A0A087X5N3_POEFO Loading...

Adenosine receptor A1

Receptor for adenosine. The activity of this receptor is mediated by G proteins which inhibit adenylyl cyclase.

AlphaFold DB , UniProt , Accession A0A087X5N3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 381 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
1M31.1Very low56.6Low236 Ų236103.9 Ų103.9100%1.16365%0.648SS**  0125.50-69.1177.7-179.900106.9G3M1-G3 PolarHBondContact O-N 3.32Å
2P36.3Very low59.7Low136 Ų13696.3 Ų96.388%0.88360%0.598SS**  trans-66.1126.6-175.523.1-22.1000108.6
3G36.3Very low62.3Low67 Ų6792.6 Ų92.669%0.69157%0.571SS**  trans-58.2137.1-172.100000111.6M1 V5M1-G3 PolarHBondContact O-N 3.32Å; G3-V5 PolarHBondContact O-N 3.43Å
4T35.8Very low64.7Low140 Ų14089 Ų8986%0.85956%0.562SS**  trans-52.2104.6166.437.70000108.8S6T4-S6 PolarHBondContact O-N 3.22Å
5V45.8Very low66.8Low100 Ų10088.5 Ų88.561%0.60655%0.551SS**  trans-49.1116.4160.6-178.20000105G3 S7G3-V5 PolarHBondContact O-N 3.43Å; V5-S7 PolarHBondContact O-N 2.93Å
6S50Low68.6Low67 Ų6782.9 Ų82.947%0.46952%0.516SS..  trans-65.381.8173.9-171.70000106.6T4 A8T4-S6 PolarHBondContact O-N 3.22Å; S6-A8 PolarHBondContact O-N 3.3Å
7S58.5Low70.3Confident87 Ų8782.4 Ų82.461%0.60851%0.512SS*.PPolyproline II helixtrans-68.3121.6-177.645.70000106.8V5V5-S7 PolarHBondContact O-N 2.93Å
8A66.9Low71.8Confident4 Ų483.9 Ų83.93%0.03352%0.516CS..PPolyproline II helixtrans-52.7132.4167.100000107.7S6 Y12 I13S6-A8 PolarHBondContact O-N 3.3Å; A8-Y12 HydrophobicContact CB-CD1 3.79Å; A8-Y12 HydrophobicContact CB-CE1 4.27Å; A8-I13 HydrophobicContact CB-CD1 4.39Å; A8-I13 HydrophobicContact CB-CG1 4.29Å
9P81.1Confident73.1Confident58 Ų5880.7 Ų80.738%0.37750%0.495SS..PPolyproline II helixtrans-54.6138-175.7-2633.4000110.4L11 Y12 I13 Y269P9-L11 PolarHBondContact O-N 3.11Å; P9-Y12 WeakPolarHBondContact O-CB 3.45Å; P9-Y12 PolarHBondContact O-N 3.39Å; P9-I13 PolarHBondContact O-N 3.09Å; P9-Y269 VanDerWaalsContact CD-CE2 3.46Å; P9-Y269 HydrophobicContact CG-CD2 4.48Å; P9-Y269 HydrophobicContact CG-CE2 4.08Å
10P89.6Confident74.4Confident114 Ų11477.3 Ų77.374%0.7448%0.475SS*.Hα-helixtrans-51.5-31.7178.3-29.135000113.2I13 G14P10-I13 PolarHBondContact O-N 2.99Å; P10-G14 PolarHBondContact O-N 3.04Å
11L91.6Very high75.5Confident134 Ų13477.2 Ų77.270%0.70247%0.474SS*.Hα-helixtrans-60.7-43.7173.6-177.362.6000113P9 G14 M15P9-L11 PolarHBondContact O-N 3.11Å; L11-G14 PolarHBondContact O-N 2.96Å; L11-M15 HydrophobicContact CD1-CG 4.37Å; L11-M15 VanDerWaalsContact O-CG 3.23Å; L11-M15 WeakPolarHBondContact O-CG 3.41Å; L11-M15 PolarHBondContact O-N 3.14Å
12Y93.1Very high78.6Confident12 Ų1268.2 Ų68.25%0.04744%0.437CS..Hα-helixtrans-62.1-48.2177.9164.3-98.8000110.9A8 P9 G14 M15 E16 Y269 I272 L273A8-Y12 HydrophobicContact CB-CD1 3.79Å; A8-Y12 HydrophobicContact CB-CE1 4.27Å; P9-Y12 WeakPolarHBondContact O-CB 3.45Å; P9-Y12 PolarHBondContact O-N 3.39Å; Y12-G14 VanDerWaalsContact C-N 3.34Å; Y12-G14 PolarHBondContact O-N 3.42Å; Y12-M15 PolarHBondContact O-N 3.31Å; Y12-E16 HydrophobicContact CD1-CG 4.43Å; Y12-E16 HydrophobicContact CD2-CG 4.24Å; Y12-E16 HydrophobicContact CE1-CG 3.99Å; Y12-E16 HydrophobicContact CE2-CG 3.78Å; Y12-E16 WeakPolarHBondContact CE2-OE1 3.48Å; Y12-E16 WeakPolarHBondContact O-CG 3.35Å; Y12-E16 PolarHBondContact O-N 3.28Å; Y12-E16 PolarHBondContact OH-OE1 3.39Å; Y12-Y269 HydrophobicContact CD1-CD1 4.34Å; Y12-Y269 HydrophobicContact CD1-CE1 4.41Å; Y12-Y269 AromaticContact CD2-CD1 3.69Å; Y12-Y269 HydrophobicContact CD2-CD1 3.69Å; Y12-Y269 AromaticContact CD2-CG 3.88Å; Y12-Y269 HydrophobicContact CD2-CG 3.88Å; Y12-Y269 HydrophobicContact CE1-CD1 4.33Å; Y12-Y269 HydrophobicContact CE1-CE1 4.38Å; Y12-Y269 AromaticContact CE2-CD1 3.68Å; Y12-Y269 HydrophobicContact CE2-CD1 3.68Å; Y12-Y269 HydrophobicContact CE2-CE1 4.49Å; Y12-Y269 HydrophobicContact CE2-CG 4.26Å; Y12-Y269 HydrophobicContact CG-CD1 4.01Å; Y12-Y269 HydrophobicContact CG-CE1 4.46Å; Y12-Y269 HydrophobicContact CG-CG 4.23Å; Y12-I272 HydrophobicContact CE2-CG2 4.35Å; Y12-L273 HydrophobicContact CD2-CD1 4.15Å; Y12-L273 HydrophobicContact CD2-CD2 4.16Å; Y12-L273 HydrophobicContact CD2-CG 4Å; Y12-L273 HydrophobicContact CE2-CD2 4.24Å; Y12-L273 HydrophobicContact CE2-CG 4.11Å
13I94.1Very high81.5Confident49 Ų4961.7 Ų61.725%0.25140%0.395SS..Hα-helixtrans-61.5-43.9179.1-59176.5000110.5A8 P9 P10 M15 E16 V17 I67A8-I13 HydrophobicContact CB-CD1 4.39Å; A8-I13 HydrophobicContact CB-CG1 4.29Å; P9-I13 PolarHBondContact O-N 3.09Å; P10-I13 PolarHBondContact O-N 2.99Å; I13-M15 VanDerWaalsContact C-N 3.33Å; I13-M15 PolarHBondContact O-N 3.24Å; I13-E16 PolarHBondContact O-N 3.01Å; I13-V17 HydrophobicContact CG2-CG2 4.47Å; I13-V17 WeakPolarHBondContact O-CG2 3.44Å; I13-V17 PolarHBondContact O-N 2.84Å; I13-I67 HydrophobicContact CG1-CG2 4.42Å; I13-I67 HydrophobicContact CG2-CD1 4.34Å; I13-I67 HydrophobicContact CG2-CG2 4.25Å
14G95.7Very high84.4Confident42 Ų4260.5 Ų60.543%0.43337%0.374SS..Hα-helixtrans-60-41.5176.400000113P10 L11 Y12 L18P10-G14 PolarHBondContact O-N 3.04Å; L11-G14 PolarHBondContact O-N 2.96Å; Y12-G14 VanDerWaalsContact C-N 3.34Å; Y12-G14 PolarHBondContact O-N 3.42Å; G14-L18 WeakPolarHBondContact O-CB 3.49Å; G14-L18 PolarHBondContact O-N 3.13Å
15M96.3Very high87.2Confident81 Ų8158.5 Ų58.540%0.39936%0.357SS..Hα-helixtrans-67.9-41.8176.5-68.4-63.4-6800112.2L11 Y12 I13 L18 I19 L273L11-M15 HydrophobicContact CD1-CG 4.37Å; L11-M15 VanDerWaalsContact O-CG 3.23Å; L11-M15 WeakPolarHBondContact O-CG 3.41Å; L11-M15 PolarHBondContact O-N 3.14Å; Y12-M15 PolarHBondContact O-N 3.31Å; I13-M15 VanDerWaalsContact C-N 3.33Å; I13-M15 PolarHBondContact O-N 3.24Å; M15-L18 PolarHBondContact O-N 2.98Å; M15-I19 VanDerWaalsContact O-CG1 3.27Å; M15-I19 WeakPolarHBondContact O-CG1 3.08Å; M15-I19 PolarHBondContact O-N 3.02Å; M15-L273 HydrophobicContact CB-CD1 4.19Å; M15-L273 HydrophobicContact CB-CD2 3.75Å
16E95.9Very high89.6Confident0 Ų054.3 Ų54.30%033%0.334CS..Hα-helixtrans-57.9-48.3173.8-78.9-65.8172.700111.5Y12 I13 L18 I19 A20 I63 I67 L273 H276Y12-E16 HydrophobicContact CD1-CG 4.43Å; Y12-E16 HydrophobicContact CD2-CG 4.24Å; Y12-E16 HydrophobicContact CE1-CG 3.99Å; Y12-E16 HydrophobicContact CE2-CG 3.78Å; Y12-E16 WeakPolarHBondContact CE2-OE1 3.48Å; Y12-E16 WeakPolarHBondContact O-CG 3.35Å; Y12-E16 PolarHBondContact O-N 3.28Å; Y12-E16 PolarHBondContact OH-OE1 3.39Å; I13-E16 PolarHBondContact O-N 3.01Å; E16-L18 VanDerWaalsContact C-N 3.32Å; E16-L18 PolarHBondContact O-N 3.41Å; E16-I19 PolarHBondContact O-N 3.45Å; E16-A20 WeakPolarHBondContact O-CB 3.45Å; E16-A20 PolarHBondContact O-N 3.28Å; E16-I63 HydrophobicContact CB-CG2 3.82Å; E16-I63 HydrophobicContact CG-CG2 4.47Å; E16-I63 VanDerWaalsContact OE2-CG2 3.23Å; E16-I63 WeakPolarHBondContact OE2-CG2 3.46Å; E16-I67 HydrophobicContact CB-CD1 3.96Å; E16-I67 HydrophobicContact CB-CG1 4.06Å; E16-I67 HydrophobicContact CG-CG1 4.34Å; E16-L273 HydrophobicContact CG-CD2 3.83Å; E16-H276 IonicContact OE1-CE1 2.79Å; E16-H276 PolarHBondContact OE1-CE1 3Å; E16-H276 IonicContact OE1-ND1 2.99Å; E16-H276 PolarHBondContact OE1-ND1 2.94Å; E16-H276 IonicContact OE2-CE1 3.73Å; E16-H276 IonicContact OE2-CG 3.78Å; E16-H276 IonicContact OE2-ND1 3.75Å; E16-H276 PolarHBondContact OE2-ND1 2.88Å
17V96.9Very high91.8Very high74 Ų7451.1 Ų51.145%0.44831%0.312SS..Hα-helixtrans-61.3-41.8178171.90000111.3I13 I19 A20 V21 I67I13-V17 HydrophobicContact CG2-CG2 4.47Å; I13-V17 WeakPolarHBondContact O-CG2 3.44Å; I13-V17 PolarHBondContact O-N 2.84Å; V17-I19 PolarHBondContact O-N 3.34Å; V17-A20 PolarHBondContact O-N 2.86Å; V17-V21 WeakPolarHBondContact O-CG2 3.42Å; V17-V21 PolarHBondContact O-N 3.06Å; V17-I67 HydrophobicContact CG2-CD1 4.17Å
18L97.6Very high93.6Very high109 Ų10950.2 Ų50.257%0.57130%0.303SS*.Hα-helixtrans-61.2-45.2176.3-179.164.8000111.6G14 M15 E16 V21 A22G14-L18 WeakPolarHBondContact O-CB 3.49Å; G14-L18 PolarHBondContact O-N 3.13Å; M15-L18 PolarHBondContact O-N 2.98Å; E16-L18 VanDerWaalsContact C-N 3.32Å; E16-L18 PolarHBondContact O-N 3.41Å; L18-V21 PolarHBondContact O-N 3.5Å; L18-A22 WeakPolarHBondContact O-CB 3.24Å; L18-A22 PolarHBondContact O-N 3.12Å
19I97.4Very high94.8Very high23 Ų2351.9 Ų51.912%0.11831%0.31CS..Hα-helixtrans-62.8-43.4177-68.8166.7000110.6M15 E16 V17 A22 S23 I63 L273 H276 A280M15-I19 VanDerWaalsContact O-CG1 3.27Å; M15-I19 WeakPolarHBondContact O-CG1 3.08Å; M15-I19 PolarHBondContact O-N 3.02Å; E16-I19 PolarHBondContact O-N 3.45Å; V17-I19 PolarHBondContact O-N 3.34Å; I19-A22 PolarHBondContact O-N 2.89Å; I19-S23 VanDerWaalsContact O-CB 3.26Å; I19-S23 WeakPolarHBondContact O-CB 3.36Å; I19-S23 PolarHBondContact O-N 3.43Å; I19-I63 HydrophobicContact CB-CD1 4.35Å; I19-I63 HydrophobicContact CG2-CD1 3.8Å; I19-L273 HydrophobicContact CD1-CB 4.35Å; I19-L273 HydrophobicContact CD1-CD2 3.71Å; I19-H276 HydrophobicContact CG2-CB 4.07Å; I19-H276 WeakPolarHBondContact CG2-O 3.44Å; I19-A280 HydrophobicContact CG2-CB 4.46Å
20A97.4Very high95.4Very high12 Ų1249.1 Ų49.110%0.09929%0.292CS..Hα-helixtrans-58.3-50.817800000112E16 V17 A22 S23 V24 G59 I63E16-A20 WeakPolarHBondContact O-CB 3.45Å; E16-A20 PolarHBondContact O-N 3.28Å; V17-A20 PolarHBondContact O-N 2.86Å; A20-A22 PolarHBondContact O-N 3.33Å; A20-S23 PolarHBondContact O-N 3.12Å; A20-V24 WeakPolarHBondContact O-CG2 3.32Å; A20-V24 PolarHBondContact O-N 3.46Å; A20-G59 WeakPolarHBondContact CB-O 2.94Å; A20-I63 HydrophobicContact CB-CB 4.12Å; A20-I63 HydrophobicContact CB-CD1 3.81Å; A20-I63 HydrophobicContact CB-CG2 3.89Å
21V97.7Very high95.5Very high77 Ų7746 Ų4647%0.46727%0.271SS..Hα-helixtrans-62-46.6179.1172.80000110.8V17 L18 S23 V24 I25V17-V21 WeakPolarHBondContact O-CG2 3.42Å; V17-V21 PolarHBondContact O-N 3.06Å; L18-V21 PolarHBondContact O-N 3.5Å; V21-S23 PolarHBondContact O-N 3.23Å; V21-V24 PolarHBondContact O-N 3.43Å; V21-I25 HydrophobicContact CG1-CD1 3.59Å; V21-I25 HydrophobicContact CG1-CG1 4.4Å; V21-I25 WeakPolarHBondContact O-CB 3.29Å; V21-I25 VanDerWaalsContact O-CG1 3.3Å; V21-I25 WeakPolarHBondContact O-CG1 3.34Å; V21-I25 PolarHBondContact O-N 3.48Å
22A96.9Very high95.5Very high46 Ų4643.2 Ų43.238%0.3825%0.251SS..Hα-helixtrans-61.5-43.1178.200000112.2L18 I19 A20 G26 A280L18-A22 WeakPolarHBondContact O-CB 3.24Å; L18-A22 PolarHBondContact O-N 3.12Å; I19-A22 PolarHBondContact O-N 2.89Å; A20-A22 PolarHBondContact O-N 3.33Å; A22-G26 PolarHBondContact O-N 3.25Å; A22-A280 HydrophobicContact CB-CB 4.13Å
23S96.2Very high95.3Very high0 Ų042.6 Ų42.60%025%0.249CC..Hα-helixtrans-62.4-50.4178.3-174.90000111.7I19 A20 V21 N27 D55 S279I19-S23 VanDerWaalsContact O-CB 3.26Å; I19-S23 WeakPolarHBondContact O-CB 3.36Å; I19-S23 PolarHBondContact O-N 3.43Å; A20-S23 PolarHBondContact O-N 3.12Å; V21-S23 PolarHBondContact O-N 3.23Å; S23-N27 WeakPolarHBondContact O-CB 2.81Å; S23-N27 PolarHBondContact O-N 2.81Å; S23-N27 PolarHBondContact O-ND2 3.43Å; S23-N27 PolarHBondContact OG-ND2 2.86Å; S23-D55 PolarHBondContact OG-O 3.45Å; S23-S279 WeakPolarHBondContact OG-CB 3.42Å
24V97.7Very high95.1Very high42 Ų4241 Ų4126%0.25524%0.241SC..Hα-helixtrans-62.8-51.5-178.6173.50000110.5A20 V21 G26 N27 V28 A60A20-V24 WeakPolarHBondContact O-CG2 3.32Å; A20-V24 PolarHBondContact O-N 3.46Å; V21-V24 PolarHBondContact O-N 3.43Å; V24-G26 PolarHBondContact O-N 2.81Å; V24-N27 PolarHBondContact O-N 3.37Å; V24-V28 HydrophobicContact CG1-CG2 4.3Å; V24-V28 WeakPolarHBondContact O-CB 3.39Å; V24-V28 WeakPolarHBondContact O-CG2 3.42Å; V24-V28 PolarHBondContact O-N 3.19Å; V24-A60 HydrophobicContact CG2-CB 4.25Å
25I95.9Very high94.6Very high98 Ų9846.5 Ų46.550%0.50325%0.253SS..Hα-helixtrans-60.2-50.7-178.5-67.6173.4000110.5V21 N27 V28 M29V21-I25 HydrophobicContact CG1-CD1 3.59Å; V21-I25 HydrophobicContact CG1-CG1 4.4Å; V21-I25 WeakPolarHBondContact O-CB 3.29Å; V21-I25 VanDerWaalsContact O-CG1 3.3Å; V21-I25 WeakPolarHBondContact O-CG1 3.34Å; V21-I25 PolarHBondContact O-N 3.48Å; I25-N27 PolarHBondContact O-N 3.28Å; I25-V28 PolarHBondContact O-N 3.12Å; I25-M29 HydrophobicContact CG2-SD 4.22Å; I25-M29 WeakPolarHBondContact O-CG 3.44Å; I25-M29 PolarHBondContact O-N 2.93Å
26G95.3Very high94Very high12 Ų1246.6 Ų46.612%0.12426%0.255CS..Hα-helixtrans-61.8-44.8-176.400000112.5A22 V24 M29 V30A22-G26 PolarHBondContact O-N 3.25Å; V24-G26 PolarHBondContact O-N 2.81Å; G26-M29 WeakPolarHBondContact O-CB 3.48Å; G26-M29 PolarHBondContact O-N 3.37Å; G26-V30 WeakPolarHBondContact O-CG2 3.39Å; G26-V30 PolarHBondContact O-N 3.39Å
27N95.9Very high93.2Very high0 Ų048.7 Ų48.70%027%0.266CS..Hα-helixtrans-76.5-30.7-177.9-72.6-68000112.8S23 V24 I25 M29 V30 V31 A52 D55 I56 S279 P283S23-N27 WeakPolarHBondContact O-CB 2.81Å; S23-N27 PolarHBondContact O-N 2.81Å; S23-N27 PolarHBondContact O-ND2 3.43Å; S23-N27 PolarHBondContact OG-ND2 2.86Å; V24-N27 PolarHBondContact O-N 3.37Å; I25-N27 PolarHBondContact O-N 3.28Å; N27-M29 VanDerWaalsContact C-N 3.31Å; N27-M29 PolarHBondContact O-N 3.46Å; N27-V30 WeakPolarHBondContact O-CB 3.45Å; N27-V30 PolarHBondContact O-N 2.85Å; N27-V31 WeakPolarHBondContact O-CG2 3.4Å; N27-V31 PolarHBondContact O-N 3.29Å; N27-A52 HydrophobicContact CB-CB 4.09Å; N27-D55 HydrophobicContact CB-CB 4.41Å; N27-D55 WeakPolarHBondContact ND2-CB 3.4Å; N27-I56 HydrophobicContact CB-CD1 4.2Å; N27-I56 HydrophobicContact CB-CG1 3.6Å; N27-S279 PolarHBondContact ND2-O 3.47Å; N27-P283 HydrophobicContact CB-CG 4.45Å; N27-P283 WeakPolarHBondContact OD1-CG 3.08Å
28V95.7Very high92.3Very high68 Ų6851.8 Ų51.841%0.41227%0.273SS..Hα-helixtrans-60.3-42.9167.7168.10000110.5V24 I25 V30 V31 W32 I56V24-V28 HydrophobicContact CG1-CG2 4.3Å; V24-V28 WeakPolarHBondContact O-CB 3.39Å; V24-V28 WeakPolarHBondContact O-CG2 3.42Å; V24-V28 PolarHBondContact O-N 3.19Å; I25-V28 PolarHBondContact O-N 3.12Å; V28-V30 VanDerWaalsContact C-N 3.32Å; V28-V30 PolarHBondContact O-N 3.35Å; V28-V31 PolarHBondContact O-N 3.32Å; V28-W32 WeakPolarHBondContact O-CB 3.31Å; V28-W32 PolarHBondContact O-N 2.94Å; V28-I56 HydrophobicContact CG2-CD1 3.8Å; V28-I56 HydrophobicContact CG2-CG1 4.15Å
29M92.8Very high91Very high39 Ų3949.5 Ų49.519%0.19227%0.266CS..Hα-helixtrans-61.4-38.7174.7-70.6176.765.200112.4I25 G26 N27 W32 A33 F297I25-M29 HydrophobicContact CG2-SD 4.22Å; I25-M29 WeakPolarHBondContact O-CG 3.44Å; I25-M29 PolarHBondContact O-N 2.93Å; G26-M29 WeakPolarHBondContact O-CB 3.48Å; G26-M29 PolarHBondContact O-N 3.37Å; N27-M29 VanDerWaalsContact C-N 3.31Å; N27-M29 PolarHBondContact O-N 3.46Å; M29-W32 PolarHBondContact O-N 3.01Å; M29-A33 VanDerWaalsContact O-CB 3.31Å; M29-A33 WeakPolarHBondContact O-CB 3.45Å; M29-A33 PolarHBondContact O-N 2.95Å; M29-F297 HydrophobicContact CB-CD1 4.42Å; M29-F297 HydrophobicContact CB-CE1 4.09Å; M29-F297 HydrophobicContact CE-CB 4.22Å; M29-F297 HydrophobicContact CE-CD1 4.18Å; M29-F297 HydrophobicContact CE-CG 4.15Å; M29-F297 WeakPolarHBondContact O-CE1 3.34Å
30V93Very high89.5Confident0 Ų048.4 Ų48.40%026%0.261CS..Hα-helixtrans-59.4-51.2175.2171.10000110.8G26 N27 V28 W32 A33 V34 I48 A52 P283 Y286 F293 F297G26-V30 WeakPolarHBondContact O-CG2 3.39Å; G26-V30 PolarHBondContact O-N 3.39Å; N27-V30 WeakPolarHBondContact O-CB 3.45Å; N27-V30 PolarHBondContact O-N 2.85Å; V28-V30 VanDerWaalsContact C-N 3.32Å; V28-V30 PolarHBondContact O-N 3.35Å; V30-W32 VanDerWaalsContact C-N 3.31Å; V30-W32 PolarHBondContact O-N 3.33Å; V30-A33 PolarHBondContact O-N 3.25Å; V30-V34 WeakPolarHBondContact O-CG2 3.5Å; V30-V34 PolarHBondContact O-N 3.08Å; V30-I48 HydrophobicContact CG1-CG2 3.75Å; V30-A52 HydrophobicContact CB-CB 4.25Å; V30-A52 HydrophobicContact CG1-CB 3.97Å; V30-P283 HydrophobicContact CG2-CB 3.95Å; V30-P283 HydrophobicContact CG2-CG 4.02Å; V30-Y286 HydrophobicContact CG1-CD2 4.35Å; V30-Y286 HydrophobicContact CG1-CE2 4.39Å; V30-Y286 HydrophobicContact CG2-CD2 3.86Å; V30-Y286 HydrophobicContact CG2-CE2 4.35Å; V30-F293 HydrophobicContact CG1-CE1 3.95Å; V30-F293 HydrophobicContact CG1-CZ 4.07Å; V30-F297 HydrophobicContact CG2-CZ 3.88Å
31V93.3Very high88.2Confident47 Ų4755.1 Ų55.129%0.28528%0.283SS..Hα-helixtrans-60.5-43.5178.5176.20000110.6N27 V28 V34 K35 V49 A52 I56N27-V31 WeakPolarHBondContact O-CG2 3.4Å; N27-V31 PolarHBondContact O-N 3.29Å; V28-V31 PolarHBondContact O-N 3.32Å; V31-V34 PolarHBondContact O-N 3.09Å; V31-K35 PolarHBondContact O-N 3.47Å; V31-V49 HydrophobicContact CG2-CG1 4.49Å; V31-A52 HydrophobicContact CG2-CB 3.8Å; V31-I56 HydrophobicContact CG2-CD1 4.33Å
32W90.9Very high86.9Confident76 Ų7654.6 Ų54.629%0.28828%0.278SS..Hα-helixtrans-63.5-43.6179.2-166.13000112.5V28 M29 V30 V34 K35 I36 I300 Y304V28-W32 WeakPolarHBondContact O-CB 3.31Å; V28-W32 PolarHBondContact O-N 2.94Å; M29-W32 PolarHBondContact O-N 3.01Å; V30-W32 VanDerWaalsContact C-N 3.31Å; V30-W32 PolarHBondContact O-N 3.33Å; W32-V34 VanDerWaalsContact C-N 3.33Å; W32-V34 PolarHBondContact O-N 3.17Å; W32-K35 WeakPolarHBondContact O-CB 3.26Å; W32-K35 PolarHBondContact O-N 3.49Å; W32-K35 VanDerWaalsContact O-N 3.13Å; W32-I36 VanDerWaalsContact CD1-CD1 3.44Å; W32-I36 HydrophobicContact CG-CD1 4.37Å; W32-I36 PolarHBondContact O-N 3Å; W32-I300 HydrophobicContact CB-CD1 4.35Å; W32-I300 HydrophobicContact CD2-CD1 4.34Å; W32-I300 HydrophobicContact CD2-CG2 4.29Å; W32-I300 HydrophobicContact CE3-CG2 3.87Å; W32-I300 HydrophobicContact CG-CD1 4.18Å; W32-I300 HydrophobicContact CH2-CG2 4.15Å; W32-I300 HydrophobicContact CZ3-CG2 3.8Å; W32-Y304 AromaticContact CH2-CD1 3.96Å; W32-Y304 HydrophobicContact CH2-CD1 3.96Å; W32-Y304 AromaticContact CH2-CD2 3.69Å; W32-Y304 HydrophobicContact CH2-CD2 3.69Å; W32-Y304 HydrophobicContact CH2-CE1 4.28Å; W32-Y304 HydrophobicContact CH2-CE2 4.05Å; W32-Y304 AromaticContact CH2-CG 3.64Å; W32-Y304 HydrophobicContact CH2-CG 3.64Å; W32-Y304 HydrophobicContact CZ2-CD1 4.06Å; W32-Y304 AromaticContact CZ2-CD2 3.63Å; W32-Y304 HydrophobicContact CZ2-CD2 3.63Å; W32-Y304 AromaticContact CZ2-CE1 3.91Å; W32-Y304 HydrophobicContact CZ2-CE1 3.91Å; W32-Y304 AromaticContact CZ2-CE2 3.47Å; W32-Y304 HydrophobicContact CZ2-CE2 3.47Å; W32-Y304 VanDerWaalsContact CZ2-CE2 3.47Å; W32-Y304 AromaticContact CZ2-CG 3.92Å; W32-Y304 HydrophobicContact CZ2-CG 3.92Å; W32-Y304 AromaticContact CZ2-CZ 3.62Å
33A89.8Confident85.6Confident0 Ų052.9 Ų52.90%026%0.263CS..Hα-helixtrans-59.4-42.1177.300000112.3M29 V30 N37 L40 F293 A296 F297 I300M29-A33 VanDerWaalsContact O-CB 3.31Å; M29-A33 WeakPolarHBondContact O-CB 3.45Å; M29-A33 PolarHBondContact O-N 2.95Å; V30-A33 PolarHBondContact O-N 3.25Å; A33-N37 WeakPolarHBondContact O-CB 3.43Å; A33-N37 PolarHBondContact O-N 3.02Å; A33-L40 HydrophobicContact CB-CD1 4.45Å; A33-F293 HydrophobicContact CB-CD1 3.99Å; A33-F293 HydrophobicContact CB-CE1 4.04Å; A33-A296 HydrophobicContact CB-CB 3.79Å; A33-F297 HydrophobicContact CB-CD1 3.98Å; A33-F297 HydrophobicContact CB-CE1 3.71Å; A33-I300 HydrophobicContact CB-CD1 4.08Å
34V88.6Confident84.5Confident16 Ų1653 Ų5310%0.09726%0.263CS..Hα-helixtrans-66.9-37.3176.1175.90000111.4V30 V31 W32 L40 F45 V49 F293V30-V34 WeakPolarHBondContact O-CG2 3.5Å; V30-V34 PolarHBondContact O-N 3.08Å; V31-V34 PolarHBondContact O-N 3.09Å; W32-V34 VanDerWaalsContact C-N 3.33Å; W32-V34 PolarHBondContact O-N 3.17Å; V34-L40 HydrophobicContact CG2-CB 4.48Å; V34-F45 HydrophobicContact CG1-CB 4.26Å; V34-F45 HydrophobicContact CG2-CB 4.46Å; V34-F45 HydrophobicContact CG2-CD1 4.23Å; V34-V49 HydrophobicContact CB-CG2 4Å; V34-V49 HydrophobicContact CG1-CG2 3.82Å; V34-V49 HydrophobicContact CG2-CG2 4.04Å; V34-F293 HydrophobicContact CG2-CE1 3.97Å; V34-F293 HydrophobicContact CG2-CZ 3.84Å
35K85.9Confident83.6Confident157 Ų15751.9 Ų51.968%0.68326%0.255SS*.Hα-helixtrans-64-45.5178.6-169.9177.4-179.7-179.50112.1V31 W32 R41V31-K35 PolarHBondContact O-N 3.47Å; W32-K35 WeakPolarHBondContact O-CB 3.26Å; W32-K35 PolarHBondContact O-N 3.49Å; W32-K35 VanDerWaalsContact O-N 3.13Å; K35-R41 PolarHBondContact O-NH2 2.97Å
36I82.9Confident83Confident83 Ų8349.7 Ų49.743%0.42625%0.248SC..Hα-helixtrans-73.1-47.1-178.6-70173.2000111.4W32 K38 I300W32-I36 VanDerWaalsContact CD1-CD1 3.44Å; W32-I36 HydrophobicContact CG-CD1 4.37Å; W32-I36 PolarHBondContact O-N 3Å; I36-K38 PolarHBondContact O-N 3.34Å; I36-I300 HydrophobicContact CD1-CD1 4.41Å; I36-I300 HydrophobicContact CD1-CG1 4.06Å
37N79.4Confident82.5Confident43 Ų4349.8 Ų49.823%0.2325%0.245CC..  trans-91.3102.2-168.5-169.5-13.6000111.6A33 S39 L40A33-N37 WeakPolarHBondContact O-CB 3.43Å; A33-N37 PolarHBondContact O-N 3.02Å; N37-S39 VanDerWaalsContact CG-OG 3.28Å; N37-S39 PolarHBondContact ND2-OG 3.43Å; N37-S39 PolarHBondContact O-N 3.41Å; N37-S39 VanDerWaalsContact O-N 3.08Å; N37-S39 VanDerWaalsContact OD1-CB 3.32Å; N37-S39 WeakPolarHBondContact OD1-CB 3.43Å; N37-S39 PolarHBondContact OD1-N 2.9Å; N37-S39 PolarHBondContact OD1-OG 3.11Å; N37-L40 HydrophobicContact CB-CB 4.27Å; N37-L40 HydrophobicContact CB-CD1 3.77Å; N37-L40 HydrophobicContact CB-CG 3.88Å; N37-L40 WeakPolarHBondContact O-CA 3.3Å; N37-L40 WeakPolarHBondContact O-CB 3.34Å; N37-L40 PolarHBondContact O-N 2.83Å
38K77.4Confident82.2Confident140 Ų14049.9 Ų49.961%0.60925%0.246SC*.G310 helixtrans-55.4-28.1176.4-65.5-177.9-177.1175.40113.1I36 L40 R41I36-K38 PolarHBondContact O-N 3.34Å; K38-L40 PolarHBondContact O-N 2.9Å; K38-R41 PolarHBondContact O-N 3.49Å; K38-R41 VanDerWaalsContact O-N 3.15Å
39S71.3Confident82Confident61 Ų6148.6 Ų48.643%0.42724%0.238SC..G310 helixtrans-72.6-7.5176.580.20000114.5N37 K292N37-S39 VanDerWaalsContact CG-OG 3.28Å; N37-S39 PolarHBondContact ND2-OG 3.43Å; N37-S39 PolarHBondContact O-N 3.41Å; N37-S39 VanDerWaalsContact O-N 3.08Å; N37-S39 VanDerWaalsContact OD1-CB 3.32Å; N37-S39 WeakPolarHBondContact OD1-CB 3.43Å; N37-S39 PolarHBondContact OD1-N 2.9Å; N37-S39 PolarHBondContact OD1-OG 3.11Å; S39-K292 PolarHBondContact O-NZ 2.84Å
40L66Low81.9Confident0 Ų047.4 Ų47.40%023%0.233CC..G310 helixtrans-102.213.8172.4-62.1179000112.2A33 V34 N37 K38 D42 F45 K292 F293 A296A33-L40 HydrophobicContact CB-CD1 4.45Å; V34-L40 HydrophobicContact CG2-CB 4.48Å; N37-L40 HydrophobicContact CB-CB 4.27Å; N37-L40 HydrophobicContact CB-CD1 3.77Å; N37-L40 HydrophobicContact CB-CG 3.88Å; N37-L40 WeakPolarHBondContact O-CA 3.3Å; N37-L40 WeakPolarHBondContact O-CB 3.34Å; N37-L40 PolarHBondContact O-N 2.83Å; K38-L40 PolarHBondContact O-N 2.9Å; L40-D42 VanDerWaalsContact C-N 3.35Å; L40-F45 VanDerWaalsContact C-CD2 3.4Å; L40-F45 HydrophobicContact CB-CD1 4.26Å; L40-F45 HydrophobicContact CB-CE1 4.16Å; L40-F45 HydrophobicContact CB-CE2 4.36Å; L40-F45 HydrophobicContact CB-CG 4.44Å; L40-F45 HydrophobicContact CB-CZ 4.19Å; L40-F45 HydrophobicContact CD2-CD1 4.34Å; L40-F45 HydrophobicContact CD2-CE1 3.46Å; L40-F45 VanDerWaalsContact CD2-CE1 3.46Å; L40-F45 HydrophobicContact CD2-CE2 4.21Å; L40-F45 HydrophobicContact CD2-CZ 3.36Å; L40-F45 HydrophobicContact CG-CE1 4.37Å; L40-F45 HydrophobicContact CG-CZ 4.39Å; L40-F45 WeakPolarHBondContact O-CB 3.2Å; L40-F45 WeakPolarHBondContact O-CD2 2.98Å; L40-F45 WeakPolarHBondContact O-CG 3.38Å; L40-K292 HydrophobicContact CD2-CB 3.49Å; L40-K292 VanDerWaalsContact CD2-CB 3.49Å; L40-K292 HydrophobicContact CD2-CD 3.77Å; L40-K292 HydrophobicContact CD2-CG 4.32Å; L40-K292 HydrophobicContact CG-CB 4.46Å; L40-F293 HydrophobicContact CD1-CD1 4.35Å; L40-F293 HydrophobicContact CD1-CE1 4.32Å; L40-A296 HydrophobicContact CD1-CB 4.26Å
41R68.8Low81.9Confident152 Ų15247.5 Ų47.557%0.57423%0.234SC*.  trans-97.735.2176.6-63-176.4-176.2-177.60.1113.4K35 K38K35-R41 PolarHBondContact O-NH2 2.97Å; K38-R41 PolarHBondContact O-N 3.49Å; K38-R41 VanDerWaalsContact O-N 3.15Å
42D71.9Confident82Confident66 Ų6645.3 Ų45.335%0.35322%0.221SC..SBendtrans-80.5162.8171.1-158.2-4.1000111.1L40 T44 F45 R108L40-D42 VanDerWaalsContact C-N 3.35Å; D42-T44 VanDerWaalsContact C-N 3.27Å; D42-T44 PolarHBondContact O-N 3.26Å; D42-F45 HydrophobicContact CB-CD2 3.61Å; D42-F45 HydrophobicContact CB-CE2 3.7Å; D42-F45 WeakPolarHBondContact O-CB 3.4Å; D42-F45 WeakPolarHBondContact O-CD2 3.42Å; D42-F45 PolarHBondContact O-N 2.95Å; D42-R108 IonicContact OD1-NH2 3.74Å; D42-R108 IonicContact OD2-CZ 3.96Å; D42-R108 IonicContact OD2-NH1 3.95Å; D42-R108 IonicContact OD2-NH2 3.23Å; D42-R108 PolarHBondContact OD2-NH2 3.18Å
43T69.3Low82.1Confident10 Ų1045 Ų456%0.06123%0.227CC..Hα-helixtrans-57.9-36.3-174.252.70000113.5F45 C46 Y115 V119T43-F45 PolarHBondContact O-N 2.62Å; T43-F45 VanDerWaalsContact O-N 3.17Å; T43-C46 WeakPolarHBondContact O-CB 3.16Å; T43-C46 PolarHBondContact O-N 2.94Å; T43-C46 VanDerWaalsContact O-N 3.1Å; T43-Y115 PolarHBondContact OG1-OH 3.02Å; T43-V119 HydrophobicContact CG2-CG1 4.23Å
44T72.4Confident82.3Confident2 Ų245 Ų451%0.01223%0.227CC..Hα-helixtrans-56.6-31.7175.9-48.20000112.4D42 C46 F47 I48 D104 R108D42-T44 VanDerWaalsContact C-N 3.27Å; D42-T44 PolarHBondContact O-N 3.26Å; T44-C46 VanDerWaalsContact C-N 3.27Å; T44-C46 PolarHBondContact O-N 2.9Å; T44-F47 PolarHBondContact O-N 3.18Å; T44-I48 HydrophobicContact CG2-CD1 4.16Å; T44-I48 PolarHBondContact O-N 3.42Å; T44-D104 WeakPolarHBondContact CB-OD2 3.46Å; T44-D104 WeakPolarHBondContact CG2-OD2 3.27Å; T44-D104 PolarHBondContact OG1-OD2 2.92Å; T44-R108 PolarHBondContact OG1-NH2 2.99Å
45F78.4Confident82.6Confident19 Ų1944.3 Ų44.38%0.08322%0.223CC..Hα-helixtrans-76.9-15.8-176.6-61.2-80.5000113V34 L40 D42 T43 I48 V49 F293V34-F45 HydrophobicContact CG1-CB 4.26Å; V34-F45 HydrophobicContact CG2-CB 4.46Å; V34-F45 HydrophobicContact CG2-CD1 4.23Å; L40-F45 VanDerWaalsContact C-CD2 3.4Å; L40-F45 HydrophobicContact CB-CD1 4.26Å; L40-F45 HydrophobicContact CB-CE1 4.16Å; L40-F45 HydrophobicContact CB-CE2 4.36Å; L40-F45 HydrophobicContact CB-CG 4.44Å; L40-F45 HydrophobicContact CB-CZ 4.19Å; L40-F45 HydrophobicContact CD2-CD1 4.34Å; L40-F45 HydrophobicContact CD2-CE1 3.46Å; L40-F45 VanDerWaalsContact CD2-CE1 3.46Å; L40-F45 HydrophobicContact CD2-CE2 4.21Å; L40-F45 HydrophobicContact CD2-CZ 3.36Å; L40-F45 HydrophobicContact CG-CE1 4.37Å; L40-F45 HydrophobicContact CG-CZ 4.39Å; L40-F45 WeakPolarHBondContact O-CB 3.2Å; L40-F45 WeakPolarHBondContact O-CD2 2.98Å; L40-F45 WeakPolarHBondContact O-CG 3.38Å; D42-F45 HydrophobicContact CB-CD2 3.61Å; D42-F45 HydrophobicContact CB-CE2 3.7Å; D42-F45 WeakPolarHBondContact O-CB 3.4Å; D42-F45 WeakPolarHBondContact O-CD2 3.42Å; D42-F45 PolarHBondContact O-N 2.95Å; T43-F45 PolarHBondContact O-N 2.62Å; T43-F45 VanDerWaalsContact O-N 3.17Å; F45-I48 HydrophobicContact CD1-CD1 3.89Å; F45-I48 HydrophobicContact CE1-CD1 4.22Å; F45-I48 PolarHBondContact O-N 3.42Å; F45-V49 WeakPolarHBondContact O-CB 2.98Å; F45-V49 VanDerWaalsContact O-CG2 3.23Å; F45-V49 WeakPolarHBondContact O-CG2 3.26Å; F45-V49 PolarHBondContact O-N 3.3Å; F45-F293 HydrophobicContact CD1-CE2 4Å; F45-F293 HydrophobicContact CD1-CZ 4.03Å; F45-F293 HydrophobicContact CE1-CD2 4.44Å; F45-F293 AromaticContact CE1-CE2 3.64Å; F45-F293 HydrophobicContact CE1-CE2 3.64Å; F45-F293 HydrophobicContact CE1-CZ 4.07Å
46C83.6Confident83.1Confident52 Ų5238.8 Ų38.835%0.35120%0.201SC..Hα-helixtrans-63.7-45.8169.3-174.80000110.6T43 T44 V49 S50 A124T43-C46 WeakPolarHBondContact O-CB 3.16Å; T43-C46 PolarHBondContact O-N 2.94Å; T43-C46 VanDerWaalsContact O-N 3.1Å; T44-C46 VanDerWaalsContact C-N 3.27Å; T44-C46 PolarHBondContact O-N 2.9Å; C46-V49 PolarHBondContact O-N 2.9Å; C46-S50 PolarHBondContact O-N 2.79Å; C46-A124 HydrophobicContact CB-CB 4.49Å
47F85.9Confident83.7Confident14 Ų1435.7 Ų35.76%0.06119%0.187CC..Hα-helixtrans-67.1-39.5176.1-58.4-62.5000112.4T44 V49 S50 L51 A100 I101 D104 A124 A127 V128T44-F47 PolarHBondContact O-N 3.18Å; F47-V49 PolarHBondContact O-N 3.22Å; F47-S50 PolarHBondContact O-N 3.4Å; F47-L51 WeakPolarHBondContact O-CB 3.47Å; F47-L51 PolarHBondContact O-N 2.86Å; F47-A100 HydrophobicContact CD1-CB 3.69Å; F47-A100 HydrophobicContact CE1-CB 3.79Å; F47-A100 HydrophobicContact CG-CB 4.21Å; F47-A100 HydrophobicContact CZ-CB 4.37Å; F47-I101 HydrophobicContact CB-CD1 4.4Å; F47-I101 HydrophobicContact CB-CG1 3.69Å; F47-D104 HydrophobicContact CD2-CB 4.38Å; F47-D104 HydrophobicContact CE2-CB 4.29Å; F47-A124 HydrophobicContact CE2-CB 4.11Å; F47-A124 HydrophobicContact CZ-CB 3.89Å; F47-A127 HydrophobicContact CE1-CB 3.87Å; F47-A127 HydrophobicContact CZ-CB 4.07Å; F47-V128 HydrophobicContact CD1-CG2 3.69Å; F47-V128 HydrophobicContact CE1-CG2 3.89Å
48I88.3Confident84.5Confident3 Ų334 Ų342%0.01518%0.178CC..Hα-helixtrans-64-40.8176.3-64.9171000111.2V30 T44 F45 L51 A52 I101 Y286 F293V30-I48 HydrophobicContact CG1-CG2 3.75Å; T44-I48 HydrophobicContact CG2-CD1 4.16Å; T44-I48 PolarHBondContact O-N 3.42Å; F45-I48 HydrophobicContact CD1-CD1 3.89Å; F45-I48 HydrophobicContact CE1-CD1 4.22Å; F45-I48 PolarHBondContact O-N 3.42Å; I48-L51 PolarHBondContact O-N 2.82Å; I48-A52 WeakPolarHBondContact O-CB 3.41Å; I48-A52 PolarHBondContact O-N 3.37Å; I48-I101 HydrophobicContact CG1-CD1 4.28Å; I48-Y286 HydrophobicContact CG2-CD2 4.38Å; I48-Y286 HydrophobicContact CG2-CE2 3.76Å; I48-F293 HydrophobicContact CD1-CE2 4.26Å; I48-F293 HydrophobicContact CG2-CE2 4.41Å; I48-F293 HydrophobicContact CG2-CZ 4.03Å
49V91.5Very high85.3Confident40 Ų4027.4 Ų27.424%0.24215%0.151CC..Hα-helixtrans-66.6-42.4175.1169.50000110.9V31 V34 F45 C46 F47 L51 A52 V53V31-V49 HydrophobicContact CG2-CG1 4.49Å; V34-V49 HydrophobicContact CB-CG2 4Å; V34-V49 HydrophobicContact CG1-CG2 3.82Å; V34-V49 HydrophobicContact CG2-CG2 4.04Å; F45-V49 WeakPolarHBondContact O-CB 2.98Å; F45-V49 VanDerWaalsContact O-CG2 3.23Å; F45-V49 WeakPolarHBondContact O-CG2 3.26Å; F45-V49 PolarHBondContact O-N 3.3Å; C46-V49 PolarHBondContact O-N 2.9Å; F47-V49 PolarHBondContact O-N 3.22Å; V49-L51 VanDerWaalsContact C-N 3.33Å; V49-L51 PolarHBondContact O-N 3.42Å; V49-A52 PolarHBondContact O-N 3.49Å; V49-V53 HydrophobicContact CG1-CG2 4.47Å; V49-V53 WeakPolarHBondContact O-CG2 3.34Å; V49-V53 PolarHBondContact O-N 3.01Å
50S92.2Very high86.5Confident15 Ų1527 Ų2711%0.10515%0.151CC..Hα-helixtrans-58.7-45.1175-174.50000111.8C46 F47 V53 A54 V128 W132C46-S50 PolarHBondContact O-N 2.79Å; F47-S50 PolarHBondContact O-N 3.4Å; S50-V53 PolarHBondContact O-N 3.33Å; S50-A54 PolarHBondContact O-N 3.45Å; S50-A54 VanDerWaalsContact O-N 3.09Å; S50-V128 WeakPolarHBondContact OG-CG1 3.44Å; S50-W132 PolarHBondContact OG-NE1 2.73Å; S50-W132 VanDerWaalsContact OG-NE1 3.08Å
51L91.8Very high87.8Confident1 Ų131.6 Ų31.61%0.00518%0.175CC..Hα-helixtrans-62.2-45176.1179.560.1000111.3F47 I48 V49 V53 A54 D55 A97 L98 I101 Y286F47-L51 WeakPolarHBondContact O-CB 3.47Å; F47-L51 PolarHBondContact O-N 2.86Å; I48-L51 PolarHBondContact O-N 2.82Å; V49-L51 VanDerWaalsContact C-N 3.33Å; V49-L51 PolarHBondContact O-N 3.42Å; L51-V53 VanDerWaalsContact C-N 3.3Å; L51-V53 PolarHBondContact O-N 2.94Å; L51-A54 WeakPolarHBondContact O-CB 3.38Å; L51-A54 PolarHBondContact O-N 3.24Å; L51-D55 PolarHBondContact O-N 2.89Å; L51-A97 HydrophobicContact CB-CB 4.02Å; L51-A97 HydrophobicContact CD1-CB 4.15Å; L51-L98 HydrophobicContact CD1-CG 4.45Å; L51-L98 HydrophobicContact CD2-CD2 3.78Å; L51-L98 HydrophobicContact CD2-CG 4.23Å; L51-I101 HydrophobicContact CD2-CD1 3.87Å; L51-Y286 WeakPolarHBondContact CD2-OH 3.43Å
52A94.7Very high89Confident1 Ų124.4 Ų24.41%0.00815%0.148CC..Hα-helixtrans-61.5-37.4177.200000112.4N27 V30 V31 I48 V49 D55 I56N27-A52 HydrophobicContact CB-CB 4.09Å; V30-A52 HydrophobicContact CB-CB 4.25Å; V30-A52 HydrophobicContact CG1-CB 3.97Å; V31-A52 HydrophobicContact CG2-CB 3.8Å; I48-A52 WeakPolarHBondContact O-CB 3.41Å; I48-A52 PolarHBondContact O-N 3.37Å; V49-A52 PolarHBondContact O-N 3.49Å; A52-D55 PolarHBondContact O-N 2.96Å; A52-I56 WeakPolarHBondContact O-CB 3.44Å; A52-I56 WeakPolarHBondContact O-CD1 3.46Å; A52-I56 WeakPolarHBondContact O-CG1 3.12Å; A52-I56 PolarHBondContact O-N 2.95Å
53V94.8Very high90.1Very high70 Ų7021.3 Ų21.342%0.42413%0.131SC..Hα-helixtrans-65.1-42.8174.8170.50000111.3V49 S50 L51 I56 A57 W132V49-V53 HydrophobicContact CG1-CG2 4.47Å; V49-V53 WeakPolarHBondContact O-CG2 3.34Å; V49-V53 PolarHBondContact O-N 3.01Å; S50-V53 PolarHBondContact O-N 3.33Å; L51-V53 VanDerWaalsContact C-N 3.3Å; L51-V53 PolarHBondContact O-N 2.94Å; V53-I56 PolarHBondContact O-N 3.21Å; V53-A57 PolarHBondContact O-N 3.01Å; V53-A57 VanDerWaalsContact O-N 3.1Å; V53-W132 HydrophobicContact CG1-CZ2 4.45Å
54A93.6Very high91.3Very high1 Ų123.7 Ų23.71%0.00815%0.147CC..Hα-helixtrans-61.7-46.3174.500000111.4S50 L51 I56 A57 V58 S93 S94 W132S50-A54 PolarHBondContact O-N 3.45Å; S50-A54 VanDerWaalsContact O-N 3.09Å; L51-A54 WeakPolarHBondContact O-CB 3.38Å; L51-A54 PolarHBondContact O-N 3.24Å; A54-I56 PolarHBondContact O-N 2.93Å; A54-A57 CarbonylContact O-C 3.58Å; A54-A57 WeakPolarHBondContact O-CA 3.4Å; A54-A57 WeakPolarHBondContact O-CB 3.4Å; A54-A57 PolarHBondContact O-N 3.47Å; A54-A57 VanDerWaalsContact O-N 3.07Å; A54-V58 WeakPolarHBondContact O-CG2 3.37Å; A54-V58 PolarHBondContact O-N 2.89Å; A54-S93 WeakPolarHBondContact CB-OG 3.44Å; A54-S94 WeakPolarHBondContact CB-OG 3.42Å; A54-W132 HydrophobicContact CB-CH2 4.28Å; A54-W132 HydrophobicContact CB-CZ2 4.22Å
55D94.8Very high92.3Very high0 Ų026.2 Ų26.20%016%0.16CC..Hα-helixtrans-67.6-32.4-179.9-73.1-26.4000113.4S23 N27 L51 A52 V58 G59 S94 S279 N282S23-D55 PolarHBondContact OG-O 3.45Å; N27-D55 HydrophobicContact CB-CB 4.41Å; N27-D55 WeakPolarHBondContact ND2-CB 3.4Å; L51-D55 PolarHBondContact O-N 2.89Å; A52-D55 PolarHBondContact O-N 2.96Å; D55-V58 PolarHBondContact O-N 2.82Å; D55-G59 PolarHBondContact O-N 3.36Å; D55-S94 PolarHBondContact OD1-OG 2.89Å; D55-S279 VanDerWaalsContact OD1-CB 3.27Å; D55-S279 WeakPolarHBondContact OD1-CB 3.28Å; D55-S279 PolarHBondContact OD1-OG 2.93Å; D55-N282 PolarHBondContact OD2-ND2 3.14Å
56I96.9Very high92.9Very high42 Ų4225.8 Ų25.822%0.21516%0.16CC..Hα-helixtrans-61.4-46.6168.4-71.5162.6000109.7N27 V28 V31 A52 V53 A54 V58 G59 A60N27-I56 HydrophobicContact CB-CD1 4.2Å; N27-I56 HydrophobicContact CB-CG1 3.6Å; V28-I56 HydrophobicContact CG2-CD1 3.8Å; V28-I56 HydrophobicContact CG2-CG1 4.15Å; V31-I56 HydrophobicContact CG2-CD1 4.33Å; A52-I56 WeakPolarHBondContact O-CB 3.44Å; A52-I56 WeakPolarHBondContact O-CD1 3.46Å; A52-I56 WeakPolarHBondContact O-CG1 3.12Å; A52-I56 PolarHBondContact O-N 2.95Å; V53-I56 PolarHBondContact O-N 3.21Å; A54-I56 PolarHBondContact O-N 2.93Å; I56-V58 VanDerWaalsContact C-N 3.29Å; I56-V58 PolarHBondContact O-N 3.36Å; I56-G59 PolarHBondContact O-N 2.94Å; I56-A60 VanDerWaalsContact O-CB 3.25Å; I56-A60 WeakPolarHBondContact O-CB 3.45Å; I56-A60 PolarHBondContact O-N 3.44Å
57A95.5Very high93.3Very high18 Ų1824.5 Ų24.515%0.14915%0.15CC..Hα-helixtrans-65.7-32.617800000112V53 A54 L61 V62 L90V53-A57 PolarHBondContact O-N 3.01Å; V53-A57 VanDerWaalsContact O-N 3.1Å; A54-A57 CarbonylContact O-C 3.58Å; A54-A57 WeakPolarHBondContact O-CA 3.4Å; A54-A57 WeakPolarHBondContact O-CB 3.4Å; A54-A57 PolarHBondContact O-N 3.47Å; A54-A57 VanDerWaalsContact O-N 3.07Å; A57-L61 WeakPolarHBondContact O-CA 3.31Å; A57-L61 VanDerWaalsContact O-CB 3.31Å; A57-L61 WeakPolarHBondContact O-CB 3.42Å; A57-L61 PolarHBondContact O-N 3.2Å; A57-V62 PolarHBondContact O-N 3.03Å; A57-L90 HydrophobicContact CB-CD1 3.67Å; A57-L90 HydrophobicContact CB-CD2 3.72Å; A57-L90 HydrophobicContact CB-CG 4.33Å
58V94.4Very high93.6Very high6 Ų626.4 Ų26.44%0.03616%0.162CC..Iπ-helixtrans-59.6-51.1170.8172.10000110.6A54 D55 I56 V62 I63 L90A54-V58 WeakPolarHBondContact O-CG2 3.37Å; A54-V58 PolarHBondContact O-N 2.89Å; D55-V58 PolarHBondContact O-N 2.82Å; I56-V58 VanDerWaalsContact C-N 3.29Å; I56-V58 PolarHBondContact O-N 3.36Å; V58-V62 HydrophobicContact CB-CB 4.37Å; V58-V62 HydrophobicContact CB-CG2 4.4Å; V58-V62 HydrophobicContact CG1-CB 4.18Å; V58-V62 HydrophobicContact CG1-CG1 4.44Å; V58-V62 HydrophobicContact CG2-CG2 4.21Å; V58-V62 WeakPolarHBondContact O-CA 3.47Å; V58-V62 WeakPolarHBondContact O-CB 3.35Å; V58-V62 PolarHBondContact O-N 3.15Å; V58-V62 VanDerWaalsContact O-N 3.1Å; V58-I63 HydrophobicContact CG1-CG1 4.43Å; V58-I63 PolarHBondContact O-N 3.4Å; V58-L90 HydrophobicContact CG2-CB 4.28Å
59G94.9Very high93.7Very high3 Ų327 Ų273%0.03117%0.166CC..Iπ-helixtrans-66.8-39.7179.200000114A20 D55 I56 P64A20-G59 WeakPolarHBondContact CB-O 2.94Å; D55-G59 PolarHBondContact O-N 3.36Å; I56-G59 PolarHBondContact O-N 2.94Å; G59-P64 WeakPolarHBondContact O-CD 3.33Å
60A96.3Very high93.5Very high53 Ų5325.9 Ų25.944%0.43816%0.16SC..Iπ-helixtrans-84.9-26.6-173.700000114.3V24 I56V24-A60 HydrophobicContact CG2-CB 4.25Å; I56-A60 VanDerWaalsContact O-CB 3.25Å; I56-A60 WeakPolarHBondContact O-CB 3.45Å; I56-A60 PolarHBondContact O-N 3.44Å
61L93.6Very high93.3Very high95 Ų9527.8 Ų27.850%0.49717%0.168SC..Iπ-helixtrans-125.4-50.8-174.2-56.6175.6000112.6A57 P64 L65A57-L61 WeakPolarHBondContact O-CA 3.31Å; A57-L61 VanDerWaalsContact O-CB 3.31Å; A57-L61 WeakPolarHBondContact O-CB 3.42Å; A57-L61 PolarHBondContact O-N 3.2Å; L61-P64 WeakPolarHBondContact O-CD 3.38Å; L61-L65 WeakPolarHBondContact O-CB 3.16Å; L61-L65 WeakPolarHBondContact O-CD1 3.44Å; L61-L65 WeakPolarHBondContact O-CG 3.38Å; L61-L65 PolarHBondContact O-N 3.09Å; L61-L65 VanDerWaalsContact O-N 3.07Å
62V93.9Very high93.1Very high1 Ų128.3 Ų28.31%0.00617%0.174CC..Iπ-helixtrans-65-49.1-174.1175.10000111.7A57 V58 L65 A66 M87 L90A57-V62 PolarHBondContact O-N 3.03Å; V58-V62 HydrophobicContact CB-CB 4.37Å; V58-V62 HydrophobicContact CB-CG2 4.4Å; V58-V62 HydrophobicContact CG1-CB 4.18Å; V58-V62 HydrophobicContact CG1-CG1 4.44Å; V58-V62 HydrophobicContact CG2-CG2 4.21Å; V58-V62 WeakPolarHBondContact O-CA 3.47Å; V58-V62 WeakPolarHBondContact O-CB 3.35Å; V58-V62 PolarHBondContact O-N 3.15Å; V58-V62 VanDerWaalsContact O-N 3.1Å; V62-L65 CarbonylContact O-C 3.51Å; V62-L65 PolarHBondContact O-N 3.35Å; V62-A66 WeakPolarHBondContact O-CB 3.35Å; V62-A66 PolarHBondContact O-N 2.81Å; V62-M87 HydrophobicContact CG1-CB 3.93Å; V62-M87 HydrophobicContact CG1-CG 3.87Å; V62-M87 HydrophobicContact CG1-SD 4.47Å; V62-M87 HydrophobicContact CG2-CB 4.49Å; V62-L90 HydrophobicContact CG2-CB 3.93Å; V62-L90 HydrophobicContact CG2-CD1 3.44Å; V62-L90 VanDerWaalsContact CG2-CD1 3.44Å; V62-L90 HydrophobicContact CG2-CG 4.29Å
63I94.9Very high92.9Very high1 Ų132.3 Ų32.31%0.00520%0.195CC..Hα-helixtrans-64.1-47.7-177.5-67.6174.2000111.9E16 I19 A20 V58 L65 A66 I67 H276E16-I63 HydrophobicContact CB-CG2 3.82Å; E16-I63 HydrophobicContact CG-CG2 4.47Å; E16-I63 VanDerWaalsContact OE2-CG2 3.23Å; E16-I63 WeakPolarHBondContact OE2-CG2 3.46Å; I19-I63 HydrophobicContact CB-CD1 4.35Å; I19-I63 HydrophobicContact CG2-CD1 3.8Å; A20-I63 HydrophobicContact CB-CB 4.12Å; A20-I63 HydrophobicContact CB-CD1 3.81Å; A20-I63 HydrophobicContact CB-CG2 3.89Å; V58-I63 HydrophobicContact CG1-CG1 4.43Å; V58-I63 PolarHBondContact O-N 3.4Å; I63-L65 VanDerWaalsContact C-N 3.31Å; I63-L65 PolarHBondContact O-N 2.94Å; I63-A66 PolarHBondContact O-N 2.92Å; I63-A66 VanDerWaalsContact O-N 3.11Å; I63-I67 HydrophobicContact CG2-CD1 4.1Å; I63-I67 WeakPolarHBondContact O-CG1 3.49Å; I63-I67 PolarHBondContact O-N 2.92Å; I63-H276 HydrophobicContact CD1-CB 3.93Å; I63-H276 HydrophobicContact CG1-CB 4.05Å
64P94.2Very high92.7Very high60 Ų6036 Ų3639%0.3921%0.208SC..Hα-helixtrans-54.5-46.1172-29.136.5000112.9G59 L61 A66 I67 T68G59-P64 WeakPolarHBondContact O-CD 3.33Å; L61-P64 WeakPolarHBondContact O-CD 3.38Å; P64-A66 VanDerWaalsContact C-N 3.34Å; P64-A66 PolarHBondContact O-N 3.39Å; P64-I67 PolarHBondContact O-N 3.26Å; P64-T68 WeakPolarHBondContact O-CG2 3.17Å; P64-T68 PolarHBondContact O-N 3.13Å; P64-T68 VanDerWaalsContact O-N 3.09Å
65L93.3Very high92.7Very high55 Ų5538.1 Ų38.129%0.28822%0.22SC..Hα-helixtrans-62.4-40.9176.2-71.8169.9000111.4L61 V62 I63 I67 T68 V69 M87L61-L65 WeakPolarHBondContact O-CB 3.16Å; L61-L65 WeakPolarHBondContact O-CD1 3.44Å; L61-L65 WeakPolarHBondContact O-CG 3.38Å; L61-L65 PolarHBondContact O-N 3.09Å; L61-L65 VanDerWaalsContact O-N 3.07Å; V62-L65 CarbonylContact O-C 3.51Å; V62-L65 PolarHBondContact O-N 3.35Å; I63-L65 VanDerWaalsContact C-N 3.31Å; I63-L65 PolarHBondContact O-N 2.94Å; L65-I67 VanDerWaalsContact C-N 3.3Å; L65-I67 PolarHBondContact O-N 3.03Å; L65-T68 PolarHBondContact O-N 3.46Å; L65-T68 VanDerWaalsContact O-N 3.08Å; L65-T68 PolarHBondContact O-OG1 3.47Å; L65-V69 WeakPolarHBondContact O-CG2 3.08Å; L65-V69 PolarHBondContact O-N 3.19Å; L65-M87 HydrophobicContact CB-CE 3.33Å
66A92.3Very high92.7Very high10 Ų1045.1 Ų45.18%0.08325%0.248CC..Hα-helixtrans-63.9-37.7179.600000111.5V62 I63 P64 V69 S70 M87V62-A66 WeakPolarHBondContact O-CB 3.35Å; V62-A66 PolarHBondContact O-N 2.81Å; I63-A66 PolarHBondContact O-N 2.92Å; I63-A66 VanDerWaalsContact O-N 3.11Å; P64-A66 VanDerWaalsContact C-N 3.34Å; P64-A66 PolarHBondContact O-N 3.39Å; A66-V69 PolarHBondContact O-N 3.48Å; A66-S70 WeakPolarHBondContact O-CB 3Å; A66-S70 PolarHBondContact O-N 3.1Å; A66-S70 PolarHBondContact O-OG 3.36Å; A66-M87 HydrophobicContact CB-CE 4.09Å; A66-M87 HydrophobicContact CB-SD 4.43Å
67I92.5Very high92.6Very high26 Ų2643.1 Ų43.113%0.13324%0.238CC..Hα-helixtrans-60.9-47.9171.4-65.4164.1000109.8I13 E16 V17 I63 P64 L65 V69 S70 I71I13-I67 HydrophobicContact CG1-CG2 4.42Å; I13-I67 HydrophobicContact CG2-CD1 4.34Å; I13-I67 HydrophobicContact CG2-CG2 4.25Å; E16-I67 HydrophobicContact CB-CD1 3.96Å; E16-I67 HydrophobicContact CB-CG1 4.06Å; E16-I67 HydrophobicContact CG-CG1 4.34Å; V17-I67 HydrophobicContact CG2-CD1 4.17Å; I63-I67 HydrophobicContact CG2-CD1 4.1Å; I63-I67 WeakPolarHBondContact O-CG1 3.49Å; I63-I67 PolarHBondContact O-N 2.92Å; P64-I67 PolarHBondContact O-N 3.26Å; L65-I67 VanDerWaalsContact C-N 3.3Å; L65-I67 PolarHBondContact O-N 3.03Å; I67-V69 VanDerWaalsContact C-N 3.34Å; I67-V69 PolarHBondContact O-N 2.89Å; I67-S70 WeakPolarHBondContact CA-OG 3.46Å; I67-S70 PolarHBondContact O-N 3.46Å; I67-S70 VanDerWaalsContact O-N 3.14Å; I67-S70 PolarHBondContact O-OG 3.26Å; I67-I71 HydrophobicContact CG2-CD1 3.87Å; I67-I71 WeakPolarHBondContact O-CG1 3.42Å; I67-I71 PolarHBondContact O-N 2.95Å; I67-I71 VanDerWaalsContact O-N 3.08Å
68T90.5Very high92.6Very high53 Ų5347.8 Ų47.833%0.32525%0.252SS..Hα-helixtrans-60.5-40.3178.4670000113.3P64 L65 G72 L73P64-T68 WeakPolarHBondContact O-CG2 3.17Å; P64-T68 PolarHBondContact O-N 3.13Å; P64-T68 VanDerWaalsContact O-N 3.09Å; L65-T68 PolarHBondContact O-N 3.46Å; L65-T68 VanDerWaalsContact O-N 3.08Å; L65-T68 PolarHBondContact O-OG1 3.47Å; T68-G72 PolarHBondContact O-N 3.17Å; T68-L73 HydrophobicContact CG2-CD1 4.2Å
69V90.3Very high92.7Very high17 Ų1750.9 Ų50.910%0.10327%0.274CS..Hα-helixtrans-68.2-36176.2175.20000111.2L65 A66 I67 G72 M87 F168L65-V69 WeakPolarHBondContact O-CG2 3.08Å; L65-V69 PolarHBondContact O-N 3.19Å; A66-V69 PolarHBondContact O-N 3.48Å; I67-V69 VanDerWaalsContact C-N 3.34Å; I67-V69 PolarHBondContact O-N 2.89Å; V69-G72 PolarHBondContact O-N 3.1Å; V69-M87 HydrophobicContact CG2-CE 3.88Å; V69-F168 HydrophobicContact CG1-CB 4.32Å
70S87.6Confident92.7Very high15 Ų1551 Ų5111%0.10527%0.274CS..Hα-helixtrans-68.7-36.7179.173.30000112.7A66 I67 G72A66-S70 WeakPolarHBondContact O-CB 3Å; A66-S70 PolarHBondContact O-N 3.1Å; A66-S70 PolarHBondContact O-OG 3.36Å; I67-S70 WeakPolarHBondContact CA-OG 3.46Å; I67-S70 PolarHBondContact O-N 3.46Å; I67-S70 VanDerWaalsContact O-N 3.14Å; I67-S70 PolarHBondContact O-OG 3.26Å; S70-G72 PolarHBondContact O-N 2.94Å
71I88.9Confident92.8Very high56 Ų5648.5 Ų48.529%0.28725%0.253SS..Hα-helixtrans-68.8-28175.8-65.4166000110.7I67 L73I67-I71 HydrophobicContact CG2-CD1 3.87Å; I67-I71 WeakPolarHBondContact O-CG1 3.42Å; I67-I71 PolarHBondContact O-N 2.95Å; I67-I71 VanDerWaalsContact O-N 3.08Å; I71-L73 HydrophobicContact CG2-CD2 4.1Å; I71-L73 HydrophobicContact CG2-CG 4.48Å
72G87.1Confident92.9Very high12 Ų1248.3 Ų48.312%0.12425%0.253CS..THydrogen-bonded Turntrans77.548.1179.900000112.4T68 V69 S70 T165 C166T68-G72 PolarHBondContact O-N 3.17Å; V69-G72 PolarHBondContact O-N 3.1Å; S70-G72 PolarHBondContact O-N 2.94Å; G72-T165 VanDerWaalsContact O-CG2 3.25Å; G72-T165 WeakPolarHBondContact O-CG2 3.47Å; G72-C166 WeakPolarHBondContact CA-O 3.2Å
73L89.8Confident93Very high84 Ų8448.9 Ų48.944%0.4426%0.258SS..  trans-61.4140.9175.9-65.1179.4000111.3T68 I71 T75 C166T68-L73 HydrophobicContact CG2-CD1 4.2Å; I71-L73 HydrophobicContact CG2-CD2 4.1Å; I71-L73 HydrophobicContact CG2-CG 4.48Å; L73-T75 HydrophobicContact CB-CG2 4.33Å; L73-T75 PolarHBondContact O-N 3.15Å; L73-C166 WeakPolarHBondContact O-CB 3.28Å; L73-C166 PolarHBondContact O-N 3.2Å
74E92Very high93Very high149 Ų14948.8 Ų48.870%0.69626%0.258SS*.EExtended strand (participates in β ladder)trans-74.2122.6171.6-65-170.7154.700109.7I163 V164E74-I163 HydrophobicContact CB-CG2 4.3Å; E74-V164 WeakPolarHBondContact CA-O 3.43Å
75T93.7Very high93.2Very high45 Ų4546 Ų4628%0.27624%0.239SC..EExtended strand (participates in β ladder)trans-147167.3-177.8610000109.8L73 V164L73-T75 HydrophobicContact CB-CG2 4.33Å; L73-T75 PolarHBondContact O-N 3.15Å; T75-V164 PolarHBondContact N-O 3.41Å; T75-V164 PolarHBondContact O-N 3.25Å
76Y94.9Very high93.3Very high147 Ų14745.5 Ų45.558%0.57624%0.239SC*.EExtended strand (participates in β ladder)trans-63.9140.3168.2-65.7-77.2000111Y78 S79 C80 D161 L162 I163Y76-Y78 VanDerWaalsContact C-N 3.3Å; Y76-Y78 PolarHBondContact O-N 3.41Å; Y76-S79 WeakPolarHBondContact O-CB 3.43Å; Y76-S79 PolarHBondContact O-N 2.88Å; Y76-C80 PolarHBondContact O-N 3.41Å; Y76-C80 VanDerWaalsContact O-N 3.09Å; Y76-D161 WeakPolarHBondContact CE1-O 3.48Å; Y76-L162 WeakPolarHBondContact CA-O 3.32Å; Y76-I163 HydrophobicContact CE1-CG1 4.4Å
77F95Very high93.3Very high0 Ų045.9 Ų45.90%024%0.239CC..Hα-helixtrans-48.1-49.6-179.3178.9-90.7000112.9S79 C80 L81 N147 L149 L152 I158 L162 V164 V171F77-S79 PolarHBondContact O-N 2.84Å; F77-C80 PolarHBondContact O-N 3Å; F77-L81 HydrophobicContact CD1-CD2 4.36Å; F77-L81 HydrophobicContact CE1-CB 4.42Å; F77-L81 HydrophobicContact CE1-CD2 3.53Å; F77-L81 HydrophobicContact CZ-CD2 4.03Å; F77-L81 VanDerWaalsContact O-CB 3.26Å; F77-L81 WeakPolarHBondContact O-CB 3.22Å; F77-L81 PolarHBondContact O-N 3.1Å; F77-N147 HydrophobicContact CE1-CB 4.5Å; F77-N147 HydrophobicContact CZ-CB 4.12Å; F77-L149 HydrophobicContact CD1-CB 4.29Å; F77-L149 HydrophobicContact CD1-CD1 3.96Å; F77-L149 HydrophobicContact CD1-CD2 4.33Å; F77-L149 HydrophobicContact CD1-CG 4.43Å; F77-L149 HydrophobicContact CD2-CD1 4.16Å; F77-L149 HydrophobicContact CE1-CB 3.65Å; F77-L149 HydrophobicContact CE1-CD1 4.19Å; F77-L149 HydrophobicContact CE1-CD2 4.28Å; F77-L149 HydrophobicContact CE1-CG 4.25Å; F77-L149 HydrophobicContact CE2-CB 4.18Å; F77-L149 HydrophobicContact CE2-CD1 4.37Å; F77-L149 HydrophobicContact CG-CD1 3.96Å; F77-L149 HydrophobicContact CZ-CB 3.6Å; F77-L149 HydrophobicContact CZ-CD1 4.39Å; F77-L152 HydrophobicContact CD2-CD1 4.18Å; F77-L152 HydrophobicContact CE2-CD1 3.88Å; F77-I158 HydrophobicContact CB-CD1 4.08Å; F77-I158 HydrophobicContact CD2-CD1 4.28Å; F77-I158 HydrophobicContact CG-CD1 4.5Å; F77-L162 PolarHBondContact N-O 2.97Å; F77-V164 HydrophobicContact CB-CG1 4.37Å; F77-V164 HydrophobicContact CD2-CG1 4.41Å; F77-V171 HydrophobicContact CD2-CG1 3.92Å; F77-V171 HydrophobicContact CE2-CB 4.04Å; F77-V171 HydrophobicContact CE2-CG1 3.82Å; F77-V171 HydrophobicContact CZ-CB 4.34Å
78Y95.5Very high93.5Very high116 Ų11645.2 Ų45.246%0.45524%0.236SC..Hα-helixtrans-69.8-29-178.3-72.4-71.9000113.6Y76 L82 M143 L149Y76-Y78 VanDerWaalsContact C-N 3.3Å; Y76-Y78 PolarHBondContact O-N 3.41Å; Y78-L82 VanDerWaalsContact O-CB 3.24Å; Y78-L82 WeakPolarHBondContact O-CB 3.24Å; Y78-L82 PolarHBondContact O-N 2.94Å; Y78-M143 HydrophobicContact CD1-CE 3.8Å; Y78-M143 HydrophobicContact CE1-CE 4.42Å; Y78-L149 HydrophobicContact CE2-CD2 4.12Å; Y78-L149 WeakPolarHBondContact OH-CD2 3.37Å
79S95.2Very high93.8Very high71 Ų7143 Ų4350%0.49722%0.222SC..Hα-helixtrans-68.4-46.2174-590000111.1Y76 F77 L81 L82 G83Y76-S79 WeakPolarHBondContact O-CB 3.43Å; Y76-S79 PolarHBondContact O-N 2.88Å; F77-S79 PolarHBondContact O-N 2.84Å; S79-L81 VanDerWaalsContact C-N 3.34Å; S79-L82 PolarHBondContact O-N 3.28Å; S79-G83 PolarHBondContact O-N 3.24Å
80C95.9Very high93.9Very high5 Ų542.8 Ų42.83%0.03422%0.221CC..Hα-helixtrans-61.8-43.7174.2-1770000111.5Y76 F77 G83 T84 C166 V171Y76-C80 PolarHBondContact O-N 3.41Å; Y76-C80 VanDerWaalsContact O-N 3.09Å; F77-C80 PolarHBondContact O-N 3Å; C80-G83 PolarHBondContact O-N 2.98Å; C80-T84 WeakPolarHBondContact O-CB 3.37Å; C80-T84 PolarHBondContact O-N 2.81Å; C80-T84 PolarHBondContact O-OG1 2.91Å; C80-C166 HydrophobicContact CB-CB 3.74Å; C80-C166 WeakPolarHBondContact CB-SG 3.28Å; C80-C166 WeakPolarHBondContact SG-CA 3.32Å; C80-C166 WeakPolarHBondContact SG-CB 3.49Å; C80-C166 CovalentContact SG-SG 2.03Å; C80-C166 PolarHBondContact SG-SG 3.38Å; C80-V171 HydrophobicContact CB-CG1 4.04Å
81L96.9Very high94Very high0 Ų043.1 Ų43.10%022%0.222CC..Hα-helixtrans-65.6-42.6-179.8-175.257.8000111.8F77 S79 T84 C85 P142 M143 N147 V171 I172F77-L81 HydrophobicContact CD1-CD2 4.36Å; F77-L81 HydrophobicContact CE1-CB 4.42Å; F77-L81 HydrophobicContact CE1-CD2 3.53Å; F77-L81 HydrophobicContact CZ-CD2 4.03Å; F77-L81 VanDerWaalsContact O-CB 3.26Å; F77-L81 WeakPolarHBondContact O-CB 3.22Å; F77-L81 PolarHBondContact O-N 3.1Å; S79-L81 VanDerWaalsContact C-N 3.34Å; L81-T84 PolarHBondContact O-N 3.23Å; L81-C85 WeakPolarHBondContact O-CB 3.47Å; L81-C85 PolarHBondContact O-N 3.02Å; L81-C85 PolarHBondContact O-SG 3.18Å; L81-P142 HydrophobicContact CD1-CB 3.98Å; L81-M143 HydrophobicContact CB-CE 3.78Å; L81-M143 HydrophobicContact CD2-CE 3.18Å; L81-M143 HydrophobicContact CG-CE 3.26Å; L81-M143 HydrophobicContact CG-SD 4.32Å; L81-N147 HydrophobicContact CD1-CB 4.27Å; L81-N147 HydrophobicContact CD2-CB 3.68Å; L81-V171 HydrophobicContact CB-CB 4.27Å; L81-V171 HydrophobicContact CB-CG2 4.44Å; L81-V171 HydrophobicContact CD1-CB 4.07Å; L81-V171 HydrophobicContact CD1-CG2 4.07Å; L81-I172 HydrophobicContact CD1-CD1 3.45Å; L81-I172 VanDerWaalsContact CD1-CD1 3.45Å; L81-I172 HydrophobicContact CD1-CG1 4.48Å
82L96.8Very high94.3Very high92 Ų9240.6 Ų40.648%0.48221%0.209SC..Hα-helixtrans-63.3-44.6175.4179.163.6000112Y78 S79 T84 C85 T86 M143Y78-L82 VanDerWaalsContact O-CB 3.24Å; Y78-L82 WeakPolarHBondContact O-CB 3.24Å; Y78-L82 PolarHBondContact O-N 2.94Å; S79-L82 PolarHBondContact O-N 3.28Å; L82-T84 VanDerWaalsContact C-N 3.32Å; L82-T84 PolarHBondContact O-N 3.4Å; L82-C85 PolarHBondContact O-N 3.28Å; L82-T86 PolarHBondContact O-N 3.08Å; L82-T86 PolarHBondContact O-OG1 2.91Å; L82-M143 HydrophobicContact CB-SD 4.02Å; L82-M143 HydrophobicContact CD1-SD 4.06Å
83G95.6Very high94.6Very high12 Ų1240.1 Ų40.112%0.12420%0.204CC..Hα-helixtrans-58-45.9174.800000111.6S79 C80 T86 M87S79-G83 PolarHBondContact O-N 3.24Å; C80-G83 PolarHBondContact O-N 2.98Å; G83-T86 WeakPolarHBondContact O-CB 3.25Å; G83-T86 PolarHBondContact O-N 3.4Å; G83-M87 WeakPolarHBondContact O-CG 3.41Å; G83-M87 PolarHBondContact O-N 3.23Å
84T95.9Very high94.6Very high0 Ų036.2 Ų36.20%018%0.184CC..Hα-helixtrans-66.1-42177.5-52.40000112.5C80 L81 L82 T86 M87 L88 F168 I172C80-T84 WeakPolarHBondContact O-CB 3.37Å; C80-T84 PolarHBondContact O-N 2.81Å; C80-T84 PolarHBondContact O-OG1 2.91Å; L81-T84 PolarHBondContact O-N 3.23Å; L82-T84 VanDerWaalsContact C-N 3.32Å; L82-T84 PolarHBondContact O-N 3.4Å; T84-T86 VanDerWaalsContact C-N 3.28Å; T84-T86 PolarHBondContact O-N 3.19Å; T84-M87 VanDerWaalsContact O-CB 3.3Å; T84-M87 WeakPolarHBondContact O-CB 3.37Å; T84-M87 PolarHBondContact O-N 2.92Å; T84-M87 VanDerWaalsContact O-N 3.12Å; T84-L88 PolarHBondContact O-N 3.4Å; T84-F168 HydrophobicContact CG2-CD2 3.27Å; T84-F168 HydrophobicContact CG2-CE2 3.39Å; T84-F168 HydrophobicContact CG2-CG 4.29Å; T84-F168 HydrophobicContact CG2-CZ 4.49Å; T84-I172 HydrophobicContact CG2-CD1 3.82Å; T84-I172 HydrophobicContact CG2-CG1 3.41Å; T84-I172 VanDerWaalsContact CG2-CG1 3.41Å
85C97.4Very high94.4Very high0 Ų029.1 Ų29.10%015%0.15CC..Hα-helixtrans-63.9-34.9176.5-680000111.7L81 L82 M87 L88 V89 G139 L140 M143L81-C85 WeakPolarHBondContact O-CB 3.47Å; L81-C85 PolarHBondContact O-N 3.02Å; L81-C85 PolarHBondContact O-SG 3.18Å; L82-C85 PolarHBondContact O-N 3.28Å; C85-M87 VanDerWaalsContact C-N 3.28Å; C85-M87 PolarHBondContact O-N 2.98Å; C85-L88 WeakPolarHBondContact O-CB 3.35Å; C85-L88 PolarHBondContact O-N 3.39Å; C85-L88 VanDerWaalsContact O-N 3.1Å; C85-V89 WeakPolarHBondContact O-CG2 3.5Å; C85-V89 PolarHBondContact O-N 3.28Å; C85-G139 VanDerWaalsContact CB-O 3.3Å; C85-G139 WeakPolarHBondContact CB-O 3.4Å; C85-L140 HydrophobicContact CB-CD2 3.98Å; C85-M143 HydrophobicContact CB-CG 4.29Å
86T95.3Very high94.4Very high45 Ų4527.6 Ų27.628%0.27614%0.14SC..Hα-helixtrans-59.8-39.6173.6-57.20000111.4L82 G83 T84 L88 V89 L90L82-T86 PolarHBondContact O-N 3.08Å; L82-T86 PolarHBondContact O-OG1 2.91Å; G83-T86 WeakPolarHBondContact O-CB 3.25Å; G83-T86 PolarHBondContact O-N 3.4Å; T84-T86 VanDerWaalsContact C-N 3.28Å; T84-T86 PolarHBondContact O-N 3.19Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3Å; T86-V89 PolarHBondContact O-N 3.2Å; T86-L90 HydrophobicContact CG2-CD1 4.13Å; T86-L90 WeakPolarHBondContact O-CG 3.3Å; T86-L90 PolarHBondContact O-N 3.02Å; T86-L90 VanDerWaalsContact O-N 3.1Å
87M93.9Very high94.2Very high19 Ų1920.9 Ų20.99%0.09412%0.115CC..Hα-helixtrans-60.6-43.7173.2-50-178.6-178.700111.8V62 L65 A66 V69 G83 T84 C85 T91V62-M87 HydrophobicContact CG1-CB 3.93Å; V62-M87 HydrophobicContact CG1-CG 3.87Å; V62-M87 HydrophobicContact CG1-SD 4.47Å; V62-M87 HydrophobicContact CG2-CB 4.49Å; L65-M87 HydrophobicContact CB-CE 3.33Å; A66-M87 HydrophobicContact CB-CE 4.09Å; A66-M87 HydrophobicContact CB-SD 4.43Å; V69-M87 HydrophobicContact CG2-CE 3.88Å; G83-M87 WeakPolarHBondContact O-CG 3.41Å; G83-M87 PolarHBondContact O-N 3.23Å; T84-M87 VanDerWaalsContact O-CB 3.3Å; T84-M87 WeakPolarHBondContact O-CB 3.37Å; T84-M87 PolarHBondContact O-N 2.92Å; T84-M87 VanDerWaalsContact O-N 3.12Å; C85-M87 VanDerWaalsContact C-N 3.28Å; C85-M87 PolarHBondContact O-N 2.98Å; M87-T91 WeakPolarHBondContact O-CB 3.45Å; M87-T91 PolarHBondContact O-N 2.89Å; M87-T91 PolarHBondContact O-OG1 2.84Å
88L95.4Very high93.8Very high12 Ų1221.2 Ų21.26%0.06312%0.117CC..Hα-helixtrans-65.2-43.9179.4-62.7176.4000112T84 C85 T86 T91 E92 P142 F168 I172 Y176 M177T84-L88 PolarHBondContact O-N 3.4Å; C85-L88 WeakPolarHBondContact O-CB 3.35Å; C85-L88 PolarHBondContact O-N 3.39Å; C85-L88 VanDerWaalsContact O-N 3.1Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3Å; L88-T91 WeakPolarHBondContact O-CB 3.25Å; L88-E92 VanDerWaalsContact O-CB 3.28Å; L88-E92 WeakPolarHBondContact O-CB 3.37Å; L88-E92 PolarHBondContact O-N 2.75Å; L88-P142 HydrophobicContact CD1-CG 4.47Å; L88-F168 HydrophobicContact CD2-CE2 4.32Å; L88-F168 HydrophobicContact CD2-CZ 4.37Å; L88-I172 HydrophobicContact CD1-CD1 4.27Å; L88-Y176 HydrophobicContact CD1-CE1 3.81Å; L88-M177 HydrophobicContact CD1-SD 4.32Å; L88-M177 HydrophobicContact CD2-CE 4.05Å; L88-M177 HydrophobicContact CD2-SD 3.91Å
89V96.9Very high93.6Very high5 Ų516.9 Ų16.93%0.0310%0.101CC..Hα-helixtrans-60.3-49.1177.3172.90000111C85 T86 E92 S93 A135 F136 L140C85-V89 WeakPolarHBondContact O-CG2 3.5Å; C85-V89 PolarHBondContact O-N 3.28Å; T86-V89 PolarHBondContact O-N 3.2Å; V89-E92 PolarHBondContact O-N 3.07Å; V89-S93 WeakPolarHBondContact O-CB 3.19Å; V89-S93 PolarHBondContact O-N 3.03Å; V89-A135 HydrophobicContact CG1-CB 4.4Å; V89-F136 HydrophobicContact CG1-CD1 3.73Å; V89-F136 HydrophobicContact CG1-CD2 4.37Å; V89-F136 HydrophobicContact CG1-CE1 3.82Å; V89-F136 HydrophobicContact CG1-CE2 4.43Å; V89-F136 HydrophobicContact CG1-CG 4.01Å; V89-F136 HydrophobicContact CG1-CZ 4.17Å; V89-F136 HydrophobicContact CG2-CD1 4.11Å; V89-L140 HydrophobicContact CG2-CD2 4.17Å; V89-L140 HydrophobicContact CG2-CG 4.05Å
90L93.4Very high93.4Very high14 Ų1414.1 Ų14.17%0.0738%0.083CC..Hα-helixtrans-66.8-41.8-176.5-70.4175.5000111.4A57 V58 V62 T86 S93 S94 W132A57-L90 HydrophobicContact CB-CD1 3.67Å; A57-L90 HydrophobicContact CB-CD2 3.72Å; A57-L90 HydrophobicContact CB-CG 4.33Å; V58-L90 HydrophobicContact CG2-CB 4.28Å; V62-L90 HydrophobicContact CG2-CB 3.93Å; V62-L90 HydrophobicContact CG2-CD1 3.44Å; V62-L90 VanDerWaalsContact CG2-CD1 3.44Å; V62-L90 HydrophobicContact CG2-CG 4.29Å; T86-L90 HydrophobicContact CG2-CD1 4.13Å; T86-L90 WeakPolarHBondContact O-CG 3.3Å; T86-L90 PolarHBondContact O-N 3.02Å; T86-L90 VanDerWaalsContact O-N 3.1Å; L90-S93 PolarHBondContact O-N 3.27Å; L90-S93 PolarHBondContact O-OG 3.21Å; L90-S94 PolarHBondContact O-N 3.45Å; L90-W132 HydrophobicContact CD2-CH2 4Å; L90-W132 HydrophobicContact CD2-CZ3 4Å
91T89.6Confident93Very high22 Ų2214.7 Ų14.714%0.1359%0.085CC..Hα-helixtrans-53.4-56.8170.4-69.80000111.6M87 L88 S93 S94 I95 W245M87-T91 WeakPolarHBondContact O-CB 3.45Å; M87-T91 PolarHBondContact O-N 2.89Å; M87-T91 PolarHBondContact O-OG1 2.84Å; L88-T91 WeakPolarHBondContact O-CB 3.25Å; T91-S93 VanDerWaalsContact C-N 3.28Å; T91-S93 PolarHBondContact O-N 2.72Å; T91-S94 WeakPolarHBondContact O-CB 3.45Å; T91-S94 PolarHBondContact O-N 3.42Å; T91-I95 HydrophobicContact CG2-CD1 4.23Å; T91-I95 WeakPolarHBondContact O-CG1 3.47Å; T91-I95 PolarHBondContact O-N 2.91Å; T91-W245 HydrophobicContact CG2-CE3 4.15Å; T91-W245 HydrophobicContact CG2-CH2 3.02Å; T91-W245 HydrophobicContact CG2-CZ2 3.81Å; T91-W245 HydrophobicContact CG2-CZ3 3.2Å; T91-W245 WeakPolarHBondContact OG1-CH2 3.36Å
92E93.5Very high92.5Very high2 Ų214.7 Ų14.71%0.0099%0.085CC..Hα-helixtrans-60.9-38.9-175.9-174.663.1-163.400111.5L88 V89 S94 I95 L96 A135 V138L88-E92 VanDerWaalsContact O-CB 3.28Å; L88-E92 WeakPolarHBondContact O-CB 3.37Å; L88-E92 PolarHBondContact O-N 2.75Å; V89-E92 PolarHBondContact O-N 3.07Å; E92-S94 VanDerWaalsContact C-N 3.3Å; E92-S94 PolarHBondContact O-N 2.8Å; E92-I95 PolarHBondContact O-N 3.2Å; E92-I95 VanDerWaalsContact O-N 3.15Å; E92-L96 HydrophobicContact CG-CD1 4.11Å; E92-L96 HydrophobicContact CG-CG 4.5Å; E92-L96 WeakPolarHBondContact O-CG 3.24Å; E92-L96 PolarHBondContact O-N 2.87Å; E92-A135 HydrophobicContact CB-CB 3.96Å; E92-A135 HydrophobicContact CG-CB 3.96Å; E92-V138 HydrophobicContact CG-CB 4.17Å; E92-V138 HydrophobicContact CG-CG1 4.15Å
93S93.9Very high92.2Very high3 Ų313.2 Ų13.22%0.0218%0.077CC..Hα-helixtrans-61.8-37176.674.30000112.6A54 V89 L90 T91 A97A54-S93 WeakPolarHBondContact CB-OG 3.44Å; V89-S93 WeakPolarHBondContact O-CB 3.19Å; V89-S93 PolarHBondContact O-N 3.03Å; L90-S93 PolarHBondContact O-N 3.27Å; L90-S93 PolarHBondContact O-OG 3.21Å; T91-S93 VanDerWaalsContact C-N 3.28Å; T91-S93 PolarHBondContact O-N 2.72Å; S93-A97 VanDerWaalsContact O-CB 3.29Å; S93-A97 WeakPolarHBondContact O-CB 3.49Å; S93-A97 PolarHBondContact O-N 3Å
94S89.6Confident91.8Very high2 Ų212.8 Ų12.81%0.0147%0.072CC..Hα-helixtrans-66.4-39173.9-70.30000112.3A54 D55 L90 T91 E92 A97 L98A54-S94 WeakPolarHBondContact CB-OG 3.42Å; D55-S94 PolarHBondContact OD1-OG 2.89Å; L90-S94 PolarHBondContact O-N 3.45Å; T91-S94 WeakPolarHBondContact O-CB 3.45Å; T91-S94 PolarHBondContact O-N 3.42Å; E92-S94 VanDerWaalsContact C-N 3.3Å; E92-S94 PolarHBondContact O-N 2.8Å; S94-A97 PolarHBondContact O-N 3.31Å; S94-L98 WeakPolarHBondContact O-CG 3.35Å; S94-L98 PolarHBondContact O-N 3.5Å
95I89.3Confident91.2Very high0 Ų014.5 Ų14.50%08%0.079CC..Hα-helixtrans-62.8-49.8176.5-54.6-174000110.4T91 E92 A97 L98 L99 V186 P189 F241T91-I95 HydrophobicContact CG2-CD1 4.23Å; T91-I95 WeakPolarHBondContact O-CG1 3.47Å; T91-I95 PolarHBondContact O-N 2.91Å; E92-I95 PolarHBondContact O-N 3.2Å; E92-I95 VanDerWaalsContact O-N 3.15Å; I95-A97 VanDerWaalsContact C-N 3.31Å; I95-A97 PolarHBondContact O-N 3.26Å; I95-L98 PolarHBondContact O-N 3.01Å; I95-L99 PolarHBondContact O-N 3.08Å; I95-V186 HydrophobicContact CD1-CB 4.43Å; I95-V186 HydrophobicContact CD1-CG1 4.14Å; I95-V186 HydrophobicContact CD1-CG2 3.69Å; I95-P189 HydrophobicContact CG2-CB 4.25Å; I95-F241 HydrophobicContact CB-CE2 4.41Å; I95-F241 HydrophobicContact CB-CZ 4.08Å; I95-F241 HydrophobicContact CD1-CZ 3.94Å; I95-F241 HydrophobicContact CG1-CE2 3.8Å; I95-F241 HydrophobicContact CG1-CZ 3.57Å; I95-F241 HydrophobicContact CG2-CE1 4.46Å; I95-F241 HydrophobicContact CG2-CZ 3.79Å
96L92.8Very high90.6Very high13 Ų1317.2 Ų17.27%0.0689%0.089CC..Hα-helixtrans-64.9-35.7179.9-66.2172.9000111.8E92 L99 A100 C131 L134 A135E92-L96 HydrophobicContact CG-CD1 4.11Å; E92-L96 HydrophobicContact CG-CG 4.5Å; E92-L96 WeakPolarHBondContact O-CG 3.24Å; E92-L96 PolarHBondContact O-N 2.87Å; L96-L99 PolarHBondContact O-N 3.26Å; L96-A100 WeakPolarHBondContact O-CB 3.35Å; L96-A100 PolarHBondContact O-N 2.89Å; L96-C131 HydrophobicContact CB-CB 3.85Å; L96-C131 HydrophobicContact CD1-CB 4.41Å; L96-C131 VanDerWaalsContact CD1-O 3.24Å; L96-C131 WeakPolarHBondContact CD1-O 3.25Å; L96-L134 HydrophobicContact CD1-CB 3.89Å; L96-L134 HydrophobicContact CD1-CD2 3.81Å; L96-L134 HydrophobicContact CD1-CG 3.9Å; L96-L134 HydrophobicContact CD2-CD2 3.92Å; L96-A135 HydrophobicContact CD1-CB 4.3Å
97A90.9Very high90.3Very high5 Ų517.1 Ų17.14%0.0419%0.087CC..Hα-helixtrans-65.8-41.517400000112.3L51 S93 S94 I95 A100 I101L51-A97 HydrophobicContact CB-CB 4.02Å; L51-A97 HydrophobicContact CD1-CB 4.15Å; S93-A97 VanDerWaalsContact O-CB 3.29Å; S93-A97 WeakPolarHBondContact O-CB 3.49Å; S93-A97 PolarHBondContact O-N 3Å; S94-A97 PolarHBondContact O-N 3.31Å; I95-A97 VanDerWaalsContact C-N 3.31Å; I95-A97 PolarHBondContact O-N 3.26Å; A97-A100 PolarHBondContact O-N 3.3Å; A97-I101 VanDerWaalsContact O-CG1 3.28Å; A97-I101 WeakPolarHBondContact O-CG1 3.23Å; A97-I101 PolarHBondContact O-N 3.5Å
98L86.3Confident89.8Confident7 Ų720 Ų204%0.03710%0.097CC..Hα-helixtrans-63.7-41.3174.4-74.7170.7000111.9L51 S94 I95 I101 A102 V237 F241L51-L98 HydrophobicContact CD1-CG 4.45Å; L51-L98 HydrophobicContact CD2-CD2 3.78Å; L51-L98 HydrophobicContact CD2-CG 4.23Å; S94-L98 WeakPolarHBondContact O-CG 3.35Å; S94-L98 PolarHBondContact O-N 3.5Å; I95-L98 PolarHBondContact O-N 3.01Å; L98-I101 WeakPolarHBondContact O-CB 3.4Å; L98-I101 PolarHBondContact O-N 2.91Å; L98-A102 PolarHBondContact O-N 3.41Å; L98-V237 HydrophobicContact CD2-CG1 3.78Å; L98-F241 HydrophobicContact CD1-CB 4.33Å; L98-F241 HydrophobicContact CD1-CD2 3.2Å; L98-F241 HydrophobicContact CD1-CE2 3.68Å; L98-F241 HydrophobicContact CD1-CG 3.92Å
99L90.8Very high89Confident25 Ų2520.5 Ų20.513%0.13110%0.1CC..Hα-helixtrans-60.4-45.6172.7170.359.8000111.4I95 L96 I101 A102 I103 P189 F192 M193I95-L99 PolarHBondContact O-N 3.08Å; L96-L99 PolarHBondContact O-N 3.26Å; L99-I101 VanDerWaalsContact C-N 3.29Å; L99-I101 PolarHBondContact O-N 3.33Å; L99-A102 WeakPolarHBondContact O-CB 3.05Å; L99-A102 PolarHBondContact O-N 2.92Å; L99-A102 VanDerWaalsContact O-N 3.08Å; L99-I103 HydrophobicContact CD1-CD1 3.96Å; L99-I103 HydrophobicContact CD1-CG1 4.1Å; L99-I103 HydrophobicContact CG-CD1 4.03Å; L99-I103 WeakPolarHBondContact O-CG1 3.35Å; L99-I103 PolarHBondContact O-N 2.94Å; L99-P189 HydrophobicContact CD2-CB 4.02Å; L99-P189 HydrophobicContact CD2-CG 4.29Å; L99-F192 HydrophobicContact CD1-CD1 3.55Å; L99-F192 HydrophobicContact CD1-CE1 4.06Å; L99-M193 HydrophobicContact CB-CG 4.48Å; L99-M193 HydrophobicContact CB-SD 4.43Å; L99-M193 HydrophobicContact CD1-CG 3.82Å
100A91.3Very high88.4Confident13 Ų1324.6 Ų24.611%0.10712%0.118CC..Hα-helixtrans-60.8-39177.100000112F47 L96 A97 I103 D104F47-A100 HydrophobicContact CD1-CB 3.69Å; F47-A100 HydrophobicContact CE1-CB 3.79Å; F47-A100 HydrophobicContact CG-CB 4.21Å; F47-A100 HydrophobicContact CZ-CB 4.37Å; L96-A100 WeakPolarHBondContact O-CB 3.35Å; L96-A100 PolarHBondContact O-N 2.89Å; A97-A100 PolarHBondContact O-N 3.3Å; A100-I103 PolarHBondContact O-N 3.4Å; A100-D104 WeakPolarHBondContact O-CB 3.46Å; A100-D104 PolarHBondContact O-N 2.91Å
101I87.5Confident88Confident17 Ų1726.3 Ų26.39%0.08713%0.126CC..Hα-helixtrans-63.1-42.3172.7-67.8164.5000110.8F47 I48 L51 A97 L98 L99 D104 R105F47-I101 HydrophobicContact CB-CD1 4.4Å; F47-I101 HydrophobicContact CB-CG1 3.69Å; I48-I101 HydrophobicContact CG1-CD1 4.28Å; L51-I101 HydrophobicContact CD2-CD1 3.87Å; A97-I101 VanDerWaalsContact O-CG1 3.28Å; A97-I101 WeakPolarHBondContact O-CG1 3.23Å; A97-I101 PolarHBondContact O-N 3.5Å; L98-I101 WeakPolarHBondContact O-CB 3.4Å; L98-I101 PolarHBondContact O-N 2.91Å; L99-I101 VanDerWaalsContact C-N 3.29Å; L99-I101 PolarHBondContact O-N 3.33Å; I101-D104 PolarHBondContact O-N 2.92Å; I101-R105 HydrophobicContact CG2-CG 4.39Å; I101-R105 WeakPolarHBondContact O-CB 3.35Å; I101-R105 WeakPolarHBondContact O-CG 3.41Å; I101-R105 PolarHBondContact O-N 3.2Å
102A86.9Confident87.8Confident0 Ų029.6 Ų29.60%015%0.148CC..Hα-helixtrans-61.4-44.6176.900000111.6L98 L99 R105 Y106 M193 Y197L98-A102 PolarHBondContact O-N 3.41Å; L99-A102 WeakPolarHBondContact O-CB 3.05Å; L99-A102 PolarHBondContact O-N 2.92Å; L99-A102 VanDerWaalsContact O-N 3.08Å; A102-R105 PolarHBondContact O-N 3.5Å; A102-Y106 WeakPolarHBondContact O-CB 3.38Å; A102-Y106 PolarHBondContact O-N 3.08Å; A102-M193 HydrophobicContact CB-CG 3.92Å; A102-M193 HydrophobicContact CB-SD 4.32Å; A102-Y197 HydrophobicContact CB-CE1 4.29Å; A102-Y197 WeakPolarHBondContact CB-OH 2.91Å
103I90.1Very high87.4Confident61 Ų6135.9 Ų35.931%0.31319%0.187SC..Hα-helixtrans-63.6-47.4176.1-65.6167.8000111.1L99 A100 R105 Y106 L107 F192 I196L99-I103 HydrophobicContact CD1-CD1 3.96Å; L99-I103 HydrophobicContact CD1-CG1 4.1Å; L99-I103 HydrophobicContact CG-CD1 4.03Å; L99-I103 WeakPolarHBondContact O-CG1 3.35Å; L99-I103 PolarHBondContact O-N 2.94Å; A100-I103 PolarHBondContact O-N 3.4Å; I103-R105 PolarHBondContact O-N 3.03Å; I103-Y106 WeakPolarHBondContact O-CB 2.86Å; I103-Y106 PolarHBondContact O-N 3.33Å; I103-L107 HydrophobicContact CG2-CD1 4.03Å; I103-L107 HydrophobicContact CG2-CG 4.33Å; I103-L107 WeakPolarHBondContact O-CG 3.29Å; I103-L107 PolarHBondContact O-N 2.88Å; I103-F192 HydrophobicContact CD1-CE1 4.08Å; I103-F192 HydrophobicContact CG1-CE1 4.02Å; I103-I196 HydrophobicContact CG1-CD1 3.93Å
104D88.1Confident87.2Confident3 Ų343 Ų432%0.01621%0.213CC..Hα-helixtrans-54.9-44.2176.9177.584000111.3T44 F47 A100 I101 L107 R108 Y115T44-D104 WeakPolarHBondContact CB-OD2 3.46Å; T44-D104 WeakPolarHBondContact CG2-OD2 3.27Å; T44-D104 PolarHBondContact OG1-OD2 2.92Å; F47-D104 HydrophobicContact CD2-CB 4.38Å; F47-D104 HydrophobicContact CE2-CB 4.29Å; A100-D104 WeakPolarHBondContact O-CB 3.46Å; A100-D104 PolarHBondContact O-N 2.91Å; I101-D104 PolarHBondContact O-N 2.92Å; D104-L107 PolarHBondContact O-N 3.14Å; D104-R108 PolarHBondContact O-N 3.1Å; D104-Y115 PolarHBondContact OD1-OH 3.23Å
105R81.8Confident87.2Confident37 Ų3743.3 Ų43.314%0.1421%0.214CC..Hα-helixtrans-66.3-44.3177.9-69.9-75.1-176.3-121.23.7112.1I101 A102 I103 L107 R108 V109 L234I101-R105 HydrophobicContact CG2-CG 4.39Å; I101-R105 WeakPolarHBondContact O-CB 3.35Å; I101-R105 WeakPolarHBondContact O-CG 3.41Å; I101-R105 PolarHBondContact O-N 3.2Å; A102-R105 PolarHBondContact O-N 3.5Å; I103-R105 PolarHBondContact O-N 3.03Å; R105-L107 VanDerWaalsContact C-N 3.35Å; R105-L107 PolarHBondContact O-N 2.95Å; R105-R108 PolarHBondContact O-N 3.42Å; R105-V109 WeakPolarHBondContact O-CG2 3.48Å; R105-V109 PolarHBondContact O-N 3.42Å; R105-V109 VanDerWaalsContact O-N 3.12Å; R105-L234 HydrophobicContact CB-CD1 3.78Å; R105-L234 HydrophobicContact CB-CD2 4.22Å; R105-L234 HydrophobicContact CG-CD1 4.07Å; R105-L234 HydrophobicContact CG-CD2 3.65Å
106Y85.4Confident87.1Confident57 Ų5752.2 Ų52.222%0.22425%0.253CS..Hα-helixtrans-55.7-49.9173.8178.3-100.8000111.5A102 I103 R108 V109 K110 I196 E199 I200A102-Y106 WeakPolarHBondContact O-CB 3.38Å; A102-Y106 PolarHBondContact O-N 3.08Å; I103-Y106 WeakPolarHBondContact O-CB 2.86Å; I103-Y106 PolarHBondContact O-N 3.33Å; Y106-R108 VanDerWaalsContact C-N 3.31Å; Y106-R108 PolarHBondContact O-N 3.15Å; Y106-V109 PolarHBondContact O-N 2.99Å; Y106-K110 HydrophobicContact CD1-CB 4.46Å; Y106-K110 HydrophobicContact CE1-CB 4.11Å; Y106-K110 HydrophobicContact CE1-CG 4.12Å; Y106-K110 VanDerWaalsContact O-CB 3.24Å; Y106-K110 WeakPolarHBondContact O-CB 3.39Å; Y106-K110 PolarHBondContact O-N 2.95Å; Y106-I196 HydrophobicContact CD2-CG1 4.48Å; Y106-I196 HydrophobicContact CD2-CG2 3.99Å; Y106-I196 HydrophobicContact CG-CG2 4.17Å; Y106-E199 HydrophobicContact CE2-CB 4.02Å; Y106-I200 HydrophobicContact CD2-CD1 4.38Å; Y106-I200 HydrophobicContact CD2-CG1 3.98Å
107L88.8Confident86.9Confident43 Ų4360 Ų6023%0.22528%0.281CS..Hα-helixtrans-61.4-40.2180-68.1174.6000111.7I103 D104 R105 V109 K110 I111 Y115 V119I103-L107 HydrophobicContact CG2-CD1 4.03Å; I103-L107 HydrophobicContact CG2-CG 4.33Å; I103-L107 WeakPolarHBondContact O-CG 3.29Å; I103-L107 PolarHBondContact O-N 2.88Å; D104-L107 PolarHBondContact O-N 3.14Å; R105-L107 VanDerWaalsContact C-N 3.35Å; R105-L107 PolarHBondContact O-N 2.95Å; L107-V109 VanDerWaalsContact C-N 3.32Å; L107-V109 PolarHBondContact O-N 3.22Å; L107-K110 PolarHBondContact O-N 3.36Å; L107-I111 HydrophobicContact CD2-CD1 4.17Å; L107-I111 HydrophobicContact CD2-CG1 4.5Å; L107-I111 WeakPolarHBondContact O-CG1 3.47Å; L107-I111 PolarHBondContact O-N 2.61Å; L107-Y115 HydrophobicContact CB-CD2 4.19Å; L107-Y115 HydrophobicContact CB-CE2 4.49Å; L107-V119 HydrophobicContact CB-CG2 4.38Å; L107-V119 HydrophobicContact CD1-CG2 3.73Å
108R82.9Confident86.9Confident80 Ų8062.3 Ų62.330%0.30229%0.294SS..Hα-helixtrans-62.7-38.6177.9-170.4179.3-76.6-109.96.1112.4D42 T44 D104 R105 Y106 Y115D42-R108 IonicContact OD1-NH2 3.74Å; D42-R108 IonicContact OD2-CZ 3.96Å; D42-R108 IonicContact OD2-NH1 3.95Å; D42-R108 IonicContact OD2-NH2 3.23Å; D42-R108 PolarHBondContact OD2-NH2 3.18Å; T44-R108 PolarHBondContact OG1-NH2 2.99Å; D104-R108 PolarHBondContact O-N 3.1Å; R105-R108 PolarHBondContact O-N 3.42Å; Y106-R108 VanDerWaalsContact C-N 3.31Å; Y106-R108 PolarHBondContact O-N 3.15Å; R108-Y115 HydrophobicContact CB-CD2 3.88Å; R108-Y115 HydrophobicContact CB-CE2 3.81Å; R108-Y115 HydrophobicContact CG-CD2 4.42Å; R108-Y115 HydrophobicContact CG-CE2 4.42Å; R108-Y115 PolarHBondContact NH2-OH 2.96Å
109V79.6Confident87.1Confident22 Ų2262.8 Ų62.813%0.13330%0.298CS..Hα-helixtrans-77.8-41.5178.5175.70000111.6R105 Y106 L107 L230R105-V109 WeakPolarHBondContact O-CG2 3.48Å; R105-V109 PolarHBondContact O-N 3.42Å; R105-V109 VanDerWaalsContact O-N 3.12Å; Y106-V109 PolarHBondContact O-N 2.99Å; L107-V109 VanDerWaalsContact C-N 3.32Å; L107-V109 PolarHBondContact O-N 3.22Å; V109-L230 HydrophobicContact CG2-CD2 4.48Å
110K83.9Confident87.1Confident91 Ų9163.9 Ų63.940%0.39631%0.306SS..Hα-helixtrans-75.5-39.4-173.9-172.867.8170.5-1640113.2Y106 L107 M203Y106-K110 HydrophobicContact CD1-CB 4.46Å; Y106-K110 HydrophobicContact CE1-CB 4.11Å; Y106-K110 HydrophobicContact CE1-CG 4.12Å; Y106-K110 VanDerWaalsContact O-CB 3.24Å; Y106-K110 WeakPolarHBondContact O-CB 3.39Å; Y106-K110 PolarHBondContact O-N 2.95Å; L107-K110 PolarHBondContact O-N 3.36Å; K110-M203 HydrophobicContact CD-CE 3.79Å
111I86.1Confident86.9Confident49 Ų4967.6 Ų67.625%0.25133%0.331SS..  trans-131.757.8-173.255.5165.6000113L107 T113 R114 Y115 V118L107-I111 HydrophobicContact CD2-CD1 4.17Å; L107-I111 HydrophobicContact CD2-CG1 4.5Å; L107-I111 WeakPolarHBondContact O-CG1 3.47Å; L107-I111 PolarHBondContact O-N 2.61Å; I111-T113 VanDerWaalsContact C-N 3.28Å; I111-T113 PolarHBondContact O-N 3.34Å; I111-T113 VanDerWaalsContact O-N 3.13Å; I111-R114 HydrophobicContact CB-CB 4.45Å; I111-R114 PolarHBondContact O-N 2.93Å; I111-Y115 WeakPolarHBondContact O-CB 3.43Å; I111-Y115 PolarHBondContact O-N 2.91Å; I111-V118 HydrophobicContact CD1-CB 4.2Å; I111-V118 HydrophobicContact CD1-CG1 4.33Å; I111-V118 HydrophobicContact CD1-CG2 3.91Å
112P83.6Confident87Confident92 Ų9277.6 Ų77.660%0.59737%0.367SS*.THydrogen-bonded Turntrans-56.7-37.2-170.922.7-34.5000114
113T86.1Confident87.3Confident133 Ų13384.7 Ų84.782%0.81639%0.394SS*.THydrogen-bonded Turntrans-74.3-30.5-179.4550000113.4I111I111-T113 VanDerWaalsContact C-N 3.28Å; I111-T113 PolarHBondContact O-N 3.34Å; I111-T113 VanDerWaalsContact O-N 3.13Å
114R89.9Confident87.3Confident152 Ų15282 Ų8257%0.57438%0.381SS*.THydrogen-bonded Turntrans-99.9-11.3-178-61.9-178.9-177.2179.41.4113I111 K116 R117 V118I111-R114 HydrophobicContact CB-CB 4.45Å; I111-R114 PolarHBondContact O-N 2.93Å; R114-K116 PolarHBondContact O-N 3.2Å; R114-R117 WeakPolarHBondContact O-CA 3.35Å; R114-R117 WeakPolarHBondContact O-CB 3.33Å; R114-R117 PolarHBondContact O-N 3.07Å; R114-V118 HydrophobicContact CB-CG2 4.39Å; R114-V118 WeakPolarHBondContact O-CG2 3.5Å; R114-V118 PolarHBondContact O-N 3.13Å
115Y88.6Confident87.5Confident10 Ų1083.1 Ų83.14%0.03939%0.393CS..Hα-helixtrans-49.8-52.2-174.8171.6-91.7000112.6T43 D104 L107 R108 I111 R117 V118 V119T43-Y115 PolarHBondContact OG1-OH 3.02Å; D104-Y115 PolarHBondContact OD1-OH 3.23Å; L107-Y115 HydrophobicContact CB-CD2 4.19Å; L107-Y115 HydrophobicContact CB-CE2 4.49Å; R108-Y115 HydrophobicContact CB-CD2 3.88Å; R108-Y115 HydrophobicContact CB-CE2 3.81Å; R108-Y115 HydrophobicContact CG-CD2 4.42Å; R108-Y115 HydrophobicContact CG-CE2 4.42Å; R108-Y115 PolarHBondContact NH2-OH 2.96Å; I111-Y115 WeakPolarHBondContact O-CB 3.43Å; I111-Y115 PolarHBondContact O-N 2.91Å; Y115-R117 PolarHBondContact O-N 3.06Å; Y115-R117 VanDerWaalsContact O-N 3.14Å; Y115-V118 PolarHBondContact O-N 3Å; Y115-V119 HydrophobicContact CD2-CB 4.31Å; Y115-V119 HydrophobicContact CD2-CG2 3.87Å; Y115-V119 HydrophobicContact CE2-CB 3.96Å; Y115-V119 HydrophobicContact CE2-CG1 4.33Å; Y115-V119 HydrophobicContact CE2-CG2 3.7Å; Y115-V119 PolarHBondContact O-N 3.35Å
116K86.9Confident88Confident186 Ų18686.1 Ų86.181%0.80941%0.412SS*.Hα-helixtrans-62.2-23.9-178.9-69.7-170.7177-177.10114R114R114-K116 PolarHBondContact O-N 3.2Å
117R89.9Confident88.4Confident178 Ų17884.6 Ų84.667%0.67241%0.41SS*.Hα-helixtrans-84.7-33.3176-170.4177.572.7179.75.9111.8R114 Y115R114-R117 WeakPolarHBondContact O-CA 3.35Å; R114-R117 WeakPolarHBondContact O-CB 3.33Å; R114-R117 PolarHBondContact O-N 3.07Å; Y115-R117 PolarHBondContact O-N 3.06Å; Y115-R117 VanDerWaalsContact O-N 3.14Å
118V90.8Very high88.7Confident52 Ų5283.6 Ų83.632%0.31541%0.406SS..Hα-helixtrans-82.4-49.4-177.6174.30000111.3I111 R114 Y115 R123I111-V118 HydrophobicContact CD1-CB 4.2Å; I111-V118 HydrophobicContact CD1-CG1 4.33Å; I111-V118 HydrophobicContact CD1-CG2 3.91Å; R114-V118 HydrophobicContact CB-CG2 4.39Å; R114-V118 WeakPolarHBondContact O-CG2 3.5Å; R114-V118 PolarHBondContact O-N 3.13Å; Y115-V118 PolarHBondContact O-N 3Å; V118-R123 VanDerWaalsContact O-CD 3.31Å; V118-R123 WeakPolarHBondContact O-CD 3.49Å; V118-R123 PolarHBondContact O-NH1 2.99Å
119V90.4Very high89.3Confident18 Ų1883.9 Ų83.911%0.10942%0.416CS..SBendtrans-97.6102.1-177.6-173.80000108.6T43 L107 Y115T43-V119 HydrophobicContact CG2-CG1 4.23Å; L107-V119 HydrophobicContact CB-CG2 4.38Å; L107-V119 HydrophobicContact CD1-CG2 3.73Å; Y115-V119 HydrophobicContact CD2-CB 4.31Å; Y115-V119 HydrophobicContact CD2-CG2 3.87Å; Y115-V119 HydrophobicContact CE2-CB 3.96Å; Y115-V119 HydrophobicContact CE2-CG1 4.33Å; Y115-V119 HydrophobicContact CE2-CG2 3.7Å; Y115-V119 PolarHBondContact O-N 3.35Å
120T90.7Very high90.1Very high48 Ų4888 Ų8829%0.29444%0.435SS..  trans-113157.4178.5680000110.3R122 R123 A124T120-R122 VanDerWaalsContact C-N 3.26Å; T120-R122 PolarHBondContact O-N 3.46Å; T120-R123 PolarHBondContact O-N 3.39Å; T120-R123 VanDerWaalsContact O-N 3.11Å; T120-R123 WeakPolarHBondContact OG1-CG 3.33Å; T120-R123 PolarHBondContact OG1-N 2.88Å; T120-A124 PolarHBondContact O-N 3.19Å
121S86.8Confident90.7Very high91 Ų9184.7 Ų84.764%0.63642%0.424SS*.Hα-helixtrans-58.3-37-179.6-50.40000113A124 G125S121-A124 PolarHBondContact O-N 3.47Å; S121-G125 PolarHBondContact O-N 2.87Å
122R89.5Confident91.2Very high226 Ų22685.1 Ų85.185%0.85342%0.422SS*.Hα-helixtrans-64-43.7176.3-174.8178.4177.9-174.6-0.1111.8T120 G125 L126T120-R122 VanDerWaalsContact C-N 3.26Å; T120-R122 PolarHBondContact O-N 3.46Å; R122-G125 PolarHBondContact O-N 3.28Å; R122-L126 WeakPolarHBondContact O-CB 3.48Å; R122-L126 PolarHBondContact O-N 2.87Å
123R92.7Very high91.9Very high150 Ų15084.5 Ų84.557%0.56642%0.417SS*.Hα-helixtrans-68.7-38.5177.9-70.6176.3177.7-177.5-3.3111.6V118 T120 L126 A127V118-R123 VanDerWaalsContact O-CD 3.31Å; V118-R123 WeakPolarHBondContact O-CD 3.49Å; V118-R123 PolarHBondContact O-NH1 2.99Å; T120-R123 PolarHBondContact O-N 3.39Å; T120-R123 VanDerWaalsContact O-N 3.11Å; T120-R123 WeakPolarHBondContact OG1-CG 3.33Å; T120-R123 PolarHBondContact OG1-N 2.88Å; R123-L126 PolarHBondContact O-N 3.43Å; R123-A127 WeakPolarHBondContact O-CB 3.38Å; R123-A127 PolarHBondContact O-N 3.29Å
124A91.1Very high92.4Very high3 Ų382.2 Ų82.23%0.02540%0.399CS..Hα-helixtrans-63.6-45.5174.500000111.7C46 F47 T120 S121 L126 A127 V128C46-A124 HydrophobicContact CB-CB 4.49Å; F47-A124 HydrophobicContact CE2-CB 4.11Å; F47-A124 HydrophobicContact CZ-CB 3.89Å; T120-A124 PolarHBondContact O-N 3.19Å; S121-A124 PolarHBondContact O-N 3.47Å; A124-L126 PolarHBondContact O-N 2.91Å; A124-A127 WeakPolarHBondContact O-CB 3.38Å; A124-A127 PolarHBondContact O-N 2.91Å; A124-V128 WeakPolarHBondContact O-CG2 3.38Å; A124-V128 PolarHBondContact O-N 3.33Å
125G91.2Very high92.8Very high27 Ų2775 Ų7528%0.27837%0.372SS..Hα-helixtrans-60.7-43174.500000112.7S121 R122 A127 V128 V129S121-G125 PolarHBondContact O-N 2.87Å; R122-G125 PolarHBondContact O-N 3.28Å; G125-A127 VanDerWaalsContact C-N 3.34Å; G125-A127 PolarHBondContact O-N 2.94Å; G125-V128 PolarHBondContact O-N 2.91Å; G125-V129 WeakPolarHBondContact O-CG2 3.35Å; G125-V129 PolarHBondContact O-N 3.39Å
126L93.8Very high93.2Very high101 Ų10179.2 Ų79.253%0.52939%0.391SS..Hα-helixtrans-60.8-42.7173.6-179.462.4000111.7R122 R123 A124 V128 V129 M130R122-L126 WeakPolarHBondContact O-CB 3.48Å; R122-L126 PolarHBondContact O-N 2.87Å; R123-L126 PolarHBondContact O-N 3.43Å; A124-L126 PolarHBondContact O-N 2.91Å; L126-V128 VanDerWaalsContact C-N 3.34Å; L126-V128 PolarHBondContact O-N 3Å; L126-V129 PolarHBondContact O-N 3.25Å; L126-M130 HydrophobicContact CG-CE 4.25Å; L126-M130 HydrophobicContact CG-SD 4.48Å; L126-M130 WeakPolarHBondContact O-CG 3.45Å; L126-M130 PolarHBondContact O-N 3Å
127A93.8Very high93.7Very high24 Ų2474.6 Ų74.620%0.19838%0.378CS..Hα-helixtrans-61.4-40.7176.100000112.4F47 R123 A124 G125 M130 C131F47-A127 HydrophobicContact CE1-CB 3.87Å; F47-A127 HydrophobicContact CZ-CB 4.07Å; R123-A127 WeakPolarHBondContact O-CB 3.38Å; R123-A127 PolarHBondContact O-N 3.29Å; A124-A127 WeakPolarHBondContact O-CB 3.38Å; A124-A127 PolarHBondContact O-N 2.91Å; G125-A127 VanDerWaalsContact C-N 3.34Å; G125-A127 PolarHBondContact O-N 2.94Å; A127-M130 HydrophobicContact CB-CE 4.25Å; A127-M130 PolarHBondContact O-N 3.4Å; A127-C131 PolarHBondContact O-N 2.91Å; A127-C131 PolarHBondContact O-SG 3.16Å
128V94.5Very high94.1Very high22 Ų2266.2 Ų66.213%0.13335%0.347CS..Hα-helixtrans-60.1-49173.4169.30000110.9F47 S50 A124 G125 L126 M130 C131 W132F47-V128 HydrophobicContact CD1-CG2 3.69Å; F47-V128 HydrophobicContact CE1-CG2 3.89Å; S50-V128 WeakPolarHBondContact OG-CG1 3.44Å; A124-V128 WeakPolarHBondContact O-CG2 3.38Å; A124-V128 PolarHBondContact O-N 3.33Å; G125-V128 PolarHBondContact O-N 2.91Å; L126-V128 VanDerWaalsContact C-N 3.34Å; L126-V128 PolarHBondContact O-N 3Å; V128-M130 VanDerWaalsContact C-N 3.32Å; V128-M130 PolarHBondContact O-N 3.23Å; V128-C131 WeakPolarHBondContact O-CB 3.38Å; V128-C131 PolarHBondContact O-N 3.34Å; V128-C131 VanDerWaalsContact O-N 3.13Å; V128-W132 VanDerWaalsContact O-CD1 3.29Å; V128-W132 PolarHBondContact O-N 2.85Å
129V95.6Very high94.4Very high86 Ų8663.8 Ų63.852%0.52133%0.332SS..Hα-helixtrans-57.9-45.6177.7173.40000110.9G125 L126 C131 W132 T133G125-V129 WeakPolarHBondContact O-CG2 3.35Å; G125-V129 PolarHBondContact O-N 3.39Å; L126-V129 PolarHBondContact O-N 3.25Å; V129-C131 VanDerWaalsContact C-N 3.33Å; V129-C131 PolarHBondContact O-N 3.41Å; V129-W132 PolarHBondContact O-N 2.83Å; V129-T133 PolarHBondContact O-N 2.95Å; V129-T133 PolarHBondContact O-OG1 3.33Å
130M96Very high94.7Very high108 Ų10865.7 Ų65.753%0.53234%0.341SS..Hα-helixtrans-59.9-40.8176.4-69.6-173.6-60.900112.5L126 A127 V128 T133 L134L126-M130 HydrophobicContact CG-CE 4.25Å; L126-M130 HydrophobicContact CG-SD 4.48Å; L126-M130 WeakPolarHBondContact O-CG 3.45Å; L126-M130 PolarHBondContact O-N 3Å; A127-M130 HydrophobicContact CB-CE 4.25Å; A127-M130 PolarHBondContact O-N 3.4Å; V128-M130 VanDerWaalsContact C-N 3.32Å; V128-M130 PolarHBondContact O-N 3.23Å; M130-T133 PolarHBondContact O-N 3.22Å; M130-L134 WeakPolarHBondContact O-CB 3.2Å; M130-L134 PolarHBondContact O-N 2.88Å
131C96.1Very high95.1Very high23 Ų2364.3 Ų64.316%0.15533%0.333CS..Hα-helixtrans-62.3-45.8176.9-66.20000111.4L96 A127 V128 V129 L134 A135L96-C131 HydrophobicContact CB-CB 3.85Å; L96-C131 HydrophobicContact CD1-CB 4.41Å; L96-C131 VanDerWaalsContact CD1-O 3.24Å; L96-C131 WeakPolarHBondContact CD1-O 3.25Å; A127-C131 PolarHBondContact O-N 2.91Å; A127-C131 PolarHBondContact O-SG 3.16Å; V128-C131 WeakPolarHBondContact O-CB 3.38Å; V128-C131 PolarHBondContact O-N 3.34Å; V128-C131 VanDerWaalsContact O-N 3.13Å; V129-C131 VanDerWaalsContact C-N 3.33Å; V129-C131 PolarHBondContact O-N 3.41Å; C131-L134 PolarHBondContact O-N 3.09Å; C131-A135 WeakPolarHBondContact O-CB 3.3Å; C131-A135 PolarHBondContact O-N 3.33Å
132W97.3Very high95.6Very high57 Ų5760 Ų6022%0.21630%0.303CS..Hα-helixtrans-64.4-45.7177-81.895.4000112S50 V53 A54 L90 V128 V129 L134 A135 F136S50-W132 PolarHBondContact OG-NE1 2.73Å; S50-W132 VanDerWaalsContact OG-NE1 3.08Å; V53-W132 HydrophobicContact CG1-CZ2 4.45Å; A54-W132 HydrophobicContact CB-CH2 4.28Å; A54-W132 HydrophobicContact CB-CZ2 4.22Å; L90-W132 HydrophobicContact CD2-CH2 4Å; L90-W132 HydrophobicContact CD2-CZ3 4Å; V128-W132 VanDerWaalsContact O-CD1 3.29Å; V128-W132 PolarHBondContact O-N 2.85Å; V129-W132 PolarHBondContact O-N 2.83Å; W132-L134 VanDerWaalsContact C-N 3.33Å; W132-L134 PolarHBondContact O-N 3.17Å; W132-A135 WeakPolarHBondContact O-CB 3.3Å; W132-A135 PolarHBondContact O-N 3.45Å; W132-F136 AromaticContact CE3-CE2 3.93Å; W132-F136 HydrophobicContact CE3-CE2 3.93Å; W132-F136 WeakPolarHBondContact O-CD2 3.43Å; W132-F136 PolarHBondContact O-N 2.9Å
133T97.7Very high96Very high80 Ų8051.8 Ų51.849%0.49128%0.275SS..Hα-helixtrans-58.6-45.7177.2-580000111.3V129 M130 A135 F136 V137V129-T133 PolarHBondContact O-N 2.95Å; V129-T133 PolarHBondContact O-OG1 3.33Å; M130-T133 PolarHBondContact O-N 3.22Å; T133-A135 PolarHBondContact O-N 3.31Å; T133-F136 PolarHBondContact O-N 3.41Å; T133-V137 WeakPolarHBondContact O-CG2 3.47Å; T133-V137 PolarHBondContact O-N 3.36Å
134L97Very high96.2Very high84 Ų8452 Ų5244%0.4429%0.286SS..Hα-helixtrans-62.7-42.9176.7-178.559.7000111.5L96 M130 C131 W132 F136 V137 V138L96-L134 HydrophobicContact CD1-CB 3.89Å; L96-L134 HydrophobicContact CD1-CD2 3.81Å; L96-L134 HydrophobicContact CD1-CG 3.9Å; L96-L134 HydrophobicContact CD2-CD2 3.92Å; M130-L134 WeakPolarHBondContact O-CB 3.2Å; M130-L134 PolarHBondContact O-N 2.88Å; C131-L134 PolarHBondContact O-N 3.09Å; W132-L134 VanDerWaalsContact C-N 3.33Å; W132-L134 PolarHBondContact O-N 3.17Å; L134-F136 VanDerWaalsContact C-N 3.33Å; L134-F136 PolarHBondContact O-N 2.92Å; L134-V137 PolarHBondContact O-N 3.45Å; L134-V138 HydrophobicContact CD1-CG2 4.07Å; L134-V138 HydrophobicContact CG-CG2 4.38Å; L134-V138 WeakPolarHBondContact O-CG2 3.21Å; L134-V138 PolarHBondContact O-N 3.26Å
135A97.8Very high96.4Very high0 Ų054.2 Ų54.20%031%0.309CS..Hα-helixtrans-60.3-40.7176.400000112.8V89 E92 L96 C131 W132 T133 G139V89-A135 HydrophobicContact CG1-CB 4.4Å; E92-A135 HydrophobicContact CB-CB 3.96Å; E92-A135 HydrophobicContact CG-CB 3.96Å; L96-A135 HydrophobicContact CD1-CB 4.3Å; C131-A135 WeakPolarHBondContact O-CB 3.3Å; C131-A135 PolarHBondContact O-N 3.33Å; W132-A135 WeakPolarHBondContact O-CB 3.3Å; W132-A135 PolarHBondContact O-N 3.45Å; T133-A135 PolarHBondContact O-N 3.31Å; A135-G139 PolarHBondContact O-N 3.13Å
136F97.8Very high96.7Very high100 Ų10058 Ų5844%0.43932%0.315SS..Hα-helixtrans-63.8-45.9173.6-85.1-70000112.1V89 W132 T133 L134 L140V89-F136 HydrophobicContact CG1-CD1 3.73Å; V89-F136 HydrophobicContact CG1-CD2 4.37Å; V89-F136 HydrophobicContact CG1-CE1 3.82Å; V89-F136 HydrophobicContact CG1-CE2 4.43Å; V89-F136 HydrophobicContact CG1-CG 4.01Å; V89-F136 HydrophobicContact CG1-CZ 4.17Å; V89-F136 HydrophobicContact CG2-CD1 4.11Å; W132-F136 AromaticContact CE3-CE2 3.93Å; W132-F136 HydrophobicContact CE3-CE2 3.93Å; W132-F136 WeakPolarHBondContact O-CD2 3.43Å; W132-F136 PolarHBondContact O-N 2.9Å; T133-F136 PolarHBondContact O-N 3.41Å; L134-F136 VanDerWaalsContact C-N 3.33Å; L134-F136 PolarHBondContact O-N 2.92Å; F136-L140 HydrophobicContact CD1-CD1 3.88Å; F136-L140 HydrophobicContact CD1-CG 4.36Å; F136-L140 WeakPolarHBondContact O-CB 3.39Å; F136-L140 VanDerWaalsContact O-CG 3.29Å; F136-L140 WeakPolarHBondContact O-CG 3.47Å; F136-L140 PolarHBondContact O-N 3.05Å
137V97.4Very high96.8Very high88 Ų8854.2 Ų54.253%0.53330%0.296SS..Hα-helixtrans-59.8-50.1178.3169.80000110.5T133 L134 T141T133-V137 WeakPolarHBondContact O-CG2 3.47Å; T133-V137 PolarHBondContact O-N 3.36Å; L134-V137 PolarHBondContact O-N 3.45Å; V137-T141 PolarHBondContact O-N 3.46Å; V137-T141 PolarHBondContact O-OG1 2.88Å
138V97.3Very high96.9Very high3 Ų354.5 Ų54.52%0.01829%0.294CS..Hα-helixtrans-62.3-57.4179.2172.70000109.9E92 L134 L140 T141 Y176 F180 C185E92-V138 HydrophobicContact CG-CB 4.17Å; E92-V138 HydrophobicContact CG-CG1 4.15Å; L134-V138 HydrophobicContact CD1-CG2 4.07Å; L134-V138 HydrophobicContact CG-CG2 4.38Å; L134-V138 WeakPolarHBondContact O-CG2 3.21Å; L134-V138 PolarHBondContact O-N 3.26Å; V138-L140 PolarHBondContact O-N 3.39Å; V138-T141 WeakPolarHBondContact O-CB 3.18Å; V138-T141 PolarHBondContact O-N 3.18Å; V138-T141 PolarHBondContact O-OG1 3.03Å; V138-Y176 PolarHBondContact O-OH 3.3Å; V138-F180 HydrophobicContact CB-CE1 4.41Å; V138-F180 HydrophobicContact CG1-CE1 4.09Å; V138-F180 HydrophobicContact CG2-CE1 4.35Å; V138-C185 HydrophobicContact CG1-CB 4.12Å; V138-C185 HydrophobicContact CG2-CB 4.46Å
139G97.4Very high96.9Very high0 Ų054.2 Ų54.20%029%0.291CS..Hα-helixtrans-68.2-27.6-172.400000115.2C85 A135C85-G139 VanDerWaalsContact CB-O 3.3Å; C85-G139 WeakPolarHBondContact CB-O 3.4Å; A135-G139 PolarHBondContact O-N 3.13Å
140L97.9Very high96.8Very high58 Ų5857.4 Ų57.430%0.30430%0.298SS..Hα-helixtrans-91.8-2.3177-60.7179.9000113.7C85 V89 F136 V138 P142 M143C85-L140 HydrophobicContact CB-CD2 3.98Å; V89-L140 HydrophobicContact CG2-CD2 4.17Å; V89-L140 HydrophobicContact CG2-CG 4.05Å; F136-L140 HydrophobicContact CD1-CD1 3.88Å; F136-L140 HydrophobicContact CD1-CG 4.36Å; F136-L140 WeakPolarHBondContact O-CB 3.39Å; F136-L140 VanDerWaalsContact O-CG 3.29Å; F136-L140 WeakPolarHBondContact O-CG 3.47Å; F136-L140 PolarHBondContact O-N 3.05Å; V138-L140 PolarHBondContact O-N 3.39Å; L140-P142 VanDerWaalsContact C-N 3.28Å; L140-M143 HydrophobicContact CD2-CG 4.34Å; L140-M143 WeakPolarHBondContact O-CA 3.29Å; L140-M143 VanDerWaalsContact O-CB 3.27Å; L140-M143 WeakPolarHBondContact O-CB 3.27Å; L140-M143 PolarHBondContact O-N 3.37Å
141T97.9Very high96.6Very high20 Ų2057.2 Ų57.212%0.12330%0.296CS..G310 helixtrans-51-39.8177.3-69.70000113.4V137 V138 M143 L144 W146 Y176 F180V137-T141 PolarHBondContact O-N 3.46Å; V137-T141 PolarHBondContact O-OG1 2.88Å; V138-T141 WeakPolarHBondContact O-CB 3.18Å; V138-T141 PolarHBondContact O-N 3.18Å; V138-T141 PolarHBondContact O-OG1 3.03Å; T141-M143 PolarHBondContact O-N 3.05Å; T141-L144 WeakPolarHBondContact O-CB 3.49Å; T141-L144 PolarHBondContact O-N 2.69Å; T141-W146 HydrophobicContact CG2-CB 4.36Å; T141-W146 HydrophobicContact CG2-CE3 3.96Å; T141-Y176 HydrophobicContact CG2-CD2 4.05Å; T141-Y176 HydrophobicContact CG2-CE2 3.82Å; T141-F180 HydrophobicContact CG2-CE1 4.45Å
142P97.9Very high96.4Very high0 Ų057 Ų570%029%0.293CS..G310 helixtrans-61.1-28.4175.2-25.336.3000114L81 L88 L140 L144 G145 W146 N147 I172 Y176L81-P142 HydrophobicContact CD1-CB 3.98Å; L88-P142 HydrophobicContact CD1-CG 4.47Å; L140-P142 VanDerWaalsContact C-N 3.28Å; P142-L144 PolarHBondContact O-N 3.24Å; P142-G145 PolarHBondContact O-N 2.79Å; P142-W146 WeakPolarHBondContact CA-O 3.32Å; P142-N147 HydrophobicContact CB-CB 4.46Å; P142-N147 PolarHBondContact O-ND2 3.3Å; P142-I172 HydrophobicContact CB-CD1 4Å; P142-I172 HydrophobicContact CG-CD1 4.01Å; P142-Y176 HydrophobicContact CG-CD1 3.9Å; P142-Y176 HydrophobicContact CG-CD2 4.36Å; P142-Y176 HydrophobicContact CG-CE1 3.56Å; P142-Y176 HydrophobicContact CG-CE2 4.03Å; P142-Y176 HydrophobicContact CG-CG 4.3Å
143M97.3Very high96.1Very high54 Ų5459.1 Ų59.127%0.26631%0.305SS..G310 helixtrans-69.7-22.4175.2-58-9357.600112.7Y78 L81 L82 C85 L140 T141 G145Y78-M143 HydrophobicContact CD1-CE 3.8Å; Y78-M143 HydrophobicContact CE1-CE 4.42Å; L81-M143 HydrophobicContact CB-CE 3.78Å; L81-M143 HydrophobicContact CD2-CE 3.18Å; L81-M143 HydrophobicContact CG-CE 3.26Å; L81-M143 HydrophobicContact CG-SD 4.32Å; L82-M143 HydrophobicContact CB-SD 4.02Å; L82-M143 HydrophobicContact CD1-SD 4.06Å; C85-M143 HydrophobicContact CB-CG 4.29Å; L140-M143 HydrophobicContact CD2-CG 4.34Å; L140-M143 WeakPolarHBondContact O-CA 3.29Å; L140-M143 VanDerWaalsContact O-CB 3.27Å; L140-M143 WeakPolarHBondContact O-CB 3.27Å; L140-M143 PolarHBondContact O-N 3.37Å; T141-M143 PolarHBondContact O-N 3.05Å; M143-G145 PolarHBondContact O-N 3Å
144L96.4Very high95.8Very high155 Ų15562.6 Ų62.681%0.81232%0.316SS*.G310 helixtrans-80.6-0.6176.4-54.8178.8000113T141 P142T141-L144 WeakPolarHBondContact O-CB 3.49Å; T141-L144 PolarHBondContact O-N 2.69Å; P142-L144 PolarHBondContact O-N 3.24Å
145G95.3Very high95.4Very high49 Ų4963 Ų6351%0.50532%0.319SS..THydrogen-bonded Turntrans121.9-5.3173.600000115.2P142 M143 N147P142-G145 PolarHBondContact O-N 2.79Å; M143-G145 PolarHBondContact O-N 3Å; G145-N147 PolarHBondContact O-N 3.44Å
146W97.4Very high94.8Very high105 Ų10566.1 Ų66.140%0.39835%0.35SS..  trans-8460.9174.7-158.6-12.4000111.6T141 P142 T175 Y176 F180T141-W146 HydrophobicContact CG2-CB 4.36Å; T141-W146 HydrophobicContact CG2-CE3 3.96Å; P142-W146 WeakPolarHBondContact CA-O 3.32Å; W146-T175 PolarHBondContact NE1-OG1 3.35Å; W146-T175 VanDerWaalsContact NE1-OG1 3.16Å; W146-Y176 HydrophobicContact CD2-CD2 4.14Å; W146-Y176 HydrophobicContact CD2-CG 4.49Å; W146-Y176 HydrophobicContact CE3-CD2 4.04Å; W146-Y176 HydrophobicContact CG-CD2 4.49Å; W146-Y176 HydrophobicContact CZ3-CD2 4.5Å; W146-F180 HydrophobicContact CH2-CB 3.89Å; W146-F180 HydrophobicContact CZ3-CB 3.91Å; W146-F180 HydrophobicContact CZ3-CD2 4.26Å; W146-F180 HydrophobicContact CZ3-CG 4.1Å
147N96.9Very high94.1Very high23 Ų2366 Ų6612%0.12336%0.358CS..BIsolated β-bridgetrans-135175.5-178.263.761.7000110.4F77 L81 P142 G145 L149 V171F77-N147 HydrophobicContact CE1-CB 4.5Å; F77-N147 HydrophobicContact CZ-CB 4.12Å; L81-N147 HydrophobicContact CD1-CB 4.27Å; L81-N147 HydrophobicContact CD2-CB 3.68Å; P142-N147 HydrophobicContact CB-CB 4.46Å; P142-N147 PolarHBondContact O-ND2 3.3Å; G145-N147 PolarHBondContact O-N 3.44Å; N147-L149 VanDerWaalsContact C-N 3.32Å; N147-L149 PolarHBondContact O-N 3.06Å; N147-L149 WeakPolarHBondContact OD1-CB 3.39Å; N147-L149 PolarHBondContact OD1-N 3.35Å; N147-V171 WeakPolarHBondContact CB-O 3.3Å
148N96.2Very high93.7Very high30 Ų3062.5 Ų62.516%0.1634%0.336CS..SBendtrans-87.48-173.6-62.2-24.5000114.4K150 H151 L152 E169 T170 V171 I172 S173N148-K150 PolarHBondContact O-N 2.9Å; N148-H151 PolarHBondContact O-N 3Å; N148-L152 HydrophobicContact CB-CD1 4.46Å; N148-L152 HydrophobicContact CB-CG 4.48Å; N148-L152 WeakPolarHBondContact O-CG 3.45Å; N148-L152 PolarHBondContact O-N 2.77Å; N148-E169 PolarHBondContact ND2-O 3.33Å; N148-T170 VanDerWaalsContact CB-O 3.25Å; N148-T170 WeakPolarHBondContact CB-O 3.45Å; N148-T170 PolarHBondContact ND2-O 3.17Å; N148-V171 PolarHBondContact N-O 3.44Å; N148-I172 VanDerWaalsContact ND2-C 3.34Å; N148-I172 PolarHBondContact ND2-O 2.9Å; N148-S173 VanDerWaalsContact OD1-CA 3.23Å; N148-S173 WeakPolarHBondContact OD1-CA 3.38Å; N148-S173 WeakPolarHBondContact OD1-CB 3.43Å
149L94.6Very high93.1Very high15 Ų1563.9 Ų63.98%0.07935%0.351CS..Hα-helixtrans-55.7-50.7-172.9-178.557.7000112.6F77 Y78 N147 H151 L152 Q153 I158 L162F77-L149 HydrophobicContact CD1-CB 4.29Å; F77-L149 HydrophobicContact CD1-CD1 3.96Å; F77-L149 HydrophobicContact CD1-CD2 4.33Å; F77-L149 HydrophobicContact CD1-CG 4.43Å; F77-L149 HydrophobicContact CD2-CD1 4.16Å; F77-L149 HydrophobicContact CE1-CB 3.65Å; F77-L149 HydrophobicContact CE1-CD1 4.19Å; F77-L149 HydrophobicContact CE1-CD2 4.28Å; F77-L149 HydrophobicContact CE1-CG 4.25Å; F77-L149 HydrophobicContact CE2-CB 4.18Å; F77-L149 HydrophobicContact CE2-CD1 4.37Å; F77-L149 HydrophobicContact CG-CD1 3.96Å; F77-L149 HydrophobicContact CZ-CB 3.6Å; F77-L149 HydrophobicContact CZ-CD1 4.39Å; Y78-L149 HydrophobicContact CE2-CD2 4.12Å; Y78-L149 WeakPolarHBondContact OH-CD2 3.37Å; N147-L149 VanDerWaalsContact C-N 3.32Å; N147-L149 PolarHBondContact O-N 3.06Å; N147-L149 WeakPolarHBondContact OD1-CB 3.39Å; N147-L149 PolarHBondContact OD1-N 3.35Å; L149-H151 VanDerWaalsContact C-N 3.31Å; L149-H151 PolarHBondContact O-N 3.37Å; L149-L152 PolarHBondContact O-N 2.88Å; L149-Q153 HydrophobicContact CD1-CG 4.32Å; L149-Q153 WeakPolarHBondContact O-CG 3.49Å; L149-Q153 PolarHBondContact O-N 2.91Å; L149-I158 HydrophobicContact CD1-CD1 4.28Å; L149-L162 HydrophobicContact CD1-CD2 3.68Å
150K92.4Very high92.4Very high153 Ų15370.5 Ų70.567%0.66539%0.394SS*.Hα-helixtrans-58.9-43.9-179.5-67.4-175.1178.9-177.90111.7N148 L152 Q153 E154N148-K150 PolarHBondContact O-N 2.9Å; K150-L152 PolarHBondContact O-N 3.06Å; K150-Q153 PolarHBondContact O-N 3.22Å; K150-E154 VanDerWaalsContact O-CG 3.32Å; K150-E154 WeakPolarHBondContact O-CG 3.36Å; K150-E154 PolarHBondContact O-N 3.05Å
151H91.8Very high91.9Very high105 Ų10571.8 Ų71.849%0.48640%0.401SS..Hα-helixtrans-64.6-39.9179.2-173.362.6000112.4N148 L149 Q153 E154 N155N148-H151 PolarHBondContact O-N 3Å; L149-H151 VanDerWaalsContact C-N 3.31Å; L149-H151 PolarHBondContact O-N 3.37Å; H151-Q153 VanDerWaalsContact C-N 3.33Å; H151-E154 PolarHBondContact O-N 3.33Å; H151-N155 PolarHBondContact CE1-ND2 3.03Å; H151-N155 PolarHBondContact NE2-ND2 3.22Å; H151-N155 WeakPolarHBondContact O-CB 3.48Å; H151-N155 VanDerWaalsContact O-CG 3.3Å; H151-N155 PolarHBondContact O-N 2.94Å
152L92.3Very high91.6Very high19 Ų1973.1 Ų73.110%0.09941%0.407CS..Hα-helixtrans-67.3-34.7176.8-69171.7000112.3F77 N148 L149 K150 G156 T157 I158 T170F77-L152 HydrophobicContact CD2-CD1 4.18Å; F77-L152 HydrophobicContact CE2-CD1 3.88Å; N148-L152 HydrophobicContact CB-CD1 4.46Å; N148-L152 HydrophobicContact CB-CG 4.48Å; N148-L152 WeakPolarHBondContact O-CG 3.45Å; N148-L152 PolarHBondContact O-N 2.77Å; L149-L152 PolarHBondContact O-N 2.88Å; K150-L152 PolarHBondContact O-N 3.06Å; L152-G156 PolarHBondContact O-N 2.93Å; L152-T157 HydrophobicContact CD2-CG2 4.15Å; L152-T157 PolarHBondContact O-N 3.09Å; L152-I158 HydrophobicContact CB-CB 4.22Å; L152-I158 HydrophobicContact CB-CG2 3.88Å; L152-I158 PolarHBondContact O-N 3.08Å; L152-T170 HydrophobicContact CD1-CG2 3.97Å; L152-T170 HydrophobicContact CD2-CG2 4.4Å
153Q91.6Very high91.4Very high101 Ų10176.5 Ų76.547%0.47243%0.425SS..Hα-helixtrans-69.2-46.1175.2-71.5175.6-45.300111.5L149 K150 H151 N155 G156 I158L149-Q153 HydrophobicContact CD1-CG 4.32Å; L149-Q153 WeakPolarHBondContact O-CG 3.49Å; L149-Q153 PolarHBondContact O-N 2.91Å; K150-Q153 PolarHBondContact O-N 3.22Å; H151-Q153 VanDerWaalsContact C-N 3.33Å; Q153-N155 VanDerWaalsContact C-N 3.33Å; Q153-N155 PolarHBondContact O-N 3.3Å; Q153-G156 PolarHBondContact O-N 3.3Å; Q153-G156 VanDerWaalsContact O-N 3.09Å; Q153-I158 HydrophobicContact CB-CG2 4.27Å; Q153-I158 HydrophobicContact CG-CG2 3.49Å; Q153-I158 VanDerWaalsContact CG-CG2 3.49Å
154E91.2Very high91.2Very high152 Ų15274.7 Ų74.771%0.7142%0.417SS*.Hα-helixtrans-62.5-38.6178.9-73.4167.3-175.500112.5K150 H151 G156K150-E154 VanDerWaalsContact O-CG 3.32Å; K150-E154 WeakPolarHBondContact O-CG 3.36Å; K150-E154 PolarHBondContact O-N 3.05Å; H151-E154 PolarHBondContact O-N 3.33Å; E154-G156 PolarHBondContact O-N 2.86Å
155N88.9Confident91Very high94 Ų9470 Ų7050%0.50340%0.395SS..THydrogen-bonded Turntrans-79.50.4177-66.8-10.6000113.6H151 Q153 T157H151-N155 PolarHBondContact CE1-ND2 3.03Å; H151-N155 PolarHBondContact NE2-ND2 3.22Å; H151-N155 WeakPolarHBondContact O-CB 3.48Å; H151-N155 VanDerWaalsContact O-CG 3.3Å; H151-N155 PolarHBondContact O-N 2.94Å; Q153-N155 VanDerWaalsContact C-N 3.33Å; Q153-N155 PolarHBondContact O-N 3.3Å; N155-T157 PolarHBondContact O-N 2.8Å
156G84.8Confident90.9Very high64 Ų6468 Ų6866%0.6637%0.373SS*.THydrogen-bonded Turntrans6518.3-178.100000114.6L152 Q153 E154L152-G156 PolarHBondContact O-N 2.93Å; Q153-G156 PolarHBondContact O-N 3.3Å; Q153-G156 VanDerWaalsContact O-N 3.09Å; E154-G156 PolarHBondContact O-N 2.86Å
157T84.2Confident90.7Very high99 Ų9967.2 Ų67.261%0.60737%0.37SS*.  trans-80.5-22.8-178.4-510000112.2L152 N155L152-T157 HydrophobicContact CD2-CG2 4.15Å; L152-T157 PolarHBondContact O-N 3.09Å; N155-T157 PolarHBondContact O-N 2.8Å
158I87.7Confident90.5Very high13 Ų1368.6 Ų68.67%0.06738%0.375CS..SBendtrans-119.2131.8177.7-159.6168000110.4F77 L149 L152 Q153 L162 V164F77-I158 HydrophobicContact CB-CD1 4.08Å; F77-I158 HydrophobicContact CD2-CD1 4.28Å; F77-I158 HydrophobicContact CG-CD1 4.5Å; L149-I158 HydrophobicContact CD1-CD1 4.28Å; L152-I158 HydrophobicContact CB-CB 4.22Å; L152-I158 HydrophobicContact CB-CG2 3.88Å; L152-I158 PolarHBondContact O-N 3.08Å; Q153-I158 HydrophobicContact CB-CG2 4.27Å; Q153-I158 HydrophobicContact CG-CG2 3.49Å; Q153-I158 VanDerWaalsContact CG-CG2 3.49Å; I158-L162 HydrophobicContact CD1-CB 4.45Å; I158-L162 HydrophobicContact CD1-CD2 4.12Å; I158-V164 HydrophobicContact CD1-CB 4.34Å
159G84.9Confident90.3Very high32 Ų3270.7 Ų70.733%0.3338%0.383SS..  trans-80.5-178.517700000113.4D161 L162G159-D161 WeakPolarHBondContact CA-OD1 3.46Å; G159-D161 PolarHBondContact O-N 3.49Å; G159-L162 PolarHBondContact O-N 3.35Å
160P83.7Confident90.2Very high140 Ų14071.7 Ų71.791%0.90939%0.39SS*.THydrogen-bonded Turntrans-65.4-17.6175.628.1-34.6000113.4L162P160-L162 VanDerWaalsContact C-N 3.31Å
161D86.7Confident90.4Very high85 Ų8564.4 Ų64.446%0.45536%0.359SS..THydrogen-bonded Turntrans-78.3-9.9176.859-15.4000113.9Y76 G159 I163Y76-D161 WeakPolarHBondContact CE1-O 3.48Å; G159-D161 WeakPolarHBondContact CA-OD1 3.46Å; G159-D161 PolarHBondContact O-N 3.49Å; D161-I163 HydrophobicContact CB-CD1 4.22Å; D161-I163 HydrophobicContact CB-CG1 4.09Å; D161-I163 PolarHBondContact O-N 3.04Å; D161-I163 VanDerWaalsContact O-N 3.17Å; D161-I163 WeakPolarHBondContact OD2-CD1 3.41Å
162L92Very high90.6Very high48 Ų4859.4 Ų59.425%0.25134%0.336SS..  trans57.825.3177.8-65.4165.5000114Y76 F77 L149 I158 G159 P160Y76-L162 WeakPolarHBondContact CA-O 3.32Å; F77-L162 PolarHBondContact N-O 2.97Å; L149-L162 HydrophobicContact CD1-CD2 3.68Å; I158-L162 HydrophobicContact CD1-CB 4.45Å; I158-L162 HydrophobicContact CD1-CD2 4.12Å; G159-L162 PolarHBondContact O-N 3.35Å; P160-L162 VanDerWaalsContact C-N 3.31Å
163I93.1Very high90.9Very high70 Ų7059.3 Ų59.336%0.35934%0.336SS..EExtended strand (participates in β ladder)trans-83133.1178-59.5-179.3000109.3E74 Y76 D161E74-I163 HydrophobicContact CB-CG2 4.3Å; Y76-I163 HydrophobicContact CE1-CG1 4.4Å; D161-I163 HydrophobicContact CB-CD1 4.22Å; D161-I163 HydrophobicContact CB-CG1 4.09Å; D161-I163 PolarHBondContact O-N 3.04Å; D161-I163 VanDerWaalsContact O-N 3.17Å; D161-I163 WeakPolarHBondContact OD2-CD1 3.41Å
164V93.5Very high91Very high17 Ų1755.5 Ų55.510%0.10332%0.319CS..EExtended strand (participates in β ladder)trans-142.1146.1179.973.90000111.3E74 T75 F77 I158 C166 T170 V171E74-V164 WeakPolarHBondContact CA-O 3.43Å; T75-V164 PolarHBondContact N-O 3.41Å; T75-V164 PolarHBondContact O-N 3.25Å; F77-V164 HydrophobicContact CB-CG1 4.37Å; F77-V164 HydrophobicContact CD2-CG1 4.41Å; I158-V164 HydrophobicContact CD1-CB 4.34Å; V164-C166 PolarHBondContact O-N 2.84Å; V164-C166 VanDerWaalsContact O-N 3.13Å; V164-T170 HydrophobicContact CG2-CG2 3.45Å; V164-T170 VanDerWaalsContact CG2-CG2 3.45Å; V164-V171 HydrophobicContact CG1-CG1 4.33Å
165T92.1Very high91.3Very high57 Ų5750.7 Ų50.735%0.3530%0.3SS..EExtended strand (participates in β ladder)trans-64.8109164.2-49.60000108.7G72 R167G72-T165 VanDerWaalsContact O-CG2 3.25Å; G72-T165 WeakPolarHBondContact O-CG2 3.47Å; T165-R167 HydrophobicContact CG2-CG 4.45Å; T165-R167 PolarHBondContact O-N 3.23Å
166C93Very high91.8Very high6 Ų646.2 Ų46.24%0.04128%0.276CS..  trans-69.6103.4-172-177.20000111.4G72 L73 C80 V164G72-C166 WeakPolarHBondContact CA-O 3.2Å; L73-C166 WeakPolarHBondContact O-CB 3.28Å; L73-C166 PolarHBondContact O-N 3.2Å; C80-C166 HydrophobicContact CB-CB 3.74Å; C80-C166 WeakPolarHBondContact CB-SG 3.28Å; C80-C166 WeakPolarHBondContact SG-CA 3.32Å; C80-C166 WeakPolarHBondContact SG-CB 3.49Å; C80-C166 CovalentContact SG-SG 2.03Å; C80-C166 PolarHBondContact SG-SG 3.38Å; V164-C166 PolarHBondContact O-N 2.84Å; V164-C166 VanDerWaalsContact O-N 3.13Å
167R92.9Very high92.4Very high89 Ų8943.5 Ų43.534%0.33625%0.246SC..  trans-131.8149171.3-56.1-175.8179.8-74.6-4.2109.1T165 E169 T170 V171T165-R167 HydrophobicContact CG2-CG 4.45Å; T165-R167 PolarHBondContact O-N 3.23Å; R167-E169 PolarHBondContact O-N 3.41Å; R167-T170 WeakPolarHBondContact O-CB 3.42Å; R167-T170 PolarHBondContact O-N 3.18Å; R167-T170 VanDerWaalsContact O-N 3.08Å; R167-V171 PolarHBondContact O-N 2.97Å
168F92.9Very high93Very high51 Ų5138.8 Ų38.822%0.22422%0.217CC..Hα-helixtrans-53.8-53.4-179-175.3-87.3000112.1V69 T84 L88 T170 V171 I172 M174 M177V69-F168 HydrophobicContact CG1-CB 4.32Å; T84-F168 HydrophobicContact CG2-CD2 3.27Å; T84-F168 HydrophobicContact CG2-CE2 3.39Å; T84-F168 HydrophobicContact CG2-CG 4.29Å; T84-F168 HydrophobicContact CG2-CZ 4.49Å; L88-F168 HydrophobicContact CD2-CE2 4.32Å; L88-F168 HydrophobicContact CD2-CZ 4.37Å; F168-T170 PolarHBondContact O-N 2.92Å; F168-V171 PolarHBondContact O-N 3.3Å; F168-I172 HydrophobicContact CD1-CB 4.39Å; F168-I172 HydrophobicContact CD2-CG1 4.33Å; F168-I172 HydrophobicContact CE1-CB 4.09Å; F168-I172 HydrophobicContact CE1-CG1 4.43Å; F168-I172 HydrophobicContact CE1-CG2 4.06Å; F168-I172 HydrophobicContact CE2-CG1 4.07Å; F168-I172 HydrophobicContact CZ-CB 4.2Å; F168-I172 HydrophobicContact CZ-CG1 4.12Å; F168-I172 HydrophobicContact CZ-CG2 4.01Å; F168-I172 WeakPolarHBondContact O-CB 3.43Å; F168-I172 PolarHBondContact O-N 3.29Å; F168-M174 HydrophobicContact CD1-CE 3.95Å; F168-M174 HydrophobicContact CE1-CE 3.92Å; F168-M177 HydrophobicContact CE1-CE 4.28Å; F168-M177 HydrophobicContact CE1-CG 3.95Å; F168-M177 HydrophobicContact CE1-SD 4.22Å; F168-M177 HydrophobicContact CZ-CE 3.75Å; F168-M177 HydrophobicContact CZ-CG 4.01Å; F168-M177 HydrophobicContact CZ-SD 3.66Å
169E92.5Very high93.5Very high74 Ų7443.7 Ų43.735%0.34624%0.236SC..Hα-helixtrans-67-21.2-178.7-48.3-169.2-163.100112.9N148 R167 M174 K263N148-E169 PolarHBondContact ND2-O 3.33Å; R167-E169 PolarHBondContact O-N 3.41Å; E169-M174 HydrophobicContact CB-CE 3.91Å; E169-M174 HydrophobicContact CG-CE 3.64Å; E169-K263 VanDerWaalsContact CD-NZ 3.29Å; E169-K263 IonicContact OE1-NZ 3.49Å; E169-K263 PolarHBondContact OE1-NZ 3.38Å; E169-K263 IonicContact OE2-NZ 2.77Å; E169-K263 PolarHBondContact OE2-NZ 2.9Å
170T92.9Very high94.1Very high37 Ų3745.4 Ų45.423%0.22723%0.234CC..Hα-helixtrans-72.7-44.6178.2-56.80000111N148 L152 V164 R167 F168N148-T170 VanDerWaalsContact CB-O 3.25Å; N148-T170 WeakPolarHBondContact CB-O 3.45Å; N148-T170 PolarHBondContact ND2-O 3.17Å; L152-T170 HydrophobicContact CD1-CG2 3.97Å; L152-T170 HydrophobicContact CD2-CG2 4.4Å; V164-T170 HydrophobicContact CG2-CG2 3.45Å; V164-T170 VanDerWaalsContact CG2-CG2 3.45Å; R167-T170 WeakPolarHBondContact O-CB 3.42Å; R167-T170 PolarHBondContact O-N 3.18Å; R167-T170 VanDerWaalsContact O-N 3.08Å; F168-T170 PolarHBondContact O-N 2.92Å
171V95.7Very high94.7Very high0 Ų039 Ų390%019%0.192CC..Hα-helixtrans-96.1-28.9-174.5-58.20000113.4F77 C80 L81 N147 N148 V164 R167 F168F77-V171 HydrophobicContact CD2-CG1 3.92Å; F77-V171 HydrophobicContact CE2-CB 4.04Å; F77-V171 HydrophobicContact CE2-CG1 3.82Å; F77-V171 HydrophobicContact CZ-CB 4.34Å; C80-V171 HydrophobicContact CB-CG1 4.04Å; L81-V171 HydrophobicContact CB-CB 4.27Å; L81-V171 HydrophobicContact CB-CG2 4.44Å; L81-V171 HydrophobicContact CD1-CB 4.07Å; L81-V171 HydrophobicContact CD1-CG2 4.07Å; N147-V171 WeakPolarHBondContact CB-O 3.3Å; N148-V171 PolarHBondContact N-O 3.44Å; V164-V171 HydrophobicContact CG1-CG1 4.33Å; R167-V171 PolarHBondContact O-N 2.97Å; F168-V171 PolarHBondContact O-N 3.3Å
172I97Very high95.2Very high0 Ų035.6 Ų35.60%017%0.173CC..BIsolated β-bridgetrans-97.8132.6-179.4-58.6-63.2000111.4L81 T84 L88 P142 N148 F168 Y176 M177L81-I172 HydrophobicContact CD1-CD1 3.45Å; L81-I172 VanDerWaalsContact CD1-CD1 3.45Å; L81-I172 HydrophobicContact CD1-CG1 4.48Å; T84-I172 HydrophobicContact CG2-CD1 3.82Å; T84-I172 HydrophobicContact CG2-CG1 3.41Å; T84-I172 VanDerWaalsContact CG2-CG1 3.41Å; L88-I172 HydrophobicContact CD1-CD1 4.27Å; P142-I172 HydrophobicContact CB-CD1 4Å; P142-I172 HydrophobicContact CG-CD1 4.01Å; N148-I172 VanDerWaalsContact ND2-C 3.34Å; N148-I172 PolarHBondContact ND2-O 2.9Å; F168-I172 HydrophobicContact CD1-CB 4.39Å; F168-I172 HydrophobicContact CD2-CG1 4.33Å; F168-I172 HydrophobicContact CE1-CB 4.09Å; F168-I172 HydrophobicContact CE1-CG1 4.43Å; F168-I172 HydrophobicContact CE1-CG2 4.06Å; F168-I172 HydrophobicContact CE2-CG1 4.07Å; F168-I172 HydrophobicContact CZ-CB 4.2Å; F168-I172 HydrophobicContact CZ-CG1 4.12Å; F168-I172 HydrophobicContact CZ-CG2 4.01Å; F168-I172 WeakPolarHBondContact O-CB 3.43Å; F168-I172 PolarHBondContact O-N 3.29Å; I172-Y176 HydrophobicContact CG2-CD1 3.91Å; I172-Y176 HydrophobicContact CG2-CE1 4.36Å; I172-M177 HydrophobicContact CG2-CG 3.42Å; I172-M177 VanDerWaalsContact CG2-CG 3.42Å; I172-M177 HydrophobicContact CG2-SD 3.88Å
173S97Very high95.4Very high16 Ų1637.4 Ų37.411%0.11218%0.179CC..  trans-74.2130.2173.9-172.50000111.9N148 T175 Y176 M177N148-S173 VanDerWaalsContact OD1-CA 3.23Å; N148-S173 WeakPolarHBondContact OD1-CA 3.38Å; N148-S173 WeakPolarHBondContact OD1-CB 3.43Å; S173-T175 PolarHBondContact O-N 3.39Å; S173-T175 PolarHBondContact OG-N 3.32Å; S173-T175 PolarHBondContact OG-OG1 3.43Å; S173-Y176 WeakPolarHBondContact O-CB 3.39Å; S173-Y176 PolarHBondContact O-N 3.31Å; S173-M177 PolarHBondContact O-N 3.47Å
174M95.3Very high95.6Very high22 Ų2236.1 Ų36.111%0.10818%0.183CC..Hα-helixtrans-65.8-27.3174.3-70.1-64133.800112.6F168 E169 M177 V178 N252 T255 L256F168-M174 HydrophobicContact CD1-CE 3.95Å; F168-M174 HydrophobicContact CE1-CE 3.92Å; E169-M174 HydrophobicContact CB-CE 3.91Å; E169-M174 HydrophobicContact CG-CE 3.64Å; M174-M177 PolarHBondContact O-N 3.03Å; M174-V178 WeakPolarHBondContact O-CB 3.41Å; M174-V178 WeakPolarHBondContact O-CG2 3.31Å; M174-V178 PolarHBondContact O-N 3.47Å; M174-N252 HydrophobicContact SD-CB 4.48Å; M174-T255 HydrophobicContact CG-CG2 3.95Å; M174-T255 HydrophobicContact SD-CG2 4.04Å; M174-L256 HydrophobicContact CB-CB 4.22Å; M174-L256 HydrophobicContact CB-CD1 4.01Å
175T97.4Very high95.7Very high51 Ų5136.1 Ų36.131%0.31318%0.184SC..Hα-helixtrans-63.2-44.1174.163.20000111.4W146 S173 Y179 L256W146-T175 PolarHBondContact NE1-OG1 3.35Å; W146-T175 VanDerWaalsContact NE1-OG1 3.16Å; S173-T175 PolarHBondContact O-N 3.39Å; S173-T175 PolarHBondContact OG-N 3.32Å; S173-T175 PolarHBondContact OG-OG1 3.43Å; T175-Y179 WeakPolarHBondContact O-CB 3.42Å; T175-Y179 VanDerWaalsContact O-CD2 3.32Å; T175-Y179 WeakPolarHBondContact O-CD2 3.37Å; T175-Y179 PolarHBondContact O-N 3.25Å; T175-L256 HydrophobicContact CG2-CD1 3.94Å
176Y97.7Very high95.7Very high0 Ų033.5 Ų33.50%017%0.168CC..Iπ-helixtrans-61.2-48.9172.4160.8-95.4000110.8L88 V138 T141 P142 W146 I172 S173 V178 F180 N181L88-Y176 HydrophobicContact CD1-CE1 3.81Å; V138-Y176 PolarHBondContact O-OH 3.3Å; T141-Y176 HydrophobicContact CG2-CD2 4.05Å; T141-Y176 HydrophobicContact CG2-CE2 3.82Å; P142-Y176 HydrophobicContact CG-CD1 3.9Å; P142-Y176 HydrophobicContact CG-CD2 4.36Å; P142-Y176 HydrophobicContact CG-CE1 3.56Å; P142-Y176 HydrophobicContact CG-CE2 4.03Å; P142-Y176 HydrophobicContact CG-CG 4.3Å; W146-Y176 HydrophobicContact CD2-CD2 4.14Å; W146-Y176 HydrophobicContact CD2-CG 4.49Å; W146-Y176 HydrophobicContact CE3-CD2 4.04Å; W146-Y176 HydrophobicContact CG-CD2 4.49Å; W146-Y176 HydrophobicContact CZ3-CD2 4.5Å; I172-Y176 HydrophobicContact CG2-CD1 3.91Å; I172-Y176 HydrophobicContact CG2-CE1 4.36Å; S173-Y176 WeakPolarHBondContact O-CB 3.39Å; S173-Y176 PolarHBondContact O-N 3.31Å; Y176-V178 VanDerWaalsContact C-N 3.34Å; Y176-V178 PolarHBondContact O-N 3Å; Y176-F180 HydrophobicContact CD2-CB 4.17Å; Y176-F180 AromaticContact CD2-CD1 3.83Å; Y176-F180 HydrophobicContact CD2-CD1 3.83Å; Y176-F180 HydrophobicContact CD2-CG 4.34Å; Y176-F180 AromaticContact CE2-CD1 3.41Å; Y176-F180 HydrophobicContact CE2-CD1 3.41Å; Y176-F180 VanDerWaalsContact CE2-CD1 3.41Å; Y176-F180 AromaticContact CE2-CE1 3.99Å; Y176-F180 HydrophobicContact CE2-CE1 3.99Å; Y176-F180 HydrophobicContact CE2-CG 4.34Å; Y176-F180 WeakPolarHBondContact O-CB 3.3Å; Y176-F180 PolarHBondContact O-N 2.93Å; Y176-F180 VanDerWaalsContact O-N 3.14Å; Y176-N181 HydrophobicContact CE1-CB 4.38Å; Y176-N181 PolarHBondContact O-N 3.45Å
177M97.3Very high95.7Very high7 Ų736.2 Ų36.23%0.03418%0.182CC..Iπ-helixtrans-62.3-37.8-176.8-76-58.6-6100113.7L88 F168 I172 S173 M174 N181 F182L88-M177 HydrophobicContact CD1-SD 4.32Å; L88-M177 HydrophobicContact CD2-CE 4.05Å; L88-M177 HydrophobicContact CD2-SD 3.91Å; F168-M177 HydrophobicContact CE1-CE 4.28Å; F168-M177 HydrophobicContact CE1-CG 3.95Å; F168-M177 HydrophobicContact CE1-SD 4.22Å; F168-M177 HydrophobicContact CZ-CE 3.75Å; F168-M177 HydrophobicContact CZ-CG 4.01Å; F168-M177 HydrophobicContact CZ-SD 3.66Å; I172-M177 HydrophobicContact CG2-CG 3.42Å; I172-M177 VanDerWaalsContact CG2-CG 3.42Å; I172-M177 HydrophobicContact CG2-SD 3.88Å; S173-M177 PolarHBondContact O-N 3.47Å; M174-M177 PolarHBondContact O-N 3.03Å; M177-N181 WeakPolarHBondContact O-CB 3.48Å; M177-N181 HydrophobicContact SD-CB 4.37Å; M177-F182 WeakPolarHBondContact O-CB 3.11Å; M177-F182 PolarHBondContact O-N 3.48Å
178V97.7Very high95.8Very high0 Ų034.8 Ų34.80%018%0.184CC..Iπ-helixtrans-86.1-54.4-177.11750000111.4M174 Y176 F182 F183 N252 L256 F257M174-V178 WeakPolarHBondContact O-CB 3.41Å; M174-V178 WeakPolarHBondContact O-CG2 3.31Å; M174-V178 PolarHBondContact O-N 3.47Å; Y176-V178 VanDerWaalsContact C-N 3.34Å; Y176-V178 PolarHBondContact O-N 3Å; V178-F182 WeakPolarHBondContact O-CB 3.48Å; V178-F183 HydrophobicContact CG1-CD2 4.23Å; V178-F183 HydrophobicContact CG1-CE2 3.75Å; V178-F183 HydrophobicContact CG1-CZ 4.06Å; V178-F183 WeakPolarHBondContact O-CG 3.49Å; V178-F183 PolarHBondContact O-N 3.14Å; V178-N252 HydrophobicContact CG2-CB 4.2Å; V178-L256 HydrophobicContact CB-CD2 3.58Å; V178-L256 HydrophobicContact CG1-CD2 3.9Å; V178-L256 HydrophobicContact CG2-CB 3.96Å; V178-L256 HydrophobicContact CG2-CD2 3.75Å; V178-F257 HydrophobicContact CG1-CE2 3.79Å; V178-F257 HydrophobicContact CG1-CZ 3.9Å
179Y97.9Very high95.7Very high116 Ų11633.1 Ų33.146%0.45518%0.179SC..Iπ-helixtrans-77.7-48.9-171.7-61.5-56.3000112.3T175 F183 G184 L256 F257T175-Y179 WeakPolarHBondContact O-CB 3.42Å; T175-Y179 VanDerWaalsContact O-CD2 3.32Å; T175-Y179 WeakPolarHBondContact O-CD2 3.37Å; T175-Y179 PolarHBondContact O-N 3.25Å; Y179-F183 HydrophobicContact CD1-CD2 4.01Å; Y179-F183 HydrophobicContact CD1-CE2 4.24Å; Y179-F183 HydrophobicContact CE1-CE2 4.47Å; Y179-G184 PolarHBondContact O-N 3.26Å; Y179-G184 VanDerWaalsContact O-N 3.1Å; Y179-L256 HydrophobicContact CD2-CD2 4.38Å; Y179-L256 HydrophobicContact CE2-CD2 3.82Å; Y179-F257 HydrophobicContact CE1-CE1 4.18Å; Y179-F257 AromaticContact CE1-CZ 3.91Å; Y179-F257 HydrophobicContact CE1-CZ 3.91Å; Y179-F257 WeakPolarHBondContact OH-CE1 3.36Å
180F97.6Very high95.6Very high67 Ų6730 Ų3029%0.29416%0.164SC..Iπ-helixtrans-84.4-55.2-175-177.3-98.3000111.4V138 T141 W146 Y176 G184 C185V138-F180 HydrophobicContact CB-CE1 4.41Å; V138-F180 HydrophobicContact CG1-CE1 4.09Å; V138-F180 HydrophobicContact CG2-CE1 4.35Å; T141-F180 HydrophobicContact CG2-CE1 4.45Å; W146-F180 HydrophobicContact CH2-CB 3.89Å; W146-F180 HydrophobicContact CZ3-CB 3.91Å; W146-F180 HydrophobicContact CZ3-CD2 4.26Å; W146-F180 HydrophobicContact CZ3-CG 4.1Å; Y176-F180 HydrophobicContact CD2-CB 4.17Å; Y176-F180 AromaticContact CD2-CD1 3.83Å; Y176-F180 HydrophobicContact CD2-CD1 3.83Å; Y176-F180 HydrophobicContact CD2-CG 4.34Å; Y176-F180 AromaticContact CE2-CD1 3.41Å; Y176-F180 HydrophobicContact CE2-CD1 3.41Å; Y176-F180 VanDerWaalsContact CE2-CD1 3.41Å; Y176-F180 AromaticContact CE2-CE1 3.99Å; Y176-F180 HydrophobicContact CE2-CE1 3.99Å; Y176-F180 HydrophobicContact CE2-CG 4.34Å; Y176-F180 WeakPolarHBondContact O-CB 3.3Å; Y176-F180 PolarHBondContact O-N 2.93Å; Y176-F180 VanDerWaalsContact O-N 3.14Å; F180-G184 CarbonylContact O-C 3.22Å; F180-G184 WeakPolarHBondContact O-CA 3.29Å; F180-G184 PolarHBondContact O-N 3.23Å; F180-C185 PolarHBondContact O-N 2.94Å; F180-C185 VanDerWaalsContact O-N 3.1Å; F180-C185 PolarHBondContact O-SG 3.29Å
181N96.8Very high95.6Very high5 Ų531.9 Ų31.93%0.02718%0.175CC..Iπ-helixtrans-70.6-58.1-177.3179.2-98.3000111.3Y176 M177 C185 V186 H249Y176-N181 HydrophobicContact CE1-CB 4.38Å; Y176-N181 PolarHBondContact O-N 3.45Å; M177-N181 WeakPolarHBondContact O-CB 3.48Å; M177-N181 HydrophobicContact SD-CB 4.37Å; N181-C185 CarbonylContact O-C 3.54Å; N181-C185 WeakPolarHBondContact O-CA 3.23Å; N181-C185 VanDerWaalsContact O-CB 3.27Å; N181-C185 WeakPolarHBondContact O-CB 3.43Å; N181-C185 PolarHBondContact O-N 3.15Å; N181-V186 WeakPolarHBondContact O-CG2 3.3Å; N181-V186 PolarHBondContact O-N 2.93Å; N181-H249 PolarHBondContact OD1-CE1 3.43Å
182F96.7Very high95.4Very high14 Ų1436.7 Ų36.76%0.06120%0.196CC..Iπ-helixtrans-70.9-62.8-176.1-179.2-138.4000113M177 V178 V186 L187 L246 H249M177-F182 WeakPolarHBondContact O-CB 3.11Å; M177-F182 PolarHBondContact O-N 3.48Å; V178-F182 WeakPolarHBondContact O-CB 3.48Å; F182-V186 HydrophobicContact CD2-CB 4.11Å; F182-V186 HydrophobicContact CD2-CG1 4.2Å; F182-V186 PolarHBondContact O-N 3.42Å; F182-L187 HydrophobicContact CD2-CB 4.47Å; F182-L187 HydrophobicContact CE2-CB 4.27Å; F182-L187 WeakPolarHBondContact O-CB 3.41Å; F182-L187 PolarHBondContact O-N 3.06Å; F182-L246 HydrophobicContact CE2-CD2 4.15Å; F182-L246 HydrophobicContact CZ-CD2 4.26Å; F182-H249 HydrophobicContact CB-CB 4.48Å; F182-H249 WeakPolarHBondContact CB-ND1 3.42Å; F182-H249 HydrophobicContact CD1-CB 3.95Å; F182-H249 HydrophobicContact CD2-CB 3.53Å; F182-H249 AromaticContact CD2-CD2 3.84Å; F182-H249 AromaticContact CD2-CG 3.35Å; F182-H249 AromaticContact CD2-ND1 3.53Å; F182-H249 HydrophobicContact CE1-CB 3.98Å; F182-H249 HydrophobicContact CE2-CB 3.6Å; F182-H249 AromaticContact CE2-CG 3.8Å; F182-H249 HydrophobicContact CG-CB 3.73Å; F182-H249 AromaticContact CG-CG 3.74Å; F182-H249 AromaticContact CG-ND1 3.61Å; F182-H249 HydrophobicContact CZ-CB 3.83Å
183F97.2Very high95.1Very high86 Ų8636.9 Ų36.938%0.37720%0.197SC..Iπ-helixtrans-71.8-31.6-176-63.1-28000113.7V178 Y179 L187 P188 F257V178-F183 HydrophobicContact CG1-CD2 4.23Å; V178-F183 HydrophobicContact CG1-CE2 3.75Å; V178-F183 HydrophobicContact CG1-CZ 4.06Å; V178-F183 WeakPolarHBondContact O-CG 3.49Å; V178-F183 PolarHBondContact O-N 3.14Å; Y179-F183 HydrophobicContact CD1-CD2 4.01Å; Y179-F183 HydrophobicContact CD1-CE2 4.24Å; Y179-F183 HydrophobicContact CE1-CE2 4.47Å; F183-L187 HydrophobicContact CD1-CD2 3.94Å; F183-P188 WeakPolarHBondContact O-CD 3.35Å; F183-P188 VanDerWaalsContact O-CG 3.24Å; F183-P188 WeakPolarHBondContact O-CG 3.36Å; F183-F257 HydrophobicContact CE2-CZ 4.38Å
184G95.9Very high94.8Very high43 Ų4340.1 Ų40.144%0.44321%0.213SC..Iπ-helixtrans-85.7-39.7-179.500000114.3Y179 F180 P188Y179-G184 PolarHBondContact O-N 3.26Å; Y179-G184 VanDerWaalsContact O-N 3.1Å; F180-G184 CarbonylContact O-C 3.22Å; F180-G184 WeakPolarHBondContact O-CA 3.29Å; F180-G184 PolarHBondContact O-N 3.23Å; G184-P188 WeakPolarHBondContact O-CG 3.31Å
185C95.2Very high94.6Very high18 Ų1842.8 Ų42.812%0.12223%0.23CC..Iπ-helixtrans-113.4-33.4-169-54.50000114V138 F180 N181 P189V138-C185 HydrophobicContact CG1-CB 4.12Å; V138-C185 HydrophobicContact CG2-CB 4.46Å; F180-C185 PolarHBondContact O-N 2.94Å; F180-C185 VanDerWaalsContact O-N 3.1Å; F180-C185 PolarHBondContact O-SG 3.29Å; N181-C185 CarbonylContact O-C 3.54Å; N181-C185 WeakPolarHBondContact O-CA 3.23Å; N181-C185 VanDerWaalsContact O-CB 3.27Å; N181-C185 WeakPolarHBondContact O-CB 3.43Å; N181-C185 PolarHBondContact O-N 3.15Å; C185-P189 WeakPolarHBondContact O-CD 3.38Å; C185-P189 WeakPolarHBondContact O-CG 3.3Å
186V92.1Very high94.1Very high1 Ų140.8 Ų40.81%0.00622%0.218CC..Iπ-helixtrans-96.6-47-175.3175.60000112.9I95 N181 F182 P189 L190I95-V186 HydrophobicContact CD1-CB 4.43Å; I95-V186 HydrophobicContact CD1-CG1 4.14Å; I95-V186 HydrophobicContact CD1-CG2 3.69Å; N181-V186 WeakPolarHBondContact O-CG2 3.3Å; N181-V186 PolarHBondContact O-N 2.93Å; F182-V186 HydrophobicContact CD2-CB 4.11Å; F182-V186 HydrophobicContact CD2-CG1 4.2Å; F182-V186 PolarHBondContact O-N 3.42Å; V186-P189 WeakPolarHBondContact O-CD 3.23Å; V186-L190 HydrophobicContact CG1-CD1 3.91Å; V186-L190 WeakPolarHBondContact O-CG 3.24Å; V186-L190 PolarHBondContact O-N 3.35Å
187L93.9Very high93.5Very high63 Ų6341.6 Ų41.633%0.3322%0.221SC..Hα-helixtrans-65.1-41.2-177.2-17563.7000112.6F182 F183 L190 V191F182-L187 HydrophobicContact CD2-CB 4.47Å; F182-L187 HydrophobicContact CE2-CB 4.27Å; F182-L187 WeakPolarHBondContact O-CB 3.41Å; F182-L187 PolarHBondContact O-N 3.06Å; F183-L187 HydrophobicContact CD1-CD2 3.94Å; L187-L190 WeakPolarHBondContact O-CB 3.26Å; L187-L190 PolarHBondContact O-N 3.41Å; L187-V191 HydrophobicContact CD1-CG2 4.2Å; L187-V191 HydrophobicContact CG-CG2 4.33Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.44Å
188P94.4Very high93Very high60 Ų6045.5 Ų45.539%0.3925%0.245SC..Hα-helixtrans-65.7-45-179.8-21.335.3000113.3F183 G184 L190 V191 F192F183-P188 WeakPolarHBondContact O-CD 3.35Å; F183-P188 VanDerWaalsContact O-CG 3.24Å; F183-P188 WeakPolarHBondContact O-CG 3.36Å; G184-P188 WeakPolarHBondContact O-CG 3.31Å; P188-L190 VanDerWaalsContact C-N 3.32Å; P188-L190 PolarHBondContact O-N 2.82Å; P188-V191 PolarHBondContact O-N 3.49Å; P188-F192 VanDerWaalsContact O-CB 3.28Å; P188-F192 WeakPolarHBondContact O-CB 3.46Å; P188-F192 PolarHBondContact O-N 3Å
189P91.4Very high92.5Very high16 Ų1649.2 Ų49.210%0.10426%0.262CS..Hα-helixtrans-56.1-41.5169.1-32.440.9000113.8I95 L99 C185 V186 F192 M193I95-P189 HydrophobicContact CG2-CB 4.25Å; L99-P189 HydrophobicContact CD2-CB 4.02Å; L99-P189 HydrophobicContact CD2-CG 4.29Å; C185-P189 WeakPolarHBondContact O-CD 3.38Å; C185-P189 WeakPolarHBondContact O-CG 3.3Å; V186-P189 WeakPolarHBondContact O-CD 3.23Å; P189-F192 PolarHBondContact O-N 2.81Å; P189-M193 VanDerWaalsContact O-CB 3.3Å; P189-M193 WeakPolarHBondContact O-CB 3.16Å; P189-M193 VanDerWaalsContact O-CG 3.25Å; P189-M193 WeakPolarHBondContact O-CG 3.3Å; P189-M193 PolarHBondContact O-N 3.21Å
190L90.6Very high91.8Very high9 Ų944 Ų445%0.04724%0.242CC..Hα-helixtrans-59.6-50176.2-85.2170.1000112.2V186 L187 P188 F192 M193 L194 F238 F241 L246V186-L190 HydrophobicContact CG1-CD1 3.91Å; V186-L190 WeakPolarHBondContact O-CG 3.24Å; V186-L190 PolarHBondContact O-N 3.35Å; L187-L190 WeakPolarHBondContact O-CB 3.26Å; L187-L190 PolarHBondContact O-N 3.41Å; P188-L190 VanDerWaalsContact C-N 3.32Å; P188-L190 PolarHBondContact O-N 2.82Å; L190-F192 VanDerWaalsContact C-N 3.34Å; L190-M193 HydrophobicContact CD2-CE 4.12Å; L190-M193 PolarHBondContact O-N 3.12Å; L190-L194 PolarHBondContact O-N 3.48Å; L190-F238 HydrophobicContact CD2-CE2 4.04Å; L190-F241 HydrophobicContact CD1-CE1 4.36Å; L190-F241 HydrophobicContact CD2-CD1 3.45Å; L190-F241 VanDerWaalsContact CD2-CD1 3.45Å; L190-F241 HydrophobicContact CD2-CE1 3.39Å; L190-F241 HydrophobicContact CG-CD1 4.39Å; L190-F241 HydrophobicContact CG-CE1 3.84Å; L190-L246 HydrophobicContact CD1-CD2 3.94Å
191V93Very high91Very high75 Ų7546.3 Ų46.346%0.45525%0.252SS..Hα-helixtrans-63.1-43.5178.1172.20000110.5L187 P188 L194 V195L187-V191 HydrophobicContact CD1-CG2 4.2Å; L187-V191 HydrophobicContact CG-CG2 4.33Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.44Å; P188-V191 PolarHBondContact O-N 3.49Å; V191-L194 WeakPolarHBondContact O-CB 3.09Å; V191-L194 PolarHBondContact O-N 3.09Å; V191-V195 WeakPolarHBondContact O-CG2 3.47Å; V191-V195 PolarHBondContact O-N 2.81Å
192F92.1Very high90.5Very high102 Ų10252.5 Ų52.545%0.44728%0.276SS..Hα-helixtrans-66.6-39.8179.9-174.8-108.8000112.4L99 I103 P188 P189 L190 V195 I196L99-F192 HydrophobicContact CD1-CD1 3.55Å; L99-F192 HydrophobicContact CD1-CE1 4.06Å; I103-F192 HydrophobicContact CD1-CE1 4.08Å; I103-F192 HydrophobicContact CG1-CE1 4.02Å; P188-F192 VanDerWaalsContact O-CB 3.28Å; P188-F192 WeakPolarHBondContact O-CB 3.46Å; P188-F192 PolarHBondContact O-N 3Å; P189-F192 PolarHBondContact O-N 2.81Å; L190-F192 VanDerWaalsContact C-N 3.34Å; F192-V195 PolarHBondContact O-N 3.31Å; F192-I196 HydrophobicContact CD1-CD1 3.74Å; F192-I196 HydrophobicContact CE1-CD1 3.36Å; F192-I196 HydrophobicContact CE1-CG1 4.29Å; F192-I196 HydrophobicContact CZ-CD1 3.85Å; F192-I196 HydrophobicContact CZ-CG1 4.38Å; F192-I196 WeakPolarHBondContact O-CG1 3.17Å; F192-I196 PolarHBondContact O-N 3.48Å
193M89.6Confident89.7Confident4 Ų453.7 Ų53.72%0.0228%0.282CS..Hα-helixtrans-59.7-45.2170.6-78.8-168.6-7000111.5L99 A102 P189 L190 V195 I196 Y197 F238 F241L99-M193 HydrophobicContact CB-CG 4.48Å; L99-M193 HydrophobicContact CB-SD 4.43Å; L99-M193 HydrophobicContact CD1-CG 3.82Å; A102-M193 HydrophobicContact CB-CG 3.92Å; A102-M193 HydrophobicContact CB-SD 4.32Å; P189-M193 VanDerWaalsContact O-CB 3.3Å; P189-M193 WeakPolarHBondContact O-CB 3.16Å; P189-M193 VanDerWaalsContact O-CG 3.25Å; P189-M193 WeakPolarHBondContact O-CG 3.3Å; P189-M193 PolarHBondContact O-N 3.21Å; L190-M193 HydrophobicContact CD2-CE 4.12Å; L190-M193 PolarHBondContact O-N 3.12Å; M193-V195 PolarHBondContact O-N 3.1Å; M193-I196 WeakPolarHBondContact O-CB 3.45Å; M193-I196 PolarHBondContact O-N 3.41Å; M193-Y197 HydrophobicContact CB-CD2 4.38Å; M193-Y197 HydrophobicContact CB-CE2 3.88Å; M193-Y197 WeakPolarHBondContact O-CD2 3.38Å; M193-Y197 PolarHBondContact O-N 3.39Å; M193-F238 HydrophobicContact CB-CD2 4.14Å; M193-F238 HydrophobicContact CB-CE2 4.32Å; M193-F241 HydrophobicContact CE-CD1 4.18Å; M193-F241 HydrophobicContact CE-CE1 4.14Å
194L90.1Very high88.7Confident83 Ų8350.1 Ų50.144%0.43527%0.267SS..Hα-helixtrans-57.6-48176.4178.164.4000111.5L190 V191 I196 Y197 V198 F238L190-L194 PolarHBondContact O-N 3.48Å; V191-L194 WeakPolarHBondContact O-CB 3.09Å; V191-L194 PolarHBondContact O-N 3.09Å; L194-I196 VanDerWaalsContact C-N 3.35Å; L194-I196 PolarHBondContact O-N 3.31Å; L194-Y197 PolarHBondContact O-N 3.1Å; L194-Y197 VanDerWaalsContact O-N 3.14Å; L194-V198 HydrophobicContact CD1-CG2 4.38Å; L194-V198 WeakPolarHBondContact O-CG2 3.44Å; L194-V198 PolarHBondContact O-N 3.39Å; L194-F238 HydrophobicContact CB-CE2 4.24Å; L194-F238 HydrophobicContact CB-CZ 3.94Å; L194-F238 HydrophobicContact CD1-CE1 3.96Å; L194-F238 HydrophobicContact CD1-CZ 4.02Å; L194-F238 HydrophobicContact CG-CZ 4.48Å
195V91.3Very high87.9Confident78 Ų7851.4 Ų51.447%0.47326%0.261SS..Hα-helixtrans-58.5-46.8176.7171.50000110.9V191 F192 M193 Y197 V198 E199V191-V195 WeakPolarHBondContact O-CG2 3.47Å; V191-V195 PolarHBondContact O-N 2.81Å; F192-V195 PolarHBondContact O-N 3.31Å; M193-V195 PolarHBondContact O-N 3.1Å; V195-Y197 VanDerWaalsContact C-N 3.29Å; V195-Y197 PolarHBondContact O-N 3.32Å; V195-V198 PolarHBondContact O-N 3.1Å; V195-E199 WeakPolarHBondContact O-CB 3.4Å; V195-E199 WeakPolarHBondContact O-CG 3.36Å; V195-E199 PolarHBondContact O-N 3.07Å
196I88.4Confident87.3Confident10 Ų1055.4 Ų55.45%0.05128%0.277CS..Hα-helixtrans-55.5-45175.3-78.7170.3000111.3I103 Y106 F192 M193 L194 E199 I200I103-I196 HydrophobicContact CG1-CD1 3.93Å; Y106-I196 HydrophobicContact CD2-CG1 4.48Å; Y106-I196 HydrophobicContact CD2-CG2 3.99Å; Y106-I196 HydrophobicContact CG-CG2 4.17Å; F192-I196 HydrophobicContact CD1-CD1 3.74Å; F192-I196 HydrophobicContact CE1-CD1 3.36Å; F192-I196 HydrophobicContact CE1-CG1 4.29Å; F192-I196 HydrophobicContact CZ-CD1 3.85Å; F192-I196 HydrophobicContact CZ-CG1 4.38Å; F192-I196 WeakPolarHBondContact O-CG1 3.17Å; F192-I196 PolarHBondContact O-N 3.48Å; M193-I196 WeakPolarHBondContact O-CB 3.45Å; M193-I196 PolarHBondContact O-N 3.41Å; L194-I196 VanDerWaalsContact C-N 3.35Å; L194-I196 PolarHBondContact O-N 3.31Å; I196-E199 WeakPolarHBondContact O-CB 3.48Å; I196-E199 PolarHBondContact O-N 2.91Å; I196-I200 HydrophobicContact CG2-CD1 3.75Å; I196-I200 HydrophobicContact CG2-CG1 4.46Å; I196-I200 VanDerWaalsContact O-CG1 3.26Å; I196-I200 WeakPolarHBondContact O-CG1 3.44Å; I196-I200 PolarHBondContact O-N 3.42Å
197Y84.1Confident86.4Confident17 Ų1759 Ų597%0.06729%0.293CS..Hα-helixtrans-71-37.3-177.5-65-46.7000112.9A102 M193 L194 V195 I200 F201 L234 F238A102-Y197 HydrophobicContact CB-CE1 4.29Å; A102-Y197 WeakPolarHBondContact CB-OH 2.91Å; M193-Y197 HydrophobicContact CB-CD2 4.38Å; M193-Y197 HydrophobicContact CB-CE2 3.88Å; M193-Y197 WeakPolarHBondContact O-CD2 3.38Å; M193-Y197 PolarHBondContact O-N 3.39Å; L194-Y197 PolarHBondContact O-N 3.1Å; L194-Y197 VanDerWaalsContact O-N 3.14Å; V195-Y197 VanDerWaalsContact C-N 3.29Å; V195-Y197 PolarHBondContact O-N 3.32Å; Y197-I200 HydrophobicContact CD1-CD1 4.2Å; Y197-I200 PolarHBondContact O-N 3.17Å; Y197-F201 WeakPolarHBondContact O-CB 3.38Å; Y197-F201 PolarHBondContact O-N 2.8Å; Y197-L234 HydrophobicContact CD1-CB 4.08Å; Y197-L234 HydrophobicContact CE1-CB 3.63Å; Y197-L234 HydrophobicContact CE1-CD1 4.41Å; Y197-L234 HydrophobicContact CE1-CG 4.49Å; Y197-F238 HydrophobicContact CD2-CB 3.8Å; Y197-F238 HydrophobicContact CD2-CD1 4.47Å; Y197-F238 HydrophobicContact CD2-CD2 4.03Å; Y197-F238 AromaticContact CD2-CG 3.82Å; Y197-F238 HydrophobicContact CD2-CG 3.82Å; Y197-F238 HydrophobicContact CE2-CB 3.43Å; Y197-F238 VanDerWaalsContact CE2-CB 3.43Å; Y197-F238 AromaticContact CE2-CD2 3.81Å; Y197-F238 HydrophobicContact CE2-CD2 3.81Å; Y197-F238 AromaticContact CE2-CG 3.77Å; Y197-F238 HydrophobicContact CE2-CG 3.77Å
198V87.3Confident85.3Confident89 Ų8957.7 Ų57.754%0.53929%0.287SS..Hα-helixtrans-61.1-46171.9172.40000110.3L194 V195 I200 F201 Y202L194-V198 HydrophobicContact CD1-CG2 4.38Å; L194-V198 WeakPolarHBondContact O-CG2 3.44Å; L194-V198 PolarHBondContact O-N 3.39Å; V195-V198 PolarHBondContact O-N 3.1Å; V198-I200 PolarHBondContact O-N 2.97Å; V198-F201 PolarHBondContact O-N 3.38Å; V198-Y202 WeakPolarHBondContact O-CB 3.41Å; V198-Y202 PolarHBondContact O-N 3.44Å
199E87.2Confident84.3Confident78 Ų7859.5 Ų59.536%0.36429%0.293SS..Hα-helixtrans-60.4-42.6176.1-79.5-73.3146.200112.7Y106 V195 I196 M203Y106-E199 HydrophobicContact CE2-CB 4.02Å; V195-E199 WeakPolarHBondContact O-CB 3.4Å; V195-E199 WeakPolarHBondContact O-CG 3.36Å; V195-E199 PolarHBondContact O-N 3.07Å; I196-E199 WeakPolarHBondContact O-CB 3.48Å; I196-E199 PolarHBondContact O-N 2.91Å; E199-M203 VanDerWaalsContact O-CB 3.29Å; E199-M203 WeakPolarHBondContact O-CB 3.45Å; E199-M203 PolarHBondContact O-N 3.05Å
200I82.6Confident83.3Confident6 Ų663.2 Ų63.23%0.03131%0.312CS..Hα-helixtrans-61.7-47.4175.8-72.2167.3000110.2Y106 I196 Y197 V198 M203 I204 A231 L234Y106-I200 HydrophobicContact CD2-CD1 4.38Å; Y106-I200 HydrophobicContact CD2-CG1 3.98Å; I196-I200 HydrophobicContact CG2-CD1 3.75Å; I196-I200 HydrophobicContact CG2-CG1 4.46Å; I196-I200 VanDerWaalsContact O-CG1 3.26Å; I196-I200 WeakPolarHBondContact O-CG1 3.44Å; I196-I200 PolarHBondContact O-N 3.42Å; Y197-I200 HydrophobicContact CD1-CD1 4.2Å; Y197-I200 PolarHBondContact O-N 3.17Å; V198-I200 PolarHBondContact O-N 2.97Å; I200-M203 PolarHBondContact O-N 3.45Å; I200-I204 HydrophobicContact CG2-CD1 3.81Å; I200-I204 VanDerWaalsContact O-CG1 3.3Å; I200-I204 WeakPolarHBondContact O-CG1 3.35Å; I200-I204 PolarHBondContact O-N 3.19Å; I200-A231 HydrophobicContact CG2-CB 4.24Å; I200-L234 HydrophobicContact CD1-CD1 4.39Å
201F81.9Confident82.1Confident115 Ų11568.1 Ų68.150%0.50433%0.333SS..Hα-helixtrans-63.2-46.1-179.6-171.9-98.8000111.3Y197 V198 M203 I204 H205Y197-F201 WeakPolarHBondContact O-CB 3.38Å; Y197-F201 PolarHBondContact O-N 2.8Å; V198-F201 PolarHBondContact O-N 3.38Å; F201-M203 PolarHBondContact O-N 3.48Å; F201-I204 PolarHBondContact O-N 3.07Å; F201-H205 AromaticContact CD1-CD2 3.72Å; F201-H205 AromaticContact CE1-CD2 3.38Å; F201-H205 WeakPolarHBondContact CE1-CD2 3.23Å; F201-H205 AromaticContact CE1-NE2 3.43Å; F201-H205 WeakPolarHBondContact CE1-NE2 3.34Å; F201-H205 AromaticContact CE2-CD2 3.75Å; F201-H205 AromaticContact CE2-NE2 3.4Å; F201-H205 WeakPolarHBondContact CE2-NE2 3.41Å; F201-H205 AromaticContact CZ-CD2 3.42Å; F201-H205 VanDerWaalsContact CZ-CD2 3.42Å; F201-H205 WeakPolarHBondContact CZ-CD2 3.33Å; F201-H205 AromaticContact CZ-CE1 3.94Å; F201-H205 AromaticContact CZ-NE2 2.98Å; F201-H205 WeakPolarHBondContact CZ-NE2 3.49Å; F201-H205 PolarHBondContact O-CD2 2.84Å; F201-H205 PolarHBondContact O-N 3.35Å
202Y85.1Confident80.4Confident135 Ų13573 Ų7353%0.52935%0.348SS..Hα-helixtrans-58.3-46.5175.2177.1-98.3000111.9V198 I204 H205 K206V198-Y202 WeakPolarHBondContact O-CB 3.41Å; V198-Y202 PolarHBondContact O-N 3.44Å; Y202-I204 PolarHBondContact O-N 2.9Å; Y202-H205 PolarHBondContact O-N 2.68Å; Y202-K206 HydrophobicContact CE1-CD 4.08Å; Y202-K206 WeakPolarHBondContact O-CB 3.33Å; Y202-K206 PolarHBondContact O-N 2.96Å
203M81Confident78.8Confident39 Ų3974.8 Ų74.819%0.19236%0.361CS..Hα-helixtrans-59.2-45177.9-17765.165.200111.9K110 E199 I200 F201 K206 Q207K110-M203 HydrophobicContact CD-CE 3.79Å; E199-M203 VanDerWaalsContact O-CB 3.29Å; E199-M203 WeakPolarHBondContact O-CB 3.45Å; E199-M203 PolarHBondContact O-N 3.05Å; I200-M203 PolarHBondContact O-N 3.45Å; F201-M203 PolarHBondContact O-N 3.48Å; M203-K206 PolarHBondContact O-N 2.88Å; M203-Q207 VanDerWaalsContact O-CG 3.32Å; M203-Q207 WeakPolarHBondContact O-CG 3.27Å; M203-Q207 PolarHBondContact O-N 2.9Å
204I76.5Confident77.4Confident12 Ų1280 Ų806%0.06239%0.393CS..Hα-helixtrans-61.9-47178.4-70167.9000110.2I200 F201 Y202 K206 Q207 L208 Y224 A231I200-I204 HydrophobicContact CG2-CD1 3.81Å; I200-I204 VanDerWaalsContact O-CG1 3.3Å; I200-I204 WeakPolarHBondContact O-CG1 3.35Å; I200-I204 PolarHBondContact O-N 3.19Å; F201-I204 PolarHBondContact O-N 3.07Å; Y202-I204 PolarHBondContact O-N 2.9Å; I204-K206 PolarHBondContact O-N 3.47Å; I204-Q207 PolarHBondContact O-N 3.49Å; I204-L208 WeakPolarHBondContact O-CG 3.37Å; I204-L208 PolarHBondContact O-N 3.31Å; I204-L208 VanDerWaalsContact O-N 3.12Å; I204-Y224 HydrophobicContact CG2-CD2 4.33Å; I204-Y224 HydrophobicContact CG2-CE2 3.88Å; I204-A231 HydrophobicContact CD1-CB 3.54Å
205H78.8Confident75.7Confident69 Ų6979.4 Ų79.432%0.31940%0.396SS..Hα-helixtrans-65.2-38.5178.6-87-90.5000113.2F201 Y202 L208 N209F201-H205 AromaticContact CD1-CD2 3.72Å; F201-H205 AromaticContact CE1-CD2 3.38Å; F201-H205 WeakPolarHBondContact CE1-CD2 3.23Å; F201-H205 AromaticContact CE1-NE2 3.43Å; F201-H205 WeakPolarHBondContact CE1-NE2 3.34Å; F201-H205 AromaticContact CE2-CD2 3.75Å; F201-H205 AromaticContact CE2-NE2 3.4Å; F201-H205 WeakPolarHBondContact CE2-NE2 3.41Å; F201-H205 AromaticContact CZ-CD2 3.42Å; F201-H205 VanDerWaalsContact CZ-CD2 3.42Å; F201-H205 WeakPolarHBondContact CZ-CD2 3.33Å; F201-H205 AromaticContact CZ-CE1 3.94Å; F201-H205 AromaticContact CZ-NE2 2.98Å; F201-H205 WeakPolarHBondContact CZ-NE2 3.49Å; F201-H205 PolarHBondContact O-CD2 2.84Å; F201-H205 PolarHBondContact O-N 3.35Å; Y202-H205 PolarHBondContact O-N 2.68Å; H205-L208 WeakPolarHBondContact O-CB 3.43Å; H205-L208 PolarHBondContact O-N 3.03Å; H205-N209 PolarHBondContact O-N 3.43Å; H205-N209 VanDerWaalsContact O-N 3.12Å
206K80.9Confident73.8Confident102 Ų10281 Ų8144%0.44341%0.41SS..Hα-helixtrans-64.1-41.7175.1-174.5172.8-177.61710111.9Y202 M203 I204 L208 N209 N210Y202-K206 HydrophobicContact CE1-CD 4.08Å; Y202-K206 WeakPolarHBondContact O-CB 3.33Å; Y202-K206 PolarHBondContact O-N 2.96Å; M203-K206 PolarHBondContact O-N 2.88Å; I204-K206 PolarHBondContact O-N 3.47Å; K206-L208 VanDerWaalsContact C-N 3.27Å; K206-L208 PolarHBondContact O-N 2.95Å; K206-N209 PolarHBondContact O-N 3.45Å; K206-N210 PolarHBondContact O-N 3Å; K206-N210 VanDerWaalsContact O-N 3.09Å
207Q73.7Confident72.2Confident77 Ų7789.9 Ų89.936%0.3645%0.449SS..Hα-helixtrans-63.7-32.1175.8-72.1-179.314.300112.5M203 I204 K211M203-Q207 VanDerWaalsContact O-CG 3.32Å; M203-Q207 WeakPolarHBondContact O-CG 3.27Å; M203-Q207 PolarHBondContact O-N 2.9Å; I204-Q207 PolarHBondContact O-N 3.49Å; Q207-K211 WeakPolarHBondContact O-CB 3.48Å; Q207-K211 WeakPolarHBondContact O-CG 3.32Å; Q207-K211 PolarHBondContact O-N 3.26Å; Q207-K211 VanDerWaalsContact O-N 3.11Å
208L70.4Confident71Confident36 Ų3693.1 Ų93.119%0.18847%0.474CS..Hα-helixtrans-64.9-49.7172.7-70.8172.3000112.3I204 H205 K206 N210 K211 K212 Y224I204-L208 WeakPolarHBondContact O-CG 3.37Å; I204-L208 PolarHBondContact O-N 3.31Å; I204-L208 VanDerWaalsContact O-N 3.12Å; H205-L208 WeakPolarHBondContact O-CB 3.43Å; H205-L208 PolarHBondContact O-N 3.03Å; K206-L208 VanDerWaalsContact C-N 3.27Å; K206-L208 PolarHBondContact O-N 2.95Å; L208-N210 VanDerWaalsContact C-N 3.31Å; L208-N210 PolarHBondContact O-N 2.93Å; L208-K211 PolarHBondContact O-N 2.93Å; L208-K212 WeakPolarHBondContact O-CG 3.23Å; L208-K212 PolarHBondContact O-N 3.43Å; L208-Y224 HydrophobicContact CD1-CD2 4.07Å; L208-Y224 HydrophobicContact CD1-CE1 4.4Å; L208-Y224 HydrophobicContact CD1-CE2 3.24Å; L208-Y224 WeakPolarHBondContact CD1-OH 3.33Å; L208-Y224 HydrophobicContact CD2-CD1 4.05Å; L208-Y224 HydrophobicContact CD2-CD2 3.17Å; L208-Y224 HydrophobicContact CD2-CE1 4.13Å; L208-Y224 HydrophobicContact CD2-CE2 3.31Å; L208-Y224 HydrophobicContact CD2-CG 3.53Å; L208-Y224 HydrophobicContact CG-CD2 3.82Å; L208-Y224 HydrophobicContact CG-CE2 3.51Å
209N73.3Confident69.6Low97 Ų9794.2 Ų94.252%0.51948%0.477SS..Hα-helixtrans-63.7-39.8-176.4-76.42.1000111H205 K206 I213H205-N209 PolarHBondContact O-N 3.43Å; H205-N209 VanDerWaalsContact O-N 3.12Å; K206-N209 PolarHBondContact O-N 3.45Å; N209-I213 WeakPolarHBondContact O-CD1 3.48Å; N209-I213 WeakPolarHBondContact O-CG1 3.26Å
210N71.1Confident68.2Low94 Ų9493.4 Ų93.450%0.50348%0.478SS..Hα-helixtrans-71.4-34.6177.7-70.57.6000113.1K206 L208 I213 T214K206-N210 PolarHBondContact O-N 3Å; K206-N210 VanDerWaalsContact O-N 3.09Å; L208-N210 VanDerWaalsContact C-N 3.31Å; L208-N210 PolarHBondContact O-N 2.93Å; N210-I213 PolarHBondContact O-N 3.35Å; N210-T214 PolarHBondContact O-OG1 3.27Å
211K64.7Low67.3Low113 Ų11398 Ų9849%0.49150%0.503SS..Hα-helixtrans-76.7-29.6178.5-78.9-176.4174.7-175.90113.7Q207 L208 I213 T214Q207-K211 WeakPolarHBondContact O-CB 3.48Å; Q207-K211 WeakPolarHBondContact O-CG 3.32Å; Q207-K211 PolarHBondContact O-N 3.26Å; Q207-K211 VanDerWaalsContact O-N 3.11Å; L208-K211 PolarHBondContact O-N 2.93Å; K211-I213 PolarHBondContact O-N 3.33Å; K211-T214 PolarHBondContact O-N 3.48Å
212K58.9Low66.5Low176 Ų176100.1 Ų100.177%0.76551%0.512SS*.Hα-helixtrans-58.9-26.2169.9-80.3-177.4177.5-176.80112.7L208L208-K212 WeakPolarHBondContact O-CG 3.23Å; L208-K212 PolarHBondContact O-N 3.43Å
213I58.9Low65.6Low141 Ų141100 Ų10072%0.72351%0.511SS*.Hα-helixtrans-84.2-20.5-178.9-63.9167000112.4N209 N210 K211N209-I213 WeakPolarHBondContact O-CD1 3.48Å; N209-I213 WeakPolarHBondContact O-CG1 3.26Å; N210-I213 PolarHBondContact O-N 3.35Å; K211-I213 PolarHBondContact O-N 3.33Å
214T60.2Low64.9Low113 Ų113100.6 Ų100.669%0.69351%0.512SS*.Hα-helixtrans-119.8-9.8-161.3-330000117.2N210 K211N210-T214 PolarHBondContact O-OG1 3.27Å; K211-T214 PolarHBondContact O-N 3.48Å
215S54Low64.5Low71 Ų71103.9 Ų103.950%0.49753%0.53SS..  trans-158.6129-178.563.10000117.9
216S50.7Low64.1Low111 Ų111107.6 Ų107.678%0.77655%0.545SS*.SBendtrans-95.214.4174.4-175.30000114.6
217F54.1Low63.6Low197 Ų197105 Ų10586%0.86453%0.534SS*.SBendtrans-136.412.4-162.7-95.1-86.3000119.7
218S58.8Low63.5Low85 Ų85102.4 Ų102.459%0.59452%0.523SS*.SBendtrans-156.3127.7170.5600000110.9P220S218-P220 WeakPolarHBondContact O-CD 3.4Å; S218-P220 WeakPolarHBondContact O-CG 3.24Å
219D58.6Low63.6Low111 Ų111104.6 Ų104.659%0.59454%0.535SS*.  trans-44.286.5-174.4-171.30.5000113.4N221 K222D219-N221 PolarHBondContact O-N 2.65Å; D219-K222 PolarHBondContact O-N 3.42Å
220P57.8Low63.3Low61 Ų61102.7 Ų102.740%0.39652%0.524SS..Hα-helixtrans-74.5-22.8-170.9-5.522.1000110.3S218 K222 Y224S218-P220 WeakPolarHBondContact O-CD 3.4Å; S218-P220 WeakPolarHBondContact O-CG 3.24Å; P220-K222 VanDerWaalsContact C-N 3.34Å; P220-K222 PolarHBondContact O-N 3.45Å; P220-Y224 VanDerWaalsContact O-CB 3.26Å; P220-Y224 WeakPolarHBondContact O-CB 3.21Å; P220-Y224 PolarHBondContact O-N 3.23Å; P220-Y224 VanDerWaalsContact O-N 3.08Å
221N64Low63.3Low102 Ų10298.7 Ų98.755%0.54550%0.504SS..Hα-helixtrans-66.5-34.8-177.5-73.3-20.2000111.3D219 N225D219-N221 PolarHBondContact O-N 2.65Å; N221-N225 WeakPolarHBondContact O-CB 3.4Å; N221-N225 PolarHBondContact O-N 3.02Å; N221-N225 PolarHBondContact O-ND2 3.37Å
222K66Low63.8Low161 Ų16199 Ų9970%0.751%0.506SS*.Hα-helixtrans-71-42.3-178.6-165.5174.4-175.9175.50113.4D219 P220 K226D219-K222 PolarHBondContact O-N 3.42Å; P220-K222 VanDerWaalsContact C-N 3.34Å; P220-K222 PolarHBondContact O-N 3.45Å; K222-K226 PolarHBondContact O-N 3.22Å
223Y65Low64.5Low131 Ų13191.7 Ų91.751%0.51448%0.476SS..Hα-helixtrans-67.1-45.2173.4177.2-92.3000110.7K226 E227Y223-K226 WeakPolarHBondContact O-CB 3.47Å; Y223-K226 PolarHBondContact O-N 3.02Å; Y223-K226 VanDerWaalsContact O-N 3.17Å; Y223-E227 HydrophobicContact CD1-CG 4.22Å; Y223-E227 HydrophobicContact CE1-CG 3.71Å; Y223-E227 HydrophobicContact CE2-CG 4.41Å; Y223-E227 PolarHBondContact O-N 3.15Å; Y223-E227 VanDerWaalsContact O-N 3.09Å
224Y66.4Low65.1Low53 Ų5385.6 Ų85.621%0.20845%0.445CS..Hα-helixtrans-59.9-50.1178.2167.2-115.7000113.1I204 L208 P220 K226 E227 L228I204-Y224 HydrophobicContact CG2-CD2 4.33Å; I204-Y224 HydrophobicContact CG2-CE2 3.88Å; L208-Y224 HydrophobicContact CD1-CD2 4.07Å; L208-Y224 HydrophobicContact CD1-CE1 4.4Å; L208-Y224 HydrophobicContact CD1-CE2 3.24Å; L208-Y224 WeakPolarHBondContact CD1-OH 3.33Å; L208-Y224 HydrophobicContact CD2-CD1 4.05Å; L208-Y224 HydrophobicContact CD2-CD2 3.17Å; L208-Y224 HydrophobicContact CD2-CE1 4.13Å; L208-Y224 HydrophobicContact CD2-CE2 3.31Å; L208-Y224 HydrophobicContact CD2-CG 3.53Å; L208-Y224 HydrophobicContact CG-CD2 3.82Å; L208-Y224 HydrophobicContact CG-CE2 3.51Å; P220-Y224 VanDerWaalsContact O-CB 3.26Å; P220-Y224 WeakPolarHBondContact O-CB 3.21Å; P220-Y224 PolarHBondContact O-N 3.23Å; P220-Y224 VanDerWaalsContact O-N 3.08Å; Y224-K226 PolarHBondContact O-N 3.45Å; Y224-K226 VanDerWaalsContact O-N 3.15Å; Y224-E227 PolarHBondContact O-N 2.92Å; Y224-E227 VanDerWaalsContact O-N 3.09Å; Y224-L228 HydrophobicContact CD2-CB 4.42Å; Y224-L228 HydrophobicContact CE1-CD1 4.06Å; Y224-L228 HydrophobicContact CE2-CB 4.03Å; Y224-L228 HydrophobicContact CE2-CD1 3.65Å; Y224-L228 HydrophobicContact CE2-CG 4.48Å; Y224-L228 WeakPolarHBondContact O-CB 3.49Å; Y224-L228 PolarHBondContact O-N 3.4Å; Y224-L228 WeakPolarHBondContact OH-CD1 3.39Å
225N68.6Low66Low80 Ų8083.3 Ų83.343%0.42843%0.431SS..Hα-helixtrans-58.8-31.3178.8-76.8-31.9000111.1N221 N229N221-N225 WeakPolarHBondContact O-CB 3.4Å; N221-N225 PolarHBondContact O-N 3.02Å; N221-N225 PolarHBondContact O-ND2 3.37Å; N225-N229 WeakPolarHBondContact O-CB 3.38Å; N225-N229 PolarHBondContact O-N 2.89Å; N225-N229 PolarHBondContact O-ND2 3.3Å
226K70.4Confident67.3Low148 Ų14883.2 Ų83.264%0.64343%0.425SS*.Hα-helixtrans-69.4-47.3175.3-168.3179.2176.3-175.30112K222 Y223 Y224 N229 L230K222-K226 PolarHBondContact O-N 3.22Å; Y223-K226 WeakPolarHBondContact O-CB 3.47Å; Y223-K226 PolarHBondContact O-N 3.02Å; Y223-K226 VanDerWaalsContact O-N 3.17Å; Y224-K226 PolarHBondContact O-N 3.45Å; Y224-K226 VanDerWaalsContact O-N 3.15Å; K226-N229 PolarHBondContact O-N 3.43Å; K226-L230 PolarHBondContact O-N 2.87Å
227E69.3Low68.7Low46 Ų4679.2 Ų79.222%0.21540%0.396CS..Hα-helixtrans-67.2-39.7178.3-66.8-55.7133.800112.3Y223 Y224 L230 A231Y223-E227 HydrophobicContact CD1-CG 4.22Å; Y223-E227 HydrophobicContact CE1-CG 3.71Å; Y223-E227 HydrophobicContact CE2-CG 4.41Å; Y223-E227 PolarHBondContact O-N 3.15Å; Y223-E227 VanDerWaalsContact O-N 3.09Å; Y224-E227 PolarHBondContact O-N 2.92Å; Y224-E227 VanDerWaalsContact O-N 3.09Å; E227-L230 VanDerWaalsContact O-CB 3.31Å; E227-L230 WeakPolarHBondContact O-CB 3.3Å; E227-L230 PolarHBondContact O-N 3.42Å; E227-A231 PolarHBondContact O-N 3.24Å
228L71.8Confident70.1Confident24 Ų2471.3 Ų71.313%0.12636%0.361CS..Hα-helixtrans-68.6-37.5176.2-174.2143.6000112Y224 L230 A231 K232Y224-L228 HydrophobicContact CD2-CB 4.42Å; Y224-L228 HydrophobicContact CE1-CD1 4.06Å; Y224-L228 HydrophobicContact CE2-CB 4.03Å; Y224-L228 HydrophobicContact CE2-CD1 3.65Å; Y224-L228 HydrophobicContact CE2-CG 4.48Å; Y224-L228 WeakPolarHBondContact O-CB 3.49Å; Y224-L228 PolarHBondContact O-N 3.4Å; Y224-L228 WeakPolarHBondContact OH-CD1 3.39Å; L228-L230 VanDerWaalsContact C-N 3.28Å; L228-L230 PolarHBondContact O-N 2.86Å; L228-A231 PolarHBondContact O-N 3.35Å; L228-K232 HydrophobicContact CD2-CD 3.68Å; L228-K232 HydrophobicContact CD2-CG 4.17Å; L228-K232 WeakPolarHBondContact O-CB 3.42Å; L228-K232 WeakPolarHBondContact O-CG 3.07Å; L228-K232 PolarHBondContact O-N 2.8Å
229N72.6Confident71.4Confident81 Ų8170.1 Ų70.143%0.43335%0.35SS..Hα-helixtrans-65.7-33.4172.1-77.9-36.2000112N225 K226 S233 R289N225-N229 WeakPolarHBondContact O-CB 3.38Å; N225-N229 PolarHBondContact O-N 2.89Å; N225-N229 PolarHBondContact O-ND2 3.3Å; K226-N229 PolarHBondContact O-N 3.43Å; N229-S233 PolarHBondContact O-N 3.37Å; N229-S233 PolarHBondContact O-OG 3.02Å; N229-R289 PolarHBondContact O-NH2 3.36Å
230L67.7Low72.8Confident58 Ų5867.2 Ų67.230%0.30433%0.334SS..Hα-helixtrans-63.1-53.3171.5-168.898.6000110.3V109 K226 E227 L228 K232 S233 L234V109-L230 HydrophobicContact CG2-CD2 4.48Å; K226-L230 PolarHBondContact O-N 2.87Å; E227-L230 VanDerWaalsContact O-CB 3.31Å; E227-L230 WeakPolarHBondContact O-CB 3.3Å; E227-L230 PolarHBondContact O-N 3.42Å; L228-L230 VanDerWaalsContact C-N 3.28Å; L228-L230 PolarHBondContact O-N 2.86Å; L230-K232 PolarHBondContact O-N 2.95Å; L230-S233 WeakPolarHBondContact O-CA 3.34Å; L230-S233 VanDerWaalsContact O-CB 3.25Å; L230-S233 WeakPolarHBondContact O-CB 3.33Å; L230-S233 PolarHBondContact O-N 3.02Å; L230-L234 PolarHBondContact O-N 3.12Å
231A70.9Confident74.1Confident10 Ų1064.5 Ų64.58%0.08332%0.316CS..Hα-helixtrans-58.9-42.8179.500000113I200 I204 E227 L228 S233 L234 V235I200-A231 HydrophobicContact CG2-CB 4.24Å; I204-A231 HydrophobicContact CD1-CB 3.54Å; E227-A231 PolarHBondContact O-N 3.24Å; L228-A231 PolarHBondContact O-N 3.35Å; A231-S233 PolarHBondContact O-N 2.8Å; A231-L234 WeakPolarHBondContact O-CB 3.26Å; A231-L234 PolarHBondContact O-N 3.39Å; A231-V235 PolarHBondContact O-N 3.45Å
232K76.1Confident75.3Confident120 Ų12060.3 Ų60.352%0.52230%0.295SS..Hα-helixtrans-57.3-36.1172.7-79.2-179.6172.6167.90112.9L228 L230 L234 L236L228-K232 HydrophobicContact CD2-CD 3.68Å; L228-K232 HydrophobicContact CD2-CG 4.17Å; L228-K232 WeakPolarHBondContact O-CB 3.42Å; L228-K232 WeakPolarHBondContact O-CG 3.07Å; L228-K232 PolarHBondContact O-N 2.8Å; L230-K232 PolarHBondContact O-N 2.95Å; K232-L234 VanDerWaalsContact C-N 3.29Å; K232-L236 WeakPolarHBondContact O-CB 3.04Å; K232-L236 PolarHBondContact O-N 3.07Å; K232-L236 VanDerWaalsContact O-N 3.07Å
233S73.4Confident76.6Confident21 Ų2157.4 Ų57.415%0.14729%0.286CS..Hα-helixtrans-67.1-34.6176.8-47.90000111.5N229 L230 A231 V237 R289N229-S233 PolarHBondContact O-N 3.37Å; N229-S233 PolarHBondContact O-OG 3.02Å; L230-S233 WeakPolarHBondContact O-CA 3.34Å; L230-S233 VanDerWaalsContact O-CB 3.25Å; L230-S233 WeakPolarHBondContact O-CB 3.33Å; L230-S233 PolarHBondContact O-N 3.02Å; A231-S233 PolarHBondContact O-N 2.8Å; S233-V237 WeakPolarHBondContact O-CG2 3.26Å; S233-V237 PolarHBondContact O-N 2.88Å; S233-R289 VanDerWaalsContact OG-CZ 3.25Å; S233-R289 PolarHBondContact OG-NE 3.28Å; S233-R289 PolarHBondContact OG-NH2 3.09Å
234L70.5Confident77.9Confident13 Ų1351.7 Ų51.77%0.06827%0.265CS..Hα-helixtrans-74.6-43.7-179.3-59.8176000111.8R105 Y197 I200 L230 A231 K232 L236 V237 F238R105-L234 HydrophobicContact CB-CD1 3.78Å; R105-L234 HydrophobicContact CB-CD2 4.22Å; R105-L234 HydrophobicContact CG-CD1 4.07Å; R105-L234 HydrophobicContact CG-CD2 3.65Å; Y197-L234 HydrophobicContact CD1-CB 4.08Å; Y197-L234 HydrophobicContact CE1-CB 3.63Å; Y197-L234 HydrophobicContact CE1-CD1 4.41Å; Y197-L234 HydrophobicContact CE1-CG 4.49Å; I200-L234 HydrophobicContact CD1-CD1 4.39Å; L230-L234 PolarHBondContact O-N 3.12Å; A231-L234 WeakPolarHBondContact O-CB 3.26Å; A231-L234 PolarHBondContact O-N 3.39Å; K232-L234 VanDerWaalsContact C-N 3.29Å; L234-L236 VanDerWaalsContact C-N 3.26Å; L234-L236 PolarHBondContact O-N 2.97Å; L234-V237 PolarHBondContact O-N 3.09Å; L234-F238 PolarHBondContact O-N 2.03Å
235V78.4Confident79.1Confident66 Ų6650 Ų5040%0.426%0.258SS..Hα-helixtrans-59.6-41173.1174.90000110.5A231 V237 F238 V239A231-V235 PolarHBondContact O-N 3.45Å; V235-V237 PolarHBondContact O-N 3.39Å; V235-F238 PolarHBondContact O-N 3.41Å; V235-V239 HydrophobicContact CG1-CG2 4.16Å; V235-V239 WeakPolarHBondContact O-CB 3.32Å; V235-V239 VanDerWaalsContact O-CG2 3.3Å; V235-V239 WeakPolarHBondContact O-CG2 3.25Å; V235-V239 PolarHBondContact O-N 2.84Å
236L82.9Confident80.3Confident69 Ų6949 Ų4936%0.36125%0.253SS..Hα-helixtrans-57.9-48.4175177.364.3000111.7K232 L234 F238 V239 L240K232-L236 WeakPolarHBondContact O-CB 3.04Å; K232-L236 PolarHBondContact O-N 3.07Å; K232-L236 VanDerWaalsContact O-N 3.07Å; L234-L236 VanDerWaalsContact C-N 3.26Å; L234-L236 PolarHBondContact O-N 2.97Å; L236-F238 VanDerWaalsContact C-N 3.33Å; L236-F238 PolarHBondContact O-N 3.45Å; L236-V239 PolarHBondContact O-N 2.87Å; L236-L240 HydrophobicContact CD1-CD1 3.89Å; L236-L240 HydrophobicContact CD1-CG 4.07Å; L236-L240 HydrophobicContact CG-CD1 3.8Å; L236-L240 HydrophobicContact CG-CG 4.4Å; L236-L240 WeakPolarHBondContact O-CB 3.2Å; L236-L240 WeakPolarHBondContact O-CG 3.37Å; L236-L240 PolarHBondContact O-N 3.07Å
237V78.8Confident81.5Confident27 Ų2744.2 Ų44.216%0.16424%0.237CC..Hα-helixtrans-60.2-42.9178.41720000111.3L98 S233 L234 V235 F241 V285L98-V237 HydrophobicContact CD2-CG1 3.78Å; S233-V237 WeakPolarHBondContact O-CG2 3.26Å; S233-V237 PolarHBondContact O-N 2.88Å; L234-V237 PolarHBondContact O-N 3.09Å; V235-V237 PolarHBondContact O-N 3.39Å; V237-F241 WeakPolarHBondContact O-CB 3.43Å; V237-F241 PolarHBondContact O-N 3.03Å; V237-V285 HydrophobicContact CG2-CG1 3.94Å
238F83.6Confident82.7Confident31 Ų3143.4 Ų43.414%0.13623%0.234CC..Hα-helixtrans-62.3-45.9176.3171.9-103.2000113.6L190 M193 L194 Y197 L234 V235 L236 F241 S242L190-F238 HydrophobicContact CD2-CE2 4.04Å; M193-F238 HydrophobicContact CB-CD2 4.14Å; M193-F238 HydrophobicContact CB-CE2 4.32Å; L194-F238 HydrophobicContact CB-CE2 4.24Å; L194-F238 HydrophobicContact CB-CZ 3.94Å; L194-F238 HydrophobicContact CD1-CE1 3.96Å; L194-F238 HydrophobicContact CD1-CZ 4.02Å; L194-F238 HydrophobicContact CG-CZ 4.48Å; Y197-F238 HydrophobicContact CD2-CB 3.8Å; Y197-F238 HydrophobicContact CD2-CD1 4.47Å; Y197-F238 HydrophobicContact CD2-CD2 4.03Å; Y197-F238 AromaticContact CD2-CG 3.82Å; Y197-F238 HydrophobicContact CD2-CG 3.82Å; Y197-F238 HydrophobicContact CE2-CB 3.43Å; Y197-F238 VanDerWaalsContact CE2-CB 3.43Å; Y197-F238 AromaticContact CE2-CD2 3.81Å; Y197-F238 HydrophobicContact CE2-CD2 3.81Å; Y197-F238 AromaticContact CE2-CG 3.77Å; Y197-F238 HydrophobicContact CE2-CG 3.77Å; L234-F238 PolarHBondContact O-N 2.03Å; V235-F238 PolarHBondContact O-N 3.41Å; L236-F238 VanDerWaalsContact C-N 3.33Å; L236-F238 PolarHBondContact O-N 3.45Å; F238-F241 PolarHBondContact O-N 3.33Å; F238-S242 WeakPolarHBondContact O-CB 3.24Å; F238-S242 PolarHBondContact O-N 3.47Å; F238-S242 PolarHBondContact O-OG 2.92Å
239V87.1Confident83.8Confident59 Ų5942.5 Ų42.536%0.35823%0.229SC..Hα-helixtrans-65.2-44.2-179.8168.80000110.2V235 L236 F241 S242 I243V235-V239 HydrophobicContact CG1-CG2 4.16Å; V235-V239 WeakPolarHBondContact O-CB 3.32Å; V235-V239 VanDerWaalsContact O-CG2 3.3Å; V235-V239 WeakPolarHBondContact O-CG2 3.25Å; V235-V239 PolarHBondContact O-N 2.84Å; L236-V239 PolarHBondContact O-N 2.87Å; V239-F241 VanDerWaalsContact C-N 3.35Å; V239-F241 PolarHBondContact O-N 3.49Å; V239-S242 PolarHBondContact O-N 3.02Å; V239-I243 HydrophobicContact CG1-CD1 3.58Å; V239-I243 HydrophobicContact CG1-CG1 4.31Å; V239-I243 WeakPolarHBondContact O-CB 3.44Å; V239-I243 VanDerWaalsContact O-CG1 3.3Å; V239-I243 WeakPolarHBondContact O-CG1 3.39Å; V239-I243 PolarHBondContact O-N 3.48Å
240L88.1Confident84.9Confident51 Ų5142.1 Ų42.127%0.26723%0.229SC..Hα-helixtrans-58.8-47.6175.7-71.4168.8000111L236 S242 I243 S244 V281 V285L236-L240 HydrophobicContact CD1-CD1 3.89Å; L236-L240 HydrophobicContact CD1-CG 4.07Å; L236-L240 HydrophobicContact CG-CD1 3.8Å; L236-L240 HydrophobicContact CG-CG 4.4Å; L236-L240 WeakPolarHBondContact O-CB 3.2Å; L236-L240 WeakPolarHBondContact O-CG 3.37Å; L236-L240 PolarHBondContact O-N 3.07Å; L240-S242 PolarHBondContact O-N 3.22Å; L240-I243 PolarHBondContact O-N 3.44Å; L240-S244 VanDerWaalsContact O-CB 3.31Å; L240-S244 WeakPolarHBondContact O-CB 3.4Å; L240-S244 PolarHBondContact O-N 3.35Å; L240-S244 PolarHBondContact O-OG 3.19Å; L240-V281 HydrophobicContact CD1-CG1 3.8Å; L240-V281 HydrophobicContact CD2-CG1 4.47Å; L240-V285 HydrophobicContact CD1-CG2 3.73Å
241F84.5Confident86.2Confident3 Ų340.4 Ų40.41%0.01322%0.22CC..Hα-helixtrans-58.9-47.8175.8179.8-96.9000112I95 L98 L190 M193 V237 F238 V239 I243 S244 W245I95-F241 HydrophobicContact CB-CE2 4.41Å; I95-F241 HydrophobicContact CB-CZ 4.08Å; I95-F241 HydrophobicContact CD1-CZ 3.94Å; I95-F241 HydrophobicContact CG1-CE2 3.8Å; I95-F241 HydrophobicContact CG1-CZ 3.57Å; I95-F241 HydrophobicContact CG2-CE1 4.46Å; I95-F241 HydrophobicContact CG2-CZ 3.79Å; L98-F241 HydrophobicContact CD1-CB 4.33Å; L98-F241 HydrophobicContact CD1-CD2 3.2Å; L98-F241 HydrophobicContact CD1-CE2 3.68Å; L98-F241 HydrophobicContact CD1-CG 3.92Å; L190-F241 HydrophobicContact CD1-CE1 4.36Å; L190-F241 HydrophobicContact CD2-CD1 3.45Å; L190-F241 VanDerWaalsContact CD2-CD1 3.45Å; L190-F241 HydrophobicContact CD2-CE1 3.39Å; L190-F241 HydrophobicContact CG-CD1 4.39Å; L190-F241 HydrophobicContact CG-CE1 3.84Å; M193-F241 HydrophobicContact CE-CD1 4.18Å; M193-F241 HydrophobicContact CE-CE1 4.14Å; V237-F241 WeakPolarHBondContact O-CB 3.43Å; V237-F241 PolarHBondContact O-N 3.03Å; F238-F241 PolarHBondContact O-N 3.33Å; V239-F241 VanDerWaalsContact C-N 3.35Å; V239-F241 PolarHBondContact O-N 3.49Å; F241-I243 PolarHBondContact O-N 2.95Å; F241-S244 PolarHBondContact O-N 3.26Å; F241-W245 AromaticContact CD2-CD1 3.35Å; F241-W245 HydrophobicContact CD2-CG 4.39Å; F241-W245 AromaticContact CD2-NE1 3.6Å; F241-W245 AromaticContact CE2-CD1 3.2Å; F241-W245 HydrophobicContact CE2-CD2 4.45Å; F241-W245 AromaticContact CE2-CG 3.95Å; F241-W245 HydrophobicContact CE2-CG 3.95Å; F241-W245 AromaticContact CE2-NE1 3.31Å; F241-W245 VanDerWaalsContact CE2-NE1 3.31Å; F241-W245 AromaticContact CG-CD1 3.97Å; F241-W245 AromaticContact CZ-CD1 3.7Å; F241-W245 HydrophobicContact CZ-CG 4.02Å; F241-W245 VanDerWaalsContact O-CD1 3.23Å; F241-W245 PolarHBondContact O-N 2.81Å
242S89.4Confident87.4Confident15 Ų1540.2 Ų40.211%0.10522%0.218CC..Hα-helixtrans-63.1-43.5-178.7-57.40000112.2F238 V239 L240 S244 W245 L246F238-S242 WeakPolarHBondContact O-CB 3.24Å; F238-S242 PolarHBondContact O-N 3.47Å; F238-S242 PolarHBondContact O-OG 2.92Å; V239-S242 PolarHBondContact O-N 3.02Å; L240-S242 PolarHBondContact O-N 3.22Å; S242-S244 VanDerWaalsContact C-N 3.31Å; S242-S244 PolarHBondContact O-N 2.98Å; S242-W245 PolarHBondContact O-N 3.33Å; S242-L246 VanDerWaalsContact O-CB 3.23Å; S242-L246 WeakPolarHBondContact O-CB 3.46Å; S242-L246 VanDerWaalsContact O-CG 3.25Å; S242-L246 WeakPolarHBondContact O-CG 3.21Å; S242-L246 PolarHBondContact O-N 3.1Å
243I92.3Very high88.4Confident99 Ų9935.5 Ų35.551%0.50820%0.2SC..Hα-helixtrans-66.3-35.8177.5-69.2171.5000111V239 L240 F241 P247V239-I243 HydrophobicContact CG1-CD1 3.58Å; V239-I243 HydrophobicContact CG1-CG1 4.31Å; V239-I243 WeakPolarHBondContact O-CB 3.44Å; V239-I243 VanDerWaalsContact O-CG1 3.3Å; V239-I243 WeakPolarHBondContact O-CG1 3.39Å; V239-I243 PolarHBondContact O-N 3.48Å; L240-I243 PolarHBondContact O-N 3.44Å; F241-I243 PolarHBondContact O-N 2.95Å; I243-P247 WeakPolarHBondContact O-CD 3.31Å; I243-P247 VanDerWaalsContact O-CG 3.3Å; I243-P247 WeakPolarHBondContact O-CG 3.36Å
244S92.8Very high89.4Confident12 Ų1237.9 Ų37.98%0.08421%0.21CC..Hα-helixtrans-69.9-37.1178.7-81.10000113.6L240 F241 S242 L274 T275L240-S244 VanDerWaalsContact O-CB 3.31Å; L240-S244 WeakPolarHBondContact O-CB 3.4Å; L240-S244 PolarHBondContact O-N 3.35Å; L240-S244 PolarHBondContact O-OG 3.19Å; F241-S244 PolarHBondContact O-N 3.26Å; S242-S244 VanDerWaalsContact C-N 3.31Å; S242-S244 PolarHBondContact O-N 2.98Å; S244-L274 VanDerWaalsContact CB-O 3.23Å; S244-L274 WeakPolarHBondContact CB-O 3.44Å; S244-L274 CarbonylContact O-C 3.47Å; S244-L274 PolarHBondContact OG-O 3.35Å; S244-T275 WeakPolarHBondContact O-CG2 3.26Å; S244-T275 PolarHBondContact O-N 3.38Å
245W91.8Very high90.5Very high16 Ų1638.2 Ų38.26%0.06121%0.213CC..Hα-helixtrans-103.1-39.6-168.5-74.993.5000115T91 F241 S242 P247 L248 H249 T275T91-W245 HydrophobicContact CG2-CE3 4.15Å; T91-W245 HydrophobicContact CG2-CH2 3.02Å; T91-W245 HydrophobicContact CG2-CZ2 3.81Å; T91-W245 HydrophobicContact CG2-CZ3 3.2Å; T91-W245 WeakPolarHBondContact OG1-CH2 3.36Å; F241-W245 AromaticContact CD2-CD1 3.35Å; F241-W245 HydrophobicContact CD2-CG 4.39Å; F241-W245 AromaticContact CD2-NE1 3.6Å; F241-W245 AromaticContact CE2-CD1 3.2Å; F241-W245 HydrophobicContact CE2-CD2 4.45Å; F241-W245 AromaticContact CE2-CG 3.95Å; F241-W245 HydrophobicContact CE2-CG 3.95Å; F241-W245 AromaticContact CE2-NE1 3.31Å; F241-W245 VanDerWaalsContact CE2-NE1 3.31Å; F241-W245 AromaticContact CG-CD1 3.97Å; F241-W245 AromaticContact CZ-CD1 3.7Å; F241-W245 HydrophobicContact CZ-CG 4.02Å; F241-W245 VanDerWaalsContact O-CD1 3.23Å; F241-W245 PolarHBondContact O-N 2.81Å; S242-W245 PolarHBondContact O-N 3.33Å; W245-P247 VanDerWaalsContact C-CD 3.42Å; W245-L248 PolarHBondContact O-N 2.93Å; W245-H249 PolarHBondContact O-CD2 3.24Å; W245-H249 PolarHBondContact O-N 3.07Å; W245-T275 HydrophobicContact CD2-CG2 4Å; W245-T275 HydrophobicContact CE3-CG2 3.69Å; W245-T275 HydrophobicContact CH2-CG2 4.23Å; W245-T275 HydrophobicContact CZ3-CG2 3.79Å
246L93.9Very high91.3Very high61 Ų6137 Ų3732%0.31920%0.204SC..Hα-helixtrans-58.5-38.9-175.1-70.1175.6000114.1F182 L190 S242 L248 H249 V250F182-L246 HydrophobicContact CE2-CD2 4.15Å; F182-L246 HydrophobicContact CZ-CD2 4.26Å; L190-L246 HydrophobicContact CD1-CD2 3.94Å; S242-L246 VanDerWaalsContact O-CB 3.23Å; S242-L246 WeakPolarHBondContact O-CB 3.46Å; S242-L246 VanDerWaalsContact O-CG 3.25Å; S242-L246 WeakPolarHBondContact O-CG 3.21Å; S242-L246 PolarHBondContact O-N 3.1Å; L246-L248 VanDerWaalsContact C-N 3.32Å; L246-L248 PolarHBondContact O-N 3.22Å; L246-H249 PolarHBondContact O-N 2.85Å; L246-V250 VanDerWaalsContact O-CG2 3.29Å; L246-V250 WeakPolarHBondContact O-CG2 3.48Å; L246-V250 PolarHBondContact O-N 3.44Å
247P95.8Very high92Very high46 Ų4639.2 Ų39.230%0.29921%0.211SC..Hα-helixtrans-56.3-43.5179.7-27.536.6000113.3I243 W245 V250 I251 A271 L274I243-P247 WeakPolarHBondContact O-CD 3.31Å; I243-P247 VanDerWaalsContact O-CG 3.3Å; I243-P247 WeakPolarHBondContact O-CG 3.36Å; W245-P247 VanDerWaalsContact C-CD 3.42Å; P247-V250 PolarHBondContact O-N 3.22Å; P247-I251 WeakPolarHBondContact O-CG1 3.43Å; P247-I251 PolarHBondContact O-N 3.05Å; P247-A271 HydrophobicContact CB-CB 4.01Å; P247-L274 HydrophobicContact CG-CD1 4.31Å
248L94.7Very high92.8Very high30 Ų3040 Ų4016%0.15722%0.217CC..Hα-helixtrans-67.4-42.4-179.5-173.962.8000111.5W245 L246 V250 I251 N252 L268 A271 I272 T275W245-L248 PolarHBondContact O-N 2.93Å; L246-L248 VanDerWaalsContact C-N 3.32Å; L246-L248 PolarHBondContact O-N 3.22Å; L248-V250 VanDerWaalsContact C-N 3.34Å; L248-V250 PolarHBondContact O-N 3Å; L248-I251 PolarHBondContact O-N 3.24Å; L248-N252 PolarHBondContact O-N 3.08Å; L248-N252 PolarHBondContact O-ND2 3.31Å; L248-L268 HydrophobicContact CD1-CD1 3.87Å; L248-A271 HydrophobicContact CB-CB 4.14Å; L248-A271 HydrophobicContact CD1-CB 4.29Å; L248-I272 HydrophobicContact CD1-CG1 4.14Å; L248-T275 HydrophobicContact CB-CG2 4.07Å; L248-T275 HydrophobicContact CD2-CG2 3.85Å
249H95.1Very high93.1Very high5 Ų543.8 Ų43.82%0.02325%0.245CC..Hα-helixtrans-65.8-36.3176.5-72.4-67.1000112.9N181 F182 W245 L246 N252 C253N181-H249 PolarHBondContact OD1-CE1 3.43Å; F182-H249 HydrophobicContact CB-CB 4.48Å; F182-H249 WeakPolarHBondContact CB-ND1 3.42Å; F182-H249 HydrophobicContact CD1-CB 3.95Å; F182-H249 HydrophobicContact CD2-CB 3.53Å; F182-H249 AromaticContact CD2-CD2 3.84Å; F182-H249 AromaticContact CD2-CG 3.35Å; F182-H249 AromaticContact CD2-ND1 3.53Å; F182-H249 HydrophobicContact CE1-CB 3.98Å; F182-H249 HydrophobicContact CE2-CB 3.6Å; F182-H249 AromaticContact CE2-CG 3.8Å; F182-H249 HydrophobicContact CG-CB 3.73Å; F182-H249 AromaticContact CG-CG 3.74Å; F182-H249 AromaticContact CG-ND1 3.61Å; F182-H249 HydrophobicContact CZ-CB 3.83Å; W245-H249 PolarHBondContact O-CD2 3.24Å; W245-H249 PolarHBondContact O-N 3.07Å; L246-H249 PolarHBondContact O-N 2.85Å; H249-N252 PolarHBondContact O-N 2.83Å; H249-C253 PolarHBondContact O-N 3.41Å; H249-C253 PolarHBondContact O-SG 3.02Å
250V95.6Very high93.3Very high73 Ų7350.9 Ų50.944%0.44227%0.271SS..Hα-helixtrans-63-43.4173170.30000110.5L246 P247 L248 N252 C253 I254L246-V250 VanDerWaalsContact O-CG2 3.29Å; L246-V250 WeakPolarHBondContact O-CG2 3.48Å; L246-V250 PolarHBondContact O-N 3.44Å; P247-V250 PolarHBondContact O-N 3.22Å; L248-V250 VanDerWaalsContact C-N 3.34Å; L248-V250 PolarHBondContact O-N 3Å; V250-N252 VanDerWaalsContact C-N 3.32Å; V250-N252 PolarHBondContact O-N 2.99Å; V250-C253 WeakPolarHBondContact O-CB 3.19Å; V250-C253 PolarHBondContact O-N 2.94Å; V250-I254 HydrophobicContact CG1-CD1 3.97Å; V250-I254 WeakPolarHBondContact O-CG1 3.34Å; V250-I254 PolarHBondContact O-N 3.47Å
251I95.2Very high93.6Very high21 Ų2151.3 Ų51.311%0.10828%0.277CS..Hα-helixtrans-61.6-40175.1-68167.6000111.4P247 L248 C253 I254 T255 K263 L268 A271P247-I251 WeakPolarHBondContact O-CG1 3.43Å; P247-I251 PolarHBondContact O-N 3.05Å; L248-I251 PolarHBondContact O-N 3.24Å; I251-C253 VanDerWaalsContact C-N 3.35Å; I251-I254 PolarHBondContact O-N 2.96Å; I251-T255 WeakPolarHBondContact O-CB 3.46Å; I251-T255 PolarHBondContact O-N 3.47Å; I251-T255 PolarHBondContact O-OG1 3.5Å; I251-K263 HydrophobicContact CG2-CD 4.49Å; I251-L268 HydrophobicContact CG2-CD1 4.19Å; I251-A271 HydrophobicContact CD1-CB 3.74Å
252N95.5Very high93.8Very high7 Ų758.6 Ų58.64%0.03732%0.317CS..Hα-helixtrans-63.7-40174.7-68.8-23.5000111.8M174 V178 L248 H249 V250 T255 L256M174-N252 HydrophobicContact SD-CB 4.48Å; V178-N252 HydrophobicContact CG2-CB 4.2Å; L248-N252 PolarHBondContact O-N 3.08Å; L248-N252 PolarHBondContact O-ND2 3.31Å; H249-N252 PolarHBondContact O-N 2.83Å; V250-N252 VanDerWaalsContact C-N 3.32Å; V250-N252 PolarHBondContact O-N 2.99Å; N252-T255 WeakPolarHBondContact O-CB 3.25Å; N252-T255 PolarHBondContact O-N 2.94Å; N252-L256 PolarHBondContact O-N 3.35Å
253C96.8Very high93.6Very high20 Ų2060.3 Ų60.314%0.13532%0.322CS..Hα-helixtrans-62.4-46173.9-66.50000111.5H249 V250 I251 T255 L256 F257H249-C253 PolarHBondContact O-N 3.41Å; H249-C253 PolarHBondContact O-SG 3.02Å; V250-C253 WeakPolarHBondContact O-CB 3.19Å; V250-C253 PolarHBondContact O-N 2.94Å; I251-C253 VanDerWaalsContact C-N 3.35Å; C253-T255 VanDerWaalsContact C-N 3.28Å; C253-T255 PolarHBondContact O-N 2.76Å; C253-L256 PolarHBondContact O-N 3.26Å; C253-F257 HydrophobicContact CB-CD2 4Å; C253-F257 HydrophobicContact CB-CE2 4.12Å; C253-F257 WeakPolarHBondContact O-CB 3.38Å; C253-F257 WeakPolarHBondContact O-CD2 3.35Å; C253-F257 PolarHBondContact O-N 3.46Å
254I95.3Very high93.3Very high71 Ų7158.8 Ų58.836%0.36432%0.319SS..Hα-helixtrans-60.5-42.3176.2-65.6165.1000110.2V250 I251 L256 C258 C261V250-I254 HydrophobicContact CG1-CD1 3.97Å; V250-I254 WeakPolarHBondContact O-CG1 3.34Å; V250-I254 PolarHBondContact O-N 3.47Å; I251-I254 PolarHBondContact O-N 2.96Å; I254-L256 VanDerWaalsContact C-N 3.31Å; I254-L256 PolarHBondContact O-N 2.95Å; I254-C258 HydrophobicContact CG2-CB 4.48Å; I254-C258 CarbonylContact O-C 3.58Å; I254-C258 VanDerWaalsContact O-C 3.22Å; I254-C258 VanDerWaalsContact O-CA 3.3Å; I254-C258 WeakPolarHBondContact O-CA 3.34Å; I254-C258 PolarHBondContact O-N 3.46Å; I254-C258 VanDerWaalsContact O-O 3.12Å; I254-C261 HydrophobicContact CG2-CB 3.92Å
255T92.9Very high93.1Very high20 Ų2063.2 Ų63.212%0.12334%0.339CS..Hα-helixtrans-61.2-39178.3-590000111.8M174 I251 N252 C253 K263M174-T255 HydrophobicContact CG-CG2 3.95Å; M174-T255 HydrophobicContact SD-CG2 4.04Å; I251-T255 WeakPolarHBondContact O-CB 3.46Å; I251-T255 PolarHBondContact O-N 3.47Å; I251-T255 PolarHBondContact O-OG1 3.5Å; N252-T255 WeakPolarHBondContact O-CB 3.25Å; N252-T255 PolarHBondContact O-N 2.94Å; C253-T255 VanDerWaalsContact C-N 3.28Å; C253-T255 PolarHBondContact O-N 2.76Å; T255-K263 PolarHBondContact OG1-NZ 3.34Å
256L95.4Very high92.9Very high42 Ų4267.1 Ų67.122%0.2237%0.365CS..Hα-helixtrans-77.3-50.2178.2-177.462.2000113.1M174 T175 V178 Y179 N252 C253 I254M174-L256 HydrophobicContact CB-CB 4.22Å; M174-L256 HydrophobicContact CB-CD1 4.01Å; T175-L256 HydrophobicContact CG2-CD1 3.94Å; V178-L256 HydrophobicContact CB-CD2 3.58Å; V178-L256 HydrophobicContact CG1-CD2 3.9Å; V178-L256 HydrophobicContact CG2-CB 3.96Å; V178-L256 HydrophobicContact CG2-CD2 3.75Å; Y179-L256 HydrophobicContact CD2-CD2 4.38Å; Y179-L256 HydrophobicContact CE2-CD2 3.82Å; N252-L256 PolarHBondContact O-N 3.35Å; C253-L256 PolarHBondContact O-N 3.26Å; I254-L256 VanDerWaalsContact C-N 3.31Å; I254-L256 PolarHBondContact O-N 2.95Å
257F97Very high92.8Very high115 Ų11568.9 Ų68.950%0.50437%0.374SS..Hα-helixtrans-86.8-22.2-170.5-61.7-59000113.6V178 Y179 F183 C253V178-F257 HydrophobicContact CG1-CE2 3.79Å; V178-F257 HydrophobicContact CG1-CZ 3.9Å; Y179-F257 HydrophobicContact CE1-CE1 4.18Å; Y179-F257 AromaticContact CE1-CZ 3.91Å; Y179-F257 HydrophobicContact CE1-CZ 3.91Å; Y179-F257 WeakPolarHBondContact OH-CE1 3.36Å; F183-F257 HydrophobicContact CE2-CZ 4.38Å; C253-F257 HydrophobicContact CB-CD2 4Å; C253-F257 HydrophobicContact CB-CE2 4.12Å; C253-F257 WeakPolarHBondContact O-CB 3.38Å; C253-F257 WeakPolarHBondContact O-CD2 3.35Å; C253-F257 PolarHBondContact O-N 3.46Å
258C95.3Very high92.6Very high43 Ų4368.1 Ų68.129%0.29137%0.367SS..  trans-133.274176.9-169.60000111.2I254 K260 C261I254-C258 HydrophobicContact CG2-CB 4.48Å; I254-C258 CarbonylContact O-C 3.58Å; I254-C258 VanDerWaalsContact O-C 3.22Å; I254-C258 VanDerWaalsContact O-CA 3.3Å; I254-C258 WeakPolarHBondContact O-CA 3.34Å; I254-C258 PolarHBondContact O-N 3.46Å; I254-C258 VanDerWaalsContact O-O 3.12Å; C258-K260 PolarHBondContact O-N 2.86Å; C258-K260 VanDerWaalsContact O-N 3.09Å; C258-C261 HydrophobicContact CB-CB 3.73Å; C258-C261 WeakPolarHBondContact CB-SG 3.49Å; C258-C261 WeakPolarHBondContact O-CB 3.34Å; C258-C261 PolarHBondContact O-N 2.99Å; C258-C261 WeakPolarHBondContact SG-CB 3.35Å; C258-C261 PolarHBondContact SG-N 3.49Å; C258-C261 VanDerWaalsContact SG-N 3.39Å; C258-C261 CovalentContact SG-SG 2.03Å; C258-C261 PolarHBondContact SG-SG 3.16Å
259P90.5Very high92.5Very high111 Ų11168.3 Ų68.372%0.72137%0.366SS*.THydrogen-bonded Turntrans-63.6-19.5-178.925.5-35000113.5
260K92.3Very high92.4Very high207 Ų20772.1 Ų72.190%0.939%0.385SS*.THydrogen-bonded Turntrans-87.4-11.2176-61.8-177.9-178.5178.40113.4C258 N262C258-K260 PolarHBondContact O-N 2.86Å; C258-K260 VanDerWaalsContact O-N 3.09Å; K260-N262 PolarHBondContact O-N 3.4Å
261C93Very high92.4Very high61 Ų6168.7 Ų68.741%0.41237%0.365SS..SBendtrans-71.4128.1-179.9-76.60000109.9I254 C258 K263I254-C261 HydrophobicContact CG2-CB 3.92Å; C258-C261 HydrophobicContact CB-CB 3.73Å; C258-C261 WeakPolarHBondContact CB-SG 3.49Å; C258-C261 WeakPolarHBondContact O-CB 3.34Å; C258-C261 PolarHBondContact O-N 2.99Å; C258-C261 WeakPolarHBondContact SG-CB 3.35Å; C258-C261 PolarHBondContact SG-N 3.49Å; C258-C261 VanDerWaalsContact SG-N 3.39Å; C258-C261 CovalentContact SG-SG 2.03Å; C258-C261 PolarHBondContact SG-SG 3.16Å; C261-K263 PolarHBondContact O-N 2.85Å
262N88.3Confident92.3Very high156 Ų15669.1 Ų69.183%0.83437%0.367SS*.  trans-72.6128.1174.1-166.78.6000109.7K260K260-N262 PolarHBondContact O-N 3.4Å
263K85.5Confident92.3Very high50 Ų5070.3 Ų70.322%0.21737%0.373CS..  trans-114.5109.217760.8-165.8-174-170.40108E169 I251 T255 C261 M265E169-K263 VanDerWaalsContact CD-NZ 3.29Å; E169-K263 IonicContact OE1-NZ 3.49Å; E169-K263 PolarHBondContact OE1-NZ 3.38Å; E169-K263 IonicContact OE2-NZ 2.77Å; E169-K263 PolarHBondContact OE2-NZ 2.9Å; I251-K263 HydrophobicContact CG2-CD 4.49Å; T255-K263 PolarHBondContact OG1-NZ 3.34Å; C261-K263 PolarHBondContact O-N 2.85Å; K263-M265 PolarHBondContact O-N 2.86Å
264P87.7Confident92.3Very high68 Ų6872.2 Ų72.244%0.44238%0.382SS..  trans-64.1126.9-179.925.4-32.9000109.4V266 L267P264-V266 PolarHBondContact O-N 2.81Å; P264-L267 HydrophobicContact CG-CB 4.2Å; P264-L267 HydrophobicContact CG-CD1 3.48Å; P264-L267 VanDerWaalsContact CG-CD1 3.48Å; P264-L267 HydrophobicContact CG-CG 3.69Å; P264-L267 WeakPolarHBondContact O-CB 3.43Å; P264-L267 PolarHBondContact O-N 3.47Å
265M86.7Confident92.2Very high104 Ų10469 Ų6951%0.51237%0.366SS..Hα-helixtrans-55.7-28.2-177.7-74.2-63.8-179.800113.2K263 L267 L268 Y269K263-M265 PolarHBondContact O-N 2.86Å; M265-L267 VanDerWaalsContact C-N 3.31Å; M265-L267 PolarHBondContact O-N 2.97Å; M265-L268 WeakPolarHBondContact O-CB 3.45Å; M265-L268 PolarHBondContact O-N 2.77Å; M265-L268 HydrophobicContact SD-CD2 4.04Å; M265-Y269 HydrophobicContact CB-CE2 4.23Å; M265-Y269 VanDerWaalsContact O-CD2 3.29Å; M265-Y269 WeakPolarHBondContact O-CD2 3.39Å; M265-Y269 PolarHBondContact O-N 3.46Å
266V89.3Confident92.2Very high98 Ų9868.8 Ų68.859%0.59436%0.363SS*.Hα-helixtrans-58.5-42174178.40000111.7P264 L268 Y269 I270P264-V266 PolarHBondContact O-N 2.81Å; V266-L268 VanDerWaalsContact C-N 3.35Å; V266-Y269 PolarHBondContact O-N 2.91Å; V266-I270 HydrophobicContact CG1-CD1 3.83Å; V266-I270 HydrophobicContact CG1-CG1 4.46Å; V266-I270 VanDerWaalsContact O-CG1 3.26Å; V266-I270 WeakPolarHBondContact O-CG1 3.29Å; V266-I270 PolarHBondContact O-N 3.38Å
267L91.1Very high92.2Very high99 Ų9967.5 Ų67.552%0.51836%0.36SS..Hα-helixtrans-67.9-36.5177.8-69.7-178.8000111.7P264 M265 I270 A271P264-L267 HydrophobicContact CG-CB 4.2Å; P264-L267 HydrophobicContact CG-CD1 3.48Å; P264-L267 VanDerWaalsContact CG-CD1 3.48Å; P264-L267 HydrophobicContact CG-CG 3.69Å; P264-L267 WeakPolarHBondContact O-CB 3.43Å; P264-L267 PolarHBondContact O-N 3.47Å; M265-L267 VanDerWaalsContact C-N 3.31Å; M265-L267 PolarHBondContact O-N 2.97Å; L267-I270 PolarHBondContact O-N 3.32Å; L267-A271 WeakPolarHBondContact O-CB 3.48Å; L267-A271 PolarHBondContact O-N 2.97Å
268L91.3Very high91.9Very high29 Ų2962.2 Ų62.215%0.15234%0.337CS..Hα-helixtrans-63.1-48.3174.3179.263.4000110.9L248 I251 M265 V266 I270 A271 I272L248-L268 HydrophobicContact CD1-CD1 3.87Å; I251-L268 HydrophobicContact CG2-CD1 4.19Å; M265-L268 WeakPolarHBondContact O-CB 3.45Å; M265-L268 PolarHBondContact O-N 2.77Å; M265-L268 HydrophobicContact SD-CD2 4.04Å; V266-L268 VanDerWaalsContact C-N 3.35Å; L268-I270 PolarHBondContact O-N 2.94Å; L268-A271 PolarHBondContact O-N 3.41Å; L268-I272 HydrophobicContact CD1-CD1 4.03Å; L268-I272 HydrophobicContact CD1-CG1 4.33Å; L268-I272 HydrophobicContact CG-CD1 3.87Å; L268-I272 VanDerWaalsContact O-CG1 3.29Å; L268-I272 WeakPolarHBondContact O-CG1 3.38Å; L268-I272 PolarHBondContact O-N 3.22Å
269Y92.2Very high91.8Very high35 Ų3560.3 Ų60.314%0.13733%0.325CS..Hα-helixtrans-62-41.8177.4-67.8-41.6000112.6P9 Y12 M265 V266 A271 I272 L273P9-Y269 VanDerWaalsContact CD-CE2 3.46Å; P9-Y269 HydrophobicContact CG-CD2 4.48Å; P9-Y269 HydrophobicContact CG-CE2 4.08Å; Y12-Y269 HydrophobicContact CD1-CD1 4.34Å; Y12-Y269 HydrophobicContact CD1-CE1 4.41Å; Y12-Y269 AromaticContact CD2-CD1 3.69Å; Y12-Y269 HydrophobicContact CD2-CD1 3.69Å; Y12-Y269 AromaticContact CD2-CG 3.88Å; Y12-Y269 HydrophobicContact CD2-CG 3.88Å; Y12-Y269 HydrophobicContact CE1-CD1 4.33Å; Y12-Y269 HydrophobicContact CE1-CE1 4.38Å; Y12-Y269 AromaticContact CE2-CD1 3.68Å; Y12-Y269 HydrophobicContact CE2-CD1 3.68Å; Y12-Y269 HydrophobicContact CE2-CE1 4.49Å; Y12-Y269 HydrophobicContact CE2-CG 4.26Å; Y12-Y269 HydrophobicContact CG-CD1 4.01Å; Y12-Y269 HydrophobicContact CG-CE1 4.46Å; Y12-Y269 HydrophobicContact CG-CG 4.23Å; M265-Y269 HydrophobicContact CB-CE2 4.23Å; M265-Y269 VanDerWaalsContact O-CD2 3.29Å; M265-Y269 WeakPolarHBondContact O-CD2 3.39Å; M265-Y269 PolarHBondContact O-N 3.46Å; V266-Y269 PolarHBondContact O-N 2.91Å; Y269-A271 VanDerWaalsContact C-N 3.34Å; Y269-A271 PolarHBondContact O-N 2.9Å; Y269-I272 PolarHBondContact O-N 3.48Å; Y269-L273 WeakPolarHBondContact O-CB 3.26Å; Y269-L273 VanDerWaalsContact O-CG 3.25Å; Y269-L273 WeakPolarHBondContact O-CG 3.33Å; Y269-L273 PolarHBondContact O-N 3.45Å
270I93.9Very high91.9Very high84 Ų8455.7 Ų55.743%0.43130%0.296SS..Hα-helixtrans-61.5-44.8174.9-69.8167.4000110.5V266 L267 L268 I272 L273 L274V266-I270 HydrophobicContact CG1-CD1 3.83Å; V266-I270 HydrophobicContact CG1-CG1 4.46Å; V266-I270 VanDerWaalsContact O-CG1 3.26Å; V266-I270 WeakPolarHBondContact O-CG1 3.29Å; V266-I270 PolarHBondContact O-N 3.38Å; L267-I270 PolarHBondContact O-N 3.32Å; L268-I270 PolarHBondContact O-N 2.94Å; I270-I272 PolarHBondContact O-N 3.5Å; I270-L273 PolarHBondContact O-N 3.43Å; I270-L274 HydrophobicContact CG2-CD1 4Å; I270-L274 HydrophobicContact CG2-CG 4.36Å; I270-L274 WeakPolarHBondContact O-CB 3.41Å; I270-L274 VanDerWaalsContact O-CG 3.26Å; I270-L274 WeakPolarHBondContact O-CG 3.27Å; I270-L274 PolarHBondContact O-N 3.24Å
271A95.4Very high91.8Very high2 Ų248 Ų482%0.01727%0.266CS..Hα-helixtrans-62.3-42178.300000112P247 L248 I251 L267 L268 Y269 L274 T275P247-A271 HydrophobicContact CB-CB 4.01Å; L248-A271 HydrophobicContact CB-CB 4.14Å; L248-A271 HydrophobicContact CD1-CB 4.29Å; I251-A271 HydrophobicContact CD1-CB 3.74Å; L267-A271 WeakPolarHBondContact O-CB 3.48Å; L267-A271 PolarHBondContact O-N 2.97Å; L268-A271 PolarHBondContact O-N 3.41Å; Y269-A271 VanDerWaalsContact C-N 3.34Å; Y269-A271 PolarHBondContact O-N 2.9Å; A271-L274 WeakPolarHBondContact O-CB 3.25Å; A271-L274 PolarHBondContact O-N 3.23Å; A271-T275 WeakPolarHBondContact O-CG2 3.48Å; A271-T275 PolarHBondContact O-N 3.36Å; A271-T275 VanDerWaalsContact O-N 3.07Å
272I93.6Very high91.6Very high30 Ų3045.4 Ų45.415%0.15425%0.248CC..Hα-helixtrans-63.3-49.7175.7-65.9166000110.5Y12 L248 L268 Y269 I270 L274 T275 H276Y12-I272 HydrophobicContact CE2-CG2 4.35Å; L248-I272 HydrophobicContact CD1-CG1 4.14Å; L268-I272 HydrophobicContact CD1-CD1 4.03Å; L268-I272 HydrophobicContact CD1-CG1 4.33Å; L268-I272 HydrophobicContact CG-CD1 3.87Å; L268-I272 VanDerWaalsContact O-CG1 3.29Å; L268-I272 WeakPolarHBondContact O-CG1 3.38Å; L268-I272 PolarHBondContact O-N 3.22Å; Y269-I272 PolarHBondContact O-N 3.48Å; I270-I272 PolarHBondContact O-N 3.5Å; I272-L274 PolarHBondContact O-N 2.9Å; I272-T275 PolarHBondContact O-N 2.93Å; I272-T275 PolarHBondContact O-OG1 2.89Å; I272-H276 WeakPolarHBondContact CG2-CE1 3.04Å; I272-H276 PolarHBondContact O-N 3.41Å
273L95.4Very high91.8Very high31 Ų3138.4 Ų38.416%0.16221%0.211CC..Hα-helixtrans-57.5-37.4176.9-72.6170.3000112.1Y12 M15 E16 I19 Y269 I270 G277Y12-L273 HydrophobicContact CD2-CD1 4.15Å; Y12-L273 HydrophobicContact CD2-CD2 4.16Å; Y12-L273 HydrophobicContact CD2-CG 4Å; Y12-L273 HydrophobicContact CE2-CD2 4.24Å; Y12-L273 HydrophobicContact CE2-CG 4.11Å; M15-L273 HydrophobicContact CB-CD1 4.19Å; M15-L273 HydrophobicContact CB-CD2 3.75Å; E16-L273 HydrophobicContact CG-CD2 3.83Å; I19-L273 HydrophobicContact CD1-CB 4.35Å; I19-L273 HydrophobicContact CD1-CD2 3.71Å; Y269-L273 WeakPolarHBondContact O-CB 3.26Å; Y269-L273 VanDerWaalsContact O-CG 3.25Å; Y269-L273 WeakPolarHBondContact O-CG 3.33Å; Y269-L273 PolarHBondContact O-N 3.45Å; I270-L273 PolarHBondContact O-N 3.43Å; L273-G277 WeakPolarHBondContact O-CA 3.19Å; L273-G277 PolarHBondContact O-N 3.21Å
274L95.4Very high92Very high60 Ų6040.4 Ų40.431%0.31422%0.223SC..Hα-helixtrans-65.2-40.5175.6-78.8174.2000112.4S244 P247 I270 A271 I272 N278S244-L274 VanDerWaalsContact CB-O 3.23Å; S244-L274 WeakPolarHBondContact CB-O 3.44Å; S244-L274 CarbonylContact O-C 3.47Å; S244-L274 PolarHBondContact OG-O 3.35Å; P247-L274 HydrophobicContact CG-CD1 4.31Å; I270-L274 HydrophobicContact CG2-CD1 4Å; I270-L274 HydrophobicContact CG2-CG 4.36Å; I270-L274 WeakPolarHBondContact O-CB 3.41Å; I270-L274 VanDerWaalsContact O-CG 3.26Å; I270-L274 WeakPolarHBondContact O-CG 3.27Å; I270-L274 PolarHBondContact O-N 3.24Å; A271-L274 WeakPolarHBondContact O-CB 3.25Å; A271-L274 PolarHBondContact O-N 3.23Å; I272-L274 PolarHBondContact O-N 2.9Å; L274-N278 PolarHBondContact O-N 3.2Å
275T93.8Very high92Very high5 Ų537.8 Ų37.83%0.03121%0.206CC..Hα-helixtrans-65-47.417658.50000112S244 W245 L248 A271 I272 N278S244-T275 WeakPolarHBondContact O-CG2 3.26Å; S244-T275 PolarHBondContact O-N 3.38Å; W245-T275 HydrophobicContact CD2-CG2 4Å; W245-T275 HydrophobicContact CE3-CG2 3.69Å; W245-T275 HydrophobicContact CH2-CG2 4.23Å; W245-T275 HydrophobicContact CZ3-CG2 3.79Å; L248-T275 HydrophobicContact CB-CG2 4.07Å; L248-T275 HydrophobicContact CD2-CG2 3.85Å; A271-T275 WeakPolarHBondContact O-CG2 3.48Å; A271-T275 PolarHBondContact O-N 3.36Å; A271-T275 VanDerWaalsContact O-N 3.07Å; I272-T275 PolarHBondContact O-N 2.93Å; I272-T275 PolarHBondContact O-OG1 2.89Å; T275-N278 VanDerWaalsContact O-CB 3.26Å; T275-N278 WeakPolarHBondContact O-CB 3.49Å; T275-N278 PolarHBondContact O-N 3.49Å
276H93.7Very high92Very high15 Ų1533.7 Ų33.77%0.06919%0.185CC..Hα-helixtrans-69.4-37.2178.5-61.9163.6000112.1E16 I19 I63 I272 N278 S279E16-H276 IonicContact OE1-CE1 2.79Å; E16-H276 PolarHBondContact OE1-CE1 3Å; E16-H276 IonicContact OE1-ND1 2.99Å; E16-H276 PolarHBondContact OE1-ND1 2.94Å; E16-H276 IonicContact OE2-CE1 3.73Å; E16-H276 IonicContact OE2-CG 3.78Å; E16-H276 IonicContact OE2-ND1 3.75Å; E16-H276 PolarHBondContact OE2-ND1 2.88Å; I19-H276 HydrophobicContact CG2-CB 4.07Å; I19-H276 WeakPolarHBondContact CG2-O 3.44Å; I63-H276 HydrophobicContact CD1-CB 3.93Å; I63-H276 HydrophobicContact CG1-CB 4.05Å; I272-H276 WeakPolarHBondContact CG2-CE1 3.04Å; I272-H276 PolarHBondContact O-N 3.41Å; H276-N278 PolarHBondContact O-N 3.05Å; H276-S279 WeakPolarHBondContact O-CB 3.34Å; H276-S279 PolarHBondContact O-N 2.97Å; H276-S279 VanDerWaalsContact O-N 3.15Å
277G94.3Very high91.9Very high15 Ų1530.1 Ų30.116%0.15517%0.166CC..Hα-helixtrans-59.4-29176.700000113.3L273 S279 A280 V281L273-G277 WeakPolarHBondContact O-CA 3.19Å; L273-G277 PolarHBondContact O-N 3.21Å; G277-S279 PolarHBondContact O-N 3.09Å; G277-A280 PolarHBondContact O-N 3.42Å; G277-V281 WeakPolarHBondContact O-CG2 3.47Å; G277-V281 PolarHBondContact O-N 3.09Å; G277-V281 VanDerWaalsContact O-N 3.12Å
278N91.7Very high91.7Very high3 Ų333.1 Ų33.12%0.01618%0.175CC..Hα-helixtrans-54.3-39.1175.7-173.464000112.3L274 T275 H276 A280 V281L274-N278 PolarHBondContact O-N 3.2Å; T275-N278 VanDerWaalsContact O-CB 3.26Å; T275-N278 WeakPolarHBondContact O-CB 3.49Å; T275-N278 PolarHBondContact O-N 3.49Å; H276-N278 PolarHBondContact O-N 3.05Å; N278-A280 VanDerWaalsContact C-N 3.32Å; N278-A280 PolarHBondContact O-N 3.35Å; N278-V281 PolarHBondContact O-N 3.21Å
279S91.9Very high91.2Very high4 Ų436.1 Ų36.13%0.02818%0.184CC..Hα-helixtrans-66.5-31.2178.4-65.30000113S23 N27 D55 H276 G277S23-S279 WeakPolarHBondContact OG-CB 3.42Å; N27-S279 PolarHBondContact ND2-O 3.47Å; D55-S279 VanDerWaalsContact OD1-CB 3.27Å; D55-S279 WeakPolarHBondContact OD1-CB 3.28Å; D55-S279 PolarHBondContact OD1-OG 2.93Å; H276-S279 WeakPolarHBondContact O-CB 3.34Å; H276-S279 PolarHBondContact O-N 2.97Å; H276-S279 VanDerWaalsContact O-N 3.15Å; G277-S279 PolarHBondContact O-N 3.09Å
280A93.4Very high90.7Very high14 Ų1436.5 Ų36.512%0.11619%0.188CC..Hα-helixtrans-80-26.1176.400000113.3I19 A22 G277 N278I19-A280 HydrophobicContact CG2-CB 4.46Å; A22-A280 HydrophobicContact CB-CB 4.13Å; G277-A280 PolarHBondContact O-N 3.42Å; N278-A280 VanDerWaalsContact C-N 3.32Å; N278-A280 PolarHBondContact O-N 3.35Å
281V91.4Very high90.2Very high45 Ų4540 Ų4027%0.27320%0.2SC..Hα-helixtrans-74.9-29.2-177.6172.20000112.3L240 G277 N278 I284 V285L240-V281 HydrophobicContact CD1-CG1 3.8Å; L240-V281 HydrophobicContact CD2-CG1 4.47Å; G277-V281 WeakPolarHBondContact O-CG2 3.47Å; G277-V281 PolarHBondContact O-N 3.09Å; G277-V281 VanDerWaalsContact O-N 3.12Å; N278-V281 PolarHBondContact O-N 3.21Å; V281-I284 WeakPolarHBondContact O-CB 3.01Å; V281-I284 PolarHBondContact O-N 2.03Å; V281-I284 VanDerWaalsContact O-N 3.14Å; V281-V285 HydrophobicContact CG1-CG2 3.75Å; V281-V285 WeakPolarHBondContact O-CG2 3.45Å; V281-V285 PolarHBondContact O-N 2.65Å
282N88.8Confident89.7Confident7 Ų744.7 Ų44.74%0.03722%0.22CC..Hα-helixtrans-55.2-54.1-176.7-74.1-27.5000113.7D55 I284 V285 Y286D55-N282 PolarHBondContact OD2-ND2 3.14Å; N282-I284 VanDerWaalsContact C-N 3.28Å; N282-I284 PolarHBondContact O-N 3Å; N282-V285 PolarHBondContact O-N 3.28Å; N282-Y286 HydrophobicContact CB-CE2 4.29Å; N282-Y286 WeakPolarHBondContact O-CD2 3.32Å; N282-Y286 VanDerWaalsContact O-CG 3.25Å; N282-Y286 PolarHBondContact O-N 3.37Å
283P91Very high89.2Confident8 Ų843.2 Ų43.25%0.05221%0.213CC..Hα-helixtrans-57-37.9175.1-26.634.3000114.1N27 V30 Y286 A287N27-P283 HydrophobicContact CB-CG 4.45Å; N27-P283 WeakPolarHBondContact OD1-CG 3.08Å; V30-P283 HydrophobicContact CG2-CB 3.95Å; V30-P283 HydrophobicContact CG2-CG 4.02Å; P283-Y286 PolarHBondContact O-N 3.41Å; P283-A287 PolarHBondContact O-N 2.92Å
284I90.9Very high88.9Confident93 Ų9347.2 Ų47.248%0.47723%0.225SC..Hα-helixtrans-63.3-50.1178.4-60.6173.9000109.2V281 N282 Y286 A287 F288V281-I284 WeakPolarHBondContact O-CB 3.01Å; V281-I284 PolarHBondContact O-N 2.03Å; V281-I284 VanDerWaalsContact O-N 3.14Å; N282-I284 VanDerWaalsContact C-N 3.28Å; N282-I284 PolarHBondContact O-N 3Å; I284-Y286 VanDerWaalsContact C-N 3.26Å; I284-Y286 PolarHBondContact O-N 2.95Å; I284-A287 WeakPolarHBondContact O-CB 3.49Å; I284-A287 PolarHBondContact O-N 3.45Å; I284-A287 VanDerWaalsContact O-N 3.15Å; I284-F288 HydrophobicContact CG2-CD2 3.76Å; I284-F288 HydrophobicContact CG2-CE2 3.8Å; I284-F288 VanDerWaalsContact O-CD2 3.26Å; I284-F288 WeakPolarHBondContact O-CD2 3.5Å; I284-F288 PolarHBondContact O-N 3.4Å
285V87.6Confident88.5Confident13 Ų1347.3 Ų47.38%0.07923%0.229CC..Hα-helixtrans-56.9-42.6176.6174.20000110.7V237 L240 V281 N282 F288 R289V237-V285 HydrophobicContact CG2-CG1 3.94Å; L240-V285 HydrophobicContact CD1-CG2 3.73Å; V281-V285 HydrophobicContact CG1-CG2 3.75Å; V281-V285 WeakPolarHBondContact O-CG2 3.45Å; V281-V285 PolarHBondContact O-N 2.65Å; N282-V285 PolarHBondContact O-N 3.28Å; V285-F288 PolarHBondContact O-N 3.32Å; V285-R289 HydrophobicContact CG1-CG 3.95Å; V285-R289 WeakPolarHBondContact O-CB 3.3Å; V285-R289 VanDerWaalsContact O-CG 3.24Å; V285-R289 WeakPolarHBondContact O-CG 3.39Å; V285-R289 PolarHBondContact O-N 3.08Å
286Y86.1Confident88.2Confident18 Ų1847.4 Ų47.47%0.07123%0.23CC..Hα-helixtrans-64.5-42.4177.7-56.8-24.9000112.7V30 I48 L51 N282 P283 I284 F288 I290 F293V30-Y286 HydrophobicContact CG1-CD2 4.35Å; V30-Y286 HydrophobicContact CG1-CE2 4.39Å; V30-Y286 HydrophobicContact CG2-CD2 3.86Å; V30-Y286 HydrophobicContact CG2-CE2 4.35Å; I48-Y286 HydrophobicContact CG2-CD2 4.38Å; I48-Y286 HydrophobicContact CG2-CE2 3.76Å; L51-Y286 WeakPolarHBondContact CD2-OH 3.43Å; N282-Y286 HydrophobicContact CB-CE2 4.29Å; N282-Y286 WeakPolarHBondContact O-CD2 3.32Å; N282-Y286 VanDerWaalsContact O-CG 3.25Å; N282-Y286 PolarHBondContact O-N 3.37Å; P283-Y286 PolarHBondContact O-N 3.41Å; I284-Y286 VanDerWaalsContact C-N 3.26Å; I284-Y286 PolarHBondContact O-N 2.95Å; Y286-F288 VanDerWaalsContact C-N 3.34Å; Y286-F288 PolarHBondContact O-N 3.11Å; Y286-I290 HydrophobicContact CD1-CD1 3.87Å; Y286-I290 HydrophobicContact CG-CD1 4.35Å; Y286-I290 WeakPolarHBondContact O-CA 3.43Å; Y286-I290 WeakPolarHBondContact O-CB 3.35Å; Y286-I290 PolarHBondContact O-N 2.97Å; Y286-F293 HydrophobicContact CG-CD2 4.48Å
287A87.4Confident88Confident23 Ų2347.8 Ų47.819%0.1923%0.232CC..Hα-helixtrans-60.5-41.7177.500000112.3P283 I284 R294 F297P283-A287 PolarHBondContact O-N 2.92Å; I284-A287 WeakPolarHBondContact O-CB 3.49Å; I284-A287 PolarHBondContact O-N 3.45Å; I284-A287 VanDerWaalsContact O-N 3.15Å; A287-R294 WeakPolarHBondContact O-CB 3.44Å; A287-F297 HydrophobicContact CB-CD2 3.85Å; A287-F297 HydrophobicContact CB-CE2 3.89Å
288F86.4Confident87.7Confident161 Ų16152 Ų5271%0.70625%0.247SC*.Hα-helixtrans-82.2-36.2-178.3-77.5-78.3000113.4I284 V285 Y286I284-F288 HydrophobicContact CG2-CD2 3.76Å; I284-F288 HydrophobicContact CG2-CE2 3.8Å; I284-F288 VanDerWaalsContact O-CD2 3.26Å; I284-F288 WeakPolarHBondContact O-CD2 3.5Å; I284-F288 PolarHBondContact O-N 3.4Å; V285-F288 PolarHBondContact O-N 3.32Å; Y286-F288 VanDerWaalsContact C-N 3.34Å; Y286-F288 PolarHBondContact O-N 3.11Å
289R81.9Confident87.4Confident93 Ų9358.2 Ų58.235%0.35127%0.274SS..Hα-helixtrans-96.1-27.9-171.6-57.1-60.5-65.3-173.9-3.2113.7N229 S233 V285N229-R289 PolarHBondContact O-NH2 3.36Å; S233-R289 VanDerWaalsContact OG-CZ 3.25Å; S233-R289 PolarHBondContact OG-NE 3.28Å; S233-R289 PolarHBondContact OG-NH2 3.09Å; V285-R289 HydrophobicContact CG1-CG 3.95Å; V285-R289 WeakPolarHBondContact O-CB 3.3Å; V285-R289 VanDerWaalsContact O-CG 3.24Å; V285-R289 WeakPolarHBondContact O-CG 3.39Å; V285-R289 PolarHBondContact O-N 3.08Å
290I81.3Confident87.2Confident43 Ų4358.1 Ų58.122%0.22127%0.273CS..  trans-112.8100.8-173.3-52.2175000109.9Y286 K292 F293 R294Y286-I290 HydrophobicContact CD1-CD1 3.87Å; Y286-I290 HydrophobicContact CG-CD1 4.35Å; Y286-I290 WeakPolarHBondContact O-CA 3.43Å; Y286-I290 WeakPolarHBondContact O-CB 3.35Å; Y286-I290 PolarHBondContact O-N 2.97Å; I290-K292 HydrophobicContact CG2-CB 4.43Å; I290-K292 PolarHBondContact O-N 3.32Å; I290-F293 HydrophobicContact CB-CB 4.29Å; I290-F293 HydrophobicContact CB-CD2 3.97Å; I290-F293 HydrophobicContact CD1-CD2 3.9Å; I290-F293 HydrophobicContact CD1-CE2 4.24Å; I290-F293 HydrophobicContact CG2-CB 4.46Å; I290-F293 HydrophobicContact CG2-CD2 3.82Å; I290-F293 PolarHBondContact O-N 3.5Å; I290-R294 PolarHBondContact O-N 3.04Å; I290-R294 VanDerWaalsContact O-N 3.09Å
291K83.1Confident86.9Confident157 Ų15764 Ų6468%0.68329%0.293SS*.Hα-helixtrans-48.7-40.6-179.3-67.9-173.8179.7-175.10113.4R294 T295K291-R294 WeakPolarHBondContact O-CB 3.23Å; K291-R294 PolarHBondContact O-N 2.98Å; K291-T295 PolarHBondContact O-N 2.87Å; K291-T295 PolarHBondContact O-OG1 3.44Å; K291-T295 VanDerWaalsContact O-OG1 3.13Å
292K84Confident86.6Confident100 Ų10066.3 Ų66.344%0.43530%0.3SS..Hα-helixtrans-65.4-38.5-179.8-61.9-175.5174.4-176.20113S39 L40 I290 A296S39-K292 PolarHBondContact O-NZ 2.84Å; L40-K292 HydrophobicContact CD2-CB 3.49Å; L40-K292 VanDerWaalsContact CD2-CB 3.49Å; L40-K292 HydrophobicContact CD2-CD 3.77Å; L40-K292 HydrophobicContact CD2-CG 4.32Å; L40-K292 HydrophobicContact CG-CB 4.46Å; I290-K292 HydrophobicContact CG2-CB 4.43Å; I290-K292 PolarHBondContact O-N 3.32Å; K292-A296 WeakPolarHBondContact O-CB 3.29Å; K292-A296 PolarHBondContact O-N 3.32Å; K292-A296 VanDerWaalsContact O-N 3.07Å
293F84.8Confident86.3Confident0 Ų070.3 Ų70.30%032%0.319CS..Hα-helixtrans-68.1-44.1174.1-90.8-68.3000110.8V30 A33 V34 L40 F45 I48 Y286 I290 T295 A296 F297V30-F293 HydrophobicContact CG1-CE1 3.95Å; V30-F293 HydrophobicContact CG1-CZ 4.07Å; A33-F293 HydrophobicContact CB-CD1 3.99Å; A33-F293 HydrophobicContact CB-CE1 4.04Å; V34-F293 HydrophobicContact CG2-CE1 3.97Å; V34-F293 HydrophobicContact CG2-CZ 3.84Å; L40-F293 HydrophobicContact CD1-CD1 4.35Å; L40-F293 HydrophobicContact CD1-CE1 4.32Å; F45-F293 HydrophobicContact CD1-CE2 4Å; F45-F293 HydrophobicContact CD1-CZ 4.03Å; F45-F293 HydrophobicContact CE1-CD2 4.44Å; F45-F293 AromaticContact CE1-CE2 3.64Å; F45-F293 HydrophobicContact CE1-CE2 3.64Å; F45-F293 HydrophobicContact CE1-CZ 4.07Å; I48-F293 HydrophobicContact CD1-CE2 4.26Å; I48-F293 HydrophobicContact CG2-CE2 4.41Å; I48-F293 HydrophobicContact CG2-CZ 4.03Å; Y286-F293 HydrophobicContact CG-CD2 4.48Å; I290-F293 HydrophobicContact CB-CB 4.29Å; I290-F293 HydrophobicContact CB-CD2 3.97Å; I290-F293 HydrophobicContact CD1-CD2 3.9Å; I290-F293 HydrophobicContact CD1-CE2 4.24Å; I290-F293 HydrophobicContact CG2-CB 4.46Å; I290-F293 HydrophobicContact CG2-CD2 3.82Å; I290-F293 PolarHBondContact O-N 3.5Å; F293-T295 VanDerWaalsContact C-N 3.34Å; F293-T295 PolarHBondContact O-N 3.21Å; F293-A296 PolarHBondContact O-N 2.95Å; F293-A296 VanDerWaalsContact O-N 3.08Å; F293-F297 HydrophobicContact CB-CE2 4.34Å; F293-F297 HydrophobicContact CB-CZ 4.4Å; F293-F297 AromaticContact CD1-CE1 3.87Å; F293-F297 HydrophobicContact CD1-CE1 3.87Å; F293-F297 AromaticContact CD1-CZ 3.78Å; F293-F297 HydrophobicContact CD1-CZ 3.78Å; F293-F297 HydrophobicContact CG-CZ 4.43Å; F293-F297 VanDerWaalsContact O-CG 3.3Å; F293-F297 WeakPolarHBondContact O-CG 3.44Å; F293-F297 PolarHBondContact O-N 3.4Å
294R88.3Confident85.8Confident114 Ų11475.2 Ų75.243%0.4334%0.337SS..Hα-helixtrans-53.9-49.5175.6-166.5171.865.2-173.16112.4A287 I290 K291 A296 F297 Q298A287-R294 WeakPolarHBondContact O-CB 3.44Å; I290-R294 PolarHBondContact O-N 3.04Å; I290-R294 VanDerWaalsContact O-N 3.09Å; K291-R294 WeakPolarHBondContact O-CB 3.23Å; K291-R294 PolarHBondContact O-N 2.98Å; R294-A296 VanDerWaalsContact C-N 3.34Å; R294-A296 PolarHBondContact O-N 2.99Å; R294-F297 PolarHBondContact O-N 3.3Å; R294-Q298 WeakPolarHBondContact O-CB 3.48Å; R294-Q298 VanDerWaalsContact O-CG 3.3Å; R294-Q298 WeakPolarHBondContact O-CG 3.38Å; R294-Q298 PolarHBondContact O-N 3.01Å
295T87.6Confident85.4Confident63 Ų6376.5 Ų76.539%0.38734%0.339SS..Hα-helixtrans-64.6-38.5177.6-56.20000111.9K291 F293 K299K291-T295 PolarHBondContact O-N 2.87Å; K291-T295 PolarHBondContact O-OG1 3.44Å; K291-T295 VanDerWaalsContact O-OG1 3.13Å; F293-T295 VanDerWaalsContact C-N 3.34Å; F293-T295 PolarHBondContact O-N 3.21Å; T295-K299 WeakPolarHBondContact O-CG 3.41Å; T295-K299 PolarHBondContact O-N 2.96Å
296A87Confident85.1Confident7 Ų778.9 Ų78.96%0.05836%0.356CS..Hα-helixtrans-65.7-44.2176.500000112A33 L40 K292 F293 R294 K299 I300A33-A296 HydrophobicContact CB-CB 3.79Å; L40-A296 HydrophobicContact CD1-CB 4.26Å; K292-A296 WeakPolarHBondContact O-CB 3.29Å; K292-A296 PolarHBondContact O-N 3.32Å; K292-A296 VanDerWaalsContact O-N 3.07Å; F293-A296 PolarHBondContact O-N 2.95Å; F293-A296 VanDerWaalsContact O-N 3.08Å; R294-A296 VanDerWaalsContact C-N 3.34Å; R294-A296 PolarHBondContact O-N 2.99Å; A296-K299 PolarHBondContact O-N 3.49Å; A296-I300 WeakPolarHBondContact O-CG1 3.25Å; A296-I300 PolarHBondContact O-N 3.02Å
297F89.5Confident84.1Confident23 Ų2383.3 Ų83.310%0.10139%0.388CS..Hα-helixtrans-62.9-42.4176.2-65.4-16.8000111.9M29 V30 A33 A287 F293 R294 K299 I300 W301M29-F297 HydrophobicContact CB-CD1 4.42Å; M29-F297 HydrophobicContact CB-CE1 4.09Å; M29-F297 HydrophobicContact CE-CB 4.22Å; M29-F297 HydrophobicContact CE-CD1 4.18Å; M29-F297 HydrophobicContact CE-CG 4.15Å; M29-F297 WeakPolarHBondContact O-CE1 3.34Å; V30-F297 HydrophobicContact CG2-CZ 3.88Å; A33-F297 HydrophobicContact CB-CD1 3.98Å; A33-F297 HydrophobicContact CB-CE1 3.71Å; A287-F297 HydrophobicContact CB-CD2 3.85Å; A287-F297 HydrophobicContact CB-CE2 3.89Å; F293-F297 HydrophobicContact CB-CE2 4.34Å; F293-F297 HydrophobicContact CB-CZ 4.4Å; F293-F297 AromaticContact CD1-CE1 3.87Å; F293-F297 HydrophobicContact CD1-CE1 3.87Å; F293-F297 AromaticContact CD1-CZ 3.78Å; F293-F297 HydrophobicContact CD1-CZ 3.78Å; F293-F297 HydrophobicContact CG-CZ 4.43Å; F293-F297 VanDerWaalsContact O-CG 3.3Å; F293-F297 WeakPolarHBondContact O-CG 3.44Å; F293-F297 PolarHBondContact O-N 3.4Å; R294-F297 PolarHBondContact O-N 3.3Å; F297-K299 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.25Å; F297-I300 PolarHBondContact O-N 3.13Å; F297-W301 WeakPolarHBondContact O-CB 3.5Å; F297-W301 PolarHBondContact O-N 2.9Å
298Q87.3Confident82.9Confident104 Ų10489.1 Ų89.149%0.48641%0.409SS..Hα-helixtrans-60.6-42.3174.6-74.7173.9-26.100112.1R294 W301 Q302R294-Q298 WeakPolarHBondContact O-CB 3.48Å; R294-Q298 VanDerWaalsContact O-CG 3.3Å; R294-Q298 WeakPolarHBondContact O-CG 3.38Å; R294-Q298 PolarHBondContact O-N 3.01Å; Q298-W301 PolarHBondContact O-N 3.2Å; Q298-Q302 WeakPolarHBondContact O-CB 3.5Å; Q298-Q302 VanDerWaalsContact O-CG 3.24Å; Q298-Q302 WeakPolarHBondContact O-CG 3.4Å; Q298-Q302 PolarHBondContact O-N 3.42Å
299K85.9Confident81.2Confident132 Ų13291 Ų9157%0.57442%0.42SS*.Hα-helixtrans-64.1-46.6176-75.2-175.8177.8-164.90112T295 A296 F297 W301 Q302 Q303T295-K299 WeakPolarHBondContact O-CG 3.41Å; T295-K299 PolarHBondContact O-N 2.96Å; A296-K299 PolarHBondContact O-N 3.49Å; F297-K299 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.25Å; K299-W301 VanDerWaalsContact C-N 3.3Å; K299-W301 PolarHBondContact O-N 3.17Å; K299-Q302 PolarHBondContact O-N 3.21Å; K299-Q303 VanDerWaalsContact O-CB 3.23Å; K299-Q303 WeakPolarHBondContact O-CB 3.49Å; K299-Q303 PolarHBondContact O-N 2.9Å
300I87.1Confident79.7Confident3 Ų390.8 Ų90.82%0.01543%0.43CS..Hα-helixtrans-58.5-46.1176.5-68.8166.4000110W32 A33 I36 A296 F297 Q303 Y304 F305W32-I300 HydrophobicContact CB-CD1 4.35Å; W32-I300 HydrophobicContact CD2-CD1 4.34Å; W32-I300 HydrophobicContact CD2-CG2 4.29Å; W32-I300 HydrophobicContact CE3-CG2 3.87Å; W32-I300 HydrophobicContact CG-CD1 4.18Å; W32-I300 HydrophobicContact CH2-CG2 4.15Å; W32-I300 HydrophobicContact CZ3-CG2 3.8Å; A33-I300 HydrophobicContact CB-CD1 4.08Å; I36-I300 HydrophobicContact CD1-CD1 4.41Å; I36-I300 HydrophobicContact CD1-CG1 4.06Å; A296-I300 WeakPolarHBondContact O-CG1 3.25Å; A296-I300 PolarHBondContact O-N 3.02Å; F297-I300 PolarHBondContact O-N 3.13Å; I300-Q303 PolarHBondContact O-N 3.44Å; I300-Y304 HydrophobicContact CG2-CD2 4.21Å; I300-Y304 WeakPolarHBondContact O-CB 3.34Å; I300-Y304 WeakPolarHBondContact O-CD2 3.41Å; I300-Y304 PolarHBondContact O-N 2.85Å; I300-F305 HydrophobicContact CG2-CE2 4.34Å
301W86.7Confident78Confident138 Ų13895.8 Ų95.852%0.52346%0.456SS..Iπ-helixtrans-59.5-49.6177.9-171-92.6000112.3F297 Q298 K299 Q303 F305 C306F297-W301 WeakPolarHBondContact O-CB 3.5Å; F297-W301 PolarHBondContact O-N 2.9Å; Q298-W301 PolarHBondContact O-N 3.2Å; K299-W301 VanDerWaalsContact C-N 3.3Å; K299-W301 PolarHBondContact O-N 3.17Å; W301-Q303 PolarHBondContact O-N 3.08Å; W301-F305 HydrophobicContact CD2-CB 4.04Å; W301-F305 HydrophobicContact CD2-CG 4.45Å; W301-F305 HydrophobicContact CE3-CB 4.09Å; W301-F305 AromaticContact CE3-CD2 3.96Å; W301-F305 HydrophobicContact CE3-CD2 3.96Å; W301-F305 HydrophobicContact CE3-CG 4Å; W301-F305 HydrophobicContact CZ3-CB 4.35Å; W301-F305 HydrophobicContact CZ3-CD1 4.42Å; W301-F305 HydrophobicContact CZ3-CD2 4.43Å; W301-F305 HydrophobicContact CZ3-CG 4.16Å; W301-F305 CarbonylContact O-C 3.58Å; W301-F305 WeakPolarHBondContact O-CA 3.23Å; W301-F305 WeakPolarHBondContact O-CB 3.38Å; W301-F305 PolarHBondContact O-N 3.14Å; W301-C306 VanDerWaalsContact CD1-SG 3.51Å; W301-C306 PolarHBondContact NE1-SG 3.44Å; W301-C306 PolarHBondContact O-N 3.29Å
302Q85.7Confident76.1Confident93 Ų9393.2 Ų93.244%0.43546%0.464SS..Iπ-helixtrans-64-41.1-179.2-73.6172-6.200112.9Q298 K299 K308Q298-Q302 WeakPolarHBondContact O-CB 3.5Å; Q298-Q302 VanDerWaalsContact O-CG 3.24Å; Q298-Q302 WeakPolarHBondContact O-CG 3.4Å; Q298-Q302 PolarHBondContact O-N 3.42Å; K299-Q302 PolarHBondContact O-N 3.21Å; Q302-K308 PolarHBondContact O-N 2.7Å; Q302-K308 VanDerWaalsContact O-N 3.16Å
303Q82.3Confident74.2Confident90 Ų9095.9 Ų95.942%0.42148%0.482SS..Iπ-helixtrans-77.4-40.8-175.1-174.6174.12.600112.8K299 I300 W301K299-Q303 VanDerWaalsContact O-CB 3.23Å; K299-Q303 WeakPolarHBondContact O-CB 3.49Å; K299-Q303 PolarHBondContact O-N 2.9Å; I300-Q303 PolarHBondContact O-N 3.44Å; W301-Q303 PolarHBondContact O-N 3.08Å
304Y81.5Confident71.9Confident112 Ų112103 Ų10344%0.43952%0.52SS..Iπ-helixtrans-108.2-24.8-170.1-65.6-81.7000114.5W32 I300W32-Y304 AromaticContact CH2-CD1 3.96Å; W32-Y304 HydrophobicContact CH2-CD1 3.96Å; W32-Y304 AromaticContact CH2-CD2 3.69Å; W32-Y304 HydrophobicContact CH2-CD2 3.69Å; W32-Y304 HydrophobicContact CH2-CE1 4.28Å; W32-Y304 HydrophobicContact CH2-CE2 4.05Å; W32-Y304 AromaticContact CH2-CG 3.64Å; W32-Y304 HydrophobicContact CH2-CG 3.64Å; W32-Y304 HydrophobicContact CZ2-CD1 4.06Å; W32-Y304 AromaticContact CZ2-CD2 3.63Å; W32-Y304 HydrophobicContact CZ2-CD2 3.63Å; W32-Y304 AromaticContact CZ2-CE1 3.91Å; W32-Y304 HydrophobicContact CZ2-CE1 3.91Å; W32-Y304 AromaticContact CZ2-CE2 3.47Å; W32-Y304 HydrophobicContact CZ2-CE2 3.47Å; W32-Y304 VanDerWaalsContact CZ2-CE2 3.47Å; W32-Y304 AromaticContact CZ2-CG 3.92Å; W32-Y304 HydrophobicContact CZ2-CG 3.92Å; W32-Y304 AromaticContact CZ2-CZ 3.62Å; I300-Y304 HydrophobicContact CG2-CD2 4.21Å; I300-Y304 WeakPolarHBondContact O-CB 3.34Å; I300-Y304 WeakPolarHBondContact O-CD2 3.41Å; I300-Y304 PolarHBondContact O-N 2.85Å
305F83.1Confident69.5Low119 Ų119106.3 Ų106.352%0.52254%0.538SS..Iπ-helixtrans-110.4-28.2-177.1-65.2-87000113.2I300 W301I300-F305 HydrophobicContact CG2-CE2 4.34Å; W301-F305 HydrophobicContact CD2-CB 4.04Å; W301-F305 HydrophobicContact CD2-CG 4.45Å; W301-F305 HydrophobicContact CE3-CB 4.09Å; W301-F305 AromaticContact CE3-CD2 3.96Å; W301-F305 HydrophobicContact CE3-CD2 3.96Å; W301-F305 HydrophobicContact CE3-CG 4Å; W301-F305 HydrophobicContact CZ3-CB 4.35Å; W301-F305 HydrophobicContact CZ3-CD1 4.42Å; W301-F305 HydrophobicContact CZ3-CD2 4.43Å; W301-F305 HydrophobicContact CZ3-CG 4.16Å; W301-F305 CarbonylContact O-C 3.58Å; W301-F305 WeakPolarHBondContact O-CA 3.23Å; W301-F305 WeakPolarHBondContact O-CB 3.38Å; W301-F305 PolarHBondContact O-N 3.14Å
306C79.5Confident66.9Low63 Ų63112.5 Ų112.543%0.42656%0.563SS.*SBendtrans-992.2174.1-64.70000114.2W301 K308W301-C306 VanDerWaalsContact CD1-SG 3.51Å; W301-C306 PolarHBondContact NE1-SG 3.44Å; W301-C306 PolarHBondContact O-N 3.29Å; C306-K308 PolarHBondContact O-N 3.3Å
307C65.4Low64.3Low111 Ų111121.5 Ų121.575%0.7560%0.603SS**  trans44.735-178.9-64.10000114.2E309C307-E309 PolarHBondContact O-N 3.43Å
308K63.1Low61.5Low145 Ų145124.8 Ų124.863%0.6363%0.629SS**  trans-81.2113.8170.4-77.2-171.5174.7-174.40107.6Q302 C306 T310Q302-K308 PolarHBondContact O-N 2.7Å; Q302-K308 VanDerWaalsContact O-N 3.16Å; C306-K308 PolarHBondContact O-N 3.3Å; K308-T310 PolarHBondContact O-N 3.32Å; K308-T310 PolarHBondContact O-OG1 2.83Å
309E50.8Low59.2Low200 Ų200126.9 Ų126.994%0.93564%0.644SS**  trans-53.4103.6164.2-88.4-175.7148.800108.2C307 L311C307-E309 PolarHBondContact O-N 3.43Å; E309-L311 PolarHBondContact O-N 2.99Å
310T50.4Low56.5Low90 Ų90131.2 Ų131.255%0.55266%0.657SS**  trans-82.1104.6168.2-50.80000104.8K308 A312K308-T310 PolarHBondContact O-N 3.32Å; K308-T310 PolarHBondContact O-OG1 2.83Å; T310-A312 PolarHBondContact O-N 3.37Å; T310-A312 VanDerWaalsContact O-N 3.17Å
311L45.9Very low53.9Low148 Ų148141.2 Ų141.278%0.77570%0.7SS**  trans-38.4125.5164.2-90.4160.8000108E309 L313E309-L311 PolarHBondContact O-N 2.99Å; L311-L313 PolarHBondContact O-N 2.99Å
312A42.8Very low51.3Low103 Ų103140.4 Ų140.485%0.85171%0.706SS**  trans-59.385.8175.100000108.7T310T310-A312 PolarHBondContact O-N 3.37Å; T310-A312 VanDerWaalsContact O-N 3.17Å
313L44.4Very low48.8Very low156 Ų156145.4 Ų145.482%0.81773%0.726SS**  trans-83.8118.8174.3-80.4169.4000107.6L311L311-L313 PolarHBondContact O-N 2.99Å
314D36.7Very low46.4Very low149 Ų149147 Ų14780%0.79774%0.744SS**  trans-32.1134.8-175.2-76.7-47.5000115.2Q316D314-Q316 PolarHBondContact O-N 3.42Å
315F36.9Very low43.9Very low184 Ų184148.8 Ų148.881%0.80776%0.761SS**  trans-56.2101158.5-80.3-86.5000108.4Q317F315-Q317 PolarHBondContact O-N 2.95Å
316Q34Very low41.5Very low193 Ų193148.4 Ų148.490%0.90277%0.769SS**  trans-59.3100.2169.4-80.9-169.5-57.600110.1D314 S318D314-Q316 PolarHBondContact O-N 3.42Å; Q316-S318 PolarHBondContact O-N 3.47Å
317Q31.8Very low39.1Very low195 Ų195153.8 Ų153.891%0.91179%0.787SS**  trans-82.792.8161.2-168162.8-8.400106.6F315F315-Q317 PolarHBondContact O-N 2.95Å
318S31.2Very low37.8Very low93 Ų93153.4 Ų153.465%0.6578%0.784SS**  trans-82.8135.9170.2-173.50000109.6Q316Q316-S318 PolarHBondContact O-N 3.47Å
319D37.1Very low36.2Very low148 Ų148155.7 Ų155.779%0.79179%0.793SS**  trans86.980.6166-59.3-57.5000119
320R30.6Very low35.4Very low223 Ų223152.4 Ų152.484%0.84279%0.789SS**  trans-155104130.8-145.8176.5-167.6167.36.1110.7D322R320-D322 WeakPolarHBondContact CD-OD2 3.41Å; R320-D322 IonicContact CZ-OD2 2.85Å; R320-D322 IonicContact NE-OD2 2.86Å; R320-D322 PolarHBondContact NE-OD2 2.93Å; R320-D322 PolarHBondContact O-N 3Å
321K33.1Very low34.3Very low213 Ų213152.6 Ų152.693%0.92680%0.8SS**  trans-79.6103.5160.3-91.7-178.2176.7175.40107.1
322D31Very low33.5Very low120 Ų120149.9 Ų149.964%0.64280%0.799SS**  trans-116.7112.9157.9-81.6-42.1000107.5R320R320-D322 WeakPolarHBondContact CD-OD2 3.41Å; R320-D322 IonicContact CZ-OD2 2.85Å; R320-D322 IonicContact NE-OD2 2.86Å; R320-D322 PolarHBondContact NE-OD2 2.93Å; R320-D322 PolarHBondContact O-N 3Å
323K33Very low32.7Very low199 Ų199150.6 Ų150.687%0.86580%0.798SS**  trans-78.5143.7164.7-80.9-176.9172.3-174.50108.3
324P33.1Very low32.2Very low123 Ų123148.9 Ų148.980%0.79980%0.796SS**  trans-110.9123.4151.922.1-4.7000111.2
325N27.9Very low31.7Very low149 Ų149151 Ų15180%0.79780%0.801SS**  trans-94152.5151-93.35.6000105.4
326V32.6Very low31.3Very low112 Ų112147.8 Ų147.868%0.67980%0.799SS**  cis-170.3159.915140.20000105
327E30.3Very low30.8Very low175 Ų175142.8 Ų142.882%0.81879%0.79SS**  164.6171.2110.4-131.8155.7156.300110.9
328P37.1Very low30.8Very low103 Ų103142.8 Ų142.867%0.66979%0.79SS**  -132.6164.2-100.943-24.6000117.4
329K30.3Very low30.5Very low193 Ų193147.8 Ų147.884%0.83980%0.803SS**  trans60.3157.8150.2-94.9-177.2-178.2178.70119.6
330P32.4Very low30.1Very low131 Ų131144.3 Ų144.385%0.85180%0.803SS**  cis-138.5178.442.833.7-9.8000117.4
331A29.3Very low29.9Very low94 Ų94140.3 Ų140.378%0.77780%0.802SS**  trans-97.5155.6-168.800000114.9
332A28.7Very low29.4Very low91 Ų91138.4 Ų138.475%0.75280%0.795SS**  trans-170105.8151.600000108.9
333S26Very low29.2Very low118 Ų118141.5 Ų141.583%0.82580%0.802SS**  101149.896.455.60000114.2
334P33.2Very low28.8Very low120 Ų120136.5 Ų136.578%0.77979%0.792SS**  trans-112.8162.5-134.139.8-32.4000116
335Q25.9Very low28.5Very low193 Ų193140.5 Ų140.590%0.90279%0.793SS**  trans-144.7156.9164.8-85.3-162-12.500112.6
336P29.1Very low28.7Very low118 Ų118138.7 Ų138.777%0.76679%0.789SS**  trans-104.6166-133.238.5-35000116.8
337A24.1Very low28.3Very low87 Ų87139 Ų13972%0.71980%0.796SS**  trans0.4126.5162.300000120.1
338H30.5Very low28.2Very low196 Ų196138.9 Ų138.991%0.90780%0.8SS**  trans-134.7124.5138.4-96.4-77.5000109.6
339E25.6Very low27.7Very low197 Ų197142.6 Ų142.692%0.92181%0.809SS**  trans-65.4143.1174.9-71.3173.6128.900112
340G27.4Very low27.6Very low76 Ų76141.8 Ų141.878%0.78481%0.813SS**  trans-168.577.2178.200000112.8
341V26.3Very low27.4Very low138 Ų138144.2 Ų144.284%0.83681%0.813SS**  trans-10.9121.7164-179.20000119
342F24Very low27.8Very low174 Ų174144.9 Ų144.976%0.76381%0.809SS**  trans48.1118.8135.9-125-94.5000121.9
343K25.8Very low28.2Very low185 Ų185146.2 Ų146.280%0.80481%0.81SS**  -161.5105.7128.4-106.8171.3-170.9-178.80111.1
344S24.3Very low28.5Very low93 Ų93146.9 Ų146.965%0.6581%0.812SS**PPolyproline II helixtrans-70.7126.1166.7490000110.6
345Y27.8Very low28.4Very low208 Ų208148.9 Ų148.982%0.81682%0.815SS**PPolyproline II helixtrans-101.5138.2162.4-84-85.6000109.2
346P32.4Very low28.6Very low110 Ų110146.7 Ų146.771%0.71481%0.805SS**PPolyproline II helixtrans-75.7147.1178.930.4-32.3000111.7L348P346-L348 PolarHBondContact O-N 2.69Å
347S24.5Very low28.6Very low119 Ų119147.4 Ų147.483%0.83280%0.802SS**PPolyproline II helixtrans-58.7121.8170.1-44.90000110.4
348L26.9Very low28.7Very low172 Ų172149.9 Ų149.990%0.90180%0.798SS**  trans-89.5110.8163.8-109.194.4000109P346P346-L348 PolarHBondContact O-N 2.69Å
349E27.6Very low28.5Very low181 Ų181147.6 Ų147.685%0.84679%0.793SS**  trans-58.5140.5162.7-88.5161.4114.100111.2Q351E349-Q351 PolarHBondContact O-N 3.3Å
350L27.3Very low28.7Very low177 Ų177146.4 Ų146.493%0.92779%0.787SS**  trans-78.2106175.9-160.878.1000108.7
351Q28.9Very low28.6Very low181 Ų181152.5 Ų152.585%0.84680%0.795SS**PPolyproline II helixtrans-78.2130.7175.4-138.2161.71.600109.9E349E349-Q351 PolarHBondContact O-N 3.3Å
352P36.8Very low28.8Very low108 Ų108154.4 Ų154.470%0.70179%0.792SS**PPolyproline II helixtrans-75.7152.8174.829.8-31.5000111.4
353P38.5Very low29Very low119 Ų119153.6 Ų153.677%0.77379%0.794SS**PPolyproline II helixtrans-72.8149.3178.528.3-31.7000112
354P31.6Very low29.3Very low133 Ų133152 Ų15286%0.86479%0.793SS**PPolyproline II helixtrans-78.2139.7177.5-8.125.3000113.8
355L30.7Very low29.5Very low162 Ų162153.1 Ų153.185%0.84880%0.796SS**PPolyproline II helixtrans-61.2158.7157.5-79.9134.6000110.9
356E31.2Very low29.6Very low146 Ų146149 Ų14968%0.68280%0.798SS**  cis-158.9170.633.7-72.3-169.6123.400108.5
357L28.1Very low29.4Very low134 Ų134151.7 Ų151.770%0.70280%0.801SS**  -174120.563.2-135.799.4000107.6
358Q25.7Very low29.7Very low139 Ų139155.2 Ų155.265%0.6580%0.801SS**  92146.791.6-81.3-176.43.400115.3
359D27.1Very low29.8Very low148 Ų148152.4 Ų152.479%0.79179%0.791SS**  trans77.2122.2-179.7-55.8-26.8000116.1
360E30.4Very low29.8Very low172 Ų172153.7 Ų153.780%0.80479%0.79SS**  cis-162.8119.815.3-128.7-173.6110.600107.3
361Q25.8Very low30Very low203 Ų203154.5 Ų154.595%0.94979%0.786SS**  trans-128.983.2166.1-152.2164.58.900108.9
362K29.1Very low30.2Very low179 Ų179153.8 Ų153.878%0.77879%0.787SS**  trans-139.7109.7166.6-113.4179.9-176.51780102.7
363I28.8Very low30.1Very low156 Ų156154 Ų15480%0.879%0.788SS**  -173.2130.973.9-84143.2000107.7
364I31.6Very low30.2Very low152 Ų152154 Ų15478%0.77979%0.788SS**  trans-80.3133.9166.2-77.5173.1000108.2
365T28.8Very low30.2Very low117 Ų117156.9 Ų156.972%0.71879%0.788SS**  trans63.6111.4150.6-460000119.3
366S29Very low30.4Very low122 Ų122155.5 Ų155.585%0.85379%0.785SS**  trans-142.6122.1141.6-158.90000110.9
367Q29.8Very low30.8Very low165 Ų165156.6 Ų156.677%0.77179%0.791SS**  trans-53.2143.1169.9-74159-58.400111.8
368K29.6Very low31Very low193 Ų193159.2 Ų159.284%0.83980%0.799SS**  trans-149.7100.4143.8-114.3174.3-173178.30111.4Y370K368-Y370 HydrophobicContact CG-CD2 4.38Å; K368-Y370 HydrophobicContact CG-CE2 4.31Å
369T29.2Very low31.4Very low113 Ų113157.4 Ų157.469%0.69380%0.802SS**  trans-70.5120161.6-44.10000108.9
370Y28Very low32.1Very low209 Ų209157 Ų15782%0.8281%0.805SS**  trans-148.9108.2156.3-83.6-72.7000112.5K368K368-Y370 HydrophobicContact CG-CD2 4.38Å; K368-Y370 HydrophobicContact CG-CE2 4.31Å
371K30.6Very low32.5Very low193 Ų193157 Ų15784%0.83983%0.834SS**  trans-12.2138.8157.7-70.9171.3171.8-178.80119.9
372L33.5Very low32.9Very low166 Ų166154.7 Ų154.787%0.86983%0.828SS**  trans-60.4153.6154.5-99.686.9000112.6
373P34.9Very low33.1Very low113 Ų113153.4 Ų153.473%0.73483%0.831SS**  trans-126.3171.5140.129.4-11.1000112.7
374P40.7Very low33.3Very low119 Ų119153.3 Ų153.377%0.77383%0.833SS**  trans-105.3173.2-137.239.7-35.5000116.4
375F31.2Very low33.4Very low194 Ų194153.4 Ų153.485%0.85184%0.836SS**  trans-28.4133.7162.7-114.3-107.7000115.8
376V36.3Very low33.7Very low132 Ų132155.6 Ų155.680%0.884%0.843SS**  trans-132.1121150.2177.50000108.6
377E38.2Very low34Very low169 Ų169157.9 Ų157.979%0.7984%0.843SS**  trans-77.7133.1170.3-169.7-180169.900108.9
378Q33.2Very low34.3Very low189 Ų189157.4 Ų157.488%0.88385%0.848SS**  trans-158.7126.2154.3-116.9167.98.100113.3
379S34.2Very low34.7Very low102 Ų102154.6 Ų154.671%0.71385%0.848SS**  trans-82.7166176.451.50000113.7
380V40.3Very low35.1Very low139 Ų139158.1 Ų158.184%0.84286%0.861SS**  trans87.3105.3155.9-165.60000117.6
381A40.5Very low35.8Very low172 Ų172153.5 Ų153.5100%1.42187%0.865SS**  -164011100000109.6

Retrieved 381 of 381 residues in 624 ms (Link to these results)