.8 Ų137.863%0.62974%0.738SS**  trans-75.7143.7154.1-173.20000109.2F291 G295F291-S293 PolarHBondContact O-N 3.43Å; F291-S293 VanDerWaalsContact O-N 3.09Å; S293-G295 PolarHBondContact O-N 3.45Å; S293-G295 VanDerWaalsContact O-N 3.14Å
294P37.7Very low37.3Very low128 Ų128136.5 Ų136.583%0.83174%0.737SS**THydrogen-bonded Turntrans-66.7114-177.4-10.725.2000110.6
295G35.5Very low37.2Very low75 Ų75143.2 Ų143.277%0.77375%0.752SS**THydrogen-bonded Turntrans131.7-416200000118.8S293S293-G295 PolarHBondContact O-N 3.45Å; S293-G295 VanDerWaalsContact O-N 3.14Å
296E34Very low36.3Very low181 Ų181146 Ų14685%0.84676%0.758SS**  trans-85.7130.8-179.6-72.3-164.2162.100113.8
297P34.9Very low36.2Very low120 Ų120144.4 Ų144.478%0.77977%0.767SS**  trans-73.2147.5176.527-31.1000113.3L299P297-L299 PolarHBondContact O-N 3.48Å; P297-L299 VanDerWaalsContact O-N 3.16Å
298L41.5Very low35.3Very low164 Ų164151.3 Ų151.386%0.85978%0.782SS**  trans-60.9104.8-170.4-64.1165.1000113.2N300L298-N300 PolarHBondContact O-N 3.04Å
299L35.5Very low34.9Very low151 Ų151150.6 Ų150.679%0.79178%0.78SS**  trans-83.2101.8166.3-150.680.1000109.5P297 L301P297-L299 PolarHBondContact O-N 3.48Å; P297-L299 VanDerWaalsContact O-N 3.16Å; L299-L301 HydrophobicContact CD2-CD1 4.45Å; L299-L301 PolarHBondContact O-N 3.1Å
300N27.7Very low34.3Very low153 Ų153152 Ų15282%0.81878%0.779SS**  trans-66.689.6176.4-81.4-26.2000111L298L298-N300 PolarHBondContact O-N 3.04Å
301L34.8Very low33.9Very low144 Ų144153.1 Ų153.175%0.75478%0.776SS**  trans-89125.7168.7-80.9160000110.3L299 R303L299-L301 HydrophobicContact CD2-CD1 4.45Å; L299-L301 PolarHBondContact O-N 3.1Å; L301-R303 PolarHBondContact O-N 2.67Å
302P30Very low34Very low117 Ų117146.9 Ų146.976%0.7676%0.759SS**  trans-65.5131.8-178.3-16.328.6000111.8A304P302-A304 PolarHBondContact O-N 3.01Å
303R35.1Very low34.4Very low240 Ų240145.3 Ų145.391%0.90676%0.76SS**  trans-54.8100177-80.2176.4171.4148.6-3.3111.8L301 R305L301-R303 PolarHBondContact O-N 2.67Å; R303-R305 PolarHBondContact O-N 2.93Å
304A29.7Very low34.6Very low91 Ų91145.9 Ų145.975%0.75276%0.755SS**  trans-74.8107.4163.800000109P302 F306P302-A304 PolarHBondContact O-N 3.01Å; A304-F306 PolarHBondContact O-N 3.31Å
305R29.4Very low34.8Very low241 Ų241147.5 Ų147.591%0.90975%0.745SS**  trans-65.596.7171.4-76.2-179.7-174.4178.71.7109.6R303R303-R305 PolarHBondContact O-N 2.93Å
306F30.8Very low34.9Very low196 Ų196150 Ų15086%0.8674%0.74SS**  trans-108.792.1156.5-99.3-89.4000108.9A304 W308A304-F306 PolarHBondContact O-N 3.31Å; F306-W308 PolarHBondContact O-N 3.34Å
307G32.3Very low35.2Very low73 Ų73144 Ų14475%0.75373%0.727SS**  trans-76.999.6175.500000110.7
308W28.3Very low35.4Very low247 Ų247147.1 Ų147.194%0.93673%0.729SS**  trans-117.297.8157.6-97.147.9000107.9F306 W310F306-W308 PolarHBondContact O-N 3.34Å; W308-W310 PolarHBondContact O-N 3.41Å
309N35.5Very low35.6Very low118 Ų118147.7 Ų147.763%0.63173%0.727SS**  trans-83.980.2-168.5-161.1-1.3000111R311 A312N309-R311 PolarHBondContact O-N 3.2Å; N309-A312 PolarHBondContact O-N 3.38Å
310W29.7Very low35.8Very low174 Ų174149.1 Ų149.166%0.65973%0.727SS**THydrogen-bonded Turntrans-51.6-26176.7136.4-96.6000114.1W308 A312 H313 L314W308-W310 PolarHBondContact O-N 3.41Å; W310-A312 PolarHBondContact O-N 3.29Å; W310-A312 VanDerWaalsContact O-N 3.12Å; W310-H313 PolarHBondContact O-N 3.41Å; W310-L314 HydrophobicContact CD2-CD1 4.44Å; W310-L314 HydrophobicContact CE3-CG 4.43Å; W310-L314 HydrophobicContact CH2-CD1 3.49Å; W310-L314 VanDerWaalsContact CH2-CD1 3.49Å; W310-L314 HydrophobicContact CH2-CD2 3.79Å; W310-L314 HydrophobicContact CH2-CG 3.62Å; W310-L314 HydrophobicContact CZ2-CD1 3.11Å; W310-L314 HydrophobicContact CZ2-CD2 4.32Å; W310-L314 HydrophobicContact CZ2-CG 3.75Å; W310-L314 HydrophobicContact CZ3-CD1 4.27Å; W310-L314 HydrophobicContact CZ3-CD2 4.22Å; W310-L314 HydrophobicContact CZ3-CG 3.97Å
311R36.7Very low36.1Very low134 Ų134148.8 Ų148.851%0.50673%0.725SS.*Hα-helixtrans-63.9-16.3179.7-77.8-172.5-80.9-148.4-2.4114.5N309N309-R311 PolarHBondContact O-N 3.2Å
312A44.3Very low36.3Very low58 Ų58149.8 Ų149.848%0.47973%0.73SS.*Hα-helixtrans-75.2-31.4173.400000112.5N309 W310N309-A312 PolarHBondContact O-N 3.38Å; W310-A312 PolarHBondContact O-N 3.29Å; W310-A312 VanDerWaalsContact O-N 3.12Å
313H39.8Very low36.6Very low157 Ų157156.9 Ų156.973%0.72775%0.752SS**Hα-helixtrans-77.8-36.1-171.7-139.360.2000112.6W310W310-H313 PolarHBondContact O-N 3.41Å
314L43.4Very low36.7Very low101 Ų101152.7 Ų152.753%0.52975%0.745SS.*Hα-helixtrans-73.6-25.4177.6-74.5-179.2000114.1W310W310-L314 HydrophobicContact CD2-CD1 4.44Å; W310-L314 HydrophobicContact CE3-CG 4.43Å; W310-L314 HydrophobicContact CH2-CD1 3.49Å; W310-L314 VanDerWaalsContact CH2-CD1 3.49Å; W310-L314 HydrophobicContact CH2-CD2 3.79Å; W310-L314 HydrophobicContact CH2-CG 3.62Å; W310-L314 HydrophobicContact CZ2-CD1 3.11Å; W310-L314 HydrophobicContact CZ2-CD2 4.32Å; W310-L314 HydrophobicContact CZ2-CG 3.75Å; W310-L314 HydrophobicContact CZ3-CD1 4.27Å; W310-L314 HydrophobicContact CZ3-CD2 4.22Å; W310-L314 HydrophobicContact CZ3-CG 3.97Å
315R42.4Very low37.1Very low163 Ų163155.9 Ų155.962%0.61574%0.744SS**Hα-helixtrans-73.1-35.6178.1-116.1-176.7-70.6-151-0.1112.1G317R315-G317 VanDerWaalsContact C-N 3.34Å; R315-G317 PolarHBondContact O-N 3.19Å
316N38.1Very low37.5Very low126 Ų126151.2 Ų151.267%0.67474%0.735SS**Hα-helixtrans-76.1-20.1179.5-74.9-4.1000113.7
317G40.2Very low37.9Very low56 Ų56148.6 Ų148.658%0.57773%0.728SS**Hα-helixtrans-75.3-29.2178.700000114.5R315R315-G317 VanDerWaalsContact C-N 3.34Å; R315-G317 PolarHBondContact O-N 3.19Å
318K39.3Very low38.2Very low186 Ų186153.3 Ų153.381%0.80973%0.726SS**Hα-helixtrans-94.1-12.4-173.4-86.7-173.2175.7-176.70115.7
319Q44.9Very low38.9Very low176 Ų176147.1 Ų147.182%0.82271%0.712SS**G310 helixtrans-86.7-3.9176.9-88.4-154.1-4300115.2
320K38.8Very low39.1Very low180 Ų180149.1 Ų149.178%0.78372%0.718SS**G310 helixtrans-87.72.1179.9-83.1-171.6173.6-174.90116.1
321N34.6Very low39.9Very low146 Ų146147.2 Ų147.278%0.78172%0.723SS**G310 helixtrans-12732.1-176.4-78.4-18.1000115.2
322L38.4Very low40.1Very low166 Ų166148.3 Ų148.387%0.86974%0.741SS**  trans-133.496.6158.4-83.4102.2000108.9
323H37.1Very low39.7Very low265 Ų265156.5 Ų156.5100%1.22777%0.765SS**  trans-96.40161.8-107.5-71.6000108.8

Retrieved 323 of 323 residues in 1097.1 ms (Link to these results)

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