A0A077YX14_TRITR Loading...

G-protein coupled receptors family 1 profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YX14, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 242 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
1M61.6Low80.6Confident217 Ų21778.9 Ų78.9100%1.06938%0.379SS*.  0122.90-65.5-174.3-167.900107.4
2E79.4Confident80.9Confident156 Ų15679.8 Ų79.873%0.72940%0.4SS*.  trans-58.6140.3175.3-63.5178.5160.700109.7V88E2-V88 VanDerWaalsContact C-CG2 3.49Å; E2-V88 HydrophobicContact CB-CB 4.25Å; E2-V88 HydrophobicContact CB-CG2 3.53Å; E2-V88 WeakPolarHBondContact O-CG2 3.49Å; E2-V88 PolarHBondContact O-N 3.47Å
3K82.7Confident81.2Confident145 Ų14574.8 Ų74.863%0.6338%0.377SS*.EExtended strand (participates in β ladder)trans-119.9143.7179.7-62.6-174-176177.30109.5L85 I86K3-L85 HydrophobicContact CB-CB 4.16Å; K3-L85 HydrophobicContact CB-CD2 4.13Å; K3-L85 HydrophobicContact CD-CB 3.95Å; K3-L85 HydrophobicContact CD-CD1 4.39Å; K3-I86 CarbonylContact C-O 3.57Å; K3-I86 VanDerWaalsContact CA-O 3.23Å; K3-I86 WeakPolarHBondContact CA-O 3.41Å
4T82.7Confident81.5Confident25 Ų2576 Ų7615%0.15339%0.392CS..EExtended strand (participates in β ladder)trans-129.3162.5175.3-171.80000109.8C9 L85 I86 V88T4-C9 HydrophobicContact CG2-CB 4.02Å; T4-L85 WeakPolarHBondContact O-CA 3.41Å; T4-I86 HydrophobicContact CG2-CG1 4.16Å; T4-I86 PolarHBondContact N-O 2.94Å; T4-I86 WeakPolarHBondContact O-CG1 3.36Å; T4-I86 PolarHBondContact O-N 2.79Å; T4-V88 HydrophobicContact CG2-CG2 4.28Å
5T83.3Confident81.8Confident33 Ų3378.5 Ų78.520%0.20240%0.396CS..EExtended strand (participates in β ladder)trans-75.4145.4174.156.70000110.2W7 L8 C9 K82T5-W7 VanDerWaalsContact C-N 3.26Å; T5-W7 PolarHBondContact O-N 2.77Å; T5-W7 PolarHBondContact OG1-NE1 3.05Å; T5-W7 VanDerWaalsContact OG1-NE1 3.13Å; T5-L8 PolarHBondContact O-N 3.24Å; T5-L8 WeakPolarHBondContact OG1-CB 2.97Å; T5-C9 WeakPolarHBondContact O-CB 3.37Å; T5-C9 PolarHBondContact O-N 3.09Å; T5-K82 WeakPolarHBondContact CG2-O 3.15Å
6A80.4Confident81.8Confident3 Ų373.6 Ų73.63%0.02537%0.371CS..Hα-helixtrans-57.4-37.7-177.100000113.6C9 L10 R84 I86A6-C9 VanDerWaalsContact O-CB 3.24Å; A6-C9 WeakPolarHBondContact O-CB 3.42Å; A6-L10 WeakPolarHBondContact O-CG 3.41Å; A6-L10 PolarHBondContact O-N 3.45Å; A6-L10 VanDerWaalsContact O-N 3.11Å; A6-R84 PolarHBondContact N-O 2.92Å; A6-I86 HydrophobicContact CB-CD1 4.11Å; A6-I86 HydrophobicContact CB-CG1 4.5Å; A6-I86 HydrophobicContact CB-CG2 4.44Å
7W81.4Confident82.2Confident85 Ų8573.7 Ų73.732%0.32237%0.369SS..Hα-helixtrans-69.5-41.8179.777.9-96000112.3T5 C9 L10 M11 Y78T5-W7 VanDerWaalsContact C-N 3.26Å; T5-W7 PolarHBondContact O-N 2.77Å; T5-W7 PolarHBondContact OG1-NE1 3.05Å; T5-W7 VanDerWaalsContact OG1-NE1 3.13Å; W7-C9 PolarHBondContact O-N 3.4Å; W7-L10 PolarHBondContact O-N 3.46Å; W7-M11 HydrophobicContact CE3-CG 4.15Å; W7-M11 HydrophobicContact CZ3-CG 4.4Å; W7-M11 WeakPolarHBondContact O-CG 3.31Å; W7-M11 PolarHBondContact O-N 3.37Å; W7-Y78 HydrophobicContact CB-CD2 4.16Å; W7-Y78 HydrophobicContact CD2-CD2 4.06Å; W7-Y78 AromaticContact CG-CD2 3.82Å; W7-Y78 HydrophobicContact CG-CD2 3.82Å
8L84.4Confident82.5Confident77 Ų7774.1 Ų74.140%0.40338%0.378SS..Hα-helixtrans-65.3-38.2179.7-177.462.9000109.7T5 M11 S12T5-L8 PolarHBondContact O-N 3.24Å; T5-L8 WeakPolarHBondContact OG1-CB 2.97Å; L8-M11 PolarHBondContact O-N 3.16Å; L8-S12 VanDerWaalsContact O-CB 3.22Å; L8-S12 WeakPolarHBondContact O-CB 3.33Å; L8-S12 PolarHBondContact O-N 3.2Å
9C85.6Confident82.6Confident5 Ų573.3 Ų73.33%0.03437%0.372CS..Hα-helixtrans-57-49.8172.8-147.50000112.8T4 T5 A6 W7 S12 S13 I86 C90T4-C9 HydrophobicContact CG2-CB 4.02Å; T5-C9 WeakPolarHBondContact O-CB 3.37Å; T5-C9 PolarHBondContact O-N 3.09Å; A6-C9 VanDerWaalsContact O-CB 3.24Å; A6-C9 WeakPolarHBondContact O-CB 3.42Å; W7-C9 PolarHBondContact O-N 3.4Å; C9-S12 PolarHBondContact O-N 3.31Å; C9-S13 WeakPolarHBondContact O-CB 3.39Å; C9-S13 PolarHBondContact O-N 3.49Å; C9-S13 PolarHBondContact O-OG 2.91Å; C9-I86 HydrophobicContact CB-CD1 3.72Å; C9-I86 HydrophobicContact CB-CG1 4.47Å; C9-I86 WeakPolarHBondContact SG-CD1 3.4Å; C9-C90 VanDerWaalsContact CA-SG 3.57Å; C9-C90 HydrophobicContact CB-CB 4.3Å; C9-C90 WeakPolarHBondContact CB-SG 3.43Å; C9-C90 PolarHBondContact O-SG 3.08Å; C9-C90 VanDerWaalsContact O-SG 3.4Å; C9-C90 WeakPolarHBondContact SG-CA 3.29Å; C9-C90 WeakPolarHBondContact SG-CB 3.49Å; C9-C90 CovalentContact SG-SG 2Å; C9-C90 PolarHBondContact SG-SG 3.24Å
10L82.8Confident82.7Confident1 Ų169.8 Ų69.81%0.00535%0.354CS..Hα-helixtrans-62.8-45178.6-72.5169.2000111.6A6 W7 S12 S13 I16 Y70 V74 T77 A95 I96A6-L10 WeakPolarHBondContact O-CG 3.41Å; A6-L10 PolarHBondContact O-N 3.45Å; A6-L10 VanDerWaalsContact O-N 3.11Å; W7-L10 PolarHBondContact O-N 3.46Å; L10-S12 PolarHBondContact O-N 3.33Å; L10-S13 PolarHBondContact O-N 3.49Å; L10-I16 HydrophobicContact CD2-CD1 4Å; L10-I16 HydrophobicContact CD2-CG2 3.79Å; L10-Y70 PolarHBondContact O-OH 3.36Å; L10-V74 HydrophobicContact CB-CG2 4.35Å; L10-T77 HydrophobicContact CD1-CG2 3.72Å; L10-T77 WeakPolarHBondContact CD1-OG1 3.41Å; L10-A95 HydrophobicContact CD2-CB 4.04Å; L10-A95 HydrophobicContact CG-CB 4.25Å; L10-I96 HydrophobicContact CD2-CD1 4.39Å; L10-I96 HydrophobicContact CD2-CG1 4Å
11M82.4Confident83.1Confident121 Ų12166.9 Ų66.960%0.59634%0.34SS*.Hα-helixtrans-66.5-35.5179.4-72.9-61.7-66.600113.1W7 L8 V74W7-M11 HydrophobicContact CE3-CG 4.15Å; W7-M11 HydrophobicContact CZ3-CG 4.4Å; W7-M11 WeakPolarHBondContact O-CG 3.31Å; W7-M11 PolarHBondContact O-N 3.37Å; L8-M11 PolarHBondContact O-N 3.16Å; M11-V74 HydrophobicContact CG-CG1 4.16Å; M11-V74 HydrophobicContact SD-CG1 3.78Å
12S84.4Confident84.4Confident90 Ų9057.9 Ų57.963%0.62930%0.303SS*.Hα-helixtrans-86.9-12.6-178.1-1690000113.8L8 C9 L10 P14L8-S12 VanDerWaalsContact O-CB 3.22Å; L8-S12 WeakPolarHBondContact O-CB 3.33Å; L8-S12 PolarHBondContact O-N 3.2Å; C9-S12 PolarHBondContact O-N 3.31Å; L10-S12 PolarHBondContact O-N 3.33Å; S12-P14 WeakPolarHBondContact O-CD 3.31Å
13S84.2Confident84.6Confident14 Ų1450.9 Ų50.910%0.09827%0.27CS..  trans-101.396.1-171.8-66.80000112.4C9 L10 Y15 I16 F17 C90C9-S13 WeakPolarHBondContact O-CB 3.39Å; C9-S13 PolarHBondContact O-N 3.49Å; C9-S13 PolarHBondContact O-OG 2.91Å; L10-S13 PolarHBondContact O-N 3.49Å; S13-Y15 PolarHBondContact O-N 3.14Å; S13-I16 PolarHBondContact O-N 3.02Å; S13-F17 PolarHBondContact O-N 3.38Å; S13-C90 PolarHBondContact OG-SG 2.9Å
14P85.9Confident85Confident92 Ų9244 Ų4460%0.59724%0.241SC*.Hα-helixtrans-63.6-29.8-178.325.7-35.4000112.6S12 I16 F17 C18S12-P14 WeakPolarHBondContact O-CD 3.31Å; P14-I16 PolarHBondContact O-N 3.42Å; P14-F17 PolarHBondContact O-N 3.43Å; P14-C18 WeakPolarHBondContact O-CB 3.42Å; P14-C18 PolarHBondContact O-N 2.92Å; P14-C18 PolarHBondContact O-SG 3.1Å
15Y85.2Confident85.4Confident113 Ų11343.7 Ų43.744%0.44324%0.238SC..Hα-helixtrans-66.6-35.6-179.373.1-89.5000112.5S13 F19 L89 C90S13-Y15 PolarHBondContact O-N 3.14Å; Y15-F19 WeakPolarHBondContact O-CB 2.99Å; Y15-F19 PolarHBondContact O-N 2.94Å; Y15-L89 PolarHBondContact OH-O 3.38Å; Y15-C90 VanDerWaalsContact OH-CB 3.24Å; Y15-C90 WeakPolarHBondContact OH-CB 3.48Å; Y15-C90 PolarHBondContact OH-O 3.22Å
16I82.5Confident85.7Confident1 Ų143.4 Ų43.41%0.00524%0.238CC..Hα-helixtrans-68.7-44.9177.3-58179.9000109.3L10 S13 P14 F19 Q20 Y70 A95 I96L10-I16 HydrophobicContact CD2-CD1 4Å; L10-I16 HydrophobicContact CD2-CG2 3.79Å; S13-I16 PolarHBondContact O-N 3.02Å; P14-I16 PolarHBondContact O-N 3.42Å; I16-F19 PolarHBondContact O-N 3.13Å; I16-Q20 HydrophobicContact CG2-CG 4.15Å; I16-Q20 VanDerWaalsContact O-CB 3.23Å; I16-Q20 WeakPolarHBondContact O-CB 3.33Å; I16-Q20 VanDerWaalsContact O-CG 3.28Å; I16-Q20 WeakPolarHBondContact O-CG 3.32Å; I16-Q20 PolarHBondContact O-N 3.19Å; I16-Y70 HydrophobicContact CG2-CE2 4.36Å; I16-A95 HydrophobicContact CD1-CB 4.36Å; I16-I96 HydrophobicContact CG2-CD1 4.18Å
17F87.7Confident86.1Confident75 Ų7543.5 Ų43.533%0.32924%0.238SC..Hα-helixtrans-57.1-56.1175.4173.5-99.2000111.3S13 P14 F19 Q20 V21 I67 Y70S13-F17 PolarHBondContact O-N 3.38Å; P14-F17 PolarHBondContact O-N 3.43Å; F17-F19 VanDerWaalsContact C-N 3.3Å; F17-F19 PolarHBondContact O-N 3.37Å; F17-Q20 PolarHBondContact O-N 3.13Å; F17-V21 HydrophobicContact CD2-CG2 3.87Å; F17-V21 HydrophobicContact CE1-CG2 4.45Å; F17-V21 HydrophobicContact CE2-CG2 3.6Å; F17-V21 HydrophobicContact CG-CG2 4.42Å; F17-V21 HydrophobicContact CZ-CG2 3.91Å; F17-V21 WeakPolarHBondContact O-CB 3.3Å; F17-V21 WeakPolarHBondContact O-CG2 3.4Å; F17-V21 PolarHBondContact O-N 2.95Å; F17-I67 HydrophobicContact CZ-CG1 4.4Å; F17-Y70 HydrophobicContact CB-CE1 4.41Å; F17-Y70 HydrophobicContact CB-CE2 4.29Å; F17-Y70 AromaticContact CD2-CD1 3.59Å; F17-Y70 HydrophobicContact CD2-CD1 3.59Å; F17-Y70 HydrophobicContact CD2-CD2 4.38Å; F17-Y70 AromaticContact CD2-CE1 3.57Å; F17-Y70 HydrophobicContact CD2-CE1 3.57Å; F17-Y70 HydrophobicContact CD2-CE2 4.36Å; F17-Y70 HydrophobicContact CD2-CG 4.01Å; F17-Y70 AromaticContact CD2-CZ 3.95Å; F17-Y70 HydrophobicContact CE2-CD1 4.05Å; F17-Y70 HydrophobicContact CE2-CE1 4.37Å; F17-Y70 HydrophobicContact CE2-CG 4.49Å; F17-Y70 HydrophobicContact CG-CE1 4.47Å
18C88.4Confident86.5Confident80 Ų8040.2 Ų40.254%0.54123%0.227SC..Hα-helixtrans-59.8-39.8-178.8-71.40000112.2P14 G22P14-C18 WeakPolarHBondContact O-CB 3.42Å; P14-C18 PolarHBondContact O-N 2.92Å; P14-C18 PolarHBondContact O-SG 3.1Å; C18-G22 VanDerWaalsContact O-CA 3.29Å; C18-G22 WeakPolarHBondContact O-CA 3.33Å; C18-G22 PolarHBondContact O-N 3.41Å
19F84.6Confident86.8Confident59 Ų5939 Ų3926%0.25922%0.22SC..Hα-helixtrans-66.1-49.6177.1-177.3-99.4000112.1Y15 I16 F17 N23 P190Y15-F19 WeakPolarHBondContact O-CB 2.99Å; Y15-F19 PolarHBondContact O-N 2.94Å; I16-F19 PolarHBondContact O-N 3.13Å; F17-F19 VanDerWaalsContact C-N 3.3Å; F17-F19 PolarHBondContact O-N 3.37Å; F19-N23 VanDerWaalsContact CE1-ND2 3.26Å; F19-N23 WeakPolarHBondContact CE1-ND2 3.34Å; F19-N23 VanDerWaalsContact CZ-ND2 3.3Å; F19-N23 WeakPolarHBondContact CZ-ND2 3.31Å; F19-N23 WeakPolarHBondContact O-CB 3.42Å; F19-N23 PolarHBondContact O-N 3.13Å; F19-N23 PolarHBondContact O-ND2 3.44Å; F19-P190 HydrophobicContact CE2-CB 4.48Å; F19-P190 HydrophobicContact CE2-CG 4.19Å
20Q85.2Confident87Confident3 Ų338.9 Ų38.91%0.01422%0.219CC..Hα-helixtrans-67.9-41.2-176.7-77.7-70.2-22.200112.8I16 F17 K24 Y70 H92 I96 D104I16-Q20 HydrophobicContact CG2-CG 4.15Å; I16-Q20 VanDerWaalsContact O-CB 3.23Å; I16-Q20 WeakPolarHBondContact O-CB 3.33Å; I16-Q20 VanDerWaalsContact O-CG 3.28Å; I16-Q20 WeakPolarHBondContact O-CG 3.32Å; I16-Q20 PolarHBondContact O-N 3.19Å; F17-Q20 PolarHBondContact O-N 3.13Å; Q20-K24 WeakPolarHBondContact O-CG 3.44Å; Q20-K24 PolarHBondContact O-NZ 3.44Å; Q20-Y70 HydrophobicContact CB-CD2 3.84Å; Q20-Y70 HydrophobicContact CB-CE2 4.31Å; Q20-Y70 HydrophobicContact CG-CD2 4.44Å; Q20-H92 PolarHBondContact NE2-CE1 2.99Å; Q20-H92 VanDerWaalsContact NE2-CE1 3.3Å; Q20-H92 PolarHBondContact NE2-NE2 2.89Å; Q20-I96 HydrophobicContact CG-CD1 4.43Å; Q20-D104 PolarHBondContact OE1-OD1 3.22Å
21V90.6Very high87.4Confident10 Ų1039.7 Ų39.76%0.06122%0.223CC..Hα-helixtrans-73.1-44.8175.8174.40000110.1F17 N23 K24 V25 A66 I67 Y70F17-V21 HydrophobicContact CD2-CG2 3.87Å; F17-V21 HydrophobicContact CE1-CG2 4.45Å; F17-V21 HydrophobicContact CE2-CG2 3.6Å; F17-V21 HydrophobicContact CG-CG2 4.42Å; F17-V21 HydrophobicContact CZ-CG2 3.91Å; F17-V21 WeakPolarHBondContact O-CB 3.3Å; F17-V21 WeakPolarHBondContact O-CG2 3.4Å; F17-V21 PolarHBondContact O-N 2.95Å; V21-N23 PolarHBondContact O-N 3.25Å; V21-K24 PolarHBondContact O-N 2.85Å; V21-V25 HydrophobicContact CG1-CG2 3.87Å; V21-V25 WeakPolarHBondContact O-CB 3.5Å; V21-V25 VanDerWaalsContact O-CG2 3.27Å; V21-V25 WeakPolarHBondContact O-CG2 3.38Å; V21-V25 PolarHBondContact O-N 3.21Å; V21-A66 HydrophobicContact CG1-CB 3.96Å; V21-I67 HydrophobicContact CG1-CG1 4.43Å; V21-Y70 HydrophobicContact CG2-CG 4.42Å
22G88.5Confident87.8Confident27 Ų2736.8 Ų36.828%0.27821%0.207SC..Hα-helixtrans-57.6-45.6-179.700000113.1C18 K24 V25 S26C18-G22 VanDerWaalsContact O-CA 3.29Å; C18-G22 WeakPolarHBondContact O-CA 3.33Å; C18-G22 PolarHBondContact O-N 3.41Å; G22-K24 VanDerWaalsContact C-N 3.33Å; G22-K24 PolarHBondContact O-N 3.43Å; G22-V25 PolarHBondContact O-N 3.21Å; G22-S26 WeakPolarHBondContact O-CB 3.33Å; G22-S26 PolarHBondContact O-N 3.4Å
23N84.8Confident87.9Confident10 Ų1035.1 Ų35.15%0.05319%0.191CC..Hα-helixtrans-58.9-44.4177.1-71.6-12.1000112.6F19 V21 S27 Q193F19-N23 VanDerWaalsContact CE1-ND2 3.26Å; F19-N23 WeakPolarHBondContact CE1-ND2 3.34Å; F19-N23 VanDerWaalsContact CZ-ND2 3.3Å; F19-N23 WeakPolarHBondContact CZ-ND2 3.31Å; F19-N23 WeakPolarHBondContact O-CB 3.42Å; F19-N23 PolarHBondContact O-N 3.13Å; F19-N23 PolarHBondContact O-ND2 3.44Å; V21-N23 PolarHBondContact O-N 3.25Å; N23-S27 PolarHBondContact O-N 2.89Å; N23-S27 VanDerWaalsContact O-N 3.11Å; N23-Q193 PolarHBondContact OD1-NE2 2.81Å; N23-Q193 PolarHBondContact OD1-OE1 3.28Å
24K89.3Confident88.1Confident1 Ų134.5 Ų34.50%0.00419%0.187CC..Hα-helixtrans-69.7-45.7179.7-68.2-175.8-179.488.60112Q20 V21 G22 S26 S27 L28 A66 F69 D104 F107Q20-K24 WeakPolarHBondContact O-CG 3.44Å; Q20-K24 PolarHBondContact O-NZ 3.44Å; V21-K24 PolarHBondContact O-N 2.85Å; G22-K24 VanDerWaalsContact C-N 3.33Å; G22-K24 PolarHBondContact O-N 3.43Å; K24-S26 VanDerWaalsContact C-N 3.31Å; K24-S26 PolarHBondContact O-N 3.38Å; K24-S27 PolarHBondContact O-N 3.5Å; K24-L28 VanDerWaalsContact O-CB 3.26Å; K24-L28 WeakPolarHBondContact O-CB 3.48Å; K24-L28 VanDerWaalsContact O-CG 3.31Å; K24-L28 WeakPolarHBondContact O-CG 3.33Å; K24-L28 PolarHBondContact O-N 3.22Å; K24-A66 HydrophobicContact CB-CB 3.8Å; K24-F69 HydrophobicContact CD-CB 3.98Å; K24-F69 HydrophobicContact CD-CD1 4.01Å; K24-F69 HydrophobicContact CD-CG 3.96Å; K24-F69 VanDerWaalsContact CE-CG 3.48Å; K24-F69 VanDerWaalsContact NZ-CD1 3.32Å; K24-D104 WeakPolarHBondContact CE-OD1 3.27Å; K24-D104 IonicContact NZ-OD1 2.74Å; K24-D104 PolarHBondContact NZ-OD1 2.95Å; K24-F107 HydrophobicContact CB-CE1 4.46Å; K24-F107 HydrophobicContact CD-CE1 4.42Å; K24-F107 HydrophobicContact CG-CD1 4.38Å; K24-F107 HydrophobicContact CG-CE1 4.16Å
25V92Very high88.3Confident17 Ų1733.9 Ų33.910%0.10318%0.178CC..Hα-helixtrans-57.8-47.8176.81700000109.5V21 G22 S27 L28 M29 V62 F63 A66V21-V25 HydrophobicContact CG1-CG2 3.87Å; V21-V25 WeakPolarHBondContact O-CB 3.5Å; V21-V25 VanDerWaalsContact O-CG2 3.27Å; V21-V25 WeakPolarHBondContact O-CG2 3.38Å; V21-V25 PolarHBondContact O-N 3.21Å; G22-V25 PolarHBondContact O-N 3.21Å; V25-S27 PolarHBondContact O-N 3.48Å; V25-L28 PolarHBondContact O-N 3.08Å; V25-M29 HydrophobicContact CG1-CE 4.05Å; V25-M29 HydrophobicContact CG1-CG 4.02Å; V25-M29 VanDerWaalsContact O-CB 3.26Å; V25-M29 WeakPolarHBondContact O-CB 3.38Å; V25-M29 WeakPolarHBondContact O-CG 3.11Å; V25-M29 PolarHBondContact O-N 3.37Å; V25-V62 HydrophobicContact CB-CG1 4.3Å; V25-V62 HydrophobicContact CG1-CG1 4.14Å; V25-V62 HydrophobicContact CG2-CG1 4.29Å; V25-F63 HydrophobicContact CG1-CE1 4.08Å; V25-F63 HydrophobicContact CG1-CE2 4.24Å; V25-F63 HydrophobicContact CG1-CZ 3.89Å; V25-F63 HydrophobicContact CG2-CD1 3.75Å; V25-F63 HydrophobicContact CG2-CE1 3.86Å; V25-F63 HydrophobicContact CG2-CG 4.28Å; V25-F63 HydrophobicContact CG2-CZ 4.47Å; V25-A66 HydrophobicContact CG2-CB 3.69Å
26S88.6Confident88.4Confident28 Ų2829.3 Ų29.320%0.19616%0.161CC..Hα-helixtrans-57.5-52178.3-165.80000111.6G22 K24 M29 V30G22-S26 WeakPolarHBondContact O-CB 3.33Å; G22-S26 PolarHBondContact O-N 3.4Å; K24-S26 VanDerWaalsContact C-N 3.31Å; K24-S26 PolarHBondContact O-N 3.38Å; S26-M29 PolarHBondContact O-N 2.87Å; S26-V30 WeakPolarHBondContact O-CG2 3.33Å; S26-V30 PolarHBondContact O-N 2.94Å
27S88.7Confident88.5Confident4 Ų433.5 Ų33.53%0.02818%0.177CC..Hα-helixtrans-64.6-44.1-178-170.60000112.8N23 K24 V25 V30 L31 A111N23-S27 PolarHBondContact O-N 2.89Å; N23-S27 VanDerWaalsContact O-N 3.11Å; K24-S27 PolarHBondContact O-N 3.5Å; V25-S27 PolarHBondContact O-N 3.48Å; S27-V30 PolarHBondContact O-N 3.05Å; S27-L31 PolarHBondContact O-N 3Å; S27-L31 VanDerWaalsContact O-N 3.07Å; S27-A111 WeakPolarHBondContact OG-CB 3.39Å
28L91.7Very high88.4Confident17 Ų1730.3 Ų30.39%0.08916%0.164CC..Hα-helixtrans-65.6-40.4177.1-73.3175.8000112K24 V25 V30 L31 F32 V62 M65 F107K24-L28 VanDerWaalsContact O-CB 3.26Å; K24-L28 WeakPolarHBondContact O-CB 3.48Å; K24-L28 VanDerWaalsContact O-CG 3.31Å; K24-L28 WeakPolarHBondContact O-CG 3.33Å; K24-L28 PolarHBondContact O-N 3.22Å; V25-L28 PolarHBondContact O-N 3.08Å; L28-V30 VanDerWaalsContact C-N 3.31Å; L28-V30 PolarHBondContact O-N 3.19Å; L28-L31 HydrophobicContact CD2-CD2 4.41Å; L28-L31 WeakPolarHBondContact O-CB 3.4Å; L28-L31 PolarHBondContact O-N 3.28Å; L28-F32 HydrophobicContact CB-CD2 4.35Å; L28-F32 HydrophobicContact CD2-CE2 4.48Å; L28-F32 WeakPolarHBondContact O-CB 3.36Å; L28-F32 WeakPolarHBondContact O-CD2 3.37Å; L28-F32 PolarHBondContact O-N 2.9Å; L28-V62 HydrophobicContact CB-CG1 3.64Å; L28-V62 HydrophobicContact CB-CG2 4.19Å; L28-V62 HydrophobicContact CD1-CG1 4.21Å; L28-M65 HydrophobicContact CD1-CB 4.29Å; L28-F107 HydrophobicContact CD1-CZ 4.17Å; L28-F107 HydrophobicContact CD2-CE1 4.43Å; L28-F107 HydrophobicContact CD2-CZ 3.92Å; L28-F107 HydrophobicContact CG-CE1 4.33Å; L28-F107 HydrophobicContact CG-CZ 4.17Å
29M90.6Very high88.3Confident51 Ų5134.2 Ų34.225%0.25117%0.167SC..Hα-helixtrans-59.4-42.8176.8-75.9-63177.600111.6V25 S26 F32 L33 V59 V62 F63V25-M29 HydrophobicContact CG1-CE 4.05Å; V25-M29 HydrophobicContact CG1-CG 4.02Å; V25-M29 VanDerWaalsContact O-CB 3.26Å; V25-M29 WeakPolarHBondContact O-CB 3.38Å; V25-M29 WeakPolarHBondContact O-CG 3.11Å; V25-M29 PolarHBondContact O-N 3.37Å; S26-M29 PolarHBondContact O-N 2.87Å; M29-F32 PolarHBondContact O-N 3.21Å; M29-L33 VanDerWaalsContact O-CB 3.22Å; M29-L33 WeakPolarHBondContact O-CB 3.08Å; M29-L33 PolarHBondContact O-N 3.44Å; M29-V59 HydrophobicContact CE-CB 4.12Å; M29-V59 HydrophobicContact CE-CG1 3.83Å; M29-V59 HydrophobicContact CE-CG2 4.05Å; M29-V59 HydrophobicContact SD-CG2 4.31Å; M29-V62 HydrophobicContact CE-CB 3.75Å; M29-V62 HydrophobicContact CE-CG1 3.71Å; M29-V62 HydrophobicContact CE-CG2 4.26Å; M29-V62 HydrophobicContact CG-CG1 4.09Å; M29-V62 HydrophobicContact SD-CB 4.26Å; M29-V62 HydrophobicContact SD-CG1 4.17Å; M29-V62 HydrophobicContact SD-CG2 4.14Å; M29-F63 HydrophobicContact CE-CD2 4.25Å; M29-F63 HydrophobicContact CE-CE2 4Å
30V88.5Confident88.1Confident2 Ų233 Ų331%0.01217%0.166CC..Hα-helixtrans-65.1-43176.8-177.70000111S26 S27 L28 L33 A34 T115 I154 V155 H158 E196 Y200S26-V30 WeakPolarHBondContact O-CG2 3.33Å; S26-V30 PolarHBondContact O-N 2.94Å; S27-V30 PolarHBondContact O-N 3.05Å; L28-V30 VanDerWaalsContact C-N 3.31Å; L28-V30 PolarHBondContact O-N 3.19Å; V30-L33 PolarHBondContact O-N 3.47Å; V30-A34 PolarHBondContact O-N 3.36Å; V30-T115 HydrophobicContact CG1-CG2 3.78Å; V30-I154 HydrophobicContact CG1-CG2 4.47Å; V30-V155 HydrophobicContact CG1-CG2 4.32Å; V30-H158 HydrophobicContact CG1-CB 4.36Å; V30-E196 WeakPolarHBondContact CG2-OE1 3.45Å; V30-Y200 WeakPolarHBondContact CG2-OH 3.46Å
31L91.1Very high87.8Confident19 Ų1933.6 Ų33.610%0.09917%0.169CC..Hα-helixtrans-59.7-51.5175.9175.161.1000111.6S27 L28 L33 A34 L35 F114 T115S27-L31 PolarHBondContact O-N 3Å; S27-L31 VanDerWaalsContact O-N 3.07Å; L28-L31 HydrophobicContact CD2-CD2 4.41Å; L28-L31 WeakPolarHBondContact O-CB 3.4Å; L28-L31 PolarHBondContact O-N 3.28Å; L31-L33 VanDerWaalsContact C-N 3.31Å; L31-L33 PolarHBondContact O-N 3.47Å; L31-A34 WeakPolarHBondContact O-CB 3.45Å; L31-A34 PolarHBondContact O-N 3.26Å; L31-A34 VanDerWaalsContact O-N 3.15Å; L31-L35 HydrophobicContact CD1-CD1 4.17Å; L31-L35 HydrophobicContact CD1-CG 4.27Å; L31-L35 HydrophobicContact CG-CD1 4.09Å; L31-L35 WeakPolarHBondContact O-CG 3.42Å; L31-L35 PolarHBondContact O-N 2.84Å; L31-F114 HydrophobicContact CD1-CB 3.64Å; L31-F114 HydrophobicContact CD2-CB 4.37Å; L31-T115 WeakPolarHBondContact CA-OG1 3.49Å; L31-T115 WeakPolarHBondContact CB-OG1 3.5Å
32F90.8Very high87.3Confident59 Ų5938.6 Ų38.626%0.25919%0.19SC..Hα-helixtrans-64.8-34.7179-85-71.8000112.3L28 M29 L35 D36 L58 V62L28-F32 HydrophobicContact CB-CD2 4.35Å; L28-F32 HydrophobicContact CD2-CE2 4.48Å; L28-F32 WeakPolarHBondContact O-CB 3.36Å; L28-F32 WeakPolarHBondContact O-CD2 3.37Å; L28-F32 PolarHBondContact O-N 2.9Å; M29-F32 PolarHBondContact O-N 3.21Å; F32-L35 PolarHBondContact O-N 3.31Å; F32-D36 VanDerWaalsContact O-CB 3.24Å; F32-D36 WeakPolarHBondContact O-CB 3.49Å; F32-D36 PolarHBondContact O-N 3.4Å; F32-L58 HydrophobicContact CB-CD1 4.07Å; F32-L58 HydrophobicContact CB-CD2 3.55Å; F32-L58 HydrophobicContact CB-CG 4.17Å; F32-L58 HydrophobicContact CD1-CD1 3.79Å; F32-L58 HydrophobicContact CD1-CD2 4.16Å; F32-L58 HydrophobicContact CD1-CG 3.89Å; F32-L58 HydrophobicContact CD2-CD2 4.38Å; F32-L58 HydrophobicContact CG-CD1 4.2Å; F32-L58 HydrophobicContact CG-CD2 3.79Å; F32-L58 HydrophobicContact CG-CG 4.06Å; F32-V62 HydrophobicContact CD2-CG2 3.3Å; F32-V62 HydrophobicContact CE2-CG2 3.55Å; F32-V62 HydrophobicContact CG-CG2 4.2Å
33L87.6Confident86.6Confident55 Ų5538.8 Ų38.829%0.28819%0.186SC..Hα-helixtrans-61.8-44.5172-177.168.1000110.9M29 V30 L31 R37M29-L33 VanDerWaalsContact O-CB 3.22Å; M29-L33 WeakPolarHBondContact O-CB 3.08Å; M29-L33 PolarHBondContact O-N 3.44Å; V30-L33 PolarHBondContact O-N 3.47Å; L31-L33 VanDerWaalsContact C-N 3.31Å; L31-L33 PolarHBondContact O-N 3.47Å; L33-R37 VanDerWaalsContact O-CG 3.29Å; L33-R37 WeakPolarHBondContact O-CG 3.35Å; L33-R37 PolarHBondContact O-N 2.93Å; L33-R37 VanDerWaalsContact O-N 3.14Å
34A88Confident85.6Confident1 Ų141.1 Ų41.11%0.00820%0.196CC..Hα-helixtrans-63.4-42.8175.800000111.7V30 L31 R37 C38 T115 A118V30-A34 PolarHBondContact O-N 3.36Å; L31-A34 WeakPolarHBondContact O-CB 3.45Å; L31-A34 PolarHBondContact O-N 3.26Å; L31-A34 VanDerWaalsContact O-N 3.15Å; A34-R37 PolarHBondContact O-N 3.3Å; A34-C38 PolarHBondContact O-N 2.99Å; A34-C38 PolarHBondContact O-SG 3.14Å; A34-T115 HydrophobicContact CB-CG2 4.29Å; A34-A118 HydrophobicContact CB-CB 3.93Å
35L89.8Confident84.2Confident80 Ų8046 Ų4642%0.41923%0.228SC..Hα-helixtrans-66.7-43.1177.5-69.3174.6000112.9L31 F32 R37 C38 W39 A118L31-L35 HydrophobicContact CD1-CD1 4.17Å; L31-L35 HydrophobicContact CD1-CG 4.27Å; L31-L35 HydrophobicContact CG-CD1 4.09Å; L31-L35 WeakPolarHBondContact O-CG 3.42Å; L31-L35 PolarHBondContact O-N 2.84Å; F32-L35 PolarHBondContact O-N 3.31Å; L35-R37 VanDerWaalsContact C-N 3.25Å; L35-R37 PolarHBondContact O-N 3.14Å; L35-C38 WeakPolarHBondContact O-CB 3.39Å; L35-C38 PolarHBondContact O-N 3.48Å; L35-W39 WeakPolarHBondContact O-CB 3.45Å; L35-W39 PolarHBondContact O-N 2.97Å; L35-A118 HydrophobicContact CD2-CB 4.07Å
36D86.8Confident82.7Confident16 Ų1649.9 Ų49.99%0.08625%0.252CS..Hα-helixtrans-57.1-41.5175172.178000110.6F32 W39 C40F32-D36 VanDerWaalsContact O-CB 3.24Å; F32-D36 WeakPolarHBondContact O-CB 3.49Å; F32-D36 PolarHBondContact O-N 3.4Å; D36-W39 PolarHBondContact O-N 3.02Å; D36-C40 WeakPolarHBondContact O-CB 3.3Å; D36-C40 PolarHBondContact O-N 3.38Å; D36-C40 PolarHBondContact O-SG 3.39Å
37R84.9Confident81Confident89 Ų8951.9 Ų51.934%0.33628%0.276SS..Hα-helixtrans-70.9-40.9176.3-66.2-61115.1164.56.8113.3L33 A34 L35 W39 C40 L41 M122 I151L33-R37 VanDerWaalsContact O-CG 3.29Å; L33-R37 WeakPolarHBondContact O-CG 3.35Å; L33-R37 PolarHBondContact O-N 2.93Å; L33-R37 VanDerWaalsContact O-N 3.14Å; A34-R37 PolarHBondContact O-N 3.3Å; L35-R37 VanDerWaalsContact C-N 3.25Å; L35-R37 PolarHBondContact O-N 3.14Å; R37-W39 VanDerWaalsContact C-N 3.28Å; R37-W39 PolarHBondContact O-N 2.82Å; R37-C40 PolarHBondContact O-N 2.82Å; R37-L41 WeakPolarHBondContact O-CG 3.3Å; R37-L41 PolarHBondContact O-N 2.96Å; R37-M122 HydrophobicContact CB-SD 3.47Å; R37-M122 WeakPolarHBondContact CB-SD 3.33Å; R37-M122 HydrophobicContact CG-SD 4.3Å; R37-I151 HydrophobicContact CG-CD1 3.42Å; R37-I151 VanDerWaalsContact CG-CD1 3.42Å
38C86.7Confident79.5Confident9 Ų962 Ų626%0.06131%0.314CS..Hα-helixtrans-55.6-48.5170.8-740000110.4A34 L35 C40 L41 F42 A118A34-C38 PolarHBondContact O-N 2.99Å; A34-C38 PolarHBondContact O-SG 3.14Å; L35-C38 WeakPolarHBondContact O-CB 3.39Å; L35-C38 PolarHBondContact O-N 3.48Å; C38-C40 PolarHBondContact O-N 3.1Å; C38-L41 PolarHBondContact O-N 3.13Å; C38-L41 VanDerWaalsContact O-N 3.14Å; C38-F42 HydrophobicContact CB-CE2 4.44Å; C38-F42 WeakPolarHBondContact O-CD2 3.37Å; C38-F42 PolarHBondContact O-N 3.16Å; C38-A118 PolarHBondContact SG-O 2.81Å
39W84.9Confident78Confident161 Ų16170.2 Ų70.261%0.6134%0.344SS*.Hα-helixtrans-59.7-46.2178-172.6-97.2000111.7L35 D36 R37 L41 F42 V43L35-W39 WeakPolarHBondContact O-CB 3.45Å; L35-W39 PolarHBondContact O-N 2.97Å; D36-W39 PolarHBondContact O-N 3.02Å; R37-W39 VanDerWaalsContact C-N 3.28Å; R37-W39 PolarHBondContact O-N 2.82Å; W39-L41 VanDerWaalsContact C-N 3.26Å; W39-L41 PolarHBondContact O-N 3.28Å; W39-F42 PolarHBondContact O-N 3.32Å; W39-F42 VanDerWaalsContact O-N 3.16Å; W39-V43 HydrophobicContact CD2-CG2 3.98Å; W39-V43 HydrophobicContact CG-CG2 4.23Å; W39-V43 HydrophobicContact CZ2-CG2 3.94Å; W39-V43 VanDerWaalsContact O-CB 3.3Å; W39-V43 WeakPolarHBondContact O-CB 3.45Å; W39-V43 WeakPolarHBondContact O-CG2 3.29Å; W39-V43 PolarHBondContact O-N 2.76Å
40C80.3Confident76.7Confident34 Ų3470.1 Ų70.123%0.2335%0.348CS..Hα-helixtrans-56.7-39.2174.9-71.80000112.4D36 R37 C38 F44D36-C40 WeakPolarHBondContact O-CB 3.3Å; D36-C40 PolarHBondContact O-N 3.38Å; D36-C40 PolarHBondContact O-SG 3.39Å; R37-C40 PolarHBondContact O-N 2.82Å; C38-C40 PolarHBondContact O-N 3.1Å; C40-F44 WeakPolarHBondContact O-CA 3.42Å; C40-F44 WeakPolarHBondContact O-CB 3.47Å; C40-F44 PolarHBondContact O-N 3.2Å
41L78.9Confident76Confident15 Ų1574.1 Ų74.18%0.07937%0.372CS..Hα-helixtrans-73.1-33.7177.5-68.9173.7000113.3R37 C38 W39 M122 L125 M126 E144R37-L41 WeakPolarHBondContact O-CG 3.3Å; R37-L41 PolarHBondContact O-N 2.96Å; C38-L41 PolarHBondContact O-N 3.13Å; C38-L41 VanDerWaalsContact O-N 3.14Å; W39-L41 VanDerWaalsContact C-N 3.26Å; W39-L41 PolarHBondContact O-N 3.28Å; L41-M122 HydrophobicContact CD1-CB 4.47Å; L41-M122 HydrophobicContact CD1-CG 3.56Å; L41-L125 HydrophobicContact CB-CB 4.41Å; L41-L125 HydrophobicContact CB-CD1 4.24Å; L41-L125 HydrophobicContact CD1-CB 4.24Å; L41-M126 HydrophobicContact CD1-CG 3.64Å; L41-M126 HydrophobicContact CD1-SD 3.89Å; L41-M126 HydrophobicContact CD2-CG 4.29Å; L41-M126 HydrophobicContact CD2-SD 3.42Å; L41-M126 WeakPolarHBondContact CD2-SD 3.22Å; L41-M126 HydrophobicContact CG-SD 4.31Å; L41-E144 WeakPolarHBondContact CD2-OE2 3.47Å
42F80.5Confident75.5Confident116 Ų11683.2 Ų83.251%0.50941%0.405SS..Hα-helixtrans-69.9-40.7174.1-78.6-64.4000112.3C38 W39 P45 I121 L125C38-F42 HydrophobicContact CB-CE2 4.44Å; C38-F42 WeakPolarHBondContact O-CD2 3.37Å; C38-F42 PolarHBondContact O-N 3.16Å; W39-F42 PolarHBondContact O-N 3.32Å; W39-F42 VanDerWaalsContact O-N 3.16Å; F42-P45 WeakPolarHBondContact O-CD 3.42Å; F42-I121 HydrophobicContact CE2-CG2 4.23Å; F42-I121 HydrophobicContact CZ-CG2 4.14Å; F42-L125 HydrophobicContact CD1-CD1 4.13Å; F42-L125 HydrophobicContact CD1-CD2 4.08Å; F42-L125 HydrophobicContact CD2-CD1 3.86Å; F42-L125 HydrophobicContact CE1-CD1 3.8Å; F42-L125 HydrophobicContact CE1-CD2 3.53Å; F42-L125 HydrophobicContact CE1-CG 4.27Å; F42-L125 HydrophobicContact CE2-CD1 3.49Å; F42-L125 VanDerWaalsContact CE2-CD1 3.49Å; F42-L125 HydrophobicContact CG-CD1 4.16Å; F42-L125 HydrophobicContact CZ-CD1 3.47Å; F42-L125 VanDerWaalsContact CZ-CD1 3.47Å; F42-L125 HydrophobicContact CZ-CD2 3.9Å; F42-L125 HydrophobicContact CZ-CG 4.19Å
43V75.3Confident75.2Confident30 Ų3085.6 Ų85.618%0.18243%0.425CS..Hα-helixtrans-94.2-5.2-173.2-178.90000111.9W39 P45 T46 R48W39-V43 HydrophobicContact CD2-CG2 3.98Å; W39-V43 HydrophobicContact CG-CG2 4.23Å; W39-V43 HydrophobicContact CZ2-CG2 3.94Å; W39-V43 VanDerWaalsContact O-CB 3.3Å; W39-V43 WeakPolarHBondContact O-CB 3.45Å; W39-V43 WeakPolarHBondContact O-CG2 3.29Å; W39-V43 PolarHBondContact O-N 2.76Å; V43-P45 WeakPolarHBondContact O-CD 3.24Å; V43-T46 WeakPolarHBondContact CG1-OG1 3.42Å; V43-T46 PolarHBondContact O-N 3.33Å; V43-T46 PolarHBondContact O-OG1 2.88Å; V43-R48 HydrophobicContact CG1-CB 4.25Å
44F63.8Low75.1Confident59 Ų5988.1 Ų88.126%0.25943%0.431SS..G310 helixtrans-38.9-39.4172.6-151.2-96.6000115.1C40 T46 Q140 E144C40-F44 WeakPolarHBondContact O-CA 3.42Å; C40-F44 WeakPolarHBondContact O-CB 3.47Å; C40-F44 PolarHBondContact O-N 3.2Å; F44-T46 PolarHBondContact O-N 3.38Å; F44-Q140 HydrophobicContact CZ-CB 3.87Å; F44-E144 WeakPolarHBondContact CD2-OE1 3.21Å; F44-E144 HydrophobicContact CE2-CG 4.41Å; F44-E144 WeakPolarHBondContact CE2-OE1 3.32Å
45P59.7Low75.1Confident105 Ų10591.5 Ų91.568%0.68245%0.452SS*.G310 helixtrans-65.2-17.9175.322-33.7000115.7F42 V43F42-P45 WeakPolarHBondContact O-CD 3.42Å; V43-P45 WeakPolarHBondContact O-CD 3.24Å
46T59.3Low75Confident98 Ų9891.8 Ų91.860%0.60145%0.453SS*.G310 helixtrans-106.94.5-171.260.50000114.9V43 F44 R48V43-T46 WeakPolarHBondContact CG1-OG1 3.42Å; V43-T46 PolarHBondContact O-N 3.33Å; V43-T46 PolarHBondContact O-OG1 2.88Å; F44-T46 PolarHBondContact O-N 3.38Å; T46-R48 PolarHBondContact O-N 3.33Å
47G53.9Low75.2Confident69 Ų6993.6 Ų93.671%0.71147%0.47SS*.  trans63.77.3171.100000115.9R49G47-R49 PolarHBondContact O-N 3.48Å
48R56.7Low75.4Confident218 Ų21890.5 Ų90.582%0.82346%0.46SS*.  trans-78.287.7-176.1-146.1174.4-165.5168.53.5109.7V43 T46 S50V43-R48 HydrophobicContact CG1-CB 4.25Å; T46-R48 PolarHBondContact O-N 3.33Å; R48-S50 PolarHBondContact O-N 3.45Å
49R59.7Low75.7Confident189 Ų18992.6 Ų92.671%0.71347%0.472SS*.PPolyproline II helixtrans-60.3131.2169.5-77.8178.4171.9-176.6-14.2108.7G47 T51 Q242G47-R49 PolarHBondContact O-N 3.48Å; R49-T51 PolarHBondContact O-N 3.32Å; R49-Q242 PolarHBondContact NH2-OXT 3.12Å
50S64.3Low76.1Confident49 Ų4990.1 Ų90.134%0.34347%0.471SS..PPolyproline II helixtrans-50.4121.5170.2-174.60000109.4R48 Y54R48-S50 PolarHBondContact O-N 3.45Å; S50-Y54 WeakPolarHBondContact OG-CD1 3.3Å
51T73.8Confident76.7Confident85 Ų8590.9 Ų90.952%0.52148%0.476SS..PPolyproline II helixtrans-75.5150.7-179.657.20000109.4R49 T53 Y54 V55R49-T51 PolarHBondContact O-N 3.32Å; T51-T53 PolarHBondContact O-N 3.04Å; T51-T53 VanDerWaalsContact O-N 3.1Å; T51-Y54 WeakPolarHBondContact O-CB 3.46Å; T51-Y54 PolarHBondContact O-N 3.17Å; T51-Y54 PolarHBondContact OG1-N 3.33Å; T51-V55 PolarHBondContact O-N 3.49Å
52R80.2Confident77.4Confident211 Ų21190.1 Ų90.180%0.79647%0.472SS*.Hα-helixtrans-51.3-36.6174.7-176.8178.7176.2-177.7-0.8111.8V55 I56R52-V55 PolarHBondContact O-N 3.15Å; R52-I56 HydrophobicContact CG-CD1 3.94Å; R52-I56 VanDerWaalsContact O-CG1 3.31Å; R52-I56 WeakPolarHBondContact O-CG1 3.49Å; R52-I56 PolarHBondContact O-N 3.28Å
53T84.9Confident78Confident108 Ų10889 Ų8966%0.66347%0.467SS*.Hα-helixtrans-61.4-42175.9-450000112.5T51 I56 A57T51-T53 PolarHBondContact O-N 3.04Å; T51-T53 VanDerWaalsContact O-N 3.1Å; T53-I56 PolarHBondContact O-N 2.86Å; T53-A57 WeakPolarHBondContact O-CB 3.43Å; T53-A57 PolarHBondContact O-N 3.12Å
54Y85.7Confident78.9Confident108 Ų10894 Ų9442%0.42449%0.487SS..Hα-helixtrans-63.5-45.4177177.1-91.8000111.5S50 T51 I56 A57 L58S50-Y54 WeakPolarHBondContact OG-CD1 3.3Å; T51-Y54 WeakPolarHBondContact O-CB 3.46Å; T51-Y54 PolarHBondContact O-N 3.17Å; T51-Y54 PolarHBondContact OG1-N 3.33Å; Y54-I56 VanDerWaalsContact C-N 3.34Å; Y54-I56 PolarHBondContact O-N 3.33Å; Y54-A57 PolarHBondContact O-N 2.87Å; Y54-L58 HydrophobicContact CE1-CD1 3.93Å; Y54-L58 WeakPolarHBondContact O-CB 3.46Å; Y54-L58 PolarHBondContact O-N 2.78Å
55V86.5Confident80.3Confident73 Ų7396.8 Ų96.844%0.44250%0.502SS..Hα-helixtrans-62-43.2178.3179.60000111T51 R52 L58 V59T51-V55 PolarHBondContact O-N 3.49Å; R52-V55 PolarHBondContact O-N 3.15Å; V55-L58 PolarHBondContact O-N 3.35Å; V55-V59 WeakPolarHBondContact O-CG2 3.32Å; V55-V59 PolarHBondContact O-N 3.19Å
56I89.5Confident81.8Confident85 Ų8591.8 Ų91.844%0.43647%0.469SS..Hα-helixtrans-63.4-46.1176.6-67.9167.6000110.7R52 T53 Y54 L58 V59 L60R52-I56 HydrophobicContact CG-CD1 3.94Å; R52-I56 VanDerWaalsContact O-CG1 3.31Å; R52-I56 WeakPolarHBondContact O-CG1 3.49Å; R52-I56 PolarHBondContact O-N 3.28Å; T53-I56 PolarHBondContact O-N 2.86Å; Y54-I56 VanDerWaalsContact C-N 3.34Å; Y54-I56 PolarHBondContact O-N 3.33Å; I56-L58 VanDerWaalsContact C-N 3.3Å; I56-L58 PolarHBondContact O-N 2.9Å; I56-V59 PolarHBondContact O-N 3.43Å; I56-L60 HydrophobicContact CG2-CD1 3.88Å; I56-L60 HydrophobicContact CG2-CG 4.3Å; I56-L60 WeakPolarHBondContact O-CB 3.45Å; I56-L60 WeakPolarHBondContact O-CG 3.34Å; I56-L60 PolarHBondContact O-N 3.4Å
57A90.3Very high83.4Confident54 Ų5490 Ų9045%0.44646%0.455SS..Hα-helixtrans-60.9-39.7178.300000112T53 Y54 L60 S61T53-A57 WeakPolarHBondContact O-CB 3.43Å; T53-A57 PolarHBondContact O-N 3.12Å; Y54-A57 PolarHBondContact O-N 2.87Å; A57-L60 PolarHBondContact O-N 2.77Å; A57-S61 WeakPolarHBondContact O-CB 3.35Å; A57-S61 PolarHBondContact O-N 3.37Å; A57-S61 PolarHBondContact O-OG 2.92Å
58L89.6Confident85.3Confident25 Ų2589.9 Ų89.913%0.13144%0.438CS..Hα-helixtrans-64.2-45.3174.9-172.1155.9000111.3F32 Y54 V55 I56 L60 S61 V62F32-L58 HydrophobicContact CB-CD1 4.07Å; F32-L58 HydrophobicContact CB-CD2 3.55Å; F32-L58 HydrophobicContact CB-CG 4.17Å; F32-L58 HydrophobicContact CD1-CD1 3.79Å; F32-L58 HydrophobicContact CD1-CD2 4.16Å; F32-L58 HydrophobicContact CD1-CG 3.89Å; F32-L58 HydrophobicContact CD2-CD2 4.38Å; F32-L58 HydrophobicContact CG-CD1 4.2Å; F32-L58 HydrophobicContact CG-CD2 3.79Å; F32-L58 HydrophobicContact CG-CG 4.06Å; Y54-L58 HydrophobicContact CE1-CD1 3.93Å; Y54-L58 WeakPolarHBondContact O-CB 3.46Å; Y54-L58 PolarHBondContact O-N 2.78Å; V55-L58 PolarHBondContact O-N 3.35Å; I56-L58 VanDerWaalsContact C-N 3.3Å; I56-L58 PolarHBondContact O-N 2.9Å; L58-L60 VanDerWaalsContact C-N 3.35Å; L58-L60 PolarHBondContact O-N 3.32Å; L58-S61 PolarHBondContact O-N 2.94Å; L58-S61 PolarHBondContact O-OG 3.14Å; L58-V62 HydrophobicContact CD2-CG2 4.18Å; L58-V62 WeakPolarHBondContact O-CG2 3.47Å; L58-V62 PolarHBondContact O-N 3.45Å
59V91.8Very high86.8Confident52 Ų5281.9 Ų81.932%0.31541%0.409SS..Hα-helixtrans-62.3-46.4178.8166.50000110.3M29 V55 I56 S61 V62 F63M29-V59 HydrophobicContact CE-CB 4.12Å; M29-V59 HydrophobicContact CE-CG1 3.83Å; M29-V59 HydrophobicContact CE-CG2 4.05Å; M29-V59 HydrophobicContact SD-CG2 4.31Å; V55-V59 WeakPolarHBondContact O-CG2 3.32Å; V55-V59 PolarHBondContact O-N 3.19Å; I56-V59 PolarHBondContact O-N 3.43Å; V59-S61 VanDerWaalsContact C-N 3.34Å; V59-S61 PolarHBondContact O-N 3.41Å; V59-V62 PolarHBondContact O-N 3.39Å; V59-F63 HydrophobicContact CG1-CD2 4Å; V59-F63 HydrophobicContact CG1-CE2 3.94Å; V59-F63 VanDerWaalsContact O-CD2 3.3Å; V59-F63 WeakPolarHBondContact O-CD2 3.5Å; V59-F63 PolarHBondContact O-N 3.36Å; V59-F63 VanDerWaalsContact O-N 3.15Å
60L93.5Very high88.2Confident110 Ų11073.3 Ų73.358%0.57638%0.377SS*.Hα-helixtrans-61.9-40.1177.3-70.2174.4000112.1I56 A57 L58 V62 F63 F64I56-L60 HydrophobicContact CG2-CD1 3.88Å; I56-L60 HydrophobicContact CG2-CG 4.3Å; I56-L60 WeakPolarHBondContact O-CB 3.45Å; I56-L60 WeakPolarHBondContact O-CG 3.34Å; I56-L60 PolarHBondContact O-N 3.4Å; A57-L60 PolarHBondContact O-N 2.77Å; L58-L60 VanDerWaalsContact C-N 3.35Å; L58-L60 PolarHBondContact O-N 3.32Å; L60-V62 VanDerWaalsContact C-N 3.34Å; L60-V62 PolarHBondContact O-N 2.96Å; L60-F63 PolarHBondContact O-N 3.21Å; L60-F64 WeakPolarHBondContact O-CB 3.32Å; L60-F64 PolarHBondContact O-N 3.11Å
61S92.8Very high89.4Confident49 Ų4975.5 Ų75.534%0.34338%0.384SS..Hα-helixtrans-65-38.517874.10000111.8A57 L58 V59 F64 M65A57-S61 WeakPolarHBondContact O-CB 3.35Å; A57-S61 PolarHBondContact O-N 3.37Å; A57-S61 PolarHBondContact O-OG 2.92Å; L58-S61 PolarHBondContact O-N 2.94Å; L58-S61 PolarHBondContact O-OG 3.14Å; V59-S61 VanDerWaalsContact C-N 3.34Å; V59-S61 PolarHBondContact O-N 3.41Å; S61-F64 PolarHBondContact O-N 3.11Å; S61-M65 WeakPolarHBondContact O-CB 3.39Å; S61-M65 WeakPolarHBondContact O-CG 3.49Å; S61-M65 PolarHBondContact O-N 3.35Å
62V93.7Very high90.1Very high0 Ų074.3 Ų74.30%038%0.379CS..Hα-helixtrans-60.4-47.7174.3171.30000111.5V25 L28 M29 F32 L58 V59 L60 M65 A66V25-V62 HydrophobicContact CB-CG1 4.3Å; V25-V62 HydrophobicContact CG1-CG1 4.14Å; V25-V62 HydrophobicContact CG2-CG1 4.29Å; L28-V62 HydrophobicContact CB-CG1 3.64Å; L28-V62 HydrophobicContact CB-CG2 4.19Å; L28-V62 HydrophobicContact CD1-CG1 4.21Å; M29-V62 HydrophobicContact CE-CB 3.75Å; M29-V62 HydrophobicContact CE-CG1 3.71Å; M29-V62 HydrophobicContact CE-CG2 4.26Å; M29-V62 HydrophobicContact CG-CG1 4.09Å; M29-V62 HydrophobicContact SD-CB 4.26Å; M29-V62 HydrophobicContact SD-CG1 4.17Å; M29-V62 HydrophobicContact SD-CG2 4.14Å; F32-V62 HydrophobicContact CD2-CG2 3.3Å; F32-V62 HydrophobicContact CE2-CG2 3.55Å; F32-V62 HydrophobicContact CG-CG2 4.2Å; L58-V62 HydrophobicContact CD2-CG2 4.18Å; L58-V62 WeakPolarHBondContact O-CG2 3.47Å; L58-V62 PolarHBondContact O-N 3.45Å; V59-V62 PolarHBondContact O-N 3.39Å; L60-V62 VanDerWaalsContact C-N 3.34Å; L60-V62 PolarHBondContact O-N 2.96Å; V62-M65 PolarHBondContact O-N 3.36Å; V62-A66 WeakPolarHBondContact O-CB 3.29Å; V62-A66 PolarHBondContact O-N 3.02Å; V62-A66 VanDerWaalsContact O-N 3.07Å
63F93.8Very high90.3Very high91 Ų9164.4 Ų64.440%0.39934%0.342SS..Hα-helixtrans-62.5-44.1176.6-84.3-78.4000111.7V25 M29 V59 L60 M65 A66 I67V25-F63 HydrophobicContact CG1-CE1 4.08Å; V25-F63 HydrophobicContact CG1-CE2 4.24Å; V25-F63 HydrophobicContact CG1-CZ 3.89Å; V25-F63 HydrophobicContact CG2-CD1 3.75Å; V25-F63 HydrophobicContact CG2-CE1 3.86Å; V25-F63 HydrophobicContact CG2-CG 4.28Å; V25-F63 HydrophobicContact CG2-CZ 4.47Å; M29-F63 HydrophobicContact CE-CD2 4.25Å; M29-F63 HydrophobicContact CE-CE2 4Å; V59-F63 HydrophobicContact CG1-CD2 4Å; V59-F63 HydrophobicContact CG1-CE2 3.94Å; V59-F63 VanDerWaalsContact O-CD2 3.3Å; V59-F63 WeakPolarHBondContact O-CD2 3.5Å; V59-F63 PolarHBondContact O-N 3.36Å; V59-F63 VanDerWaalsContact O-N 3.15Å; L60-F63 PolarHBondContact O-N 3.21Å; F63-M65 PolarHBondContact O-N 3.1Å; F63-A66 PolarHBondContact O-N 2.84Å; F63-I67 WeakPolarHBondContact O-CB 3.36Å; F63-I67 VanDerWaalsContact O-CG1 3.24Å; F63-I67 WeakPolarHBondContact O-CG1 3.24Å; F63-I67 PolarHBondContact O-N 3.36Å
64F93.7Very high90.3Very high137 Ų13760 Ų6060%0.60132%0.315SS*.Hα-helixtrans-60.8-45.5179.7-166.6-107.2000111.8L60 S61 A66 I67 I68L60-F64 WeakPolarHBondContact O-CB 3.32Å; L60-F64 PolarHBondContact O-N 3.11Å; S61-F64 PolarHBondContact O-N 3.11Å; F64-A66 PolarHBondContact O-N 3.03Å; F64-I67 PolarHBondContact O-N 3.09Å; F64-I68 HydrophobicContact CD1-CD1 3.4Å; F64-I68 HydrophobicContact CD1-CG1 4.33Å; F64-I68 HydrophobicContact CE1-CD1 3.2Å; F64-I68 HydrophobicContact CE1-CG1 4.19Å; F64-I68 HydrophobicContact CG-CD1 4.23Å; F64-I68 HydrophobicContact CZ-CD1 3.86Å; F64-I68 HydrophobicContact CZ-CG1 4.46Å; F64-I68 WeakPolarHBondContact O-CG1 3.48Å; F64-I68 PolarHBondContact O-N 3.28Å
65M92.2Very high90.3Very high116 Ų11657.3 Ų57.357%0.57131%0.314SS*.Hα-helixtrans-62.1-42.3176.3-68.7-64.1-77.300112.2L28 S61 V62 F63 F69L28-M65 HydrophobicContact CD1-CB 4.29Å; S61-M65 WeakPolarHBondContact O-CB 3.39Å; S61-M65 WeakPolarHBondContact O-CG 3.49Å; S61-M65 PolarHBondContact O-N 3.35Å; V62-M65 PolarHBondContact O-N 3.36Å; F63-M65 PolarHBondContact O-N 3.1Å; M65-F69 PolarHBondContact O-N 3.47Å; M65-F69 VanDerWaalsContact O-N 3.09Å
66A92.2Very high90.2Very high0 Ų056.7 Ų56.70%031%0.308CS..Hα-helixtrans-65.7-4017800000112.4V21 K24 V25 V62 F63 F64 Y70V21-A66 HydrophobicContact CG1-CB 3.96Å; K24-A66 HydrophobicContact CB-CB 3.8Å; V25-A66 HydrophobicContact CG2-CB 3.69Å; V62-A66 WeakPolarHBondContact O-CB 3.29Å; V62-A66 PolarHBondContact O-N 3.02Å; V62-A66 VanDerWaalsContact O-N 3.07Å; F63-A66 PolarHBondContact O-N 2.84Å; F64-A66 PolarHBondContact O-N 3.03Å; A66-Y70 PolarHBondContact O-N 2.94Å; A66-Y70 VanDerWaalsContact O-N 3.14Å
67I92.8Very high89.8Confident60 Ų6052.8 Ų52.831%0.30829%0.288SS..Hα-helixtrans-68.1-44.8177-68165.4000110.7F17 V21 F63 F64 F69 Y70 L71F17-I67 HydrophobicContact CZ-CG1 4.4Å; V21-I67 HydrophobicContact CG1-CG1 4.43Å; F63-I67 WeakPolarHBondContact O-CB 3.36Å; F63-I67 VanDerWaalsContact O-CG1 3.24Å; F63-I67 WeakPolarHBondContact O-CG1 3.24Å; F63-I67 PolarHBondContact O-N 3.36Å; F64-I67 PolarHBondContact O-N 3.09Å; I67-F69 VanDerWaalsContact C-N 3.29Å; I67-F69 PolarHBondContact O-N 3.13Å; I67-Y70 WeakPolarHBondContact O-CB 3.22Å; I67-Y70 PolarHBondContact O-N 3.47Å; I67-Y70 VanDerWaalsContact O-N 3.12Å; I67-L71 HydrophobicContact CG2-CD1 4.05Å; I67-L71 HydrophobicContact CG2-CG 4.28Å; I67-L71 WeakPolarHBondContact O-CG 3.45Å; I67-L71 PolarHBondContact O-N 3.09Å
68I92.8Very high89.4Confident67 Ų6755.2 Ų55.234%0.34429%0.286SS..Hα-helixtrans-56.1-47.4176-73.5167.2000110.4F64 Y70 L71 C72F64-I68 HydrophobicContact CD1-CD1 3.4Å; F64-I68 HydrophobicContact CD1-CG1 4.33Å; F64-I68 HydrophobicContact CE1-CD1 3.2Å; F64-I68 HydrophobicContact CE1-CG1 4.19Å; F64-I68 HydrophobicContact CG-CD1 4.23Å; F64-I68 HydrophobicContact CZ-CD1 3.86Å; F64-I68 HydrophobicContact CZ-CG1 4.46Å; F64-I68 WeakPolarHBondContact O-CG1 3.48Å; F64-I68 PolarHBondContact O-N 3.28Å; I68-Y70 VanDerWaalsContact C-N 3.28Å; I68-Y70 PolarHBondContact O-N 2.95Å; I68-L71 PolarHBondContact O-N 2.67Å; I68-L71 VanDerWaalsContact O-N 3.12Å; I68-C72 PolarHBondContact O-N 3.37Å; I68-C72 PolarHBondContact O-SG 3.45Å
69F89.5Confident89.1Confident50 Ų5060.6 Ų60.622%0.21931%0.311CS..Hα-helixtrans-59.1-43179-166.3-74.7000111.4K24 M65 I67 C72 I73 F107K24-F69 HydrophobicContact CD-CB 3.98Å; K24-F69 HydrophobicContact CD-CD1 4.01Å; K24-F69 HydrophobicContact CD-CG 3.96Å; K24-F69 VanDerWaalsContact CE-CG 3.48Å; K24-F69 VanDerWaalsContact NZ-CD1 3.32Å; M65-F69 PolarHBondContact O-N 3.47Å; M65-F69 VanDerWaalsContact O-N 3.09Å; I67-F69 VanDerWaalsContact C-N 3.29Å; I67-F69 PolarHBondContact O-N 3.13Å; F69-C72 WeakPolarHBondContact O-CB 3.1Å; F69-C72 PolarHBondContact O-N 3.42Å; F69-I73 HydrophobicContact CD1-CD1 3.83Å; F69-I73 HydrophobicContact CD1-CG1 4.13Å; F69-I73 HydrophobicContact CE1-CD1 3.83Å; F69-I73 HydrophobicContact CE1-CG1 4.12Å; F69-I73 WeakPolarHBondContact O-CG1 3.26Å; F69-I73 PolarHBondContact O-N 3.22Å; F69-I73 VanDerWaalsContact O-N 3.15Å; F69-F107 HydrophobicContact CE2-CD2 4.44Å; F69-F107 HydrophobicContact CE2-CG 4.46Å
70Y88.8Confident88.3Confident9 Ų968.2 Ų68.24%0.03533%0.334CS..Hα-helixtrans-61.9-43.6175.5179.8-94.2000112.1L10 I16 F17 Q20 V21 A66 I67 I68 C72 I73 V74L10-Y70 PolarHBondContact O-OH 3.36Å; I16-Y70 HydrophobicContact CG2-CE2 4.36Å; F17-Y70 HydrophobicContact CB-CE1 4.41Å; F17-Y70 HydrophobicContact CB-CE2 4.29Å; F17-Y70 AromaticContact CD2-CD1 3.59Å; F17-Y70 HydrophobicContact CD2-CD1 3.59Å; F17-Y70 HydrophobicContact CD2-CD2 4.38Å; F17-Y70 AromaticContact CD2-CE1 3.57Å; F17-Y70 HydrophobicContact CD2-CE1 3.57Å; F17-Y70 HydrophobicContact CD2-CE2 4.36Å; F17-Y70 HydrophobicContact CD2-CG 4.01Å; F17-Y70 AromaticContact CD2-CZ 3.95Å; F17-Y70 HydrophobicContact CE2-CD1 4.05Å; F17-Y70 HydrophobicContact CE2-CE1 4.37Å; F17-Y70 HydrophobicContact CE2-CG 4.49Å; F17-Y70 HydrophobicContact CG-CE1 4.47Å; Q20-Y70 HydrophobicContact CB-CD2 3.84Å; Q20-Y70 HydrophobicContact CB-CE2 4.31Å; Q20-Y70 HydrophobicContact CG-CD2 4.44Å; V21-Y70 HydrophobicContact CG2-CG 4.42Å; A66-Y70 PolarHBondContact O-N 2.94Å; A66-Y70 VanDerWaalsContact O-N 3.14Å; I67-Y70 WeakPolarHBondContact O-CB 3.22Å; I67-Y70 PolarHBondContact O-N 3.47Å; I67-Y70 VanDerWaalsContact O-N 3.12Å; I68-Y70 VanDerWaalsContact C-N 3.28Å; I68-Y70 PolarHBondContact O-N 2.95Å; Y70-C72 VanDerWaalsContact C-N 3.29Å; Y70-C72 PolarHBondContact O-N 3.39Å; Y70-I73 WeakPolarHBondContact O-CB 3.46Å; Y70-I73 PolarHBondContact O-N 3.43Å; Y70-I73 VanDerWaalsContact O-N 3.08Å; Y70-V74 HydrophobicContact CD1-CG2 3.96Å; Y70-V74 HydrophobicContact CE1-CG2 3.45Å; Y70-V74 VanDerWaalsContact CE1-CG2 3.45Å; Y70-V74 WeakPolarHBondContact O-CG2 3.47Å; Y70-V74 PolarHBondContact O-N 3.36Å
71L89.4Confident87.1Confident95 Ų9563.3 Ų63.350%0.49731%0.31SS..Hα-helixtrans-61.8-35.8176-68.8175.3000112.1I67 I68 I73 V74 A75I67-L71 HydrophobicContact CG2-CD1 4.05Å; I67-L71 HydrophobicContact CG2-CG 4.28Å; I67-L71 WeakPolarHBondContact O-CG 3.45Å; I67-L71 PolarHBondContact O-N 3.09Å; I68-L71 PolarHBondContact O-N 2.67Å; I68-L71 VanDerWaalsContact O-N 3.12Å; L71-I73 VanDerWaalsContact C-N 3.35Å; L71-V74 PolarHBondContact O-N 2.94Å; L71-A75 WeakPolarHBondContact O-CB 3.45Å; L71-A75 PolarHBondContact O-N 3.39Å
72C88.4Confident86Confident61 Ų6165.2 Ų65.241%0.41231%0.312SS..Hα-helixtrans-61.8-41.4172-65.30000112I68 F69 Y70 A75 I76I68-C72 PolarHBondContact O-N 3.37Å; I68-C72 PolarHBondContact O-SG 3.45Å; F69-C72 WeakPolarHBondContact O-CB 3.1Å; F69-C72 PolarHBondContact O-N 3.42Å; Y70-C72 VanDerWaalsContact C-N 3.29Å; Y70-C72 PolarHBondContact O-N 3.39Å; C72-A75 PolarHBondContact O-N 2.94Å; C72-I76 VanDerWaalsContact O-CG1 3.29Å; C72-I76 WeakPolarHBondContact O-CG1 3.26Å; C72-I76 PolarHBondContact O-N 2.85Å
73I84.4Confident85Confident2 Ų272.6 Ų72.61%0.0135%0.352CS..Hα-helixtrans-60.7-48.5174-60.2168.5000109.7F69 Y70 L71 A75 I76 T77 F100F69-I73 HydrophobicContact CD1-CD1 3.83Å; F69-I73 HydrophobicContact CD1-CG1 4.13Å; F69-I73 HydrophobicContact CE1-CD1 3.83Å; F69-I73 HydrophobicContact CE1-CG1 4.12Å; F69-I73 WeakPolarHBondContact O-CG1 3.26Å; F69-I73 PolarHBondContact O-N 3.22Å; F69-I73 VanDerWaalsContact O-N 3.15Å; Y70-I73 WeakPolarHBondContact O-CB 3.46Å; Y70-I73 PolarHBondContact O-N 3.43Å; Y70-I73 VanDerWaalsContact O-N 3.08Å; L71-I73 VanDerWaalsContact C-N 3.35Å; I73-A75 VanDerWaalsContact C-N 3.35Å; I73-A75 PolarHBondContact O-N 3.41Å; I73-I76 PolarHBondContact O-N 3.26Å; I73-T77 HydrophobicContact CG2-CG2 4.15Å; I73-T77 WeakPolarHBondContact O-CB 3.21Å; I73-T77 VanDerWaalsContact O-CG2 3.27Å; I73-T77 WeakPolarHBondContact O-CG2 3.48Å; I73-T77 PolarHBondContact O-N 2.92Å; I73-T77 PolarHBondContact O-OG1 2.88Å; I73-F100 HydrophobicContact CB-CD1 4.41Å; I73-F100 HydrophobicContact CG1-CD1 3.73Å; I73-F100 HydrophobicContact CG1-CE1 4.11Å; I73-F100 HydrophobicContact CG1-CG 4.37Å; I73-F100 HydrophobicContact CG2-CD1 4.46Å; I73-F100 HydrophobicContact CG2-CG 4.37Å
74V85Confident84.1Confident17 Ų1774 Ų7410%0.10336%0.355CS..Hα-helixtrans-60.6-44179176.10000111.2L10 M11 Y70 L71 I76 T77 Y78L10-V74 HydrophobicContact CB-CG2 4.35Å; M11-V74 HydrophobicContact CG-CG1 4.16Å; M11-V74 HydrophobicContact SD-CG1 3.78Å; Y70-V74 HydrophobicContact CD1-CG2 3.96Å; Y70-V74 HydrophobicContact CE1-CG2 3.45Å; Y70-V74 VanDerWaalsContact CE1-CG2 3.45Å; Y70-V74 WeakPolarHBondContact O-CG2 3.47Å; Y70-V74 PolarHBondContact O-N 3.36Å; L71-V74 PolarHBondContact O-N 2.94Å; V74-I76 PolarHBondContact O-N 3.2Å; V74-T77 VanDerWaalsContact CA-OG1 3.31Å; V74-T77 WeakPolarHBondContact CA-OG1 3.32Å; V74-T77 PolarHBondContact O-N 3.44Å; V74-T77 PolarHBondContact O-OG1 2.94Å; V74-Y78 VanDerWaalsContact O-CB 3.26Å; V74-Y78 WeakPolarHBondContact O-CB 3.38Å; V74-Y78 PolarHBondContact O-N 3.35Å
75A86.1Confident83.4Confident50 Ų5072.5 Ų72.541%0.41335%0.352SS..Hα-helixtrans-63.4-42.7179.600000112.3L71 C72 I73 Y78 Q79L71-A75 WeakPolarHBondContact O-CB 3.45Å; L71-A75 PolarHBondContact O-N 3.39Å; C72-A75 PolarHBondContact O-N 2.94Å; I73-A75 VanDerWaalsContact C-N 3.35Å; I73-A75 PolarHBondContact O-N 3.41Å; A75-Y78 WeakPolarHBondContact O-CB 3.46Å; A75-Y78 PolarHBondContact O-N 3.47Å; A75-Q79 PolarHBondContact O-N 2.93Å
76I84.1Confident82.8Confident60 Ų6067.4 Ų67.431%0.30833%0.327SS..Hα-helixtrans-76.1-38.6-178.9-62.7167000110.6C72 I73 V74 Y78 Q79 W80 F100C72-I76 VanDerWaalsContact O-CG1 3.29Å; C72-I76 WeakPolarHBondContact O-CG1 3.26Å; C72-I76 PolarHBondContact O-N 2.85Å; I73-I76 PolarHBondContact O-N 3.26Å; V74-I76 PolarHBondContact O-N 3.2Å; I76-Y78 PolarHBondContact O-N 2.91Å; I76-Q79 PolarHBondContact O-N 3.29Å; I76-W80 HydrophobicContact CG2-CG 4.35Å; I76-W80 PolarHBondContact O-N 3.25Å; I76-F100 HydrophobicContact CB-CE1 4.49Å; I76-F100 HydrophobicContact CB-CE2 3.82Å; I76-F100 HydrophobicContact CB-CZ 3.4Å; I76-F100 VanDerWaalsContact CB-CZ 3.4Å; I76-F100 HydrophobicContact CD1-CE1 3.92Å; I76-F100 HydrophobicContact CD1-CZ 3.43Å; I76-F100 VanDerWaalsContact CD1-CZ 3.43Å; I76-F100 HydrophobicContact CG1-CZ 3.95Å; I76-F100 HydrophobicContact CG2-CE2 3.49Å; I76-F100 VanDerWaalsContact CG2-CE2 3.49Å; I76-F100 HydrophobicContact CG2-CZ 3.42Å; I76-F100 VanDerWaalsContact CG2-CZ 3.42Å
77T80.4Confident82.3Confident3 Ų368.6 Ų68.62%0.01834%0.336CS..Hα-helixtrans-62.6-33.717153.70000112.2L10 I73 V74 G81 P97L10-T77 HydrophobicContact CD1-CG2 3.72Å; L10-T77 WeakPolarHBondContact CD1-OG1 3.41Å; I73-T77 HydrophobicContact CG2-CG2 4.15Å; I73-T77 WeakPolarHBondContact O-CB 3.21Å; I73-T77 VanDerWaalsContact O-CG2 3.27Å; I73-T77 WeakPolarHBondContact O-CG2 3.48Å; I73-T77 PolarHBondContact O-N 2.92Å; I73-T77 PolarHBondContact O-OG1 2.88Å; V74-T77 VanDerWaalsContact CA-OG1 3.31Å; V74-T77 WeakPolarHBondContact CA-OG1 3.32Å; V74-T77 PolarHBondContact O-N 3.44Å; V74-T77 PolarHBondContact O-OG1 2.94Å; T77-G81 WeakPolarHBondContact O-CA 3.37Å; T77-G81 PolarHBondContact O-N 3.1Å; T77-P97 VanDerWaalsContact CG2-CD 3.41Å; T77-P97 HydrophobicContact CG2-CG 3.96Å
78Y82.1Confident81.6Confident105 Ų10569.1 Ų69.141%0.41234%0.341SS..Hα-helixtrans-66.4-36169.7178.6-102.6000112.2W7 V74 A75 I76 K82W7-Y78 HydrophobicContact CB-CD2 4.16Å; W7-Y78 HydrophobicContact CD2-CD2 4.06Å; W7-Y78 AromaticContact CG-CD2 3.82Å; W7-Y78 HydrophobicContact CG-CD2 3.82Å; V74-Y78 VanDerWaalsContact O-CB 3.26Å; V74-Y78 WeakPolarHBondContact O-CB 3.38Å; V74-Y78 PolarHBondContact O-N 3.35Å; A75-Y78 WeakPolarHBondContact O-CB 3.46Å; A75-Y78 PolarHBondContact O-N 3.47Å; I76-Y78 PolarHBondContact O-N 2.91Å; Y78-K82 HydrophobicContact CD2-CG 4.47Å; Y78-K82 HydrophobicContact CE1-CD 4.45Å; Y78-K82 HydrophobicContact CE2-CD 4.21Å; Y78-K82 HydrophobicContact CE2-CG 4.44Å; Y78-K82 WeakPolarHBondContact O-CE 3.33Å; Y78-K82 WeakPolarHBondContact O-CG 3.36Å; Y78-K82 PolarHBondContact OH-NZ 3.44Å; Y78-K82 VanDerWaalsContact OH-NZ 3.07Å
79Q83Confident81Confident138 Ų13872.1 Ų72.165%0.64536%0.357SS*.Hα-helixtrans-73.5-40.5177.3-75.8179.3-1200113.2A75 I76A75-Q79 PolarHBondContact O-N 2.93Å; I76-Q79 PolarHBondContact O-N 3.29Å
80W76.3Confident80.6Confident213 Ų21369.9 Ų69.981%0.80735%0.348SS*.Hα-helixtrans-95.9-16.5-171.8-68.866.9000113.8I76I76-W80 HydrophobicContact CG2-CG 4.35Å; I76-W80 PolarHBondContact O-N 3.25Å
81G67.7Low80Confident7 Ų773.8 Ų73.87%0.07237%0.369CS..  trans-127.119.3-167.300000115T77 D83 R84T77-G81 WeakPolarHBondContact O-CA 3.37Å; T77-G81 PolarHBondContact O-N 3.1Å; G81-D83 PolarHBondContact O-N 3.32Å; G81-R84 PolarHBondContact O-N 3.33Å; G81-R84 VanDerWaalsContact O-N 3.16Å
82K69.6Low79.2Confident88 Ų8870.9 Ų70.938%0.38335%0.352SS..THydrogen-bonded Turntrans-54-42.9178.6-61.6-163.6-175.7-174.70112T5 Y78T5-K82 WeakPolarHBondContact CG2-O 3.15Å; Y78-K82 HydrophobicContact CD2-CG 4.47Å; Y78-K82 HydrophobicContact CE1-CD 4.45Å; Y78-K82 HydrophobicContact CE2-CD 4.21Å; Y78-K82 HydrophobicContact CE2-CG 4.44Å; Y78-K82 WeakPolarHBondContact O-CE 3.33Å; Y78-K82 WeakPolarHBondContact O-CG 3.36Å; Y78-K82 PolarHBondContact OH-NZ 3.44Å; Y78-K82 VanDerWaalsContact OH-NZ 3.07Å
83D71.9Confident78.5Confident155 Ų15572.3 Ų72.383%0.82935%0.352SS*.THydrogen-bonded Turntrans-96.9-1.8-176.1-51-43.3000112.6G81 L85G81-D83 PolarHBondContact O-N 3.32Å; D83-L85 PolarHBondContact O-N 3.26Å
84R75.9Confident78Confident122 Ų12275.4 Ų75.446%0.4637%0.366SS..  trans-78.4100.1-179.7-168.1-178.2-176.4-159.70.1109.8A6 G81 I86 Q94A6-R84 PolarHBondContact N-O 2.92Å; G81-R84 PolarHBondContact O-N 3.33Å; G81-R84 VanDerWaalsContact O-N 3.16Å; R84-I86 HydrophobicContact CG-CG2 4.29Å; R84-Q94 PolarHBondContact NH1-O 3.48Å
85L78.2Confident77.4Confident105 Ų10574.7 Ų74.755%0.5536%0.362SS..EExtended strand (participates in β ladder)trans-75.5124.5173-68.3167.1000110.7K3 T4 D83K3-L85 HydrophobicContact CB-CB 4.16Å; K3-L85 HydrophobicContact CB-CD2 4.13Å; K3-L85 HydrophobicContact CD-CB 3.95Å; K3-L85 HydrophobicContact CD-CD1 4.39Å; T4-L85 WeakPolarHBondContact O-CA 3.41Å; D83-L85 PolarHBondContact O-N 3.26Å
86I80.7Confident76.9Confident8 Ų872.4 Ų72.44%0.04134%0.343CS..EExtended strand (participates in β ladder)trans-123167.9177.163167.6000110.6K3 T4 A6 C9 R84 Q94 A95K3-I86 CarbonylContact C-O 3.57Å; K3-I86 VanDerWaalsContact CA-O 3.23Å; K3-I86 WeakPolarHBondContact CA-O 3.41Å; T4-I86 HydrophobicContact CG2-CG1 4.16Å; T4-I86 PolarHBondContact N-O 2.94Å; T4-I86 WeakPolarHBondContact O-CG1 3.36Å; T4-I86 PolarHBondContact O-N 2.79Å; A6-I86 HydrophobicContact CB-CD1 4.11Å; A6-I86 HydrophobicContact CB-CG1 4.5Å; A6-I86 HydrophobicContact CB-CG2 4.44Å; C9-I86 HydrophobicContact CB-CD1 3.72Å; C9-I86 HydrophobicContact CB-CG1 4.47Å; C9-I86 WeakPolarHBondContact SG-CD1 3.4Å; R84-I86 HydrophobicContact CG-CG2 4.29Å; I86-Q94 HydrophobicContact CB-CB 4.05Å; I86-Q94 HydrophobicContact CG2-CB 3.93Å; I86-A95 HydrophobicContact CD1-CB 3.85Å
87S80.7Confident76.5Confident26 Ų2671.3 Ų71.318%0.18234%0.34CS..EExtended strand (participates in β ladder)trans-62.9142.1176.5-179.20000111.1L89 C90S87-L89 PolarHBondContact O-N 3.27Å; S87-L89 VanDerWaalsContact O-N 3.14Å; S87-L89 PolarHBondContact OG-N 3.2Å; S87-C90 PolarHBondContact O-N 2.85Å
88V78.5Confident76.3Confident70 Ų7075.5 Ų75.542%0.42437%0.365SS..THydrogen-bonded Turntrans-59.7-20.8173.7170.80000112.8E2 T4 C90E2-V88 VanDerWaalsContact C-CG2 3.49Å; E2-V88 HydrophobicContact CB-CB 4.25Å; E2-V88 HydrophobicContact CB-CG2 3.53Å; E2-V88 WeakPolarHBondContact O-CG2 3.49Å; E2-V88 PolarHBondContact O-N 3.47Å; T4-V88 HydrophobicContact CG2-CG2 4.28Å; V88-C90 PolarHBondContact O-N 3.5Å
89L80.7Confident76.1Confident131 Ų13178.3 Ų78.369%0.68638%0.376SS*.THydrogen-bonded Turntrans-64.5-7171-68.6171.7000114Y15 S87 L91Y15-L89 PolarHBondContact OH-O 3.38Å; S87-L89 PolarHBondContact O-N 3.27Å; S87-L89 VanDerWaalsContact O-N 3.14Å; S87-L89 PolarHBondContact OG-N 3.2Å; L89-L91 VanDerWaalsContact C-N 3.25Å; L89-L91 HydrophobicContact CB-CG 4.44Å; L89-L91 PolarHBondContact O-N 3.4Å; L89-L91 VanDerWaalsContact O-N 3.13Å
90C80.3Confident75.9Confident2 Ų272.7 Ų72.71%0.01435%0.349CS..  trans54.235.9173.4-150.90000115.5C9 S13 Y15 S87 V88 H92C9-C90 VanDerWaalsContact CA-SG 3.57Å; C9-C90 HydrophobicContact CB-CB 4.3Å; C9-C90 WeakPolarHBondContact CB-SG 3.43Å; C9-C90 PolarHBondContact O-SG 3.08Å; C9-C90 VanDerWaalsContact O-SG 3.4Å; C9-C90 WeakPolarHBondContact SG-CA 3.29Å; C9-C90 WeakPolarHBondContact SG-CB 3.49Å; C9-C90 CovalentContact SG-SG 2Å; C9-C90 PolarHBondContact SG-SG 3.24Å; S13-C90 PolarHBondContact OG-SG 2.9Å; Y15-C90 VanDerWaalsContact OH-CB 3.24Å; Y15-C90 WeakPolarHBondContact OH-CB 3.48Å; Y15-C90 PolarHBondContact OH-O 3.22Å; S87-C90 PolarHBondContact O-N 2.85Å; V88-C90 PolarHBondContact O-N 3.5Å; C90-H92 PolarHBondContact O-N 3.06Å; C90-H92 VanDerWaalsContact O-N 3.15Å
91L76.1Confident75.9Confident91 Ų9163.5 Ų63.548%0.47632%0.315SS..  trans-52.6128.5-177.3-67.1175.3000110.5L89 K93 Q94 A95L89-L91 VanDerWaalsContact C-N 3.25Å; L89-L91 HydrophobicContact CB-CG 4.44Å; L89-L91 PolarHBondContact O-N 3.4Å; L89-L91 VanDerWaalsContact O-N 3.13Å; L91-K93 PolarHBondContact O-N 3.47Å; L91-K93 VanDerWaalsContact O-N 3.09Å; L91-Q94 HydrophobicContact CB-CG 4.18Å; L91-Q94 WeakPolarHBondContact O-CA 3.38Å; L91-Q94 WeakPolarHBondContact O-CB 3.43Å; L91-Q94 PolarHBondContact O-N 3Å; L91-A95 PolarHBondContact O-N 3.42Å; L91-A95 VanDerWaalsContact O-N 3.11Å
92H73.3Confident76.5Confident34 Ų3466.9 Ų66.916%0.15733%0.326CS..Hα-helixtrans-51.1-42.9-172.7-162.351.3000111.8Q20 C90 Q94 A95 I96 Y101Q20-H92 PolarHBondContact NE2-CE1 2.99Å; Q20-H92 VanDerWaalsContact NE2-CE1 3.3Å; Q20-H92 PolarHBondContact NE2-NE2 2.89Å; C90-H92 PolarHBondContact O-N 3.06Å; C90-H92 VanDerWaalsContact O-N 3.15Å; H92-Q94 PolarHBondContact O-N 2.79Å; H92-A95 PolarHBondContact O-N 2.82Å; H92-I96 WeakPolarHBondContact CE1-CD1 3.36Å; H92-I96 PolarHBondContact O-N 3.22Å; H92-I96 VanDerWaalsContact O-N 3.1Å; H92-Y101 AromaticContact CD2-CE1 3.51Å; H92-Y101 AromaticContact CD2-CZ 3.59Å; H92-Y101 PolarHBondContact CD2-OH 2.75Å; H92-Y101 AromaticContact NE2-CE1 3.42Å; H92-Y101 WeakPolarHBondContact NE2-CE1 3.48Å; H92-Y101 AromaticContact NE2-CZ 3.78Å; H92-Y101 PolarHBondContact NE2-OH 3.34Å; H92-Y101 PolarHBondContact O-OH 3.33Å
93K73.3Confident77.2Confident92 Ų9264.4 Ų64.440%0.432%0.319SS..Hα-helixtrans-58.2-29.1176.8-66.7-179.3172.7166.30114L91 Y101 D183L91-K93 PolarHBondContact O-N 3.47Å; L91-K93 VanDerWaalsContact O-N 3.09Å; K93-Y101 PolarHBondContact N-OH 3.07Å; K93-D183 WeakPolarHBondContact CE-OD1 2.99Å; K93-D183 IonicContact NZ-OD1 2.84Å; K93-D183 PolarHBondContact NZ-OD1 3.22Å; K93-D183 IonicContact NZ-OD2 3.8Å; K93-D183 PolarHBondContact NZ-OD2 3.09Å
94Q73.7Confident77.9Confident67 Ų6757.4 Ų57.431%0.31328%0.282SS..Hα-helixtrans-90.3-38.8-178-62.1-177.5-10.900111.3R84 I86 L91 H92R84-Q94 PolarHBondContact NH1-O 3.48Å; I86-Q94 HydrophobicContact CB-CB 4.05Å; I86-Q94 HydrophobicContact CG2-CB 3.93Å; L91-Q94 HydrophobicContact CB-CG 4.18Å; L91-Q94 WeakPolarHBondContact O-CA 3.38Å; L91-Q94 WeakPolarHBondContact O-CB 3.43Å; L91-Q94 PolarHBondContact O-N 3Å; H92-Q94 PolarHBondContact O-N 2.79Å
95A73.7Confident78.2Confident1 Ų152.5 Ų52.51%0.00827%0.265CS..Hα-helixtrans-74.7-35.7-17700000113.5L10 I16 I86 L91 H92L10-A95 HydrophobicContact CD2-CB 4.04Å; L10-A95 HydrophobicContact CG-CB 4.25Å; I16-A95 HydrophobicContact CD1-CB 4.36Å; I86-A95 HydrophobicContact CD1-CB 3.85Å; L91-A95 PolarHBondContact O-N 3.42Å; L91-A95 VanDerWaalsContact O-N 3.11Å; H92-A95 PolarHBondContact O-N 2.82Å
96I74.7Confident78.7Confident3 Ų350.9 Ų50.92%0.01525%0.253CS..SBendtrans-105.8127.4-174.8-57.9-169.6000111L10 I16 Q20 H92 F100 Y101L10-I96 HydrophobicContact CD2-CD1 4.39Å; L10-I96 HydrophobicContact CD2-CG1 4Å; I16-I96 HydrophobicContact CG2-CD1 4.18Å; Q20-I96 HydrophobicContact CG-CD1 4.43Å; H92-I96 WeakPolarHBondContact CE1-CD1 3.36Å; H92-I96 PolarHBondContact O-N 3.22Å; H92-I96 VanDerWaalsContact O-N 3.1Å; I96-F100 HydrophobicContact CG2-CB 3.6Å; I96-F100 HydrophobicContact CG2-CG 4.48Å; I96-Y101 HydrophobicContact CB-CD2 4.45Å; I96-Y101 HydrophobicContact CB-CE2 3.75Å; I96-Y101 HydrophobicContact CG2-CD2 4.06Å; I96-Y101 HydrophobicContact CG2-CE2 3.85Å; I96-Y101 WeakPolarHBondContact O-CE2 3.01Å
97P75.9Confident79.1Confident37 Ų3753.4 Ų53.424%0.2426%0.264CS..  trans-60.5145.1174-20.428.9000112.6T77 Y99 F100 Y101T77-P97 VanDerWaalsContact CG2-CD 3.41Å; T77-P97 HydrophobicContact CG2-CG 3.96Å; P97-Y99 PolarHBondContact O-N 3.15Å; P97-F100 HydrophobicContact CB-CD2 3.91Å; P97-F100 HydrophobicContact CG-CD2 3.74Å; P97-F100 HydrophobicContact CG-CE2 4.14Å; P97-F100 WeakPolarHBondContact O-CB 3.25Å; P97-F100 PolarHBondContact O-N 2.96Å; P97-Y101 PolarHBondContact O-N 3.07Å
98V75.6Confident79.4Confident90 Ų9053 Ų5355%0.54526%0.26SS..Hα-helixtrans-55.7-37.5-179.5-1790000112.2F100 Y101 Y102V98-F100 VanDerWaalsContact C-N 3.26Å; V98-F100 PolarHBondContact O-N 3.42Å; V98-Y101 WeakPolarHBondContact O-CB 3.42Å; V98-Y101 PolarHBondContact O-N 3.4Å; V98-Y101 VanDerWaalsContact O-N 3.09Å; V98-Y102 PolarHBondContact O-N 3.3Å
99Y77.5Confident79.9Confident165 Ų16550.8 Ų50.865%0.64725%0.245SC*.Hα-helixtrans-56.8-38.6176.1-176.2-99.8000112.8P97 Y101 Y102 C103P97-Y99 PolarHBondContact O-N 3.15Å; Y99-Y101 PolarHBondContact O-N 3.14Å; Y99-Y102 WeakPolarHBondContact O-CB 3.4Å; Y99-Y102 PolarHBondContact O-N 2.86Å; Y99-C103 WeakPolarHBondContact CE1-SG 3.26Å; Y99-C103 PolarHBondContact O-N 3.45Å; Y99-C103 PolarHBondContact O-SG 2.97Å
100F79.8Confident80.4Confident19 Ų1947.6 Ų47.68%0.08323%0.231CC..Hα-helixtrans-69.1-34.6176.9-80.6-72.7000113.2I73 I76 I96 P97 V98 Y102 C103 D104I73-F100 HydrophobicContact CB-CD1 4.41Å; I73-F100 HydrophobicContact CG1-CD1 3.73Å; I73-F100 HydrophobicContact CG1-CE1 4.11Å; I73-F100 HydrophobicContact CG1-CG 4.37Å; I73-F100 HydrophobicContact CG2-CD1 4.46Å; I73-F100 HydrophobicContact CG2-CG 4.37Å; I76-F100 HydrophobicContact CB-CE1 4.49Å; I76-F100 HydrophobicContact CB-CE2 3.82Å; I76-F100 HydrophobicContact CB-CZ 3.4Å; I76-F100 VanDerWaalsContact CB-CZ 3.4Å; I76-F100 HydrophobicContact CD1-CE1 3.92Å; I76-F100 HydrophobicContact CD1-CZ 3.43Å; I76-F100 VanDerWaalsContact CD1-CZ 3.43Å; I76-F100 HydrophobicContact CG1-CZ 3.95Å; I76-F100 HydrophobicContact CG2-CE2 3.49Å; I76-F100 VanDerWaalsContact CG2-CE2 3.49Å; I76-F100 HydrophobicContact CG2-CZ 3.42Å; I76-F100 VanDerWaalsContact CG2-CZ 3.42Å; I96-F100 HydrophobicContact CG2-CB 3.6Å; I96-F100 HydrophobicContact CG2-CG 4.48Å; P97-F100 HydrophobicContact CB-CD2 3.91Å; P97-F100 HydrophobicContact CG-CD2 3.74Å; P97-F100 HydrophobicContact CG-CE2 4.14Å; P97-F100 WeakPolarHBondContact O-CB 3.25Å; P97-F100 PolarHBondContact O-N 2.96Å; V98-F100 VanDerWaalsContact C-N 3.26Å; V98-F100 PolarHBondContact O-N 3.42Å; F100-Y102 PolarHBondContact O-N 3.48Å; F100-C103 PolarHBondContact O-N 3.36Å; F100-D104 WeakPolarHBondContact O-CB 3.34Å; F100-D104 PolarHBondContact O-N 3.32Å
101Y77Confident80.8Confident20 Ų2047.8 Ų47.88%0.07823%0.233CC..Hα-helixtrans-60.6-39.6172.5-75.7-72.8000111.4H92 K93 I96 P97 V98 Y99 N105H92-Y101 AromaticContact CD2-CE1 3.51Å; H92-Y101 AromaticContact CD2-CZ 3.59Å; H92-Y101 PolarHBondContact CD2-OH 2.75Å; H92-Y101 AromaticContact NE2-CE1 3.42Å; H92-Y101 WeakPolarHBondContact NE2-CE1 3.48Å; H92-Y101 AromaticContact NE2-CZ 3.78Å; H92-Y101 PolarHBondContact NE2-OH 3.34Å; H92-Y101 PolarHBondContact O-OH 3.33Å; K93-Y101 PolarHBondContact N-OH 3.07Å; I96-Y101 HydrophobicContact CB-CD2 4.45Å; I96-Y101 HydrophobicContact CB-CE2 3.75Å; I96-Y101 HydrophobicContact CG2-CD2 4.06Å; I96-Y101 HydrophobicContact CG2-CE2 3.85Å; I96-Y101 WeakPolarHBondContact O-CE2 3.01Å; P97-Y101 PolarHBondContact O-N 3.07Å; V98-Y101 WeakPolarHBondContact O-CB 3.42Å; V98-Y101 PolarHBondContact O-N 3.4Å; V98-Y101 VanDerWaalsContact O-N 3.09Å; Y99-Y101 PolarHBondContact O-N 3.14Å; Y101-N105 VanDerWaalsContact O-CB 3.31Å; Y101-N105 WeakPolarHBondContact O-CB 3.15Å; Y101-N105 VanDerWaalsContact O-CG 3.24Å; Y101-N105 PolarHBondContact O-N 2.88Å; Y101-N105 PolarHBondContact O-ND2 3.38Å
102Y79.7Confident81.4Confident78 Ų7843.5 Ų43.531%0.30621%0.21SC..Hα-helixtrans-63.7-49.2175.4-170.7-98.6000111.6V98 Y99 F100 D104 N105 K106 T170 E174V98-Y102 PolarHBondContact O-N 3.3Å; Y99-Y102 WeakPolarHBondContact O-CB 3.4Å; Y99-Y102 PolarHBondContact O-N 2.86Å; F100-Y102 PolarHBondContact O-N 3.48Å; Y102-D104 PolarHBondContact O-N 3.34Å; Y102-N105 PolarHBondContact O-N 2.94Å; Y102-K106 HydrophobicContact CD1-CG 4.09Å; Y102-K106 HydrophobicContact CE1-CD 4.38Å; Y102-K106 HydrophobicContact CE1-CG 3.86Å; Y102-K106 WeakPolarHBondContact O-CB 2.89Å; Y102-K106 VanDerWaalsContact O-CG 3.29Å; Y102-K106 WeakPolarHBondContact O-CG 3.32Å; Y102-K106 PolarHBondContact O-N 3.05Å; Y102-K106 WeakPolarHBondContact OH-CE 3.37Å; Y102-K106 PolarHBondContact OH-NZ 2.92Å; Y102-K106 VanDerWaalsContact OH-NZ 3.15Å; Y102-T170 HydrophobicContact CD2-CG2 4.09Å; Y102-T170 HydrophobicContact CE2-CG2 3.74Å; Y102-E174 HydrophobicContact CE2-CG 4.06Å; Y102-E174 VanDerWaalsContact CE2-OE1 3.27Å; Y102-E174 WeakPolarHBondContact CE2-OE1 3.38Å; Y102-E174 PolarHBondContact OH-OE1 3.46Å
103C84.5Confident82.2Confident37 Ų3744.8 Ų44.825%0.2522%0.221CC..Hα-helixtrans-61.2-43.5177.3-66.90000112.7Y99 F100 K106 F107Y99-C103 WeakPolarHBondContact CE1-SG 3.26Å; Y99-C103 PolarHBondContact O-N 3.45Å; Y99-C103 PolarHBondContact O-SG 2.97Å; F100-C103 PolarHBondContact O-N 3.36Å; C103-K106 PolarHBondContact O-N 2.86Å; C103-F107 WeakPolarHBondContact O-CB 3.31Å; C103-F107 PolarHBondContact O-N 3.43Å
104D85.2Confident83.2Confident8 Ų846.4 Ų46.44%0.04323%0.228CC..Hα-helixtrans-62.3-47.4178.5-170.462.8000111.1Q20 K24 F100 Y102 K106 F107 L108Q20-D104 PolarHBondContact OE1-OD1 3.22Å; K24-D104 WeakPolarHBondContact CE-OD1 3.27Å; K24-D104 IonicContact NZ-OD1 2.74Å; K24-D104 PolarHBondContact NZ-OD1 2.95Å; F100-D104 WeakPolarHBondContact O-CB 3.34Å; F100-D104 PolarHBondContact O-N 3.32Å; Y102-D104 PolarHBondContact O-N 3.34Å; D104-K106 PolarHBondContact O-N 2.86Å; D104-F107 WeakPolarHBondContact O-CB 3.47Å; D104-F107 PolarHBondContact O-N 3.29Å; D104-L108 WeakPolarHBondContact O-CG 3.42Å; D104-L108 PolarHBondContact O-N 3.37Å
105N84.1Confident84Confident18 Ų1843.2 Ų43.210%0.09621%0.213CC..Hα-helixtrans-63.1-43.9175.9-76-19.9000112.3Y101 Y102 F107 L108 I109 P166 T169 T170Y101-N105 VanDerWaalsContact O-CB 3.31Å; Y101-N105 WeakPolarHBondContact O-CB 3.15Å; Y101-N105 VanDerWaalsContact O-CG 3.24Å; Y101-N105 PolarHBondContact O-N 2.88Å; Y101-N105 PolarHBondContact O-ND2 3.38Å; Y102-N105 PolarHBondContact O-N 2.94Å; N105-F107 VanDerWaalsContact C-N 3.29Å; N105-F107 PolarHBondContact O-N 3.04Å; N105-L108 PolarHBondContact O-N 2.98Å; N105-I109 WeakPolarHBondContact O-CB 3.38Å; N105-I109 WeakPolarHBondContact O-CD1 3.4Å; N105-I109 WeakPolarHBondContact O-CG1 3.38Å; N105-I109 PolarHBondContact O-N 2.78Å; N105-P166 HydrophobicContact CB-CB 4.4Å; N105-T169 PolarHBondContact ND2-OG1 3.35Å; N105-T170 WeakPolarHBondContact CB-OG1 3.44Å; N105-T170 PolarHBondContact ND2-OG1 3.18Å
106K86.9Confident84.8Confident71 Ų7146 Ų4631%0.30923%0.228SC..Hα-helixtrans-62.4-37.9176.3-71.2-69.2-174.8-172.90111.3Y102 C103 D104 I109 T110 T170 E174Y102-K106 HydrophobicContact CD1-CG 4.09Å; Y102-K106 HydrophobicContact CE1-CD 4.38Å; Y102-K106 HydrophobicContact CE1-CG 3.86Å; Y102-K106 WeakPolarHBondContact O-CB 2.89Å; Y102-K106 VanDerWaalsContact O-CG 3.29Å; Y102-K106 WeakPolarHBondContact O-CG 3.32Å; Y102-K106 PolarHBondContact O-N 3.05Å; Y102-K106 WeakPolarHBondContact OH-CE 3.37Å; Y102-K106 PolarHBondContact OH-NZ 2.92Å; Y102-K106 VanDerWaalsContact OH-NZ 3.15Å; C103-K106 PolarHBondContact O-N 2.86Å; D104-K106 PolarHBondContact O-N 2.86Å; K106-I109 PolarHBondContact O-N 3.26Å; K106-T110 WeakPolarHBondContact O-CB 3.4Å; K106-T110 VanDerWaalsContact O-CG2 3.25Å; K106-T110 WeakPolarHBondContact O-CG2 3.4Å; K106-T110 PolarHBondContact O-N 2.88Å; K106-T110 PolarHBondContact O-OG1 3.41Å; K106-T170 HydrophobicContact CD-CG2 4.4Å; K106-E174 IonicContact NZ-OE1 3.55Å; K106-E174 PolarHBondContact NZ-OE1 3.17Å
107F89.2Confident85.7Confident62 Ų6249.7 Ų49.727%0.27225%0.246SC..Hα-helixtrans-61.6-47.5173.8179.5-92.8000111.7K24 L28 F69 C103 D104 N105 I109 T110 A111K24-F107 HydrophobicContact CB-CE1 4.46Å; K24-F107 HydrophobicContact CD-CE1 4.42Å; K24-F107 HydrophobicContact CG-CD1 4.38Å; K24-F107 HydrophobicContact CG-CE1 4.16Å; L28-F107 HydrophobicContact CD1-CZ 4.17Å; L28-F107 HydrophobicContact CD2-CE1 4.43Å; L28-F107 HydrophobicContact CD2-CZ 3.92Å; L28-F107 HydrophobicContact CG-CE1 4.33Å; L28-F107 HydrophobicContact CG-CZ 4.17Å; F69-F107 HydrophobicContact CE2-CD2 4.44Å; F69-F107 HydrophobicContact CE2-CG 4.46Å; C103-F107 WeakPolarHBondContact O-CB 3.31Å; C103-F107 PolarHBondContact O-N 3.43Å; D104-F107 WeakPolarHBondContact O-CB 3.47Å; D104-F107 PolarHBondContact O-N 3.29Å; N105-F107 VanDerWaalsContact C-N 3.29Å; N105-F107 PolarHBondContact O-N 3.04Å; F107-I109 PolarHBondContact O-N 3.12Å; F107-T110 WeakPolarHBondContact CA-OG1 3.39Å; F107-T110 PolarHBondContact O-N 2.93Å; F107-T110 PolarHBondContact O-OG1 3.28Å; F107-A111 WeakPolarHBondContact O-CB 3.33Å; F107-A111 PolarHBondContact O-N 2.88Å
108L87.8Confident86.4Confident18 Ų1848.1 Ų48.19%0.09424%0.236CC..Hα-helixtrans-64-42.2177.9-67.7172000112.1D104 N105 A111 A112 P166D104-L108 WeakPolarHBondContact O-CG 3.42Å; D104-L108 PolarHBondContact O-N 3.37Å; N105-L108 PolarHBondContact O-N 2.98Å; L108-A111 PolarHBondContact O-N 2.87Å; L108-A112 WeakPolarHBondContact O-CB 3.43Å; L108-A112 PolarHBondContact O-N 3.39Å; L108-P166 HydrophobicContact CD1-CG 4.2Å
109I88.5Confident87Confident22 Ų2245.3 Ų45.311%0.11322%0.216CC..Hα-helixtrans-61.3-47.3176.1-71.1165.8000110.4N105 K106 F107 A112 V113 F163 P166 F167N105-I109 WeakPolarHBondContact O-CB 3.38Å; N105-I109 WeakPolarHBondContact O-CD1 3.4Å; N105-I109 WeakPolarHBondContact O-CG1 3.38Å; N105-I109 PolarHBondContact O-N 2.78Å; K106-I109 PolarHBondContact O-N 3.26Å; F107-I109 PolarHBondContact O-N 3.12Å; I109-A112 PolarHBondContact O-N 2.85Å; I109-V113 VanDerWaalsContact O-CG2 3.29Å; I109-V113 WeakPolarHBondContact O-CG2 3.22Å; I109-V113 PolarHBondContact O-N 3.25Å; I109-F163 HydrophobicContact CB-CD2 4.48Å; I109-F163 HydrophobicContact CB-CE2 4.01Å; I109-F163 HydrophobicContact CG1-CD2 4.32Å; I109-F163 HydrophobicContact CG1-CE2 4.05Å; I109-F163 HydrophobicContact CG2-CE2 3.71Å; I109-F163 HydrophobicContact CG2-CZ 4.38Å; I109-P166 HydrophobicContact CG1-CB 4.38Å; I109-F167 HydrophobicContact CD1-CB 4.49Å; I109-F167 HydrophobicContact CD1-CD2 4.37Å
110T90.7Very high87.7Confident65 Ų6542.6 Ų42.640%0.39921%0.212SC..Hα-helixtrans-65.2-45.3179.849.20000111.6K106 F107 A112 V113 F114K106-T110 WeakPolarHBondContact O-CB 3.4Å; K106-T110 VanDerWaalsContact O-CG2 3.25Å; K106-T110 WeakPolarHBondContact O-CG2 3.4Å; K106-T110 PolarHBondContact O-N 2.88Å; K106-T110 PolarHBondContact O-OG1 3.41Å; F107-T110 WeakPolarHBondContact CA-OG1 3.39Å; F107-T110 PolarHBondContact O-N 2.93Å; F107-T110 PolarHBondContact O-OG1 3.28Å; T110-A112 VanDerWaalsContact C-N 3.29Å; T110-A112 PolarHBondContact O-N 3.39Å; T110-V113 PolarHBondContact O-N 3.4Å; T110-F114 WeakPolarHBondContact O-CD2 3.35Å; T110-F114 PolarHBondContact O-N 2.69Å
111A90.5Very high88.2Confident5 Ų545.1 Ų45.14%0.04123%0.226CC..Hα-helixtrans-57.7-41.6175.200000112.2S27 F107 L108 F114 T115S27-A111 WeakPolarHBondContact OG-CB 3.39Å; F107-A111 WeakPolarHBondContact O-CB 3.33Å; F107-A111 PolarHBondContact O-N 2.88Å; L108-A111 PolarHBondContact O-N 2.87Å; A111-F114 PolarHBondContact O-N 3.44Å; A111-T115 WeakPolarHBondContact O-CB 3.46Å; A111-T115 PolarHBondContact O-N 3.33Å; A111-T115 PolarHBondContact O-OG1 2.82Å
112A88.3Confident88.7Confident1 Ų144.3 Ų44.31%0.00822%0.223CC..Hα-helixtrans-66-43175.400000112.7L108 I109 T110 T115 I116 M159 F163L108-A112 WeakPolarHBondContact O-CB 3.43Å; L108-A112 PolarHBondContact O-N 3.39Å; I109-A112 PolarHBondContact O-N 2.85Å; T110-A112 VanDerWaalsContact C-N 3.29Å; T110-A112 PolarHBondContact O-N 3.39Å; A112-T115 WeakPolarHBondContact O-CA 3.46Å; A112-T115 VanDerWaalsContact O-CB 3.29Å; A112-T115 WeakPolarHBondContact O-CB 3.43Å; A112-T115 PolarHBondContact O-N 3.39Å; A112-T115 VanDerWaalsContact O-N 3.13Å; A112-I116 WeakPolarHBondContact O-CG1 3.45Å; A112-I116 PolarHBondContact O-N 3.2Å; A112-M159 HydrophobicContact CB-CE 3.82Å; A112-M159 HydrophobicContact CB-SD 3.93Å; A112-M159 WeakPolarHBondContact O-CE 3.22Å; A112-F163 HydrophobicContact CB-CB 3.95Å; A112-F163 HydrophobicContact CB-CD2 3.31Å; A112-F163 HydrophobicContact CB-CE2 4.03Å; A112-F163 HydrophobicContact CB-CG 3.95Å
113V90.4Very high89Confident62 Ų6243.6 Ų43.638%0.37622%0.223SC..Hα-helixtrans-61-45.9175.1169.70000110.9I109 T110 T115 I116 I117 F163I109-V113 VanDerWaalsContact O-CG2 3.29Å; I109-V113 WeakPolarHBondContact O-CG2 3.22Å; I109-V113 PolarHBondContact O-N 3.25Å; T110-V113 PolarHBondContact O-N 3.4Å; V113-T115 PolarHBondContact O-N 3.47Å; V113-I116 PolarHBondContact O-N 2.85Å; V113-I116 VanDerWaalsContact O-N 3.15Å; V113-I117 HydrophobicContact CG1-CD1 3.86Å; V113-I117 HydrophobicContact CG1-CG1 4.48Å; V113-I117 WeakPolarHBondContact O-CG1 3.4Å; V113-I117 PolarHBondContact O-N 3.46Å; V113-F163 HydrophobicContact CG2-CE2 4.28Å
114F93Very high89.2Confident125 Ų12544.2 Ų44.255%0.54823%0.23SC..Hα-helixtrans-60.2-36.4174.2-78.3-65.2000112.1L31 T110 A111 I117 A118L31-F114 HydrophobicContact CD1-CB 3.64Å; L31-F114 HydrophobicContact CD2-CB 4.37Å; T110-F114 WeakPolarHBondContact O-CD2 3.35Å; T110-F114 PolarHBondContact O-N 2.69Å; A111-F114 PolarHBondContact O-N 3.44Å; F114-I117 PolarHBondContact O-N 3.11Å; F114-A118 WeakPolarHBondContact O-CB 3.44Å; F114-A118 PolarHBondContact O-N 3.37Å
115T91.4Very high89.2Confident0 Ų045 Ų450%024%0.235CC..Hα-helixtrans-64.1-43.3175.4-57.90000111.2V30 L31 A34 A111 A112 V113 A118 Y119 V155 M159V30-T115 HydrophobicContact CG1-CG2 3.78Å; L31-T115 WeakPolarHBondContact CA-OG1 3.49Å; L31-T115 WeakPolarHBondContact CB-OG1 3.5Å; A34-T115 HydrophobicContact CB-CG2 4.29Å; A111-T115 WeakPolarHBondContact O-CB 3.46Å; A111-T115 PolarHBondContact O-N 3.33Å; A111-T115 PolarHBondContact O-OG1 2.82Å; A112-T115 WeakPolarHBondContact O-CA 3.46Å; A112-T115 VanDerWaalsContact O-CB 3.29Å; A112-T115 WeakPolarHBondContact O-CB 3.43Å; A112-T115 PolarHBondContact O-N 3.39Å; A112-T115 VanDerWaalsContact O-N 3.13Å; V113-T115 PolarHBondContact O-N 3.47Å; T115-A118 PolarHBondContact O-N 2.83Å; T115-Y119 WeakPolarHBondContact O-CB 3.19Å; T115-Y119 PolarHBondContact O-N 3.42Å; T115-V155 HydrophobicContact CG2-CG1 4.13Å; T115-V155 HydrophobicContact CG2-CG2 4.12Å; T115-M159 HydrophobicContact CG2-CE 4.08Å
116I90.1Very high89.1Confident61 Ų6144.5 Ų44.531%0.31323%0.232SC..Hα-helixtrans-61.8-47.6175.2-66.3163.1000110.3A112 V113 A118 Y119 L120 M159A112-I116 WeakPolarHBondContact O-CG1 3.45Å; A112-I116 PolarHBondContact O-N 3.2Å; V113-I116 PolarHBondContact O-N 2.85Å; V113-I116 VanDerWaalsContact O-N 3.15Å; I116-A118 PolarHBondContact O-N 2.79Å; I116-Y119 WeakPolarHBondContact O-CB 3.26Å; I116-Y119 PolarHBondContact O-N 3.04Å; I116-Y119 VanDerWaalsContact O-N 3.14Å; I116-L120 HydrophobicContact CG2-CD1 4.12Å; I116-L120 HydrophobicContact CG2-CG 4.32Å; I116-L120 WeakPolarHBondContact O-CG 3.31Å; I116-L120 PolarHBondContact O-N 3.08Å; I116-M159 HydrophobicContact CD1-CE 4.32Å; I116-M159 HydrophobicContact CD1-CG 4.18Å; I116-M159 HydrophobicContact CD1-SD 3.47Å; I116-M159 WeakPolarHBondContact CD1-SD 3.39Å; I116-M159 HydrophobicContact CG1-CE 3.83Å; I116-M159 HydrophobicContact CG1-CG 4.06Å; I116-M159 HydrophobicContact CG1-SD 3.58Å; I116-M159 VanDerWaalsContact CG1-SD 3.58Å
117I92.7Very high88.9Confident79 Ų7947.9 Ų47.941%0.40525%0.246SC..Hα-helixtrans-59.6-48179.3-66.9166.1000110.1V113 F114 Y119 L120 I121V113-I117 HydrophobicContact CG1-CD1 3.86Å; V113-I117 HydrophobicContact CG1-CG1 4.48Å; V113-I117 WeakPolarHBondContact O-CG1 3.4Å; V113-I117 PolarHBondContact O-N 3.46Å; F114-I117 PolarHBondContact O-N 3.11Å; I117-Y119 VanDerWaalsContact C-N 3.3Å; I117-Y119 PolarHBondContact O-N 3.47Å; I117-L120 PolarHBondContact O-N 3.29Å; I117-I121 HydrophobicContact CG2-CD1 3.84Å; I117-I121 HydrophobicContact CG2-CG1 4.49Å; I117-I121 VanDerWaalsContact O-CG1 3.29Å; I117-I121 WeakPolarHBondContact O-CG1 3.45Å; I117-I121 PolarHBondContact O-N 2.81Å
118A91.4Very high88.6Confident4 Ų451.9 Ų51.93%0.03326%0.264CS..Hα-helixtrans-57.8-43.7175.100000111.3A34 L35 C38 F114 T115 I116 L120 I121 M122A34-A118 HydrophobicContact CB-CB 3.93Å; L35-A118 HydrophobicContact CD2-CB 4.07Å; C38-A118 PolarHBondContact SG-O 2.81Å; F114-A118 WeakPolarHBondContact O-CB 3.44Å; F114-A118 PolarHBondContact O-N 3.37Å; T115-A118 PolarHBondContact O-N 2.83Å; I116-A118 PolarHBondContact O-N 2.79Å; A118-L120 PolarHBondContact O-N 3.31Å; A118-I121 PolarHBondContact O-N 3.45Å; A118-M122 WeakPolarHBondContact O-CB 3.06Å; A118-M122 PolarHBondContact O-N 3.28Å
119Y89.2Confident88Confident32 Ų3252.4 Ų52.413%0.12527%0.269CS..Hα-helixtrans-62.7-41.6177-179.4-93000113.1T115 I116 I117 M122 M123 K152 V155T115-Y119 WeakPolarHBondContact O-CB 3.19Å; T115-Y119 PolarHBondContact O-N 3.42Å; I116-Y119 WeakPolarHBondContact O-CB 3.26Å; I116-Y119 PolarHBondContact O-N 3.04Å; I116-Y119 VanDerWaalsContact O-N 3.14Å; I117-Y119 VanDerWaalsContact C-N 3.3Å; I117-Y119 PolarHBondContact O-N 3.47Å; Y119-M122 HydrophobicContact CD2-CE 3.29Å; Y119-M122 HydrophobicContact CE2-CE 3.77Å; Y119-M122 HydrophobicContact CG-CE 4.17Å; Y119-M122 WeakPolarHBondContact O-CB 3.46Å; Y119-M122 PolarHBondContact O-N 2.82Å; Y119-M123 HydrophobicContact CD1-CG 4.24Å; Y119-M123 HydrophobicContact CE1-CG 3.67Å; Y119-M123 HydrophobicContact CE1-SD 4.42Å; Y119-M123 HydrophobicContact CE2-CG 4.39Å; Y119-M123 WeakPolarHBondContact O-CG 3.1Å; Y119-M123 PolarHBondContact O-N 3.34Å; Y119-M123 PolarHBondContact OH-SD 3.14Å; Y119-M123 VanDerWaalsContact OH-SD 3.4Å; Y119-K152 HydrophobicContact CE2-CB 3.79Å; Y119-K152 HydrophobicContact CE2-CG 4.25Å; Y119-K152 WeakPolarHBondContact OH-CB 3.31Å; Y119-K152 VanDerWaalsContact OH-CD 3.26Å; Y119-K152 WeakPolarHBondContact OH-CD 3.38Å; Y119-K152 WeakPolarHBondContact OH-CG 3.4Å; Y119-V155 HydrophobicContact CD2-CB 4.39Å; Y119-V155 HydrophobicContact CD2-CG2 4.2Å; Y119-V155 HydrophobicContact CG-CG1 4.33Å
120L90.5Very high87.4Confident108 Ų10855.9 Ų55.957%0.56528%0.284SS*.Hα-helixtrans-64.4-42.3175.4-68.6176000111.7I116 I117 A118 M123 A124I116-L120 HydrophobicContact CG2-CD1 4.12Å; I116-L120 HydrophobicContact CG2-CG 4.32Å; I116-L120 WeakPolarHBondContact O-CG 3.31Å; I116-L120 PolarHBondContact O-N 3.08Å; I117-L120 PolarHBondContact O-N 3.29Å; A118-L120 PolarHBondContact O-N 3.31Å; L120-M123 PolarHBondContact O-N 3.12Å; L120-A124 WeakPolarHBondContact O-CB 3.29Å; L120-A124 PolarHBondContact O-N 3.15Å
121I91Very high86.5Confident72 Ų7261.7 Ų61.737%0.36930%0.304SS..Hα-helixtrans-59.4-48.7173.9-68.3166.1000109.8F42 I117 A118 M123 A124 L125F42-I121 HydrophobicContact CE2-CG2 4.23Å; F42-I121 HydrophobicContact CZ-CG2 4.14Å; I117-I121 HydrophobicContact CG2-CD1 3.84Å; I117-I121 HydrophobicContact CG2-CG1 4.49Å; I117-I121 VanDerWaalsContact O-CG1 3.29Å; I117-I121 WeakPolarHBondContact O-CG1 3.45Å; I117-I121 PolarHBondContact O-N 2.81Å; A118-I121 PolarHBondContact O-N 3.45Å; I121-M123 VanDerWaalsContact C-N 3.32Å; I121-M123 PolarHBondContact O-N 2.9Å; I121-A124 WeakPolarHBondContact O-CB 3.47Å; I121-A124 PolarHBondContact O-N 3.36Å; I121-A124 VanDerWaalsContact O-N 3.1Å; I121-L125 HydrophobicContact CG2-CD1 3.82Å; I121-L125 HydrophobicContact CG2-CG 4.19Å; I121-L125 VanDerWaalsContact O-CG 3.3Å; I121-L125 WeakPolarHBondContact O-CG 3.49Å; I121-L125 PolarHBondContact O-N 3.28Å
122M88.1Confident85.4Confident2 Ų270.2 Ų70.21%0.0134%0.34CS..Hα-helixtrans-55.3-45.8177.5-169175.341.200111.7R37 L41 A118 Y119 L125 M126 L148 I151R37-M122 HydrophobicContact CB-SD 3.47Å; R37-M122 WeakPolarHBondContact CB-SD 3.33Å; R37-M122 HydrophobicContact CG-SD 4.3Å; L41-M122 HydrophobicContact CD1-CB 4.47Å; L41-M122 HydrophobicContact CD1-CG 3.56Å; A118-M122 WeakPolarHBondContact O-CB 3.06Å; A118-M122 PolarHBondContact O-N 3.28Å; Y119-M122 HydrophobicContact CD2-CE 3.29Å; Y119-M122 HydrophobicContact CE2-CE 3.77Å; Y119-M122 HydrophobicContact CG-CE 4.17Å; Y119-M122 WeakPolarHBondContact O-CB 3.46Å; Y119-M122 PolarHBondContact O-N 2.82Å; M122-L125 PolarHBondContact O-N 3.12Å; M122-M126 WeakPolarHBondContact O-CB 3.34Å; M122-M126 WeakPolarHBondContact O-CG 3.34Å; M122-M126 PolarHBondContact O-N 2.87Å; M122-L148 HydrophobicContact CE-CD1 3.29Å; M122-L148 HydrophobicContact CG-CD1 3.46Å; M122-L148 VanDerWaalsContact CG-CD1 3.46Å; M122-L148 HydrophobicContact SD-CD1 3.15Å; M122-L148 WeakPolarHBondContact SD-CD1 3.25Å; M122-I151 HydrophobicContact CE-CG2 4Å
123M86.5Confident84.4Confident64 Ų6471.9 Ų71.932%0.31535%0.349SS..Hα-helixtrans-63.7-40.5176.3-73.2-64.9-64.900112.7Y119 L120 I121 K127 L148Y119-M123 HydrophobicContact CD1-CG 4.24Å; Y119-M123 HydrophobicContact CE1-CG 3.67Å; Y119-M123 HydrophobicContact CE1-SD 4.42Å; Y119-M123 HydrophobicContact CE2-CG 4.39Å; Y119-M123 WeakPolarHBondContact O-CG 3.1Å; Y119-M123 PolarHBondContact O-N 3.34Å; Y119-M123 PolarHBondContact OH-SD 3.14Å; Y119-M123 VanDerWaalsContact OH-SD 3.4Å; L120-M123 PolarHBondContact O-N 3.12Å; I121-M123 VanDerWaalsContact C-N 3.32Å; I121-M123 PolarHBondContact O-N 2.9Å; M123-K127 WeakPolarHBondContact O-CG 3.38Å; M123-K127 PolarHBondContact O-N 3.3Å; M123-K127 VanDerWaalsContact O-N 3.11Å; M123-L148 HydrophobicContact SD-CD2 3.64Å; M123-L148 HydrophobicContact SD-CG 4.25Å
124A87.9Confident83.1Confident49 Ų4977.4 Ų77.441%0.40537%0.371SS..Hα-helixtrans-66.4-42.8176.900000111.7L120 I121 K127 K128L120-A124 WeakPolarHBondContact O-CB 3.29Å; L120-A124 PolarHBondContact O-N 3.15Å; I121-A124 WeakPolarHBondContact O-CB 3.47Å; I121-A124 PolarHBondContact O-N 3.36Å; I121-A124 VanDerWaalsContact O-N 3.1Å; A124-K127 PolarHBondContact O-N 2.9Å; A124-K128 WeakPolarHBondContact O-CG 3.4Å; A124-K128 PolarHBondContact O-N 3.5Å
125L85.2Confident81.9Confident26 Ų2674.1 Ų74.114%0.13637%0.372CS..Hα-helixtrans-62.3-45.3175.6-68.7172.2000111.3L41 F42 I121 M122 K127 K128 C129L41-L125 HydrophobicContact CB-CB 4.41Å; L41-L125 HydrophobicContact CB-CD1 4.24Å; L41-L125 HydrophobicContact CD1-CB 4.24Å; F42-L125 HydrophobicContact CD1-CD1 4.13Å; F42-L125 HydrophobicContact CD1-CD2 4.08Å; F42-L125 HydrophobicContact CD2-CD1 3.86Å; F42-L125 HydrophobicContact CE1-CD1 3.8Å; F42-L125 HydrophobicContact CE1-CD2 3.53Å; F42-L125 HydrophobicContact CE1-CG 4.27Å; F42-L125 HydrophobicContact CE2-CD1 3.49Å; F42-L125 VanDerWaalsContact CE2-CD1 3.49Å; F42-L125 HydrophobicContact CG-CD1 4.16Å; F42-L125 HydrophobicContact CZ-CD1 3.47Å; F42-L125 VanDerWaalsContact CZ-CD1 3.47Å; F42-L125 HydrophobicContact CZ-CD2 3.9Å; F42-L125 HydrophobicContact CZ-CG 4.19Å; I121-L125 HydrophobicContact CG2-CD1 3.82Å; I121-L125 HydrophobicContact CG2-CG 4.19Å; I121-L125 VanDerWaalsContact O-CG 3.3Å; I121-L125 WeakPolarHBondContact O-CG 3.49Å; I121-L125 PolarHBondContact O-N 3.28Å; M122-L125 PolarHBondContact O-N 3.12Å; L125-K127 VanDerWaalsContact C-N 3.32Å; L125-K127 PolarHBondContact O-N 2.86Å; L125-K128 CarbonylContact O-C 3.6Å; L125-K128 WeakPolarHBondContact O-CA 3.34Å; L125-K128 WeakPolarHBondContact O-CB 3.11Å; L125-K128 PolarHBondContact O-N 3.28Å; L125-C129 PolarHBondContact O-N 2.92Å; L125-C129 PolarHBondContact O-SG 3.13Å
126M82.4Confident80.7Confident7 Ų779.2 Ų79.23%0.03440%0.403CS..Hα-helixtrans-58-43.7176.5-76.4-71-59.900112.3L41 M122 K128 C129 Q130 L141 E144 K145 L148L41-M126 HydrophobicContact CD1-CG 3.64Å; L41-M126 HydrophobicContact CD1-SD 3.89Å; L41-M126 HydrophobicContact CD2-CG 4.29Å; L41-M126 HydrophobicContact CD2-SD 3.42Å; L41-M126 WeakPolarHBondContact CD2-SD 3.22Å; L41-M126 HydrophobicContact CG-SD 4.31Å; M122-M126 WeakPolarHBondContact O-CB 3.34Å; M122-M126 WeakPolarHBondContact O-CG 3.34Å; M122-M126 PolarHBondContact O-N 2.87Å; M126-K128 VanDerWaalsContact C-N 3.33Å; M126-K128 PolarHBondContact O-N 3.37Å; M126-C129 PolarHBondContact O-N 2.75Å; M126-Q130 VanDerWaalsContact O-CG 3.32Å; M126-Q130 WeakPolarHBondContact O-CG 3.47Å; M126-Q130 PolarHBondContact O-N 2.95Å; M126-L141 HydrophobicContact CE-CD1 3.64Å; M126-L141 HydrophobicContact CE-CG 4.23Å; M126-L141 HydrophobicContact SD-CD1 3.8Å; M126-E144 HydrophobicContact CE-CB 4.29Å; M126-K145 HydrophobicContact CE-CB 4.3Å; M126-L148 HydrophobicContact CB-CD2 4.22Å; M126-L148 HydrophobicContact CE-CD2 4.18Å; M126-L148 HydrophobicContact CG-CD2 3.65Å; M126-L148 HydrophobicContact SD-CD2 4.45Å
127K82.9Confident79.7Confident141 Ų14183.5 Ų83.561%0.61342%0.415SS*.Hα-helixtrans-62.2-38.8174.1-75.1-177.6177.1-177.10112M123 A124 L125M123-K127 WeakPolarHBondContact O-CG 3.38Å; M123-K127 PolarHBondContact O-N 3.3Å; M123-K127 VanDerWaalsContact O-N 3.11Å; A124-K127 PolarHBondContact O-N 2.9Å; L125-K127 VanDerWaalsContact C-N 3.32Å; L125-K127 PolarHBondContact O-N 2.86Å
128K81.9Confident78.7Confident147 Ų14781.2 Ų81.264%0.63941%0.408SS*.Hα-helixtrans-67.2-42.4176.1-73.4-177.8179.2-177.40112.1A124 L125 M126 K131A124-K128 WeakPolarHBondContact O-CG 3.4Å; A124-K128 PolarHBondContact O-N 3.5Å; L125-K128 CarbonylContact O-C 3.6Å; L125-K128 WeakPolarHBondContact O-CA 3.34Å; L125-K128 WeakPolarHBondContact O-CB 3.11Å; L125-K128 PolarHBondContact O-N 3.28Å; M126-K128 VanDerWaalsContact C-N 3.33Å; M126-K128 PolarHBondContact O-N 3.37Å; K128-K131 PolarHBondContact O-N 3.33Å
129C76.1Confident77.7Confident29 Ų2985.4 Ų85.420%0.19643%0.429CS..Hα-helixtrans-66.8-38.6178-66.30000111.9L125 M126 K131 K132 L133 L141L125-C129 PolarHBondContact O-N 2.92Å; L125-C129 PolarHBondContact O-SG 3.13Å; M126-C129 PolarHBondContact O-N 2.75Å; C129-K131 PolarHBondContact O-N 3.38Å; C129-K132 PolarHBondContact O-N 2.93Å; C129-K132 VanDerWaalsContact O-N 3.1Å; C129-L133 WeakPolarHBondContact O-CD1 3.37Å; C129-L133 PolarHBondContact O-N 3.48Å; C129-L141 HydrophobicContact CB-CD1 4.11Å; C129-L141 HydrophobicContact CB-CD2 4.43Å
130Q74.8Confident77Confident94 Ų9488.2 Ų88.244%0.43944%0.443SS..Hα-helixtrans-58.4-32176.9-79177.9-500113.4M126 K132 L141M126-Q130 VanDerWaalsContact O-CG 3.32Å; M126-Q130 WeakPolarHBondContact O-CG 3.47Å; M126-Q130 PolarHBondContact O-N 2.95Å; Q130-K132 VanDerWaalsContact C-N 3.33Å; Q130-L141 HydrophobicContact CB-CD2 4.13Å; Q130-L141 HydrophobicContact CG-CD2 3.44Å; Q130-L141 VanDerWaalsContact CG-CD2 3.44Å; Q130-L141 HydrophobicContact CG-CG 4.24Å
131K71.3Confident76.2Confident188 Ų18883.6 Ų83.682%0.81742%0.419SS*.THydrogen-bonded Turntrans-76.1-17179.8-69-175.9176-1690114.2K128 C129K128-K131 PolarHBondContact O-N 3.33Å; C129-K131 PolarHBondContact O-N 3.38Å
132K68.9Low75.6Confident183 Ų18389 Ų8980%0.79644%0.435SS*.THydrogen-bonded Turntrans-113.6-6.4-168.5-68.9-171.4175.1-170.40114.6C129 Q130C129-K132 PolarHBondContact O-N 2.93Å; C129-K132 VanDerWaalsContact O-N 3.1Å; Q130-K132 VanDerWaalsContact C-N 3.33Å
133L65.9Low75Confident37 Ų3796.5 Ų96.519%0.19446%0.463CS..  trans-113.3117.6-164.9-93.567.9000112.4C129 R137 L141C129-L133 WeakPolarHBondContact O-CD1 3.37Å; C129-L133 PolarHBondContact O-N 3.48Å; L133-R137 HydrophobicContact CB-CB 4.13Å; L133-R137 HydrophobicContact CD2-CB 3.6Å; L133-R137 HydrophobicContact CG-CB 3.71Å; L133-L141 HydrophobicContact CD2-CD2 4.36Å
134E64.8Low74.7Confident178 Ų17895.6 Ų95.683%0.83246%0.458SS*.  trans-109.2162.2169.7-64.5-174.6168.300111.7
135G68Low74.3Confident55 Ų5598.8 Ų98.857%0.56746%0.462SS*.THydrogen-bonded Turntrans69-140.7173.800000115.5R137 A138G135-R137 PolarHBondContact O-N 2.93Å; G135-R137 VanDerWaalsContact O-N 3.13Å; G135-A138 VanDerWaalsContact O-CB 3.31Å; G135-A138 WeakPolarHBondContact O-CB 3.29Å; G135-A138 PolarHBondContact O-N 3.15Å
136V65.3Low74.1Confident108 Ų108102.5 Ų102.566%0.65548%0.482SS*.Hα-helixtrans-56.5-31-177.1-177.80000112.2A138 I139 Q140V136-A138 VanDerWaalsContact C-N 3.31Å; V136-A138 PolarHBondContact O-N 2.88Å; V136-I139 WeakPolarHBondContact O-CB 3.41Å; V136-I139 PolarHBondContact O-N 3Å; V136-I139 VanDerWaalsContact O-N 3.13Å; V136-Q140 PolarHBondContact O-N 3.35Å; V136-Q140 VanDerWaalsContact O-N 3.13Å
137R69Low73.9Confident150 Ų150105 Ų10557%0.56650%0.497SS*.Hα-helixtrans-65.6-33.7177.3-68.3-177.3174.3178.7-0.7112.2L133 G135 I139 Q140 L141L133-R137 HydrophobicContact CB-CB 4.13Å; L133-R137 HydrophobicContact CD2-CB 3.6Å; L133-R137 HydrophobicContact CG-CB 3.71Å; G135-R137 PolarHBondContact O-N 2.93Å; G135-R137 VanDerWaalsContact O-N 3.13Å; R137-I139 VanDerWaalsContact C-N 3.3Å; R137-I139 PolarHBondContact O-N 3.39Å; R137-Q140 PolarHBondContact O-N 3.45Å; R137-L141 WeakPolarHBondContact O-CB 3.36Å; R137-L141 PolarHBondContact O-N 3.48Å
138A72.3Confident73.7Confident31 Ų3199.1 Ų99.126%0.25647%0.472SS..Hα-helixtrans-65.5-34.3173.400000111.9G135 V136 L141 R142G135-A138 VanDerWaalsContact O-CB 3.31Å; G135-A138 WeakPolarHBondContact O-CB 3.29Å; G135-A138 PolarHBondContact O-N 3.15Å; V136-A138 VanDerWaalsContact C-N 3.31Å; V136-A138 PolarHBondContact O-N 2.88Å; A138-L141 PolarHBondContact O-N 3.42Å; A138-R142 WeakPolarHBondContact O-CG 3.44Å; A138-R142 PolarHBondContact O-N 2.89Å
139I70.5Confident73.7Confident92 Ų9295.1 Ų95.147%0.47246%0.46SS..Hα-helixtrans-67.9-44.2176.3-58.9174.8000110.7V136 R137 L141 R142 R143V136-I139 WeakPolarHBondContact O-CB 3.41Å; V136-I139 PolarHBondContact O-N 3Å; V136-I139 VanDerWaalsContact O-N 3.13Å; R137-I139 VanDerWaalsContact C-N 3.3Å; R137-I139 PolarHBondContact O-N 3.39Å; I139-L141 VanDerWaalsContact C-N 3.32Å; I139-L141 PolarHBondContact O-N 3.49Å; I139-R142 WeakPolarHBondContact O-CB 3.37Å; I139-R142 PolarHBondContact O-N 3.44Å; I139-R143 PolarHBondContact O-N 3.36Å
140Q73.6Confident74Confident91 Ų9196.7 Ų96.743%0.42546%0.464SS..Hα-helixtrans-61.3-43.1175.7-66178-32.100111.1F44 V136 R137 R142 R143 E144F44-Q140 HydrophobicContact CZ-CB 3.87Å; V136-Q140 PolarHBondContact O-N 3.35Å; V136-Q140 VanDerWaalsContact O-N 3.13Å; R137-Q140 PolarHBondContact O-N 3.45Å; Q140-R142 VanDerWaalsContact C-N 3.31Å; Q140-R142 PolarHBondContact O-N 3.05Å; Q140-R143 WeakPolarHBondContact O-CA 3.5Å; Q140-R143 WeakPolarHBondContact O-CB 3.28Å; Q140-R143 PolarHBondContact O-N 3.3Å; Q140-E144 PolarHBondContact O-N 2.89Å
141L74.3Confident74.4Confident11 Ų1192.7 Ų92.76%0.05845%0.445CS..Hα-helixtrans-64.4-33.2177.6-165.866.4000113.1M126 C129 Q130 L133 R137 A138 I139 R143 E144 K145M126-L141 HydrophobicContact CE-CD1 3.64Å; M126-L141 HydrophobicContact CE-CG 4.23Å; M126-L141 HydrophobicContact SD-CD1 3.8Å; C129-L141 HydrophobicContact CB-CD1 4.11Å; C129-L141 HydrophobicContact CB-CD2 4.43Å; Q130-L141 HydrophobicContact CB-CD2 4.13Å; Q130-L141 HydrophobicContact CG-CD2 3.44Å; Q130-L141 VanDerWaalsContact CG-CD2 3.44Å; Q130-L141 HydrophobicContact CG-CG 4.24Å; L133-L141 HydrophobicContact CD2-CD2 4.36Å; R137-L141 WeakPolarHBondContact O-CB 3.36Å; R137-L141 PolarHBondContact O-N 3.48Å; A138-L141 PolarHBondContact O-N 3.42Å; I139-L141 VanDerWaalsContact C-N 3.32Å; I139-L141 PolarHBondContact O-N 3.49Å; L141-R143 VanDerWaalsContact C-N 3.35Å; L141-E144 PolarHBondContact O-N 2.85Å; L141-K145 WeakPolarHBondContact O-CB 3.42Å; L141-K145 PolarHBondContact O-N 3.23Å
142R78.6Confident75Confident186 Ų18687.7 Ų87.770%0.70242%0.423SS*.Hα-helixtrans-62.9-40.9171-76.2179.6-171.4-178.43.4111.5A138 I139 Q140 K145 I146A138-R142 WeakPolarHBondContact O-CG 3.44Å; A138-R142 PolarHBondContact O-N 2.89Å; I139-R142 WeakPolarHBondContact O-CB 3.37Å; I139-R142 PolarHBondContact O-N 3.44Å; Q140-R142 VanDerWaalsContact C-N 3.31Å; Q140-R142 PolarHBondContact O-N 3.05Å; R142-K145 PolarHBondContact O-N 3.46Å; R142-I146 PolarHBondContact O-N 3.32Å
143R76Confident75.7Confident160 Ų16082.1 Ų82.160%0.60440%0.402SS*.Hα-helixtrans-65-43.5174.8-65.2-178.6-179.2-172.41.3111I139 Q140 L141 K145 I146 V147I139-R143 PolarHBondContact O-N 3.36Å; Q140-R143 WeakPolarHBondContact O-CA 3.5Å; Q140-R143 WeakPolarHBondContact O-CB 3.28Å; Q140-R143 PolarHBondContact O-N 3.3Å; L141-R143 VanDerWaalsContact C-N 3.35Å; R143-K145 VanDerWaalsContact C-N 3.33Å; R143-K145 PolarHBondContact O-N 2.96Å; R143-I146 WeakPolarHBondContact O-CB 3.45Å; R143-I146 PolarHBondContact O-N 3.47Å; R143-V147 PolarHBondContact O-N 3.3Å; R143-V147 VanDerWaalsContact O-N 3.17Å
144E78.2Confident76.5Confident44 Ų4480.6 Ų80.621%0.20639%0.394CS..Hα-helixtrans-62.2-38.4175.8-69.4-166.413800112.6L41 F44 M126 Q140 L141 I146 V147 L148L41-E144 WeakPolarHBondContact CD2-OE2 3.47Å; F44-E144 WeakPolarHBondContact CD2-OE1 3.21Å; F44-E144 HydrophobicContact CE2-CG 4.41Å; F44-E144 WeakPolarHBondContact CE2-OE1 3.32Å; M126-E144 HydrophobicContact CE-CB 4.29Å; Q140-E144 PolarHBondContact O-N 2.89Å; L141-E144 PolarHBondContact O-N 2.85Å; E144-I146 VanDerWaalsContact C-N 3.27Å; E144-I146 PolarHBondContact O-N 2.83Å; E144-V147 CarbonylContact O-C 3.57Å; E144-V147 PolarHBondContact O-N 2.89Å; E144-V147 VanDerWaalsContact O-N 3.12Å; E144-L148 VanDerWaalsContact O-CB 3.3Å; E144-L148 WeakPolarHBondContact O-CB 3.23Å; E144-L148 PolarHBondContact O-N 3.25Å
145K79.7Confident77.4Confident116 Ų11672.4 Ų72.450%0.50436%0.356SS..Hα-helixtrans-59.4-37.9175.4-172.1179.1-179.8-179.70112.4M126 L141 R142 R143 T149M126-K145 HydrophobicContact CE-CB 4.3Å; L141-K145 WeakPolarHBondContact O-CB 3.42Å; L141-K145 PolarHBondContact O-N 3.23Å; R142-K145 PolarHBondContact O-N 3.46Å; R143-K145 VanDerWaalsContact C-N 3.33Å; R143-K145 PolarHBondContact O-N 2.96Å; K145-T149 WeakPolarHBondContact O-CB 3.33Å; K145-T149 PolarHBondContact O-N 2.91Å; K145-T149 PolarHBondContact O-OG1 3.41Å
146I80.9Confident78.2Confident105 Ų10574.3 Ų74.354%0.53835%0.353SS..Hα-helixtrans-66.2-45.3175.2-64168.3000110.1R142 R143 E144 T149 K150R142-I146 PolarHBondContact O-N 3.32Å; R143-I146 WeakPolarHBondContact O-CB 3.45Å; R143-I146 PolarHBondContact O-N 3.47Å; E144-I146 VanDerWaalsContact C-N 3.27Å; E144-I146 PolarHBondContact O-N 2.83Å; I146-T149 PolarHBondContact O-N 3.45Å; I146-K150 PolarHBondContact O-N 3Å
147V78.2Confident79.1Confident60 Ų6069.8 Ų69.836%0.36433%0.325SS..Hα-helixtrans-61.1-46.7176.8176.20000110.7R143 E144 T149 K150 I151R143-V147 PolarHBondContact O-N 3.3Å; R143-V147 VanDerWaalsContact O-N 3.17Å; E144-V147 CarbonylContact O-C 3.57Å; E144-V147 PolarHBondContact O-N 2.89Å; E144-V147 VanDerWaalsContact O-N 3.12Å; V147-T149 VanDerWaalsContact C-N 3.28Å; V147-T149 PolarHBondContact O-N 3.31Å; V147-K150 WeakPolarHBondContact O-CB 3.46Å; V147-K150 PolarHBondContact O-N 3.01Å; V147-I151 HydrophobicContact CG1-CD1 3.99Å; V147-I151 HydrophobicContact CG1-CG1 4.5Å; V147-I151 WeakPolarHBondContact O-CG1 3.49Å; V147-I151 PolarHBondContact O-N 2.87Å
148L80.4Confident79.8Confident17 Ų1762.8 Ų62.89%0.08930%0.299CS..Hα-helixtrans-59.9-38.4178.2-171.871.1000112.5M122 M123 M126 E144 K150 I151 K152M122-L148 HydrophobicContact CE-CD1 3.29Å; M122-L148 HydrophobicContact CG-CD1 3.46Å; M122-L148 VanDerWaalsContact CG-CD1 3.46Å; M122-L148 HydrophobicContact SD-CD1 3.15Å; M122-L148 WeakPolarHBondContact SD-CD1 3.25Å; M123-L148 HydrophobicContact SD-CD2 3.64Å; M123-L148 HydrophobicContact SD-CG 4.25Å; M126-L148 HydrophobicContact CB-CD2 4.22Å; M126-L148 HydrophobicContact CE-CD2 4.18Å; M126-L148 HydrophobicContact CG-CD2 3.65Å; M126-L148 HydrophobicContact SD-CD2 4.45Å; E144-L148 VanDerWaalsContact O-CB 3.3Å; E144-L148 WeakPolarHBondContact O-CB 3.23Å; E144-L148 PolarHBondContact O-N 3.25Å; L148-K150 VanDerWaalsContact C-N 3.27Å; L148-K150 PolarHBondContact O-N 2.92Å; L148-I151 PolarHBondContact O-N 3.41Å; L148-K152 WeakPolarHBondContact O-CB 3.36Å; L148-K152 PolarHBondContact O-N 2.82Å
149T82Confident80.3Confident63 Ų6362.5 Ų62.539%0.38729%0.293SS..Hα-helixtrans-63.9-36.1177-58.50000111.3K145 I146 V147 K152 I153K145-T149 WeakPolarHBondContact O-CB 3.33Å; K145-T149 PolarHBondContact O-N 2.91Å; K145-T149 PolarHBondContact O-OG1 3.41Å; I146-T149 PolarHBondContact O-N 3.45Å; V147-T149 VanDerWaalsContact C-N 3.28Å; V147-T149 PolarHBondContact O-N 3.31Å; T149-K152 WeakPolarHBondContact O-CB 3.22Å; T149-I153 WeakPolarHBondContact O-CG1 3.36Å; T149-I153 PolarHBondContact O-N 2.73Å
150K82.3Confident80.9Confident61 Ų6163.8 Ų63.827%0.26530%0.3SS..Hα-helixtrans-67.3-45.9173-62.5173.4-179.3178.40111I146 V147 L148 K152 I153 I154 T203I146-K150 PolarHBondContact O-N 3Å; V147-K150 WeakPolarHBondContact O-CB 3.46Å; V147-K150 PolarHBondContact O-N 3.01Å; L148-K150 VanDerWaalsContact C-N 3.27Å; L148-K150 PolarHBondContact O-N 2.92Å; K150-K152 VanDerWaalsContact C-N 3.27Å; K150-K152 PolarHBondContact O-N 3.45Å; K150-I153 WeakPolarHBondContact O-CB 3.34Å; K150-I153 PolarHBondContact O-N 2.77Å; K150-I153 VanDerWaalsContact O-N 3.08Å; K150-I154 WeakPolarHBondContact O-CD1 3.44Å; K150-I154 WeakPolarHBondContact O-CG1 3.29Å; K150-I154 PolarHBondContact O-N 3.05Å; K150-T203 VanDerWaalsContact CE-O 3.29Å; K150-T203 WeakPolarHBondContact CE-O 3.46Å
151I82Confident81.2Confident11 Ų1161.5 Ų61.56%0.05629%0.291CS..Hα-helixtrans-62.8-35.7178.3-63.8178.8000111.4R37 M122 V147 L148 I153 I154 V155R37-I151 HydrophobicContact CG-CD1 3.42Å; R37-I151 VanDerWaalsContact CG-CD1 3.42Å; M122-I151 HydrophobicContact CE-CG2 4Å; V147-I151 HydrophobicContact CG1-CD1 3.99Å; V147-I151 HydrophobicContact CG1-CG1 4.5Å; V147-I151 WeakPolarHBondContact O-CG1 3.49Å; V147-I151 PolarHBondContact O-N 2.87Å; L148-I151 PolarHBondContact O-N 3.41Å; I151-I153 PolarHBondContact O-N 3.27Å; I151-I154 WeakPolarHBondContact O-CB 3.43Å; I151-I154 PolarHBondContact O-N 3.32Å; I151-V155 HydrophobicContact CG2-CG2 4.05Å; I151-V155 WeakPolarHBondContact O-CB 3.45Å; I151-V155 VanDerWaalsContact O-CG2 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.88Å
152K84Confident81.3Confident82 Ų8261.7 Ų61.736%0.35729%0.293SS..Hα-helixtrans-56.2-49.8171.2179.6-179.369.6169.90111.6Y119 L148 T149 K150 I154 V155 L156Y119-K152 HydrophobicContact CE2-CB 3.79Å; Y119-K152 HydrophobicContact CE2-CG 4.25Å; Y119-K152 WeakPolarHBondContact OH-CB 3.31Å; Y119-K152 VanDerWaalsContact OH-CD 3.26Å; Y119-K152 WeakPolarHBondContact OH-CD 3.38Å; Y119-K152 WeakPolarHBondContact OH-CG 3.4Å; L148-K152 WeakPolarHBondContact O-CB 3.36Å; L148-K152 PolarHBondContact O-N 2.82Å; T149-K152 WeakPolarHBondContact O-CB 3.22Å; K150-K152 VanDerWaalsContact C-N 3.27Å; K150-K152 PolarHBondContact O-N 3.45Å; K152-I154 VanDerWaalsContact C-N 3.26Å; K152-I154 PolarHBondContact O-N 3.45Å; K152-V155 PolarHBondContact O-N 3.5Å; K152-L156 HydrophobicContact CD-CD1 4.37Å; K152-L156 HydrophobicContact CG-CD1 3.76Å; K152-L156 HydrophobicContact CG-CG 4.31Å; K152-L156 WeakPolarHBondContact O-CB 3.36Å; K152-L156 WeakPolarHBondContact O-CG 3.01Å; K152-L156 PolarHBondContact O-N 3.01Å
153I83.7Confident81.5Confident66 Ų6654.6 Ų54.634%0.33827%0.267SS..Hα-helixtrans-59-45.3-180-67.6166000109.6T149 K150 I151 L156 S157 L199 T203T149-I153 WeakPolarHBondContact O-CG1 3.36Å; T149-I153 PolarHBondContact O-N 2.73Å; K150-I153 WeakPolarHBondContact O-CB 3.34Å; K150-I153 PolarHBondContact O-N 2.77Å; K150-I153 VanDerWaalsContact O-N 3.08Å; I151-I153 PolarHBondContact O-N 3.27Å; I153-L156 PolarHBondContact O-N 3.31Å; I153-S157 WeakPolarHBondContact O-CB 3.39Å; I153-S157 PolarHBondContact O-N 2.85Å; I153-S157 PolarHBondContact O-OG 2.69Å; I153-S157 VanDerWaalsContact O-OG 3.05Å; I153-L199 HydrophobicContact CG2-CD1 4.3Å; I153-L199 HydrophobicContact CG2-CD2 3.59Å; I153-L199 HydrophobicContact CG2-CG 4.02Å; I153-T203 HydrophobicContact CD1-CG2 4.46Å; I153-T203 HydrophobicContact CG2-CG2 4.34Å
154I82.4Confident81.8Confident6 Ų650.9 Ų50.93%0.03126%0.259CS..Hα-helixtrans-58.8-52.3177.2-74.6157.5000112.2V30 K150 I151 K152 L156 S157 H158 Y200V30-I154 HydrophobicContact CG1-CG2 4.47Å; K150-I154 WeakPolarHBondContact O-CD1 3.44Å; K150-I154 WeakPolarHBondContact O-CG1 3.29Å; K150-I154 PolarHBondContact O-N 3.05Å; I151-I154 WeakPolarHBondContact O-CB 3.43Å; I151-I154 PolarHBondContact O-N 3.32Å; K152-I154 VanDerWaalsContact C-N 3.26Å; K152-I154 PolarHBondContact O-N 3.45Å; I154-L156 VanDerWaalsContact C-N 3.33Å; I154-L156 PolarHBondContact O-N 2.88Å; I154-S157 WeakPolarHBondContact CA-OG 3.27Å; I154-S157 PolarHBondContact O-N 2.85Å; I154-S157 PolarHBondContact O-OG 3.43Å; I154-H158 VanDerWaalsContact O-CB 3.32Å; I154-H158 WeakPolarHBondContact O-CB 3.02Å; I154-H158 PolarHBondContact O-N 3.07Å; I154-Y200 HydrophobicContact CB-CE1 3.99Å; I154-Y200 HydrophobicContact CD1-CD1 3.35Å; I154-Y200 HydrophobicContact CD1-CE1 3.18Å; I154-Y200 HydrophobicContact CD1-CG 4.46Å; I154-Y200 HydrophobicContact CG1-CD1 3.58Å; I154-Y200 HydrophobicContact CG1-CE1 3.31Å; I154-Y200 HydrophobicContact CG1-CG 4.32Å; I154-Y200 HydrophobicContact CG2-CE1 3.48Å; I154-Y200 VanDerWaalsContact CG2-CE1 3.48Å; I154-Y200 HydrophobicContact CG2-CE2 4.31Å; I154-Y200 WeakPolarHBondContact CG2-OH 3.27Å
155V83.9Confident81.9Confident6 Ų648.9 Ų48.94%0.03625%0.249CC..Hα-helixtrans-64-42.5-178.8171.60000109.7V30 T115 Y119 I151 K152 H158 M159V30-V155 HydrophobicContact CG1-CG2 4.32Å; T115-V155 HydrophobicContact CG2-CG1 4.13Å; T115-V155 HydrophobicContact CG2-CG2 4.12Å; Y119-V155 HydrophobicContact CD2-CB 4.39Å; Y119-V155 HydrophobicContact CD2-CG2 4.2Å; Y119-V155 HydrophobicContact CG-CG1 4.33Å; I151-V155 HydrophobicContact CG2-CG2 4.05Å; I151-V155 WeakPolarHBondContact O-CB 3.45Å; I151-V155 VanDerWaalsContact O-CG2 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.26Å; I151-V155 PolarHBondContact O-N 2.88Å; K152-V155 PolarHBondContact O-N 3.5Å; V155-H158 PolarHBondContact O-N 3.42Å; V155-M159 HydrophobicContact CG1-CE 4.29Å; V155-M159 HydrophobicContact CG1-CG 4.49Å; V155-M159 VanDerWaalsContact O-CG 3.27Å; V155-M159 WeakPolarHBondContact O-CG 3.25Å; V155-M159 PolarHBondContact O-N 3.32Å
156L85.3Confident81.8Confident95 Ų9543.7 Ų43.750%0.49723%0.227SC..Hα-helixtrans-63-44.3176.4-71.8172.7000112.1K152 I153 I154 H158 M159 L160K152-L156 HydrophobicContact CD-CD1 4.37Å; K152-L156 HydrophobicContact CG-CD1 3.76Å; K152-L156 HydrophobicContact CG-CG 4.31Å; K152-L156 WeakPolarHBondContact O-CB 3.36Å; K152-L156 WeakPolarHBondContact O-CG 3.01Å; K152-L156 PolarHBondContact O-N 3.01Å; I153-L156 PolarHBondContact O-N 3.31Å; I154-L156 VanDerWaalsContact C-N 3.33Å; I154-L156 PolarHBondContact O-N 2.88Å; L156-H158 VanDerWaalsContact C-N 3.33Å; L156-M159 PolarHBondContact O-N 2.89Å; L156-L160 WeakPolarHBondContact O-CG 3.4Å; L156-L160 PolarHBondContact O-N 3.47Å
157S83.6Confident82Confident12 Ų1243.2 Ų43.28%0.08422%0.222CC..Hα-helixtrans-63.9-40.9175.654.90000111.6I153 I154 M159 L160 L161 L199I153-S157 WeakPolarHBondContact O-CB 3.39Å; I153-S157 PolarHBondContact O-N 2.85Å; I153-S157 PolarHBondContact O-OG 2.69Å; I153-S157 VanDerWaalsContact O-OG 3.05Å; I154-S157 WeakPolarHBondContact CA-OG 3.27Å; I154-S157 PolarHBondContact O-N 2.85Å; I154-S157 PolarHBondContact O-OG 3.43Å; S157-M159 VanDerWaalsContact C-N 3.32Å; S157-M159 PolarHBondContact O-N 2.97Å; S157-L160 PolarHBondContact O-N 3.08Å; S157-L161 VanDerWaalsContact O-CB 3.22Å; S157-L161 WeakPolarHBondContact O-CB 3.29Å; S157-L161 WeakPolarHBondContact O-CG 3.33Å; S157-L161 PolarHBondContact O-N 3.38Å; S157-L199 WeakPolarHBondContact OG-CD2 3.45Å
158H84.4Confident82.2Confident4 Ų443.7 Ų43.72%0.01922%0.222CC..Hα-helixtrans-62.4-41176.6-168.872.1000111.2V30 I154 V155 L156 C162 F163 E196V30-H158 HydrophobicContact CG1-CB 4.36Å; I154-H158 VanDerWaalsContact O-CB 3.32Å; I154-H158 WeakPolarHBondContact O-CB 3.02Å; I154-H158 PolarHBondContact O-N 3.07Å; V155-H158 PolarHBondContact O-N 3.42Å; L156-H158 VanDerWaalsContact C-N 3.33Å; H158-C162 WeakPolarHBondContact O-CA 3.47Å; H158-C162 VanDerWaalsContact O-CB 3.25Å; H158-C162 WeakPolarHBondContact O-CB 3.2Å; H158-C162 PolarHBondContact O-N 3.01Å; H158-F163 PolarHBondContact O-N 3.22Å; H158-E196 IonicContact CE1-OE2 3.66Å; H158-E196 IonicContact CG-OE2 2.95Å; H158-E196 IonicContact ND1-OE1 2.77Å; H158-E196 IonicContact ND1-OE2 2.69Å; H158-E196 PolarHBondContact ND1-OE2 2.96Å
159M83.1Confident82.1Confident24 Ų2443.4 Ų43.412%0.11822%0.221CC..Iπ-helixtrans-63.8-46.1175.5-69.1-52.2130.500112.5A112 T115 I116 V155 L156 S157 F163 L164A112-M159 HydrophobicContact CB-CE 3.82Å; A112-M159 HydrophobicContact CB-SD 3.93Å; A112-M159 WeakPolarHBondContact O-CE 3.22Å; T115-M159 HydrophobicContact CG2-CE 4.08Å; I116-M159 HydrophobicContact CD1-CE 4.32Å; I116-M159 HydrophobicContact CD1-CG 4.18Å; I116-M159 HydrophobicContact CD1-SD 3.47Å; I116-M159 WeakPolarHBondContact CD1-SD 3.39Å; I116-M159 HydrophobicContact CG1-CE 3.83Å; I116-M159 HydrophobicContact CG1-CG 4.06Å; I116-M159 HydrophobicContact CG1-SD 3.58Å; I116-M159 VanDerWaalsContact CG1-SD 3.58Å; V155-M159 HydrophobicContact CG1-CE 4.29Å; V155-M159 HydrophobicContact CG1-CG 4.49Å; V155-M159 VanDerWaalsContact O-CG 3.27Å; V155-M159 WeakPolarHBondContact O-CG 3.25Å; V155-M159 PolarHBondContact O-N 3.32Å; L156-M159 PolarHBondContact O-N 2.89Å; S157-M159 VanDerWaalsContact C-N 3.32Å; S157-M159 PolarHBondContact O-N 2.97Å; M159-F163 VanDerWaalsContact O-CB 3.32Å; M159-F163 WeakPolarHBondContact O-CB 3.26Å; M159-F163 PolarHBondContact O-N 2.99Å; M159-F163 HydrophobicContact SD-CB 4.02Å; M159-F163 HydrophobicContact SD-CG 4.24Å; M159-L164 PolarHBondContact O-N 3.03Å
160L82.5Confident81.9Confident119 Ų11940.6 Ų40.662%0.62320%0.203SC*.Iπ-helixtrans-69.1-41.9-178.3-70.2171.9000112.3L156 S157 L164L156-L160 WeakPolarHBondContact O-CG 3.4Å; L156-L160 PolarHBondContact O-N 3.47Å; S157-L160 PolarHBondContact O-N 3.08Å; L160-L164 WeakPolarHBondContact O-CB 3.06Å
161L79.3Confident81.9Confident43 Ų4340 Ų4023%0.22521%0.205CC..Iπ-helixtrans-92-34.3-170.3-64172.4000113.4S157 P165 L195S157-L161 VanDerWaalsContact O-CB 3.22Å; S157-L161 WeakPolarHBondContact O-CB 3.29Å; S157-L161 WeakPolarHBondContact O-CG 3.33Å; S157-L161 PolarHBondContact O-N 3.38Å; L161-P165 WeakPolarHBondContact O-CD 3.38Å; L161-P165 VanDerWaalsContact O-CG 3.25Å; L161-P165 WeakPolarHBondContact O-CG 3.16Å; L161-L195 HydrophobicContact CD1-CB 3.94Å; L161-L195 HydrophobicContact CD2-CD1 4.34Å
162C77.4Confident81.7Confident15 Ų1540.4 Ų40.410%0.10121%0.21CC..Iπ-helixtrans-111.9-27.1-171.5-630000113.8H158 P166H158-C162 WeakPolarHBondContact O-CA 3.47Å; H158-C162 VanDerWaalsContact O-CB 3.25Å; H158-C162 WeakPolarHBondContact O-CB 3.2Å; H158-C162 PolarHBondContact O-N 3.01Å; C162-P166 WeakPolarHBondContact O-CD 3.41Å; C162-P166 WeakPolarHBondContact O-CG 3.24Å
163F81.8Confident81.3Confident38 Ų3838.4 Ų38.417%0.16720%0.203CC..Iπ-helixtrans-89.7-42.3178.8170-99.6000113.1I109 A112 V113 H158 M159 P166 F167I109-F163 HydrophobicContact CB-CD2 4.48Å; I109-F163 HydrophobicContact CB-CE2 4.01Å; I109-F163 HydrophobicContact CG1-CD2 4.32Å; I109-F163 HydrophobicContact CG1-CE2 4.05Å; I109-F163 HydrophobicContact CG2-CE2 3.71Å; I109-F163 HydrophobicContact CG2-CZ 4.38Å; A112-F163 HydrophobicContact CB-CB 3.95Å; A112-F163 HydrophobicContact CB-CD2 3.31Å; A112-F163 HydrophobicContact CB-CE2 4.03Å; A112-F163 HydrophobicContact CB-CG 3.95Å; V113-F163 HydrophobicContact CG2-CE2 4.28Å; H158-F163 PolarHBondContact O-N 3.22Å; M159-F163 VanDerWaalsContact O-CB 3.32Å; M159-F163 WeakPolarHBondContact O-CB 3.26Å; M159-F163 PolarHBondContact O-N 2.99Å; M159-F163 HydrophobicContact SD-CB 4.02Å; M159-F163 HydrophobicContact SD-CG 4.24Å; F163-P166 WeakPolarHBondContact O-CD 3.03Å; F163-F167 HydrophobicContact CE1-CB 4.3Å; F163-F167 HydrophobicContact CE1-CD2 4.44Å; F163-F167 HydrophobicContact CE1-CG 4.38Å; F163-F167 HydrophobicContact CZ-CB 4.4Å; F163-F167 HydrophobicContact CZ-CD2 4.04Å; F163-F167 HydrophobicContact CZ-CG 4.39Å; F163-F167 WeakPolarHBondContact O-CB 3.34Å; F163-F167 PolarHBondContact O-N 2.85Å
164L81.9Confident81.2Confident82 Ų8240.3 Ų40.343%0.42921%0.21SC..Hα-helixtrans-59.2-43.3-176.9-158.372.7000113.2M159 L160 F167 I168M159-L164 PolarHBondContact O-N 3.03Å; L160-L164 WeakPolarHBondContact O-CB 3.06Å; L164-F167 PolarHBondContact O-N 3.38Å; L164-I168 HydrophobicContact CD2-CD1 4.35Å; L164-I168 HydrophobicContact CG-CD1 3.9Å; L164-I168 VanDerWaalsContact O-CG1 3.26Å; L164-I168 WeakPolarHBondContact O-CG1 3.48Å; L164-I168 PolarHBondContact O-N 3.37Å
165P81.1Confident81.1Confident1 Ų144.6 Ų44.61%0.00624%0.237CC..Hα-helixtrans-64.5-52.3179-8.118.5000112.9L161 F167 I168 T169 L185 L188 P189L161-P165 WeakPolarHBondContact O-CD 3.38Å; L161-P165 VanDerWaalsContact O-CG 3.25Å; L161-P165 WeakPolarHBondContact O-CG 3.16Å; P165-F167 VanDerWaalsContact C-N 3.27Å; P165-F167 PolarHBondContact O-N 3.37Å; P165-I168 PolarHBondContact O-N 3Å; P165-T169 VanDerWaalsContact O-CG2 3.27Å; P165-T169 WeakPolarHBondContact O-CG2 3.14Å; P165-T169 PolarHBondContact O-N 3.44Å; P165-T169 PolarHBondContact O-OG1 3.4Å; P165-L185 HydrophobicContact CB-CD1 3.91Å; P165-L185 HydrophobicContact CB-CG 4.28Å; P165-L188 HydrophobicContact CB-CB 4.42Å; P165-L188 HydrophobicContact CB-CD2 4.1Å; P165-L188 HydrophobicContact CB-CG 4.49Å; P165-L188 HydrophobicContact CG-CB 4.28Å; P165-L188 HydrophobicContact CG-CD2 3.7Å; P165-L188 HydrophobicContact CG-CG 3.91Å; P165-P189 HydrophobicContact CB-CG 4.37Å
166P78Confident80.4Confident7 Ų747.1 Ų47.15%0.04526%0.264CS..Hα-helixtrans-56.2-38.4174.3-28.637.4000113.6N105 L108 I109 C162 F163 T169 T170N105-P166 HydrophobicContact CB-CB 4.4Å; L108-P166 HydrophobicContact CD1-CG 4.2Å; I109-P166 HydrophobicContact CG1-CB 4.38Å; C162-P166 WeakPolarHBondContact O-CD 3.41Å; C162-P166 WeakPolarHBondContact O-CG 3.24Å; F163-P166 WeakPolarHBondContact O-CD 3.03Å; P166-T169 VanDerWaalsContact CA-OG1 3.28Å; P166-T169 WeakPolarHBondContact CA-OG1 3.22Å; P166-T169 PolarHBondContact O-N 3.49Å; P166-T169 PolarHBondContact O-OG1 3.36Å; P166-T170 WeakPolarHBondContact O-CB 3.42Å; P166-T170 PolarHBondContact O-N 2.87Å; P166-T170 PolarHBondContact O-OG1 2.82Å
167F83.9Confident79.6Confident95 Ų9547.1 Ų47.142%0.41727%0.268SS..Hα-helixtrans-61.4-53176.2-175.1-98.9000111.6I109 F163 L164 P165 T169 T170 T171I109-F167 HydrophobicContact CD1-CB 4.49Å; I109-F167 HydrophobicContact CD1-CD2 4.37Å; F163-F167 HydrophobicContact CE1-CB 4.3Å; F163-F167 HydrophobicContact CE1-CD2 4.44Å; F163-F167 HydrophobicContact CE1-CG 4.38Å; F163-F167 HydrophobicContact CZ-CB 4.4Å; F163-F167 HydrophobicContact CZ-CD2 4.04Å; F163-F167 HydrophobicContact CZ-CG 4.39Å; F163-F167 WeakPolarHBondContact O-CB 3.34Å; F163-F167 PolarHBondContact O-N 2.85Å; L164-F167 PolarHBondContact O-N 3.38Å; P165-F167 VanDerWaalsContact C-N 3.27Å; P165-F167 PolarHBondContact O-N 3.37Å; F167-T169 VanDerWaalsContact C-N 3.32Å; F167-T169 PolarHBondContact O-N 3.39Å; F167-T170 PolarHBondContact O-N 2.9Å; F167-T170 VanDerWaalsContact O-N 3.16Å; F167-T171 HydrophobicContact CD1-CG2 4.46Å; F167-T171 HydrophobicContact CE1-CG2 4.09Å; F167-T171 HydrophobicContact CZ-CG2 4.12Å; F167-T171 PolarHBondContact O-N 2.97Å; F167-T171 PolarHBondContact O-OG1 3.25Å
168I82.7Confident78.6Confident71 Ų7149.9 Ų49.936%0.36428%0.278SS..Hα-helixtrans-60-41.5177.2-65.1166000111.1L164 P165 T170 T171 A172 L185L164-I168 HydrophobicContact CD2-CD1 4.35Å; L164-I168 HydrophobicContact CG-CD1 3.9Å; L164-I168 VanDerWaalsContact O-CG1 3.26Å; L164-I168 WeakPolarHBondContact O-CG1 3.48Å; L164-I168 PolarHBondContact O-N 3.37Å; P165-I168 PolarHBondContact O-N 3Å; I168-T170 VanDerWaalsContact C-N 3.31Å; I168-T170 PolarHBondContact O-N 3.49Å; I168-T171 PolarHBondContact O-N 3.25Å; I168-T171 PolarHBondContact O-OG1 2.89Å; I168-A172 VanDerWaalsContact O-CB 3.25Å; I168-A172 WeakPolarHBondContact O-CB 3.48Å; I168-A172 PolarHBondContact O-N 3.42Å; I168-L185 HydrophobicContact CB-CD2 4.25Å; I168-L185 HydrophobicContact CG2-CD2 3.86Å
169T78Confident77.2Confident11 Ų1157.7 Ų57.77%0.06732%0.315CS..Hα-helixtrans-62.8-39.2178.260.30000111.9N105 P165 P166 F167 A172 I173 M182 L185N105-T169 PolarHBondContact ND2-OG1 3.35Å; P165-T169 VanDerWaalsContact O-CG2 3.27Å; P165-T169 WeakPolarHBondContact O-CG2 3.14Å; P165-T169 PolarHBondContact O-N 3.44Å; P165-T169 PolarHBondContact O-OG1 3.4Å; P166-T169 VanDerWaalsContact CA-OG1 3.28Å; P166-T169 WeakPolarHBondContact CA-OG1 3.22Å; P166-T169 PolarHBondContact O-N 3.49Å; P166-T169 PolarHBondContact O-OG1 3.36Å; F167-T169 VanDerWaalsContact C-N 3.32Å; F167-T169 PolarHBondContact O-N 3.39Å; T169-A172 PolarHBondContact O-N 3.34Å; T169-I173 WeakPolarHBondContact O-CD1 3.25Å; T169-I173 WeakPolarHBondContact O-CG1 3.42Å; T169-I173 PolarHBondContact O-N 2.99Å; T169-M182 VanDerWaalsContact CB-CE 3.4Å; T169-M182 HydrophobicContact CG2-CE 3.5Å; T169-M182 HydrophobicContact CG2-SD 3.88Å; T169-L185 HydrophobicContact CG2-CD2 3.37Å; T169-L185 HydrophobicContact CG2-CG 3.79Å
170T79.3Confident75.7Confident3 Ų364 Ų642%0.01835%0.347CS..Hα-helixtrans-69.9-43.9-179.4-54.60000111Y102 N105 K106 P166 F167 I168 A172 I173 E174Y102-T170 HydrophobicContact CD2-CG2 4.09Å; Y102-T170 HydrophobicContact CE2-CG2 3.74Å; N105-T170 WeakPolarHBondContact CB-OG1 3.44Å; N105-T170 PolarHBondContact ND2-OG1 3.18Å; K106-T170 HydrophobicContact CD-CG2 4.4Å; P166-T170 WeakPolarHBondContact O-CB 3.42Å; P166-T170 PolarHBondContact O-N 2.87Å; P166-T170 PolarHBondContact O-OG1 2.82Å; F167-T170 PolarHBondContact O-N 2.9Å; F167-T170 VanDerWaalsContact O-N 3.16Å; I168-T170 VanDerWaalsContact C-N 3.31Å; I168-T170 PolarHBondContact O-N 3.49Å; T170-A172 VanDerWaalsContact C-N 3.32Å; T170-A172 PolarHBondContact O-N 2.86Å; T170-I173 PolarHBondContact O-N 3.47Å; T170-E174 WeakPolarHBondContact O-CG 3.18Å; T170-E174 PolarHBondContact O-N 2.86Å
171T82.1Confident74.3Confident50 Ų5062.8 Ų62.831%0.30735%0.349SS..Hα-helixtrans-66.4-35.5176.358.90000111.6F167 I168 E174 T175F167-T171 HydrophobicContact CD1-CG2 4.46Å; F167-T171 HydrophobicContact CE1-CG2 4.09Å; F167-T171 HydrophobicContact CZ-CG2 4.12Å; F167-T171 PolarHBondContact O-N 2.97Å; F167-T171 PolarHBondContact O-OG1 3.25Å; I168-T171 PolarHBondContact O-N 3.25Å; I168-T171 PolarHBondContact O-OG1 2.89Å; T171-E174 PolarHBondContact O-N 3.48Å; T171-T175 WeakPolarHBondContact O-CB 3.26Å; T171-T175 VanDerWaalsContact O-CG2 3.32Å; T171-T175 WeakPolarHBondContact O-CG2 3.27Å; T171-T175 PolarHBondContact O-N 2.85Å; T171-T175 PolarHBondContact O-OG1 2.77Å
172A78.5Confident73.3Confident19 Ų1961.5 Ų61.516%0.15734%0.342CS..Hα-helixtrans-65.4-38.3174.200000112.7I168 T169 T170 T175 G176 T177 M182I168-A172 VanDerWaalsContact O-CB 3.25Å; I168-A172 WeakPolarHBondContact O-CB 3.48Å; I168-A172 PolarHBondContact O-N 3.42Å; T169-A172 PolarHBondContact O-N 3.34Å; T170-A172 VanDerWaalsContact C-N 3.32Å; T170-A172 PolarHBondContact O-N 2.86Å; A172-T175 WeakPolarHBondContact CA-OG1 3.3Å; A172-T175 PolarHBondContact O-OG1 3.18Å; A172-G176 PolarHBondContact O-N 2.72Å; A172-T177 PolarHBondContact O-N 3.02Å; A172-T177 PolarHBondContact O-OG1 3.41Å; A172-M182 HydrophobicContact CB-CE 4.47Å
173I75.4Confident72.5Confident40 Ų4065 Ų6521%0.20536%0.359CS..Hα-helixtrans-62.5-49172.2-68161.3000110.3T169 T170 T175 G176 F178T169-I173 WeakPolarHBondContact O-CD1 3.25Å; T169-I173 WeakPolarHBondContact O-CG1 3.42Å; T169-I173 PolarHBondContact O-N 2.99Å; T170-I173 PolarHBondContact O-N 3.47Å; I173-T175 VanDerWaalsContact C-N 3.32Å; I173-T175 PolarHBondContact O-N 3.24Å; I173-G176 PolarHBondContact O-N 3.47Å; I173-F178 HydrophobicContact CB-CD2 4.18Å; I173-F178 HydrophobicContact CD1-CD2 4.29Å; I173-F178 HydrophobicContact CD1-CE2 3.78Å; I173-F178 HydrophobicContact CG1-CD2 3.21Å; I173-F178 HydrophobicContact CG1-CE2 3.19Å; I173-F178 HydrophobicContact CG1-CG 4.2Å; I173-F178 HydrophobicContact CG1-CZ 4.2Å
174E79.9Confident71.7Confident105 Ų10566.9 Ų66.949%0.49138%0.382SS..Hα-helixtrans-65.9-32.8-176.8-73.2174.5178.900112.5Y102 K106 T170 T171 G176Y102-E174 HydrophobicContact CE2-CG 4.06Å; Y102-E174 VanDerWaalsContact CE2-OE1 3.27Å; Y102-E174 WeakPolarHBondContact CE2-OE1 3.38Å; Y102-E174 PolarHBondContact OH-OE1 3.46Å; K106-E174 IonicContact NZ-OE1 3.55Å; K106-E174 PolarHBondContact NZ-OE1 3.17Å; T170-E174 WeakPolarHBondContact O-CG 3.18Å; T170-E174 PolarHBondContact O-N 2.86Å; T171-E174 PolarHBondContact O-N 3.48Å; E174-G176 VanDerWaalsContact C-N 3.33Å
175T80.3Confident71Confident97 Ų9764.5 Ų64.560%0.59537%0.37SS*.THydrogen-bonded Turntrans-84.6-0.5178.452.30000114.3T171 A172 I173 T177T171-T175 WeakPolarHBondContact O-CB 3.26Å; T171-T175 VanDerWaalsContact O-CG2 3.32Å; T171-T175 WeakPolarHBondContact O-CG2 3.27Å; T171-T175 PolarHBondContact O-N 2.85Å; T171-T175 PolarHBondContact O-OG1 2.77Å; A172-T175 WeakPolarHBondContact CA-OG1 3.3Å; A172-T175 PolarHBondContact O-OG1 3.18Å; I173-T175 VanDerWaalsContact C-N 3.32Å; I173-T175 PolarHBondContact O-N 3.24Å; T175-T177 PolarHBondContact O-N 3.39Å; T175-T177 VanDerWaalsContact O-N 3.12Å; T175-T177 PolarHBondContact OG1-OG1 3.32Å
176G70Confident70.2Confident58 Ų5866.8 Ų66.860%0.59838%0.378SS*.THydrogen-bonded Turntrans67.87.6-178.900000114.4A172 I173 E174 F178A172-G176 PolarHBondContact O-N 2.72Å; I173-G176 PolarHBondContact O-N 3.47Å; E174-G176 VanDerWaalsContact C-N 3.33Å; G176-F178 PolarHBondContact O-N 2.91Å; G176-F178 VanDerWaalsContact O-N 3.08Å
177T68.5Low69.9Low95 Ų9571.6 Ų71.658%0.58340%0.403SS*.  trans-78.115.7176.154.30000112.8A172 T175 H179A172-T177 PolarHBondContact O-N 3.02Å; A172-T177 PolarHBondContact O-OG1 3.41Å; T175-T177 PolarHBondContact O-N 3.39Å; T175-T177 VanDerWaalsContact O-N 3.12Å; T175-T177 PolarHBondContact OG1-OG1 3.32Å; T177-H179 PolarHBondContact O-N 3.13Å
178F62.2Low69.5Low71 Ų7170.4 Ų70.431%0.31140%0.4SS..  trans-80.171.9-170.8-163.6-94.3000111.6I173 G176 M182I173-F178 HydrophobicContact CB-CD2 4.18Å; I173-F178 HydrophobicContact CD1-CD2 4.29Å; I173-F178 HydrophobicContact CD1-CE2 3.78Å; I173-F178 HydrophobicContact CG1-CD2 3.21Å; I173-F178 HydrophobicContact CG1-CE2 3.19Å; I173-F178 HydrophobicContact CG1-CG 4.2Å; I173-F178 HydrophobicContact CG1-CZ 4.2Å; G176-F178 PolarHBondContact O-N 2.91Å; G176-F178 VanDerWaalsContact O-N 3.08Å; F178-M182 HydrophobicContact CD2-CE 3.67Å; F178-M182 HydrophobicContact CD2-CG 4.28Å; F178-M182 HydrophobicContact CD2-SD 4.37Å; F178-M182 HydrophobicContact CE2-CE 3.26Å; F178-M182 HydrophobicContact CE2-CG 3.76Å; F178-M182 HydrophobicContact CE2-SD 3.5Å; F178-M182 WeakPolarHBondContact CE2-SD 3.39Å; F178-M182 HydrophobicContact CZ-CE 4.27Å; F178-M182 HydrophobicContact CZ-CG 3.97Å; F178-M182 HydrophobicContact CZ-SD 3.93Å
179H55.5Low69.1Low168 Ų16867.8 Ų67.878%0.77839%0.388SS*.SBendtrans-128-33.9178.1-98.4-77.7000118.1T177T177-H179 PolarHBondContact O-N 3.13Å
180I52.5Low69.1Low156 Ų15669.8 Ų69.880%0.840%0.401SS*.SBendtrans-142.4-22.5-170.4-58.1177.1000115.3M182I180-M182 VanDerWaalsContact C-N 3.32Å; I180-M182 PolarHBondContact O-N 3.41Å
181S53Low69.2Low94 Ų9474.1 Ų74.166%0.65742%0.423SS*.THydrogen-bonded Turntrans-81.1-0.7-170.5-20.40000116.1
182M57.9Low69.2Low15 Ų1571.8 Ų71.87%0.07441%0.409CS..Hα-helixtrans-78.8-25.4-162.1-86.4-87.6154.100115.8T169 A172 F178 I180 R186T169-M182 VanDerWaalsContact CB-CE 3.4Å; T169-M182 HydrophobicContact CG2-CE 3.5Å; T169-M182 HydrophobicContact CG2-SD 3.88Å; A172-M182 HydrophobicContact CB-CE 4.47Å; F178-M182 HydrophobicContact CD2-CE 3.67Å; F178-M182 HydrophobicContact CD2-CG 4.28Å; F178-M182 HydrophobicContact CD2-SD 4.37Å; F178-M182 HydrophobicContact CE2-CE 3.26Å; F178-M182 HydrophobicContact CE2-CG 3.76Å; F178-M182 HydrophobicContact CE2-SD 3.5Å; F178-M182 WeakPolarHBondContact CE2-SD 3.39Å; F178-M182 HydrophobicContact CZ-CE 4.27Å; F178-M182 HydrophobicContact CZ-CG 3.97Å; F178-M182 HydrophobicContact CZ-SD 3.93Å; I180-M182 VanDerWaalsContact C-N 3.32Å; I180-M182 PolarHBondContact O-N 3.41Å; M182-R186 VanDerWaalsContact O-CB 3.29Å; M182-R186 WeakPolarHBondContact O-CB 3.35Å; M182-R186 VanDerWaalsContact O-CD 3.27Å; M182-R186 WeakPolarHBondContact O-CD 3.42Å; M182-R186 WeakPolarHBondContact O-CG 3.32Å; M182-R186 PolarHBondContact O-N 3.22Å
183D61Low69.2Low89 Ų8973 Ų7348%0.47641%0.411SS..Hα-helixtrans-74.5-43.7-176.1-66.4-39.6000111.1K93 L185 R186 L187K93-D183 WeakPolarHBondContact CE-OD1 2.99Å; K93-D183 IonicContact NZ-OD1 2.84Å; K93-D183 PolarHBondContact NZ-OD1 3.22Å; K93-D183 IonicContact NZ-OD2 3.8Å; K93-D183 PolarHBondContact NZ-OD2 3.09Å; D183-L185 PolarHBondContact O-N 3.07Å; D183-R186 WeakPolarHBondContact O-CB 3.19Å; D183-R186 PolarHBondContact O-N 3.11Å; D183-L187 WeakPolarHBondContact O-CD1 2.8Å; D183-L187 PolarHBondContact O-N 3.4Å; D183-L187 VanDerWaalsContact O-N 3.15Å
184A63.4Low69.6Low77 Ų7772.8 Ų72.864%0.63642%0.419SS*.Hα-helixtrans-62.4-42.4172.800000112.2R186 L187 L188A184-R186 PolarHBondContact O-N 3.24Å; A184-L187 PolarHBondContact O-N 3.33Å; A184-L187 VanDerWaalsContact O-N 3.15Å; A184-L188 PolarHBondContact O-N 3.24Å
185L68.9Low69.9Low33 Ų3371.9 Ų71.917%0.17342%0.417CS..Hα-helixtrans-67.9-22.8178.9-162.658.9000112.4P165 I168 T169 D183 L188 P189P165-L185 HydrophobicContact CB-CD1 3.91Å; P165-L185 HydrophobicContact CB-CG 4.28Å; I168-L185 HydrophobicContact CB-CD2 4.25Å; I168-L185 HydrophobicContact CG2-CD2 3.86Å; T169-L185 HydrophobicContact CG2-CD2 3.37Å; T169-L185 HydrophobicContact CG2-CG 3.79Å; D183-L185 PolarHBondContact O-N 3.07Å; L185-L188 HydrophobicContact CD1-CD2 4.02Å; L185-L188 WeakPolarHBondContact O-CB 3.19Å; L185-P189 WeakPolarHBondContact O-CD 3.46Å
186R64.2Low69.9Low49 Ų4967.3 Ų67.319%0.18539%0.389CS..Hα-helixtrans-81.4-23.8173.1-77.2168.5-179.9-148-3.6114.1M182 D183 A184 L188 P189 P190M182-R186 VanDerWaalsContact O-CB 3.29Å; M182-R186 WeakPolarHBondContact O-CB 3.35Å; M182-R186 VanDerWaalsContact O-CD 3.27Å; M182-R186 WeakPolarHBondContact O-CD 3.42Å; M182-R186 WeakPolarHBondContact O-CG 3.32Å; M182-R186 PolarHBondContact O-N 3.22Å; D183-R186 WeakPolarHBondContact O-CB 3.19Å; D183-R186 PolarHBondContact O-N 3.11Å; A184-R186 PolarHBondContact O-N 3.24Å; R186-L188 VanDerWaalsContact C-N 3.26Å; R186-P189 WeakPolarHBondContact O-CD 3.28Å; R186-P190 WeakPolarHBondContact O-CD 3.31Å
187L71.2Confident70.5Confident108 Ų10867 Ų6757%0.56538%0.381SS*.Hα-helixtrans-75.4-17.2169.4-85.6131.9000112.2D183 A184 P190 I191D183-L187 WeakPolarHBondContact O-CD1 2.8Å; D183-L187 PolarHBondContact O-N 3.4Å; D183-L187 VanDerWaalsContact O-N 3.15Å; A184-L187 PolarHBondContact O-N 3.33Å; A184-L187 VanDerWaalsContact O-N 3.15Å; L187-P190 WeakPolarHBondContact O-CD 3.44Å; L187-P190 VanDerWaalsContact O-CG 3.26Å; L187-P190 WeakPolarHBondContact O-CG 3.2Å; L187-I191 HydrophobicContact CB-CD1 4.44Å; L187-I191 VanDerWaalsContact O-CD1 3.32Å; L187-I191 WeakPolarHBondContact O-CD1 3.37Å; L187-I191 VanDerWaalsContact O-CG1 3.22Å; L187-I191 WeakPolarHBondContact O-CG1 3.17Å; L187-I191 PolarHBondContact O-N 3.3Å
188L75.8Confident71.2Confident69 Ų6967.7 Ų67.736%0.36138%0.38SS..Hα-helixtrans-69.8-44.1-177.1-16659.9000113.9P165 A184 L185 R186 I191 G192P165-L188 HydrophobicContact CB-CB 4.42Å; P165-L188 HydrophobicContact CB-CD2 4.1Å; P165-L188 HydrophobicContact CB-CG 4.49Å; P165-L188 HydrophobicContact CG-CB 4.28Å; P165-L188 HydrophobicContact CG-CD2 3.7Å; P165-L188 HydrophobicContact CG-CG 3.91Å; A184-L188 PolarHBondContact O-N 3.24Å; L185-L188 HydrophobicContact CD1-CD2 4.02Å; L185-L188 WeakPolarHBondContact O-CB 3.19Å; R186-L188 VanDerWaalsContact C-N 3.26Å; L188-I191 PolarHBondContact O-N 2.85Å; L188-G192 PolarHBondContact O-N 2.83Å
189P74.4Confident72.3Confident17 Ų1767.2 Ų67.211%0.1138%0.381CS..Hα-helixtrans-55.6-47.8174.9-25.532.2000115.6P165 L185 R186 G192 Q193P165-P189 HydrophobicContact CB-CG 4.37Å; L185-P189 WeakPolarHBondContact O-CD 3.46Å; R186-P189 WeakPolarHBondContact O-CD 3.28Å; P189-G192 PolarHBondContact O-N 3.2Å; P189-Q193 WeakPolarHBondContact O-CG 3.22Å; P189-Q193 PolarHBondContact O-N 3.36Å
190P77.9Confident73.4Confident53 Ų5361.9 Ų61.934%0.34435%0.354SS..Hα-helixtrans-69.1-36.8-179.925.1-32.3000112.3F19 R186 L187 G192 Q193 G194F19-P190 HydrophobicContact CE2-CB 4.48Å; F19-P190 HydrophobicContact CE2-CG 4.19Å; R186-P190 WeakPolarHBondContact O-CD 3.31Å; L187-P190 WeakPolarHBondContact O-CD 3.44Å; L187-P190 VanDerWaalsContact O-CG 3.26Å; L187-P190 WeakPolarHBondContact O-CG 3.2Å; P190-G192 VanDerWaalsContact C-N 3.31Å; P190-Q193 PolarHBondContact O-N 2.85Å; P190-G194 PolarHBondContact O-N 2.81Å
191I81.4Confident74.8Confident94 Ų9456.2 Ų56.248%0.48233%0.327SS..Hα-helixtrans-62.5-44.2171.9-65.6169.1000109.7L187 L188 G194 L195L187-I191 HydrophobicContact CB-CD1 4.44Å; L187-I191 VanDerWaalsContact O-CD1 3.32Å; L187-I191 WeakPolarHBondContact O-CD1 3.37Å; L187-I191 VanDerWaalsContact O-CG1 3.22Å; L187-I191 WeakPolarHBondContact O-CG1 3.17Å; L187-I191 PolarHBondContact O-N 3.3Å; L188-I191 PolarHBondContact O-N 2.85Å; I191-G194 PolarHBondContact O-N 3.47Å; I191-L195 HydrophobicContact CG2-CD1 4.02Å; I191-L195 HydrophobicContact CG2-CG 4.45Å; I191-L195 WeakPolarHBondContact O-CB 3.34Å; I191-L195 WeakPolarHBondContact O-CG 3.36Å; I191-L195 PolarHBondContact O-N 3.18Å
192G81.3Confident76.2Confident0 Ų058.5 Ų58.50%032%0.322CS..Hα-helixtrans-58.6-47177.500000112.9L188 P189 P190 L195 E196L188-G192 PolarHBondContact O-N 2.83Å; P189-G192 PolarHBondContact O-N 3.2Å; P190-G192 VanDerWaalsContact C-N 3.31Å; G192-L195 PolarHBondContact O-N 3.2Å; G192-E196 WeakPolarHBondContact O-CB 2.91Å; G192-E196 PolarHBondContact O-N 3.41Å
193Q79.2Confident77.2Confident45 Ų4559.2 Ų59.221%0.2133%0.327CS..Hα-helixtrans-65.5-40.1176.4-74169.65.700112.6N23 P189 P190 L195 E196 A197N23-Q193 PolarHBondContact OD1-NE2 2.81Å; N23-Q193 PolarHBondContact OD1-OE1 3.28Å; P189-Q193 WeakPolarHBondContact O-CG 3.22Å; P189-Q193 PolarHBondContact O-N 3.36Å; P190-Q193 PolarHBondContact O-N 2.85Å; Q193-L195 VanDerWaalsContact C-N 3.34Å; Q193-E196 PolarHBondContact O-N 2.91Å; Q193-A197 WeakPolarHBondContact O-CB 3.37Å; Q193-A197 PolarHBondContact O-N 2.97Å
194G84.3Confident78Confident36 Ų3657.7 Ų57.737%0.37132%0.319SS..Hα-helixtrans-60.6-44.5173.900000111.8P190 I191 A197 L198P190-G194 PolarHBondContact O-N 2.81Å; I191-G194 PolarHBondContact O-N 3.47Å; G194-A197 PolarHBondContact O-N 3.42Å; G194-L198 WeakPolarHBondContact O-CG 3.24Å; G194-L198 PolarHBondContact O-N 3.33Å
195L85.3Confident78.7Confident85 Ų8562.7 Ų62.745%0.44532%0.321SS..Hα-helixtrans-65.5-40.3175-72.3173.5000112.2L161 I191 G192 Q193 L198 L199L161-L195 HydrophobicContact CD1-CB 3.94Å; L161-L195 HydrophobicContact CD2-CD1 4.34Å; I191-L195 HydrophobicContact CG2-CD1 4.02Å; I191-L195 HydrophobicContact CG2-CG 4.45Å; I191-L195 WeakPolarHBondContact O-CB 3.34Å; I191-L195 WeakPolarHBondContact O-CG 3.36Å; I191-L195 PolarHBondContact O-N 3.18Å; G192-L195 PolarHBondContact O-N 3.2Å; Q193-L195 VanDerWaalsContact C-N 3.34Å; L195-L198 PolarHBondContact O-N 2.89Å; L195-L199 WeakPolarHBondContact O-CB 3.48Å; L195-L199 PolarHBondContact O-N 3.45Å
196E81.3Confident79.1Confident2 Ų266.8 Ų66.81%0.00934%0.343CS..Hα-helixtrans-60.1-49.8175.6-156.4-168.3144.500110.1V30 H158 G192 Q193 L198 L199 Y200V30-E196 WeakPolarHBondContact CG2-OE1 3.45Å; H158-E196 IonicContact CE1-OE2 3.66Å; H158-E196 IonicContact CG-OE2 2.95Å; H158-E196 IonicContact ND1-OE1 2.77Å; H158-E196 IonicContact ND1-OE2 2.69Å; H158-E196 PolarHBondContact ND1-OE2 2.96Å; G192-E196 WeakPolarHBondContact O-CB 2.91Å; G192-E196 PolarHBondContact O-N 3.41Å; Q193-E196 PolarHBondContact O-N 2.91Å; E196-L198 PolarHBondContact O-N 3.42Å; E196-L199 CarbonylContact O-C 3.59Å; E196-L199 WeakPolarHBondContact O-CA 3.16Å; E196-L199 WeakPolarHBondContact O-CB 3.29Å; E196-L199 PolarHBondContact O-N 3.02Å; E196-Y200 HydrophobicContact CB-CE2 4.4Å; E196-Y200 HydrophobicContact CG-CD2 4.14Å; E196-Y200 HydrophobicContact CG-CE2 3.55Å; E196-Y200 WeakPolarHBondContact O-CD2 3.48Å; E196-Y200 PolarHBondContact O-N 2.72Å; E196-Y200 WeakPolarHBondContact OE1-CE2 3.44Å; E196-Y200 PolarHBondContact OE1-OH 3.13Å
197A81.2Confident79.6Confident52 Ų5269.4 Ų69.443%0.4336%0.359SS..Hα-helixtrans-56.3-46.117600000112.2Q193 G194 L199 Y200 T201Q193-A197 WeakPolarHBondContact O-CB 3.37Å; Q193-A197 PolarHBondContact O-N 2.97Å; G194-A197 PolarHBondContact O-N 3.42Å; A197-L199 VanDerWaalsContact C-N 3.31Å; A197-L199 PolarHBondContact O-N 3.09Å; A197-Y200 WeakPolarHBondContact O-CB 2.72Å; A197-Y200 PolarHBondContact O-N 3.5Å; A197-T201 WeakPolarHBondContact O-CG2 3.07Å; A197-T201 PolarHBondContact O-N 3.47Å
198L83.9Confident80Confident108 Ų10869.3 Ų69.357%0.56535%0.351SS*.Hα-helixtrans-60.9-41.8175-72.6172.8000111.5G194 L195 E196 Y200 T201 Y202G194-L198 WeakPolarHBondContact O-CG 3.24Å; G194-L198 PolarHBondContact O-N 3.33Å; L195-L198 PolarHBondContact O-N 2.89Å; E196-L198 PolarHBondContact O-N 3.42Å; L198-Y200 PolarHBondContact O-N 3.02Å; L198-T201 PolarHBondContact O-N 3.4Å; L198-T201 PolarHBondContact O-OG1 3.14Å; L198-Y202 PolarHBondContact O-N 2.59Å
199L84.2Confident80.3Confident61 Ų6169.2 Ų69.232%0.31935%0.35SS..Hα-helixtrans-64.5-39.5177.6-167.565.6000112.2I153 S157 L195 E196 A197 Y202 T203I153-L199 HydrophobicContact CG2-CD1 4.3Å; I153-L199 HydrophobicContact CG2-CD2 3.59Å; I153-L199 HydrophobicContact CG2-CG 4.02Å; S157-L199 WeakPolarHBondContact OG-CD2 3.45Å; L195-L199 WeakPolarHBondContact O-CB 3.48Å; L195-L199 PolarHBondContact O-N 3.45Å; E196-L199 CarbonylContact O-C 3.59Å; E196-L199 WeakPolarHBondContact O-CA 3.16Å; E196-L199 WeakPolarHBondContact O-CB 3.29Å; E196-L199 PolarHBondContact O-N 3.02Å; A197-L199 VanDerWaalsContact C-N 3.31Å; A197-L199 PolarHBondContact O-N 3.09Å; L199-Y202 PolarHBondContact O-N 2.84Å; L199-T203 HydrophobicContact CD1-CG2 4.42Å; L199-T203 HydrophobicContact CG-CG2 4.4Å; L199-T203 WeakPolarHBondContact O-CB 3.32Å; L199-T203 VanDerWaalsContact O-CG2 3.25Å; L199-T203 WeakPolarHBondContact O-CG2 3.22Å; L199-T203 PolarHBondContact O-N 2.95Å; L199-T203 PolarHBondContact O-OG1 3.15Å
200Y80.2Confident80.7Confident56 Ų5670.3 Ų70.322%0.2236%0.361CS..Hα-helixtrans-58.5-50.5171.8-77.7-80.7000111.3V30 I154 E196 A197 L198 Y202 T203 L204V30-Y200 WeakPolarHBondContact CG2-OH 3.46Å; I154-Y200 HydrophobicContact CB-CE1 3.99Å; I154-Y200 HydrophobicContact CD1-CD1 3.35Å; I154-Y200 HydrophobicContact CD1-CE1 3.18Å; I154-Y200 HydrophobicContact CD1-CG 4.46Å; I154-Y200 HydrophobicContact CG1-CD1 3.58Å; I154-Y200 HydrophobicContact CG1-CE1 3.31Å; I154-Y200 HydrophobicContact CG1-CG 4.32Å; I154-Y200 HydrophobicContact CG2-CE1 3.48Å; I154-Y200 VanDerWaalsContact CG2-CE1 3.48Å; I154-Y200 HydrophobicContact CG2-CE2 4.31Å; I154-Y200 WeakPolarHBondContact CG2-OH 3.27Å; E196-Y200 HydrophobicContact CB-CE2 4.4Å; E196-Y200 HydrophobicContact CG-CD2 4.14Å; E196-Y200 HydrophobicContact CG-CE2 3.55Å; E196-Y200 WeakPolarHBondContact O-CD2 3.48Å; E196-Y200 PolarHBondContact O-N 2.72Å; E196-Y200 WeakPolarHBondContact OE1-CE2 3.44Å; E196-Y200 PolarHBondContact OE1-OH 3.13Å; A197-Y200 WeakPolarHBondContact O-CB 2.72Å; A197-Y200 PolarHBondContact O-N 3.5Å; L198-Y200 PolarHBondContact O-N 3.02Å; Y200-Y202 PolarHBondContact O-N 2.92Å; Y200-T203 PolarHBondContact O-N 3.06Å; Y200-T203 PolarHBondContact O-OG1 2.95Å; Y200-T203 VanDerWaalsContact O-OG1 3.12Å; Y200-L204 HydrophobicContact CD1-CD1 4.44Å; Y200-L204 VanDerWaalsContact O-CD1 3.26Å; Y200-L204 WeakPolarHBondContact O-CD1 3.49Å; Y200-L204 PolarHBondContact O-N 2Å; Y200-L204 VanDerWaalsContact O-N 3.1Å
201T80.9Confident80.8Confident37 Ų3770.2 Ų70.223%0.22736%0.357CS..Hα-helixtrans-64.1-31.9-177.465.40000112.2A197 L198 R208 M211A197-T201 WeakPolarHBondContact O-CG2 3.07Å; A197-T201 PolarHBondContact O-N 3.47Å; L198-T201 PolarHBondContact O-N 3.4Å; L198-T201 PolarHBondContact O-OG1 3.14Å; T201-R208 PolarHBondContact O-N 2.8Å; T201-M211 HydrophobicContact CG2-CE 4.48Å; T201-M211 HydrophobicContact CG2-SD 4.1Å; T201-M211 WeakPolarHBondContact OG1-CE 3.27Å
202Y81.7Confident80.9Confident143 Ų14370.8 Ų70.856%0.56136%0.357SS*.Hα-helixtrans-75.3-39.7175.8-118-96.7000112.9L198 L199 Y200 R208L198-Y202 PolarHBondContact O-N 2.59Å; L199-Y202 PolarHBondContact O-N 2.84Å; Y200-Y202 PolarHBondContact O-N 2.92Å; Y202-R208 PolarHBondContact O-NE 3.15Å; Y202-R208 VanDerWaalsContact O-NE 3.17Å; Y202-R208 PolarHBondContact O-NH2 3.15Å
203T79.1Confident80.9Confident29 Ų2975.8 Ų75.818%0.17838%0.376CS..Hα-helixtrans-76.8-29.1-175.352.60000113.5K150 I153 L199 Y200K150-T203 VanDerWaalsContact CE-O 3.29Å; K150-T203 WeakPolarHBondContact CE-O 3.46Å; I153-T203 HydrophobicContact CD1-CG2 4.46Å; I153-T203 HydrophobicContact CG2-CG2 4.34Å; L199-T203 HydrophobicContact CD1-CG2 4.42Å; L199-T203 HydrophobicContact CG-CG2 4.4Å; L199-T203 WeakPolarHBondContact O-CB 3.32Å; L199-T203 VanDerWaalsContact O-CG2 3.25Å; L199-T203 WeakPolarHBondContact O-CG2 3.22Å; L199-T203 PolarHBondContact O-N 2.95Å; L199-T203 PolarHBondContact O-OG1 3.15Å; Y200-T203 PolarHBondContact O-N 3.06Å; Y200-T203 PolarHBondContact O-OG1 2.95Å; Y200-T203 VanDerWaalsContact O-OG1 3.12Å
204L78.3Confident81.1Confident57 Ų5778.6 Ų78.630%0.29839%0.391SS..  trans-86115.9174-77.6108.2000111.3Y200 D206 M207 R208Y200-L204 HydrophobicContact CD1-CD1 4.44Å; Y200-L204 VanDerWaalsContact O-CD1 3.26Å; Y200-L204 WeakPolarHBondContact O-CD1 3.49Å; Y200-L204 PolarHBondContact O-N 2Å; Y200-L204 VanDerWaalsContact O-N 3.1Å; L204-D206 VanDerWaalsContact C-N 3.29Å; L204-D206 PolarHBondContact O-N 3.09Å; L204-M207 HydrophobicContact CB-CB 3.95Å; L204-M207 HydrophobicContact CB-CG 3.86Å; L204-M207 PolarHBondContact O-N 3.15Å; L204-R208 PolarHBondContact O-N 3.11Å
205R77.9Confident81.1Confident182 Ų18285 Ų8569%0.68740%0.404SS*.Hα-helixtrans-56.5-42.7178.8-173.4-179.3-177.8179.10.9112.1R208 L209R205-R208 WeakPolarHBondContact O-CB 3.17Å; R205-R208 PolarHBondContact O-N 2.8Å; R205-L209 HydrophobicContact CG-CD1 4.16Å; R205-L209 HydrophobicContact CG-CG 4.49Å; R205-L209 WeakPolarHBondContact O-CG 3.35Å; R205-L209 PolarHBondContact O-N 3.19Å
206D76.5Confident80.9Confident120 Ų12084.3 Ų84.364%0.64241%0.407SS*.Hα-helixtrans-66.3-41-178.1-54.3-40.7000111.4L204 L209 A210L204-D206 VanDerWaalsContact C-N 3.29Å; L204-D206 PolarHBondContact O-N 3.09Å; D206-L209 PolarHBondContact O-N 3.4Å; D206-A210 WeakPolarHBondContact O-CB 3.49Å; D206-A210 PolarHBondContact O-N 3.29Å
207M75.2Confident80.6Confident103 Ų10387.3 Ų87.351%0.50742%0.422SS..Hα-helixtrans-65.3-41.5174-67.6-62.5-175.100111.7L204 L209 A210 M211L204-M207 HydrophobicContact CB-CB 3.95Å; L204-M207 HydrophobicContact CB-CG 3.86Å; L204-M207 PolarHBondContact O-N 3.15Å; M207-L209 PolarHBondContact O-N 3.03Å; M207-A210 PolarHBondContact O-N 3.33Å; M207-M211 WeakPolarHBondContact O-CG 3.29Å; M207-M211 PolarHBondContact O-N 3.26Å
208R80.8Confident80.4Confident107 Ų10789.6 Ų89.640%0.40443%0.434SS..Hα-helixtrans-60.5-44.7175.3-167.4-170.2-59.4-176.6-1.1111.8T201 Y202 L204 R205 M211 Q212T201-R208 PolarHBondContact O-N 2.8Å; Y202-R208 PolarHBondContact O-NE 3.15Å; Y202-R208 VanDerWaalsContact O-NE 3.17Å; Y202-R208 PolarHBondContact O-NH2 3.15Å; L204-R208 PolarHBondContact O-N 3.11Å; R205-R208 WeakPolarHBondContact O-CB 3.17Å; R205-R208 PolarHBondContact O-N 2.8Å; R208-M211 PolarHBondContact O-N 3.28Å; R208-Q212 WeakPolarHBondContact O-CB 3.26Å; R208-Q212 WeakPolarHBondContact O-CG 3.5Å; R208-Q212 PolarHBondContact O-N 3.35Å
209L81.1Confident80Confident66 Ų6688.2 Ų88.235%0.34644%0.439SS..Hα-helixtrans-65.1-40.8176.3-71.6172000111.4R205 D206 M207 Q212 R213R205-L209 HydrophobicContact CG-CD1 4.16Å; R205-L209 HydrophobicContact CG-CG 4.49Å; R205-L209 WeakPolarHBondContact O-CG 3.35Å; R205-L209 PolarHBondContact O-N 3.19Å; D206-L209 PolarHBondContact O-N 3.4Å; M207-L209 PolarHBondContact O-N 3.03Å; L209-Q212 PolarHBondContact O-N 3.06Å; L209-R213 WeakPolarHBondContact O-CG 3.37Å; L209-R213 PolarHBondContact O-N 2.85Å
210A82.1Confident79.5Confident41 Ų4191.7 Ų91.734%0.33945%0.451SS..Hα-helixtrans-61.7-46.2174.800000111.5D206 M207 Q212 R213 I214D206-A210 WeakPolarHBondContact O-CB 3.49Å; D206-A210 PolarHBondContact O-N 3.29Å; M207-A210 PolarHBondContact O-N 3.33Å; A210-Q212 PolarHBondContact O-N 3.16Å; A210-R213 WeakPolarHBondContact O-CB 3.42Å; A210-R213 PolarHBondContact O-N 3.07Å; A210-I214 WeakPolarHBondContact O-CG1 3.42Å; A210-I214 PolarHBondContact O-N 3.35Å
211M81.7Confident78.8Confident50 Ų5093.1 Ų93.125%0.24647%0.467CS..Hα-helixtrans-61.6-40.7175.1-73.3-167-60.900112.5T201 M207 R208 R213 I214 R215T201-M211 HydrophobicContact CG2-CE 4.48Å; T201-M211 HydrophobicContact CG2-SD 4.1Å; T201-M211 WeakPolarHBondContact OG1-CE 3.27Å; M207-M211 WeakPolarHBondContact O-CG 3.29Å; M207-M211 PolarHBondContact O-N 3.26Å; R208-M211 PolarHBondContact O-N 3.28Å; M211-R213 VanDerWaalsContact C-N 3.33Å; M211-I214 PolarHBondContact O-N 2.97Å; M211-R215 WeakPolarHBondContact O-CG 3.19Å; M211-R215 PolarHBondContact O-N 2.76Å
212Q83.6Confident78.1Confident107 Ų10795.5 Ų95.550%0.549%0.485SS..Hα-helixtrans-63.3-39.7175.3-76.2176-17.700111.8R208 L209 A210 R215 S216R208-Q212 WeakPolarHBondContact O-CB 3.26Å; R208-Q212 WeakPolarHBondContact O-CG 3.5Å; R208-Q212 PolarHBondContact O-N 3.35Å; L209-Q212 PolarHBondContact O-N 3.06Å; A210-Q212 PolarHBondContact O-N 3.16Å; Q212-R215 PolarHBondContact O-N 3.1Å; Q212-S216 PolarHBondContact O-N 3.23Å
213R81.1Confident77.1Confident104 Ų10492.4 Ų92.439%0.39248%0.476SS..Hα-helixtrans-63.1-48173.8-72.6178.3-169.5173.37.6111.3L209 A210 M211 R215 S216 L217L209-R213 WeakPolarHBondContact O-CG 3.37Å; L209-R213 PolarHBondContact O-N 2.85Å; A210-R213 WeakPolarHBondContact O-CB 3.42Å; A210-R213 PolarHBondContact O-N 3.07Å; M211-R213 VanDerWaalsContact C-N 3.33Å; R213-R215 VanDerWaalsContact C-N 3.29Å; R213-R215 PolarHBondContact O-N 2.87Å; R213-S216 WeakPolarHBondContact CA-OG 3.45Å; R213-S216 PolarHBondContact O-N 3.25Å; R213-S216 VanDerWaalsContact O-N 3.09Å; R213-S216 PolarHBondContact O-OG 3.29Å; R213-L217 WeakPolarHBondContact O-CG 3.4Å; R213-L217 PolarHBondContact O-N 3Å
214I82.9Confident76.1Confident104 Ų10494.4 Ų94.453%0.53349%0.485SS..Hα-helixtrans-57.4-44.5176.8-66.3166.2000110.4A210 M211 S216 L217 C218A210-I214 WeakPolarHBondContact O-CG1 3.42Å; A210-I214 PolarHBondContact O-N 3.35Å; M211-I214 PolarHBondContact O-N 2.97Å; I214-S216 PolarHBondContact O-N 3.4Å; I214-L217 PolarHBondContact O-N 3.46Å; I214-C218 PolarHBondContact O-N 3.19Å; I214-C218 PolarHBondContact O-SG 3.46Å; I214-C218 VanDerWaalsContact O-SG 3.39Å
215R83.3Confident75.1Confident171 Ų17199 Ų9965%0.64551%0.509SS*.Hα-helixtrans-59.9-43174.8-74.2-179.2-173.9179.41.9112.8M211 Q212 R213 L217 C218 A219M211-R215 WeakPolarHBondContact O-CG 3.19Å; M211-R215 PolarHBondContact O-N 2.76Å; Q212-R215 PolarHBondContact O-N 3.1Å; R213-R215 VanDerWaalsContact C-N 3.29Å; R213-R215 PolarHBondContact O-N 2.87Å; R215-L217 VanDerWaalsContact C-N 3.32Å; R215-L217 PolarHBondContact O-N 3.16Å; R215-C218 PolarHBondContact O-N 3.38Å; R215-A219 WeakPolarHBondContact O-CB 3.27Å; R215-A219 PolarHBondContact O-N 3.42Å
216S81.6Confident74.2Confident70 Ų7095.6 Ų95.649%0.4950%0.499SS..Hα-helixtrans-65.3-34.6177.266.70000113.1Q212 R213 I214 A219 K220Q212-S216 PolarHBondContact O-N 3.23Å; R213-S216 WeakPolarHBondContact CA-OG 3.45Å; R213-S216 PolarHBondContact O-N 3.25Å; R213-S216 VanDerWaalsContact O-N 3.09Å; R213-S216 PolarHBondContact O-OG 3.29Å; I214-S216 PolarHBondContact O-N 3.4Å; S216-A219 PolarHBondContact O-N 2.88Å; S216-K220 PolarHBondContact O-N 2.74Å; S216-K220 VanDerWaalsContact O-N 3.13Å
217L74.9Confident73.3Confident65 Ų6594.5 Ų94.534%0.3450%0.499SS..Hα-helixtrans-70.8-40.8177-69.6164.4000111.4R213 I214 R215 A219 K220 L224R213-L217 WeakPolarHBondContact O-CG 3.4Å; R213-L217 PolarHBondContact O-N 3Å; I214-L217 PolarHBondContact O-N 3.46Å; R215-L217 VanDerWaalsContact C-N 3.32Å; R215-L217 PolarHBondContact O-N 3.16Å; L217-A219 VanDerWaalsContact C-N 3.3Å; L217-A219 PolarHBondContact O-N 2.98Å; L217-K220 CarbonylContact O-C 3.29Å; L217-K220 VanDerWaalsContact O-C 3.29Å; L217-K220 PolarHBondContact O-N 3.41Å; L217-L224 HydrophobicContact CB-CD1 4.14Å; L217-L224 HydrophobicContact CD2-CD1 3.77Å; L217-L224 HydrophobicContact CD2-CD2 4.1Å; L217-L224 HydrophobicContact CD2-CG 3.65Å; L217-L224 HydrophobicContact CG-CD1 4.49Å
218C76.6Confident72.5Confident101 Ų10199.8 Ų99.868%0.68251%0.513SS*.Hα-helixtrans-65.2-32.7173.6-67.30000112.6I214 R215I214-C218 PolarHBondContact O-N 3.19Å; I214-C218 PolarHBondContact O-SG 3.46Å; I214-C218 VanDerWaalsContact O-SG 3.39Å; R215-C218 PolarHBondContact O-N 3.38Å
219A76.2Confident71.5Confident79 Ų7997 Ų9765%0.65351%0.508SS*.Hα-helixtrans-76.7-25.3178.300000113.6R215 S216 L217R215-A219 WeakPolarHBondContact O-CB 3.27Å; R215-A219 PolarHBondContact O-N 3.42Å; S216-A219 PolarHBondContact O-N 2.88Å; L217-A219 VanDerWaalsContact C-N 3.3Å; L217-A219 PolarHBondContact O-N 2.98Å
220K72.9Confident70.2Confident133 Ų133101 Ų10158%0.57852%0.519SS*.  trans-137.773-179.6-67.6-174.6-179.2-178.10110.8S216 L217 S222 E223S216-K220 PolarHBondContact O-N 2.74Å; S216-K220 VanDerWaalsContact O-N 3.13Å; L217-K220 CarbonylContact O-C 3.29Å; L217-K220 VanDerWaalsContact O-C 3.29Å; L217-K220 PolarHBondContact O-N 3.41Å; K220-S222 PolarHBondContact O-N 3.02Å; K220-S222 VanDerWaalsContact O-N 3.09Å; K220-E223 HydrophobicContact CB-CG 4.23Å; K220-E223 PolarHBondContact O-N 2.98Å; K220-E223 VanDerWaalsContact O-N 3.13Å
221P66.3Low69Low87 Ų87107.4 Ų107.457%0.56553%0.534SS*.G310 helixtrans-60.3-23.5179.823.6-32.8000112.7E223 L224P221-E223 VanDerWaalsContact C-N 3.26Å; P221-E223 PolarHBondContact O-N 3.28Å; P221-L224 PolarHBondContact O-N 3.37Å
222S65.9Low67.9Low87 Ų87111.8 Ų111.861%0.60855%0.554SS**G310 helixtrans-66.3-18.8177.655.30000114.8K220K220-S222 PolarHBondContact O-N 3.02Å; K220-S222 VanDerWaalsContact O-N 3.09Å
223E61.4Low66.6Low77 Ų77110.2 Ų110.236%0.3655%0.549SS..G310 helixtrans-79.3-15.6177.2-76-77.9135.300113.3K220 P221 L225 K226 T229K220-E223 HydrophobicContact CB-CG 4.23Å; K220-E223 PolarHBondContact O-N 2.98Å; K220-E223 VanDerWaalsContact O-N 3.13Å; P221-E223 VanDerWaalsContact C-N 3.26Å; P221-E223 PolarHBondContact O-N 3.28Å; E223-L225 VanDerWaalsContact C-N 3.34Å; E223-K226 IonicContact OE1-NZ 2.76Å; E223-K226 PolarHBondContact OE1-NZ 3.37Å; E223-K226 IonicContact OE2-NZ 3.94Å; E223-T229 PolarHBondContact O-OG1 2.91Å
224L57.4Low65.5Low72 Ų72111.3 Ų111.338%0.37756%0.558SS.*G310 helixtrans-73.6-21.5176.7-88.8140.9000113.8L217 P221 K226 W230L217-L224 HydrophobicContact CB-CD1 4.14Å; L217-L224 HydrophobicContact CD2-CD1 3.77Å; L217-L224 HydrophobicContact CD2-CD2 4.1Å; L217-L224 HydrophobicContact CD2-CG 3.65Å; L217-L224 HydrophobicContact CG-CD1 4.49Å; P221-L224 PolarHBondContact O-N 3.37Å; L224-K226 VanDerWaalsContact C-N 3.33Å; L224-W230 HydrophobicContact CD2-CZ2 4.4Å; L224-W230 PolarHBondContact O-NE1 3.47Å
225L56.9Low64.2Low152 Ų152111.7 Ų111.780%0.79656%0.561SS**G310 helixtrans-81.2-8.1178.3-88.896.3000113.8E223 P227E223-L225 VanDerWaalsContact C-N 3.34Å; L225-P227 VanDerWaalsContact O-CD 3.31Å; L225-P227 WeakPolarHBondContact O-CD 3.44Å
226K60.2Low62.7Low111 Ų111111.2 Ų111.248%0.48356%0.559SS.*  trans-79.9118.9177.6-73.6176-176.31650110E223 L224 R228 T229E223-K226 IonicContact OE1-NZ 2.76Å; E223-K226 PolarHBondContact OE1-NZ 3.37Å; E223-K226 IonicContact OE2-NZ 3.94Å; L224-K226 VanDerWaalsContact C-N 3.33Å; K226-R228 PolarHBondContact O-N 2.74Å; K226-T229 PolarHBondContact O-N 3.47Å; K226-T229 PolarHBondContact O-OG1 3.32Å
227P57.8Low61.3Low97 Ų97113.3 Ų113.363%0.6357%0.565SS**Hα-helixtrans-64.6-15.3-179.422.2-31.5000113.9L225L225-P227 VanDerWaalsContact O-CD 3.31Å; L225-P227 WeakPolarHBondContact O-CD 3.44Å
228R58.1Low60.2Low214 Ų214119.9 Ų119.981%0.80859%0.585SS**Hα-helixtrans-72.7-32.4176.4-87.1-176.7173.5-179.7-1.6113.7K226 R231 Q232K226-R228 PolarHBondContact O-N 2.74Å; R228-R231 PolarHBondContact O-N 3.41Å; R228-Q232 PolarHBondContact O-N 2.84Å
229T58.8Low59Low49 Ų49120.7 Ų120.730%0.30159%0.586SS.*Hα-helixtrans-71.1-37.3-179.715.50000111.6E223 K226 R231 Q232 L233E223-T229 PolarHBondContact O-OG1 2.91Å; K226-T229 PolarHBondContact O-N 3.47Å; K226-T229 PolarHBondContact O-OG1 3.32Å; T229-R231 PolarHBondContact O-N 2.93Å; T229-Q232 PolarHBondContact O-N 3.47Å; T229-L233 WeakPolarHBondContact O-CG 3.23Å; T229-L233 PolarHBondContact O-N 3.22Å; T229-L233 VanDerWaalsContact O-N 3.08Å
230W55.6Low57.4Low149 Ų149122.1 Ų122.156%0.56459%0.587SS**Hα-helixtrans-61.3-41.1173.4-78.794.4000113.2L224 L233 Q234L224-W230 HydrophobicContact CD2-CZ2 4.4Å; L224-W230 PolarHBondContact O-NE1 3.47Å; W230-L233 PolarHBondContact O-N 3.02Å; W230-Q234 PolarHBondContact O-N 3.37Å; W230-Q234 VanDerWaalsContact O-N 3.08Å
231R56.2Low55.5Low176 Ų176120.5 Ų120.566%0.66459%0.591SS**Hα-helixtrans-68.1-37.5179.6-129.7-177.9-82.4-176.6-7.2112R228 T229 L235R228-R231 PolarHBondContact O-N 3.41Å; T229-R231 PolarHBondContact O-N 2.93Å; R231-L235 WeakPolarHBondContact O-CB 3.12Å; R231-L235 WeakPolarHBondContact O-CD1 3.43Å; R231-L235 WeakPolarHBondContact O-CG 3.25Å; R231-L235 PolarHBondContact O-N 3.28Å; R231-L235 VanDerWaalsContact O-N 3.09Å
232Q58.9Low54.2Low142 Ų142126.7 Ų126.766%0.66461%0.612SS**Hα-helixtrans-70.8-32.5175.7-72.8-164-12.500113.4R228 T229 R236R228-Q232 PolarHBondContact O-N 2.84Å; T229-Q232 PolarHBondContact O-N 3.47Å; Q232-R236 WeakPolarHBondContact O-CB 3.5Å; Q232-R236 PolarHBondContact O-N 3.35Å; Q232-R236 VanDerWaalsContact O-N 3.16Å
233L56.3Low53.6Low75 Ų75128.7 Ų128.739%0.39361%0.612SS.*Hα-helixtrans-67.2-47.2173.9-78.6157.8000111.3T229 W230 L235 R236 D237T229-L233 WeakPolarHBondContact O-CG 3.23Å; T229-L233 PolarHBondContact O-N 3.22Å; T229-L233 VanDerWaalsContact O-N 3.08Å; W230-L233 PolarHBondContact O-N 3.02Å; L233-L235 VanDerWaalsContact C-N 3.35Å; L233-L235 PolarHBondContact O-N 2.75Å; L233-R236 PolarHBondContact O-N 3.25Å; L233-D237 PolarHBondContact O-N 3.24Å
234Q58.2Low53.2Low127 Ų127131.4 Ų131.459%0.59363%0.625SS**Hα-helixtrans-64.4-35.2177.3-77.8-168-29.500113.8W230W230-Q234 PolarHBondContact O-N 3.37Å; W230-Q234 VanDerWaalsContact O-N 3.08Å
235L53.9Low52.9Low112 Ų112134.7 Ų134.759%0.58664%0.639SS**Hα-helixtrans-72.8-33.5178.3-80.9160.6000112.1R231 L233 V239R231-L235 WeakPolarHBondContact O-CB 3.12Å; R231-L235 WeakPolarHBondContact O-CD1 3.43Å; R231-L235 WeakPolarHBondContact O-CG 3.25Å; R231-L235 PolarHBondContact O-N 3.28Å; R231-L235 VanDerWaalsContact O-N 3.09Å; L233-L235 VanDerWaalsContact C-N 3.35Å; L233-L235 PolarHBondContact O-N 2.75Å; L235-V239 WeakPolarHBondContact O-CG2 3.32Å
236R52Low52.7Low161 Ų161133.6 Ų133.661%0.60863%0.63SS**Hα-helixtrans-77.2-33.9-178.5-162.3176.6-81.5-157.4-2.1112.5Q232 L233 R238 V239 T240Q232-R236 WeakPolarHBondContact O-CB 3.5Å; Q232-R236 PolarHBondContact O-N 3.35Å; Q232-R236 VanDerWaalsContact O-N 3.16Å; L233-R236 PolarHBondContact O-N 3.25Å; R236-R238 PolarHBondContact O-N 3.29Å; R236-V239 PolarHBondContact O-N 2.94Å; R236-V239 VanDerWaalsContact O-N 3.14Å; R236-T240 PolarHBondContact O-N 3.08Å; R236-T240 PolarHBondContact O-OG1 2.94Å
237D52.9Low52.2Low114 Ų114135.1 Ų135.161%0.6164%0.639SS**Hα-helixtrans-69.1-19.3175.2-71.5-16.8000113.1L233L233-D237 PolarHBondContact O-N 3.24Å
238R50.6Low51.8Low203 Ų203137.6 Ų137.677%0.76664%0.639SS**THydrogen-bonded Turntrans-81.8-18.5171-71.4-167.9-164-164.85.2114.3R236R236-R238 PolarHBondContact O-N 3.29Å
239V52Low51.4Low117 Ų117132.1 Ų132.171%0.70963%0.627SS**THydrogen-bonded Turntrans-99.5-9.2-173.4179.60000112.6L235 R236 P241L235-V239 WeakPolarHBondContact O-CG2 3.32Å; R236-V239 PolarHBondContact O-N 2.94Å; R236-V239 VanDerWaalsContact O-N 3.14Å; V239-P241 WeakPolarHBondContact O-CD 3.41Å
240T42.2Very low50.8Low109 Ų109138.5 Ų138.567%0.66965%0.653SS**  trans-11077.8170.549.10000113.4R236R236-T240 PolarHBondContact O-N 3.08Å; R236-T240 PolarHBondContact O-OG1 2.94Å
241P33.3Very low50.4Low100 Ų100137.7 Ų137.765%0.64966%0.66SS**  trans-120.689.3152.935.6-21.2000109.5V239V239-P241 WeakPolarHBondContact O-CD 3.41Å
242Q38.6Very low49.9Very low216 Ų216134.2 Ų134.2100%1.00966%0.66SS**  trans-144.10164.8-78.6-157.1-7.400113.8R49R49-Q242 PolarHBondContact NH2-OXT 3.12Å

Retrieved 242 of 242 residues in 49.4 ms (Link to these results)

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