A0A087YJJ8_POEFO Loading...

Large neutral amino acids transporter small subunit 4

AlphaFold DB , UniProt , Accession A0A087YJJ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 592 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
1M41.6Very low72.8Confident242 Ų242104.7 Ų104.7100%1.19262%0.617SS**  0135.70-87.5172.2-169.100108.6
2A52.4Low73.9Confident93 Ų93101.5 Ų101.577%0.76959%0.586SS**PPolyproline II helixtrans-64.7138.6166.900000108.7
3P69.4Low75Confident89 Ų89101.9 Ų101.958%0.57857%0.572SS**PPolyproline II helixtrans-61.5147.5179.524.8-32.6000110.7T7P3-T7 WeakPolarHBondContact CB-OG1 3.49Å
4T78.3Confident76.1Confident87 Ų87104.9 Ų104.953%0.53457%0.57SS.*PPolyproline II helixtrans-61.7154.3170.968.80000110.7A6 T7 A8T4-A6 PolarHBondContact O-N 2.91Å; T4-T7 WeakPolarHBondContact CA-OG1 3.45Å; T4-T7 PolarHBondContact N-OG1 3.06Å; T4-T7 PolarHBondContact O-N 3.31Å; T4-T7 PolarHBondContact O-OG1 3.32Å; T4-T7 WeakPolarHBondContact OG1-CG2 3.35Å; T4-T7 PolarHBondContact OG1-N 3.06Å; T4-T7 PolarHBondContact OG1-OG1 3.23Å; T4-A8 PolarHBondContact O-N 3.15Å
5L74.4Confident77Confident159 Ų15998.4 Ų98.483%0.83254%0.535SS*.Hα-helixtrans-54.5-40.5178.5-165.190.3000112.1A8 F9L5-A8 PolarHBondContact O-N 2.88Å; L5-F9 WeakPolarHBondContact O-CB 3.37Å; L5-F9 PolarHBondContact O-N 3.24Å
6A76.9Confident77.7Confident73 Ų7392.3 Ų92.360%0.60350%0.502SS*.Hα-helixtrans-63.3-44.9176.700000112T4 A8 F9 A10T4-A6 PolarHBondContact O-N 2.91Å; A6-A8 VanDerWaalsContact C-N 3.34Å; A6-A8 PolarHBondContact O-N 2.92Å; A6-F9 PolarHBondContact O-N 3.32Å; A6-A10 WeakPolarHBondContact O-CB 3.25Å; A6-A10 PolarHBondContact O-N 3.3Å
7T80.6Confident78.5Confident72 Ų7291.2 Ų91.244%0.44250%0.499SS..Hα-helixtrans-66.4-34.817651.70000112.7P3 T4 R11P3-T7 WeakPolarHBondContact CB-OG1 3.49Å; T4-T7 WeakPolarHBondContact CA-OG1 3.45Å; T4-T7 PolarHBondContact N-OG1 3.06Å; T4-T7 PolarHBondContact O-N 3.31Å; T4-T7 PolarHBondContact O-OG1 3.32Å; T4-T7 WeakPolarHBondContact OG1-CG2 3.35Å; T4-T7 PolarHBondContact OG1-N 3.06Å; T4-T7 PolarHBondContact OG1-OG1 3.23Å; T7-R11 VanDerWaalsContact O-CB 3.25Å; T7-R11 WeakPolarHBondContact O-CB 3.45Å; T7-R11 PolarHBondContact O-N 2.7Å
8A76.9Confident79.3Confident47 Ų4787.1 Ų87.139%0.38848%0.476SS..Hα-helixtrans-67.6-40.8175.100000111.7T4 L5 A6 R12T4-A8 PolarHBondContact O-N 3.15Å; L5-A8 PolarHBondContact O-N 2.88Å; A6-A8 VanDerWaalsContact C-N 3.34Å; A6-A8 PolarHBondContact O-N 2.92Å; A8-R12 WeakPolarHBondContact O-CB 3.25Å; A8-R12 PolarHBondContact O-N 3.48Å
9F81.1Confident80Confident125 Ų12582.5 Ų82.555%0.54845%0.451SS..Hα-helixtrans-64.8-47.4175.5-172-95.7000112L5 A6 R11 R12 W13L5-F9 WeakPolarHBondContact O-CB 3.37Å; L5-F9 PolarHBondContact O-N 3.24Å; A6-F9 PolarHBondContact O-N 3.32Å; F9-R11 PolarHBondContact O-N 3.38Å; F9-R12 WeakPolarHBondContact O-CB 3.49Å; F9-R12 PolarHBondContact O-N 3.38Å; F9-W13 AromaticContact CD1-CD1 3.78Å; F9-W13 AromaticContact CE1-CD1 3.45Å; F9-W13 VanDerWaalsContact CE1-CD1 3.45Å; F9-W13 AromaticContact CE1-NE1 3.37Å; F9-W13 AromaticContact CE2-NE1 3.61Å; F9-W13 AromaticContact CZ-CD1 3.66Å; F9-W13 AromaticContact CZ-NE1 3.09Å; F9-W13 PolarHBondContact O-N 3.3Å; F9-W13 VanDerWaalsContact O-N 3.17Å
10A84.6Confident80.6Confident61 Ų6180.1 Ų80.150%0.50444%0.438SS..Hα-helixtrans-60.4-44.5176.700000111.8A6 R12 W13 W14A6-A10 WeakPolarHBondContact O-CB 3.25Å; A6-A10 PolarHBondContact O-N 3.3Å; A10-R12 VanDerWaalsContact C-N 3.33Å; A10-R12 PolarHBondContact O-N 3.49Å; A10-W13 PolarHBondContact O-N 2.98Å; A10-W14 WeakPolarHBondContact O-CB 3.34Å; A10-W14 PolarHBondContact O-N 3.12Å
11R84.9Confident81.2Confident104 Ų10480.5 Ų80.539%0.39244%0.438SS..Hα-helixtrans-62.8-38.6177.1-174.6175.4175.2167.53.4112.3T7 F9 W14 M15 F255 N256T7-R11 VanDerWaalsContact O-CB 3.25Å; T7-R11 WeakPolarHBondContact O-CB 3.45Å; T7-R11 PolarHBondContact O-N 2.7Å; F9-R11 PolarHBondContact O-N 3.38Å; R11-W14 PolarHBondContact O-N 2.96Å; R11-M15 HydrophobicContact CG-CE 4.33Å; R11-M15 HydrophobicContact CG-CG 4.46Å; R11-M15 HydrophobicContact CG-SD 4.46Å; R11-M15 VanDerWaalsContact O-CG 3.29Å; R11-M15 WeakPolarHBondContact O-CG 3.14Å; R11-M15 PolarHBondContact O-N 3.29Å; R11-F255 PolarHBondContact NH2-O 3.16Å; R11-F255 VanDerWaalsContact NH2-O 3.13Å; R11-N256 PolarHBondContact NE-O 3.47Å; R11-N256 VanDerWaalsContact NH2-C 3.31Å; R11-N256 PolarHBondContact NH2-O 3.37Å
12R85.6Confident83.7Confident66 Ų6669.5 Ų69.525%0.24938%0.384CS..Hα-helixtrans-60.7-46176.1172.3175.5164.9-166.5-14111.9A8 F9 A10 A16 M199 F200A8-R12 WeakPolarHBondContact O-CB 3.25Å; A8-R12 PolarHBondContact O-N 3.48Å; F9-R12 WeakPolarHBondContact O-CB 3.49Å; F9-R12 PolarHBondContact O-N 3.38Å; A10-R12 VanDerWaalsContact C-N 3.33Å; A10-R12 PolarHBondContact O-N 3.49Å; R12-A16 PolarHBondContact O-N 3.19Å; R12-A16 VanDerWaalsContact O-N 3.11Å; R12-M199 HydrophobicContact CB-CE 4.05Å; R12-M199 HydrophobicContact CG-CE 3.92Å; R12-M199 PolarHBondContact NE-O 2.85Å; R12-M199 PolarHBondContact NH1-O 3.46Å; R12-M199 VanDerWaalsContact NH1-O 3.17Å; R12-M199 PolarHBondContact NH2-O 3.3Å; R12-F200 HydrophobicContact CG-CE1 4.17Å; R12-F200 HydrophobicContact CG-CE2 3.91Å; R12-F200 HydrophobicContact CG-CZ 3.52Å; R12-F200 VanDerWaalsContact NE-CE1 3.33Å; R12-F200 VanDerWaalsContact NH2-CA 3.34Å
13W88Confident85.7Confident107 Ų10765 Ų6541%0.40535%0.347SS..Hα-helixtrans-69.1-39.9177.1-80.6101.3000112.7F9 A10 M15 A16 V17 F200 F207F9-W13 AromaticContact CD1-CD1 3.78Å; F9-W13 AromaticContact CE1-CD1 3.45Å; F9-W13 VanDerWaalsContact CE1-CD1 3.45Å; F9-W13 AromaticContact CE1-NE1 3.37Å; F9-W13 AromaticContact CE2-NE1 3.61Å; F9-W13 AromaticContact CZ-CD1 3.66Å; F9-W13 AromaticContact CZ-NE1 3.09Å; F9-W13 PolarHBondContact O-N 3.3Å; F9-W13 VanDerWaalsContact O-N 3.17Å; A10-W13 PolarHBondContact O-N 2.98Å; W13-M15 PolarHBondContact O-N 2.93Å; W13-A16 PolarHBondContact O-N 3.46Å; W13-V17 WeakPolarHBondContact O-CG2 3.37Å; W13-V17 PolarHBondContact O-N 2.92Å; W13-F200 HydrophobicContact CZ2-CE1 4.5Å; W13-F207 HydrophobicContact CH2-CZ 4.2Å; W13-F207 AromaticContact CZ3-CZ 4Å; W13-F207 HydrophobicContact CZ3-CZ 4Å
14W90.7Very high86.8Confident143 Ų14362.9 Ų62.954%0.54233%0.331SS..Hα-helixtrans-54.6-54172.6178.9-94.9000111.1A10 R11 A16 V17 T18 N252 N256A10-W14 WeakPolarHBondContact O-CB 3.34Å; A10-W14 PolarHBondContact O-N 3.12Å; R11-W14 PolarHBondContact O-N 2.96Å; W14-A16 VanDerWaalsContact C-N 3.27Å; W14-A16 PolarHBondContact O-N 3.33Å; W14-V17 PolarHBondContact O-N 2.97Å; W14-T18 HydrophobicContact CD2-CG2 4Å; W14-T18 HydrophobicContact CG-CG2 4.33Å; W14-T18 HydrophobicContact CH2-CG2 4.5Å; W14-T18 HydrophobicContact CZ2-CG2 3.85Å; W14-T18 WeakPolarHBondContact O-CG2 3.48Å; W14-T18 PolarHBondContact O-N 3.47Å; W14-T18 PolarHBondContact O-OG1 2.91Å; W14-T18 VanDerWaalsContact O-OG1 3.07Å; W14-N252 PolarHBondContact NE1-OD1 3.01Å; W14-N256 PolarHBondContact NE1-ND2 2.94Å
15M89.3Confident87.6Confident8 Ų861.9 Ų61.94%0.03932%0.322CS..Hα-helixtrans-59.8-38.1179.5-68.3-176.1-60.600112.3R11 W13 T18 A19 L196 M199 N256 W257R11-M15 HydrophobicContact CG-CE 4.33Å; R11-M15 HydrophobicContact CG-CG 4.46Å; R11-M15 HydrophobicContact CG-SD 4.46Å; R11-M15 VanDerWaalsContact O-CG 3.29Å; R11-M15 WeakPolarHBondContact O-CG 3.14Å; R11-M15 PolarHBondContact O-N 3.29Å; W13-M15 PolarHBondContact O-N 2.93Å; M15-T18 PolarHBondContact O-OG1 3.17Å; M15-A19 WeakPolarHBondContact O-CB 3.28Å; M15-A19 PolarHBondContact O-N 3.25Å; M15-L196 HydrophobicContact CB-CD1 3.67Å; M15-M199 HydrophobicContact CE-CE 3.75Å; M15-M199 HydrophobicContact CE-SD 3.76Å; M15-N256 HydrophobicContact CG-CB 4.24Å; M15-W257 HydrophobicContact CB-CZ3 4.22Å
16A88.8Confident88.5Confident1 Ų154.5 Ų54.51%0.00828%0.283CS..Hα-helixtrans-65.2-49.9178.100000111.8R12 W13 W14 A19 I20 L196 F200 F207R12-A16 PolarHBondContact O-N 3.19Å; R12-A16 VanDerWaalsContact O-N 3.11Å; W13-A16 PolarHBondContact O-N 3.46Å; W14-A16 VanDerWaalsContact C-N 3.27Å; W14-A16 PolarHBondContact O-N 3.33Å; A16-A19 PolarHBondContact O-N 3.47Å; A16-I20 VanDerWaalsContact O-CD1 3.28Å; A16-I20 WeakPolarHBondContact O-CD1 3.35Å; A16-I20 VanDerWaalsContact O-CG1 3.23Å; A16-I20 WeakPolarHBondContact O-CG1 3.25Å; A16-I20 PolarHBondContact O-N 2.89Å; A16-L196 HydrophobicContact CB-CD2 3.84Å; A16-F200 HydrophobicContact CB-CE2 4.03Å; A16-F200 HydrophobicContact CB-CZ 3.7Å; A16-F207 HydrophobicContact CB-CE1 3.91Å
17V91.3Very high89.2Confident74 Ų7451 Ų5145%0.44825%0.254SS..Hα-helixtrans-64.8-47179.9173.80000110.9W13 W14 A19 I20 I21W13-V17 WeakPolarHBondContact O-CG2 3.37Å; W13-V17 PolarHBondContact O-N 2.92Å; W14-V17 PolarHBondContact O-N 2.97Å; V17-A19 VanDerWaalsContact C-N 3.3Å; V17-A19 PolarHBondContact O-N 2.77Å; V17-I20 PolarHBondContact O-N 2.87Å; V17-I21 HydrophobicContact CG1-CD1 3.89Å; V17-I21 WeakPolarHBondContact O-CG1 3.08Å; V17-I21 PolarHBondContact O-N 3.32Å; V17-I21 VanDerWaalsContact O-N 3.12Å
18T92.9Very high89.7Confident16 Ų1647.6 Ų47.610%0.09823%0.233CC..Hα-helixtrans-63.5-38.5178.760.50000111.2W14 M15 I20 I21 E22 N252W14-T18 HydrophobicContact CD2-CG2 4Å; W14-T18 HydrophobicContact CG-CG2 4.33Å; W14-T18 HydrophobicContact CH2-CG2 4.5Å; W14-T18 HydrophobicContact CZ2-CG2 3.85Å; W14-T18 WeakPolarHBondContact O-CG2 3.48Å; W14-T18 PolarHBondContact O-N 3.47Å; W14-T18 PolarHBondContact O-OG1 2.91Å; W14-T18 VanDerWaalsContact O-OG1 3.07Å; M15-T18 PolarHBondContact O-OG1 3.17Å; T18-I20 VanDerWaalsContact C-N 3.32Å; T18-I20 PolarHBondContact O-N 2.89Å; T18-I21 PolarHBondContact O-N 2.9Å; T18-E22 WeakPolarHBondContact O-CB 3.48Å; T18-E22 WeakPolarHBondContact O-CG 3.43Å; T18-E22 PolarHBondContact O-N 3.18Å; T18-N252 VanDerWaalsContact CB-ND2 3.35Å; T18-N252 WeakPolarHBondContact CB-ND2 3.31Å; T18-N252 PolarHBondContact OG1-ND2 3.45Å; T18-N252 VanDerWaalsContact OG1-ND2 3.1Å
19A91.7Very high90.5Very high0 Ų045.4 Ų45.40%022%0.215CC..Hα-helixtrans-64.9-34.5178.500000113.4M15 A16 V17 N23 L196 M211 W257M15-A19 WeakPolarHBondContact O-CB 3.28Å; M15-A19 PolarHBondContact O-N 3.25Å; A16-A19 PolarHBondContact O-N 3.47Å; V17-A19 VanDerWaalsContact C-N 3.3Å; V17-A19 PolarHBondContact O-N 2.77Å; A19-N23 WeakPolarHBondContact O-CB 3.41Å; A19-N23 PolarHBondContact O-N 2.69Å; A19-N23 PolarHBondContact O-ND2 2.91Å; A19-N23 PolarHBondContact O-OD1 3.37Å; A19-L196 HydrophobicContact CB-CD1 4.29Å; A19-M211 HydrophobicContact CB-CE 3.73Å; A19-M211 HydrophobicContact CB-SD 4.37Å; A19-W257 HydrophobicContact CB-CH2 3.83Å; A19-W257 HydrophobicContact CB-CZ3 4.28Å
20I92.4Very high91Very high35 Ų3539.4 Ų39.418%0.17919%0.189CC..Hα-helixtrans-67.3-47.2175.3-64.4158000110.2A16 V17 T18 N23 L24 L210 M211A16-I20 VanDerWaalsContact O-CD1 3.28Å; A16-I20 WeakPolarHBondContact O-CD1 3.35Å; A16-I20 VanDerWaalsContact O-CG1 3.23Å; A16-I20 WeakPolarHBondContact O-CG1 3.25Å; A16-I20 PolarHBondContact O-N 2.89Å; V17-I20 PolarHBondContact O-N 2.87Å; T18-I20 VanDerWaalsContact C-N 3.32Å; T18-I20 PolarHBondContact O-N 2.89Å; I20-N23 PolarHBondContact O-N 2.9Å; I20-L24 WeakPolarHBondContact O-CB 3.46Å; I20-L24 PolarHBondContact O-N 3.38Å; I20-L210 HydrophobicContact CB-CD2 4.33Å; I20-L210 HydrophobicContact CD1-CD2 3.17Å; I20-L210 HydrophobicContact CG1-CD2 3.38Å; I20-L210 HydrophobicContact CG2-CD2 3.97Å; I20-M211 HydrophobicContact CG1-CE 4.1Å; I20-M211 HydrophobicContact CG1-SD 4.19Å
21I93.6Very high91.3Very high88 Ų8836.6 Ų36.645%0.45117%0.165SC..Hα-helixtrans-64.2-43.9177.9-64.6169.5000110.4V17 T18 L24 L25V17-I21 HydrophobicContact CG1-CD1 3.89Å; V17-I21 WeakPolarHBondContact O-CG1 3.08Å; V17-I21 PolarHBondContact O-N 3.32Å; V17-I21 VanDerWaalsContact O-N 3.12Å; T18-I21 PolarHBondContact O-N 2.9Å; I21-L24 PolarHBondContact O-N 2.96Å; I21-L25 HydrophobicContact CG2-CD1 3.85Å; I21-L25 HydrophobicContact CG2-CG 4.45Å; I21-L25 WeakPolarHBondContact O-CG 3.44Å; I21-L25 PolarHBondContact O-N 3.45Å
22E94.2Very high91.5Very high11 Ų1131.8 Ų31.85%0.05115%0.148CC..Hα-helixtrans-63.6-42.7178.9-74.2169.7-172.200111.4T18 L25 F26 R147 V249 N252T18-E22 WeakPolarHBondContact O-CB 3.48Å; T18-E22 WeakPolarHBondContact O-CG 3.43Å; T18-E22 PolarHBondContact O-N 3.18Å; E22-L25 PolarHBondContact O-N 3Å; E22-F26 WeakPolarHBondContact O-CB 3.43Å; E22-F26 WeakPolarHBondContact O-CD2 3.22Å; E22-F26 PolarHBondContact O-N 3.27Å; E22-R147 IonicContact OE2-CZ 2.71Å; E22-R147 IonicContact OE2-NE 3.78Å; E22-R147 PolarHBondContact OE2-NE 3.21Å; E22-R147 IonicContact OE2-NH2 2.77Å; E22-R147 PolarHBondContact OE2-NH2 3.31Å; E22-V249 HydrophobicContact CG-CB 4.41Å; E22-V249 HydrophobicContact CG-CG1 3.93Å; E22-V249 HydrophobicContact CG-CG2 3.71Å; E22-N252 PolarHBondContact OE1-ND2 3.1Å
23N93.1Very high91.9Very high0 Ų028.7 Ų28.70%014%0.136CC..Hα-helixtrans-61.2-50.9171.8-73.5-8.8000110.3A19 I20 L25 F26 S27 S193 M211 S214 S218A19-N23 WeakPolarHBondContact O-CB 3.41Å; A19-N23 PolarHBondContact O-N 2.69Å; A19-N23 PolarHBondContact O-ND2 2.91Å; A19-N23 PolarHBondContact O-OD1 3.37Å; I20-N23 PolarHBondContact O-N 2.9Å; N23-L25 PolarHBondContact O-N 3.15Å; N23-L25 VanDerWaalsContact O-N 3.15Å; N23-F26 PolarHBondContact O-N 3.17Å; N23-S27 VanDerWaalsContact O-CB 3.26Å; N23-S27 WeakPolarHBondContact O-CB 3.29Å; N23-S27 PolarHBondContact O-N 3.18Å; N23-S27 PolarHBondContact O-OG 3.17Å; N23-S193 WeakPolarHBondContact ND2-CB 3.32Å; N23-S193 WeakPolarHBondContact OD1-CB 3.39Å; N23-S193 PolarHBondContact OD1-OG 2.78Å; N23-M211 PolarHBondContact ND2-SD 3.44Å; N23-S214 VanDerWaalsContact CB-OG 3.29Å; N23-S214 WeakPolarHBondContact CB-OG 3.3Å; N23-S214 PolarHBondContact ND2-OG 3.05Å; N23-S218 VanDerWaalsContact O-CB 3.26Å; N23-S218 WeakPolarHBondContact O-CB 3.48Å
24L93.6Very high92Very high43 Ų4323.8 Ų23.823%0.22512%0.119CC..Hα-helixtrans-54.7-39.2-178.1-171.469000112.4I20 I21 S218 V220 T221 L397I20-L24 WeakPolarHBondContact O-CB 3.46Å; I20-L24 PolarHBondContact O-N 3.38Å; I21-L24 PolarHBondContact O-N 2.96Å; L24-S218 WeakPolarHBondContact O-CA 3.22Å; L24-S218 WeakPolarHBondContact O-CB 3.19Å; L24-V220 HydrophobicContact CD1-CG1 4.07Å; L24-V220 HydrophobicContact CG-CG1 4.46Å; L24-T221 PolarHBondContact O-OG1 2.76Å; L24-L397 HydrophobicContact CD1-CD2 4.14Å
25L94.6Very high92Very high66 Ų6617.1 Ų17.135%0.3469%0.094SC..Hα-helixtrans-94.1-20.8-174.7-65177.8000115.1I21 E22 N23 V29 T221 W242I21-L25 HydrophobicContact CG2-CD1 3.85Å; I21-L25 HydrophobicContact CG2-CG 4.45Å; I21-L25 WeakPolarHBondContact O-CG 3.44Å; I21-L25 PolarHBondContact O-N 3.45Å; E22-L25 PolarHBondContact O-N 3Å; N23-L25 PolarHBondContact O-N 3.15Å; N23-L25 VanDerWaalsContact O-N 3.15Å; L25-V29 WeakPolarHBondContact O-CG1 3.4Å; L25-T221 HydrophobicContact CD2-CG2 4.28Å; L25-W242 WeakPolarHBondContact O-CZ2 3.25Å; L25-W242 PolarHBondContact O-NE1 3.05Å
26F94.7Very high92.2Very high5 Ų516.8 Ų16.82%0.0229%0.092CC..Hα-helixtrans-133.8-4.3-168.2-56-82.6000115.1E22 N23 F154 G186 M189 W242 C245 A246 V249E22-F26 WeakPolarHBondContact O-CB 3.43Å; E22-F26 WeakPolarHBondContact O-CD2 3.22Å; E22-F26 PolarHBondContact O-N 3.27Å; N23-F26 PolarHBondContact O-N 3.17Å; F26-F154 HydrophobicContact CB-CD2 4.44Å; F26-F154 HydrophobicContact CB-CE2 4.31Å; F26-F154 HydrophobicContact CB-CZ 4.34Å; F26-F154 AromaticContact CD1-CD1 3.65Å; F26-F154 HydrophobicContact CD1-CD1 3.65Å; F26-F154 AromaticContact CD1-CE1 3.48Å; F26-F154 HydrophobicContact CD1-CE1 3.48Å; F26-F154 VanDerWaalsContact CD1-CE1 3.48Å; F26-F154 HydrophobicContact CD1-CG 4.35Å; F26-F154 HydrophobicContact CD1-CZ 4.03Å; F26-F154 HydrophobicContact CE1-CD1 4.38Å; F26-F154 HydrophobicContact CE1-CE1 4.19Å; F26-F154 HydrophobicContact CG-CE1 4.46Å; F26-F154 VanDerWaalsContact O-CD2 3.29Å; F26-F154 WeakPolarHBondContact O-CD2 3.29Å; F26-F154 WeakPolarHBondContact O-CE2 3.38Å; F26-G186 WeakPolarHBondContact O-CA 3.42Å; F26-M189 HydrophobicContact CB-CE 3.58Å; F26-M189 HydrophobicContact CB-SD 3.59Å; F26-M189 VanDerWaalsContact CB-SD 3.59Å; F26-M189 HydrophobicContact CG-CE 4.46Å; F26-M189 HydrophobicContact CG-SD 4.33Å; F26-W242 AromaticContact CD1-NE1 3.73Å; F26-W242 AromaticContact CE1-CD1 3.47Å; F26-W242 VanDerWaalsContact CE1-CD1 3.47Å; F26-W242 AromaticContact CE1-NE1 3.39Å; F26-C245 HydrophobicContact CE1-CB 4.29Å; F26-C245 HydrophobicContact CZ-CB 3.69Å; F26-A246 HydrophobicContact CD1-CB 4.23Å; F26-A246 HydrophobicContact CE1-CB 3.87Å; F26-V249 HydrophobicContact CD2-CG2 3.87Å; F26-V249 HydrophobicContact CE2-CG2 3.5Å; F26-V249 HydrophobicContact CZ-CG2 4.04Å
27S90.8Very high92.4Very high0 Ų016.8 Ų16.80%09%0.092CC..THydrogen-bonded Turntrans-84.3-60.6-172.164.40000115.9N23 L127 G186 T190 S218N23-S27 VanDerWaalsContact O-CB 3.26Å; N23-S27 WeakPolarHBondContact O-CB 3.29Å; N23-S27 PolarHBondContact O-N 3.18Å; N23-S27 PolarHBondContact O-OG 3.17Å; S27-L127 WeakPolarHBondContact O-CD1 3.48Å; S27-G186 CarbonylContact O-C 3.58Å; S27-G186 VanDerWaalsContact O-C 3.27Å; S27-G186 WeakPolarHBondContact O-CA 3.3Å; S27-T190 WeakPolarHBondContact CB-OG1 3.43Å; S27-S218 WeakPolarHBondContact OG-CB 3.23Å; S27-S218 PolarHBondContact OG-OG 3.47Å; S27-S218 VanDerWaalsContact OG-OG 3.12Å
28A90.9Very high92.4Very high0 Ų014.1 Ų14.10%08%0.075CC..SBendtrans-132.137.4-166.800000109.7L30 L31 L127 Y215 S218A28-L30 PolarHBondContact O-N 3.34Å; A28-L31 HydrophobicContact CB-CD1 3.68Å; A28-L31 HydrophobicContact CB-CG 4.25Å; A28-L31 VanDerWaalsContact O-CB 3.3Å; A28-L31 WeakPolarHBondContact O-CB 3.31Å; A28-L31 WeakPolarHBondContact O-CG 3.3Å; A28-L31 PolarHBondContact O-N 3.35Å; A28-L127 HydrophobicContact CB-CD2 4.17Å; A28-Y215 HydrophobicContact CB-CD2 3.67Å; A28-Y215 HydrophobicContact CB-CE2 3.34Å; A28-Y215 HydrophobicContact CB-CG 4.43Å; A28-S218 VanDerWaalsContact C-OG 3.23Å; A28-S218 WeakPolarHBondContact CA-OG 3.31Å; A28-S218 WeakPolarHBondContact CB-OG 3.44Å; A28-S218 PolarHBondContact N-OG 3.09Å
29V92.8Very high92.4Very high0 Ų013.4 Ų13.40%07%0.071CC..G310 helixtrans-58.9-34-173.1-57.20000110.4L25 L31 G32 F154 N182 T221 F222 W242L25-V29 WeakPolarHBondContact O-CG1 3.4Å; V29-L31 PolarHBondContact O-N 3.06Å; V29-G32 WeakPolarHBondContact O-CA 3.41Å; V29-G32 PolarHBondContact O-N 2.85Å; V29-F154 HydrophobicContact CG1-CE2 4.5Å; V29-F154 HydrophobicContact CG1-CZ 4.26Å; V29-F154 HydrophobicContact CG2-CE2 3.83Å; V29-F154 HydrophobicContact CG2-CZ 3.81Å; V29-N182 WeakPolarHBondContact CG2-OD1 3.28Å; V29-T221 HydrophobicContact CG1-CG2 4.35Å; V29-F222 HydrophobicContact CB-CD2 4.34Å; V29-F222 HydrophobicContact CB-CE2 3.89Å; V29-F222 HydrophobicContact CB-CZ 4.15Å; V29-F222 HydrophobicContact CG2-CE2 3.84Å; V29-F222 HydrophobicContact CG2-CZ 3.79Å; V29-F222 WeakPolarHBondContact O-CD2 3.42Å; V29-F222 WeakPolarHBondContact O-CE2 3.31Å; V29-W242 HydrophobicContact CB-CH2 4Å; V29-W242 HydrophobicContact CB-CZ2 4.21Å; V29-W242 HydrophobicContact CG1-CH2 4.14Å; V29-W242 HydrophobicContact CG1-CZ2 3.81Å; V29-W242 HydrophobicContact CG2-CH2 3.86Å; V29-W242 HydrophobicContact CG2-CZ2 4.28Å
30L92.7Very high92.5Very high0 Ų013.4 Ų13.40%07%0.071CC..G310 helixtrans-49.7-28.2173.9-62.9-175000113.8A28 G32 W33 F120 L179 N182 F222A28-L30 PolarHBondContact O-N 3.34Å; L30-G32 PolarHBondContact O-N 3.15Å; L30-W33 WeakPolarHBondContact O-CA 3.24Å; L30-W33 WeakPolarHBondContact O-CB 3.39Å; L30-W33 PolarHBondContact O-N 2.6Å; L30-F120 VanDerWaalsContact O-CE2 3.26Å; L30-F120 WeakPolarHBondContact O-CE2 3.28Å; L30-L179 HydrophobicContact CD2-CD2 3.56Å; L30-N182 HydrophobicContact CD1-CB 4.47Å; L30-N182 HydrophobicContact CD2-CB 4.24Å; L30-N182 HydrophobicContact CG-CB 4.5Å; L30-F222 HydrophobicContact CD2-CE2 4.42Å
31L90Very high92.5Very high2 Ų212.5 Ų12.51%0.017%0.066CC..G310 helixtrans-75-3.9179.1-54.6175.2000112.6A28 V29 W33 L127 A219 L364 M367 Q396 R484A28-L31 HydrophobicContact CB-CD1 3.68Å; A28-L31 HydrophobicContact CB-CG 4.25Å; A28-L31 VanDerWaalsContact O-CB 3.3Å; A28-L31 WeakPolarHBondContact O-CB 3.31Å; A28-L31 WeakPolarHBondContact O-CG 3.3Å; A28-L31 PolarHBondContact O-N 3.35Å; V29-L31 PolarHBondContact O-N 3.06Å; L31-W33 VanDerWaalsContact C-N 3.3Å; L31-L127 HydrophobicContact CD1-CD2 3.93Å; L31-L127 HydrophobicContact CD2-CD2 4.27Å; L31-L127 HydrophobicContact CG-CD2 4.06Å; L31-A219 VanDerWaalsContact C-CB 3.42Å; L31-A219 HydrophobicContact CB-CB 4.05Å; L31-L364 HydrophobicContact CD2-CD2 3.5Å; L31-M367 HydrophobicContact CB-SD 3.9Å; L31-M367 HydrophobicContact CD2-CE 4.2Å; L31-M367 HydrophobicContact CD2-SD 4.28Å; L31-Q396 PolarHBondContact O-NE2 3.49Å; L31-Q396 VanDerWaalsContact O-NE2 3.17Å; L31-R484 VanDerWaalsContact CD1-CZ 3.41Å
32G90.4Very high92.4Very high3 Ų38.5 Ų8.53%0.0315%0.045CC..G310 helixtrans-92.424.4164.500000113.4V29 L30 G34 S35 A219V29-G32 WeakPolarHBondContact O-CA 3.41Å; V29-G32 PolarHBondContact O-N 2.85Å; L30-G32 PolarHBondContact O-N 3.15Å; G32-G34 VanDerWaalsContact C-N 3.27Å; G32-G34 PolarHBondContact O-N 3Å; G32-G34 VanDerWaalsContact O-N 3.13Å; G32-S35 PolarHBondContact O-N 3.04Å; G32-A219 VanDerWaalsContact CA-O 3.28Å; G32-A219 WeakPolarHBondContact CA-O 3.37Å
33W92.5Very high92.4Very high1 Ų19.8 Ų9.80%0.0045%0.051CC..Hα-helixtrans-47.5-42.1-170.9177.8-116000114.5L30 L31 S35 L36 L37 L40 L116 N117 F120 L179L30-W33 WeakPolarHBondContact O-CA 3.24Å; L30-W33 WeakPolarHBondContact O-CB 3.39Å; L30-W33 PolarHBondContact O-N 2.6Å; L31-W33 VanDerWaalsContact C-N 3.3Å; W33-S35 VanDerWaalsContact C-N 3.26Å; W33-S35 PolarHBondContact O-N 3.21Å; W33-S35 VanDerWaalsContact O-N 3.15Å; W33-L36 HydrophobicContact CE3-CB 4.4Å; W33-L36 HydrophobicContact CE3-CD2 3.93Å; W33-L36 HydrophobicContact CE3-CG 4.42Å; W33-L36 HydrophobicContact CZ3-CD2 3.78Å; W33-L36 HydrophobicContact CZ3-CG 4.31Å; W33-L36 CarbonylContact O-C 3.55Å; W33-L36 WeakPolarHBondContact O-CA 3.4Å; W33-L36 PolarHBondContact O-N 2.9Å; W33-L37 HydrophobicContact CD2-CB 4.38Å; W33-L37 HydrophobicContact CZ2-CB 4.22Å; W33-L37 HydrophobicContact CZ2-CD1 3.82Å; W33-L37 HydrophobicContact CZ2-CG 4.48Å; W33-L37 WeakPolarHBondContact O-CB 3.32Å; W33-L37 PolarHBondContact O-N 2.75Å; W33-L40 HydrophobicContact CH2-CD1 4.04Å; W33-L40 HydrophobicContact CZ3-CD1 4.13Å; W33-L116 HydrophobicContact CH2-CB 4.15Å; W33-L116 VanDerWaalsContact CH2-O 3.28Å; W33-L116 WeakPolarHBondContact CH2-O 3.45Å; W33-L116 VanDerWaalsContact CZ2-C 3.48Å; W33-L116 HydrophobicContact CZ2-CB 3.86Å; W33-L116 WeakPolarHBondContact CZ2-O 3.37Å; W33-N117 PolarHBondContact NE1-OD1 3.5Å; W33-F120 HydrophobicContact CB-CD2 3.75Å; W33-F120 HydrophobicContact CB-CE2 3.77Å; W33-F120 HydrophobicContact CB-CG 4.33Å; W33-F120 HydrophobicContact CB-CZ 4.34Å; W33-F120 HydrophobicContact CD2-CB 3.66Å; W33-F120 AromaticContact CD2-CD2 3.79Å; W33-F120 HydrophobicContact CD2-CD2 3.79Å; W33-F120 AromaticContact CD2-CG 3.79Å; W33-F120 HydrophobicContact CD2-CG 3.79Å; W33-F120 HydrophobicContact CE3-CB 3.89Å; W33-F120 AromaticContact CE3-CD2 3.97Å; W33-F120 HydrophobicContact CE3-CD2 3.97Å; W33-F120 HydrophobicContact CE3-CG 4.23Å; W33-F120 HydrophobicContact CG-CB 4.22Å; W33-F120 HydrophobicContact CG-CD1 4.38Å; W33-F120 AromaticContact CG-CD2 3.7Å; W33-F120 HydrophobicContact CG-CD2 3.7Å; W33-F120 HydrophobicContact CG-CE2 4.17Å; W33-F120 AromaticContact CG-CG 3.82Å; W33-F120 HydrophobicContact CG-CG 3.82Å; W33-F120 HydrophobicContact CH2-CB 4.01Å; W33-F120 HydrophobicContact CZ2-CB 3.77Å; W33-F120 HydrophobicContact CZ3-CB 4.06Å; W33-L179 HydrophobicContact CH2-CD1 4.39Å; W33-L179 HydrophobicContact CZ3-CD1 3.99Å
34G90.1Very high92.3Very high4 Ų49.8 Ų9.84%0.0415%0.051CC..Hα-helixtrans-53.5-39.8-176.900000114G32 I38 N371 S389G32-G34 VanDerWaalsContact C-N 3.27Å; G32-G34 PolarHBondContact O-N 3Å; G32-G34 VanDerWaalsContact O-N 3.13Å; G34-I38 WeakPolarHBondContact O-CD1 3.46Å; G34-I38 WeakPolarHBondContact O-CG1 3.45Å; G34-I38 PolarHBondContact O-N 3.11Å; G34-N371 PolarHBondContact O-ND2 3.23Å; G34-S389 PolarHBondContact O-OG 3.49Å
35S92Very high92.3Very high2 Ų27.8 Ų7.81%0.0144%0.041CC..Hα-helixtrans-73.8-39176.4-64.50000112.3G32 W33 M39 P223G32-S35 PolarHBondContact O-N 3.04Å; W33-S35 VanDerWaalsContact C-N 3.26Å; W33-S35 PolarHBondContact O-N 3.21Å; W33-S35 VanDerWaalsContact O-N 3.15Å; S35-M39 PolarHBondContact O-N 2.99Å; S35-P223 WeakPolarHBondContact OG-CG 3.23Å
36L93Very high92.3Very high1 Ų14.6 Ų4.61%0.0052%0.024CC..Hα-helixtrans-65.7-42.2176.7179.964.1000111.9W33 I38 M39 L40 L179 F222 F235W33-L36 HydrophobicContact CE3-CB 4.4Å; W33-L36 HydrophobicContact CE3-CD2 3.93Å; W33-L36 HydrophobicContact CE3-CG 4.42Å; W33-L36 HydrophobicContact CZ3-CD2 3.78Å; W33-L36 HydrophobicContact CZ3-CG 4.31Å; W33-L36 CarbonylContact O-C 3.55Å; W33-L36 WeakPolarHBondContact O-CA 3.4Å; W33-L36 PolarHBondContact O-N 2.9Å; L36-I38 VanDerWaalsContact C-N 3.28Å; L36-I38 PolarHBondContact O-N 3.43Å; L36-M39 HydrophobicContact CB-CE 4.42Å; L36-M39 HydrophobicContact CD1-CE 4.14Å; L36-M39 PolarHBondContact O-N 3.21Å; L36-M39 VanDerWaalsContact O-N 3.13Å; L36-L40 HydrophobicContact CD1-CD1 4.24Å; L36-L40 HydrophobicContact CD1-CD2 4.37Å; L36-L40 HydrophobicContact CD1-CG 4Å; L36-L40 HydrophobicContact CD2-CD1 4.2Å; L36-L40 HydrophobicContact CG-CD1 3.81Å; L36-L40 HydrophobicContact CG-CG 4.04Å; L36-L40 WeakPolarHBondContact O-CG 3.28Å; L36-L40 PolarHBondContact O-N 3.26Å; L36-L179 HydrophobicContact CD2-CD2 4.35Å; L36-F222 HydrophobicContact CB-CB 4.41Å; L36-F222 HydrophobicContact CB-CD1 4.01Å; L36-F222 HydrophobicContact CB-CD2 3.93Å; L36-F222 HydrophobicContact CB-CE1 4.24Å; L36-F222 HydrophobicContact CB-CE2 4.2Å; L36-F222 HydrophobicContact CB-CG 3.89Å; L36-F222 HydrophobicContact CB-CZ 4.39Å; L36-F222 HydrophobicContact CD1-CD1 4.11Å; L36-F222 HydrophobicContact CD1-CE1 3.84Å; L36-F222 HydrophobicContact CD1-CZ 4.37Å; L36-F222 HydrophobicContact CD2-CD2 4.4Å; L36-F222 HydrophobicContact CD2-CE1 3.92Å; L36-F222 HydrophobicContact CD2-CE2 3.8Å; L36-F222 HydrophobicContact CD2-CZ 3.58Å; L36-F222 HydrophobicContact CG-CD1 4.43Å; L36-F222 HydrophobicContact CG-CE1 4.21Å; L36-F222 HydrophobicContact CG-CZ 4.32Å; L36-F235 HydrophobicContact CD1-CZ 4.45Å
37L92.9Very high92.1Very high2 Ų24.8 Ų4.81%0.013%0.026CC..Hα-helixtrans-57.1-43.9179.2177.659.7000111.1W33 L40 K41 L116 N371W33-L37 HydrophobicContact CD2-CB 4.38Å; W33-L37 HydrophobicContact CZ2-CB 4.22Å; W33-L37 HydrophobicContact CZ2-CD1 3.82Å; W33-L37 HydrophobicContact CZ2-CG 4.48Å; W33-L37 WeakPolarHBondContact O-CB 3.32Å; W33-L37 PolarHBondContact O-N 2.75Å; L37-L40 PolarHBondContact O-N 3.42Å; L37-K41 WeakPolarHBondContact O-CG 3.07Å; L37-K41 PolarHBondContact O-N 3.31Å; L37-L116 HydrophobicContact CD1-CB 3.73Å; L37-L116 HydrophobicContact CD1-CD1 3.58Å; L37-L116 HydrophobicContact CD1-CG 4.26Å; L37-N371 HydrophobicContact CD2-CB 4.26Å
38I91.1Very high92.1Very high18 Ų189.8 Ų9.89%0.0925%0.046CC..Hα-helixtrans-60.9-48.4175.8-68.4170.3000110.3G34 L36 L40 K41 S42 M103G34-I38 WeakPolarHBondContact O-CD1 3.46Å; G34-I38 WeakPolarHBondContact O-CG1 3.45Å; G34-I38 PolarHBondContact O-N 3.11Å; L36-I38 VanDerWaalsContact C-N 3.28Å; L36-I38 PolarHBondContact O-N 3.43Å; I38-L40 PolarHBondContact O-N 2.99Å; I38-K41 PolarHBondContact O-N 3.32Å; I38-S42 PolarHBondContact O-N 3.17Å; I38-S42 PolarHBondContact O-OG 3.15Å; I38-M103 HydrophobicContact CB-CE 4.4Å; I38-M103 HydrophobicContact CG2-CE 3.29Å; I38-M103 HydrophobicContact CG2-SD 4.36Å; I38-M103 WeakPolarHBondContact O-CE 3.45Å
39M92.8Very high92Very high1 Ų112.3 Ų12.31%0.0056%0.059CC..Hα-helixtrans-63.4-38.8177.9-68.3-176.9-69.600113.1S35 L36 S42 E43 F222 V225 K226 Y229 F235S35-M39 PolarHBondContact O-N 2.99Å; L36-M39 HydrophobicContact CB-CE 4.42Å; L36-M39 HydrophobicContact CD1-CE 4.14Å; L36-M39 PolarHBondContact O-N 3.21Å; L36-M39 VanDerWaalsContact O-N 3.13Å; M39-S42 VanDerWaalsContact C-OG 3.31Å; M39-S42 VanDerWaalsContact CA-OG 3.27Å; M39-S42 WeakPolarHBondContact CA-OG 3.29Å; M39-S42 PolarHBondContact O-N 2.9Å; M39-S42 PolarHBondContact O-OG 3.24Å; M39-E43 VanDerWaalsContact O-CG 3.27Å; M39-E43 WeakPolarHBondContact O-CG 3.15Å; M39-E43 PolarHBondContact O-N 3.27Å; M39-E43 VanDerWaalsContact O-N 3.12Å; M39-F222 HydrophobicContact CE-CD1 4.32Å; M39-V225 HydrophobicContact CE-CB 4.47Å; M39-V225 HydrophobicContact CE-CG1 3.9Å; M39-V225 HydrophobicContact SD-CG1 3.9Å; M39-K226 HydrophobicContact CE-CB 4.14Å; M39-K226 HydrophobicContact CG-CB 4.37Å; M39-K226 HydrophobicContact CG-CG 4.34Å; M39-K226 VanDerWaalsContact SD-CA 3.55Å; M39-K226 HydrophobicContact SD-CB 3.84Å; M39-K226 HydrophobicContact SD-CG 4.4Å; M39-Y229 HydrophobicContact CG-CD1 4.08Å; M39-Y229 HydrophobicContact CG-CG 4.42Å; M39-Y229 HydrophobicContact SD-CG 4.39Å; M39-F235 HydrophobicContact CB-CD2 4.31Å; M39-F235 HydrophobicContact CB-CE2 3.88Å; M39-F235 HydrophobicContact SD-CD2 4.46Å; M39-F235 HydrophobicContact SD-CE2 4.25Å
40L94.2Very high91.8Very high0 Ų012.8 Ų12.80%06%0.062CC..Hα-helixtrans-66.5-39.2178-70.1173.9000111.4W33 L36 L37 I38 E43 G44 F45 L116 I161 I175 F235W33-L40 HydrophobicContact CH2-CD1 4.04Å; W33-L40 HydrophobicContact CZ3-CD1 4.13Å; L36-L40 HydrophobicContact CD1-CD1 4.24Å; L36-L40 HydrophobicContact CD1-CD2 4.37Å; L36-L40 HydrophobicContact CD1-CG 4Å; L36-L40 HydrophobicContact CD2-CD1 4.2Å; L36-L40 HydrophobicContact CG-CD1 3.81Å; L36-L40 HydrophobicContact CG-CG 4.04Å; L36-L40 WeakPolarHBondContact O-CG 3.28Å; L36-L40 PolarHBondContact O-N 3.26Å; L37-L40 PolarHBondContact O-N 3.42Å; I38-L40 PolarHBondContact O-N 2.99Å; L40-E43 PolarHBondContact O-N 3.03Å; L40-G44 PolarHBondContact O-N 3.28Å; L40-F45 HydrophobicContact CB-CB 4.28Å; L40-F45 HydrophobicContact CB-CD2 4.28Å; L40-F45 HydrophobicContact CB-CG 4.33Å; L40-F45 HydrophobicContact CD2-CD1 4.27Å; L40-F45 HydrophobicContact CD2-CD2 3.73Å; L40-F45 HydrophobicContact CD2-CE1 4.22Å; L40-F45 HydrophobicContact CD2-CE2 3.67Å; L40-F45 HydrophobicContact CD2-CG 4.02Å; L40-F45 HydrophobicContact CD2-CZ 3.92Å; L40-F45 WeakPolarHBondContact O-CB 3.4Å; L40-F45 WeakPolarHBondContact O-CD2 3.45Å; L40-F45 PolarHBondContact O-N 3.41Å; L40-F45 VanDerWaalsContact O-N 3.08Å; L40-L116 HydrophobicContact CB-CD2 4.47Å; L40-L116 HydrophobicContact CD1-CD2 4.1Å; L40-I161 HydrophobicContact CD2-CG2 4.3Å; L40-I175 HydrophobicContact CD1-CD1 4.21Å; L40-I175 HydrophobicContact CD1-CG1 4.4Å; L40-I175 HydrophobicContact CD2-CD1 4.19Å; L40-F235 HydrophobicContact CD2-CE1 4.42Å; L40-F235 HydrophobicContact CD2-CZ 4.08Å
41K92.3Very high91.2Very high16 Ų1619.1 Ų19.17%0.0710%0.096CC..Hα-helixtrans-63.5-43.3173.6-74.5-174.3174.1-171.50111.9L37 I38 E43 G44 M103 I108 D113 L116L37-K41 WeakPolarHBondContact O-CG 3.07Å; L37-K41 PolarHBondContact O-N 3.31Å; I38-K41 PolarHBondContact O-N 3.32Å; K41-E43 PolarHBondContact O-N 3.17Å; K41-G44 PolarHBondContact O-N 3.37Å; K41-M103 HydrophobicContact CB-SD 3.81Å; K41-I108 HydrophobicContact CB-CG2 4.35Å; K41-I108 HydrophobicContact CD-CG2 4.19Å; K41-D113 WeakPolarHBondContact CE-OD1 3.5Å; K41-D113 IonicContact NZ-OD1 2.63Å; K41-D113 PolarHBondContact NZ-OD1 3.05Å; K41-D113 IonicContact NZ-OD2 2.6Å; K41-D113 PolarHBondContact NZ-OD2 2.64Å; K41-L116 HydrophobicContact CG-CD1 4.26Å
42S91.6Very high90Very high4 Ų424.6 Ų24.63%0.02812%0.121CC..Hα-helixtrans-65.9-23.8177.252.70000114.2I38 M39 G44 N104 W106 Y229I38-S42 PolarHBondContact O-N 3.17Å; I38-S42 PolarHBondContact O-OG 3.15Å; M39-S42 VanDerWaalsContact C-OG 3.31Å; M39-S42 VanDerWaalsContact CA-OG 3.27Å; M39-S42 WeakPolarHBondContact CA-OG 3.29Å; M39-S42 PolarHBondContact O-N 2.9Å; M39-S42 PolarHBondContact O-OG 3.24Å; S42-G44 VanDerWaalsContact C-N 3.31Å; S42-N104 WeakPolarHBondContact CB-ND2 3.37Å; S42-W106 VanDerWaalsContact O-CD1 3.24Å; S42-Y229 WeakPolarHBondContact OG-CE1 3.16Å; S42-Y229 PolarHBondContact OG-OH 2.98Å
43E93.6Very high88Confident38 Ų3832 Ų3218%0.17816%0.155CC..THydrogen-bonded Turntrans-89.94.5174.4-63.9-69.6136.900112.6M39 L40 K41 F45 P168 Y229 F235M39-E43 VanDerWaalsContact O-CG 3.27Å; M39-E43 WeakPolarHBondContact O-CG 3.15Å; M39-E43 PolarHBondContact O-N 3.27Å; M39-E43 VanDerWaalsContact O-N 3.12Å; L40-E43 PolarHBondContact O-N 3.03Å; K41-E43 PolarHBondContact O-N 3.17Å; E43-F45 HydrophobicContact CB-CD2 4.06Å; E43-F45 HydrophobicContact CB-CE2 4.2Å; E43-P168 WeakPolarHBondContact O-CB 3.24Å; E43-P168 WeakPolarHBondContact O-CG 3.2Å; E43-Y229 WeakPolarHBondContact OE1-CE2 3.43Å; E43-Y229 VanDerWaalsContact OE1-CZ 3.31Å; E43-Y229 PolarHBondContact OE1-OH 3.49Å; E43-F235 VanDerWaalsContact CD-CB 3.42Å; E43-F235 HydrophobicContact CG-CB 3.89Å; E43-F235 HydrophobicContact CG-CD1 3.66Å; E43-F235 HydrophobicContact CG-CD2 4.36Å; E43-F235 HydrophobicContact CG-CE1 4.21Å; E43-F235 HydrophobicContact CG-CG 3.74Å; E43-F235 WeakPolarHBondContact OE1-CB 3.48Å
44G91.1Very high85.7Confident0 Ų035.9 Ų35.90%020%0.196CC..THydrogen-bonded Turntrans79.814.7173.700000115.3L40 K41 S42 Y46 S47L40-G44 PolarHBondContact O-N 3.28Å; K41-G44 PolarHBondContact O-N 3.37Å; S42-G44 VanDerWaalsContact C-N 3.31Å; G44-Y46 PolarHBondContact O-N 3.29Å; G44-S47 WeakPolarHBondContact O-CB 3.1Å; G44-S47 PolarHBondContact O-N 3.48Å
45F94.6Very high83.4Confident0 Ų042.3 Ų42.30%023%0.229CC..THydrogen-bonded Turntrans-57126.2177.3-84.4-105.6000110.6L40 E43 S47 Q112 L116 A165 S172 I175 F235L40-F45 HydrophobicContact CB-CB 4.28Å; L40-F45 HydrophobicContact CB-CD2 4.28Å; L40-F45 HydrophobicContact CB-CG 4.33Å; L40-F45 HydrophobicContact CD2-CD1 4.27Å; L40-F45 HydrophobicContact CD2-CD2 3.73Å; L40-F45 HydrophobicContact CD2-CE1 4.22Å; L40-F45 HydrophobicContact CD2-CE2 3.67Å; L40-F45 HydrophobicContact CD2-CG 4.02Å; L40-F45 HydrophobicContact CD2-CZ 3.92Å; L40-F45 WeakPolarHBondContact O-CB 3.4Å; L40-F45 WeakPolarHBondContact O-CD2 3.45Å; L40-F45 PolarHBondContact O-N 3.41Å; L40-F45 VanDerWaalsContact O-N 3.08Å; E43-F45 HydrophobicContact CB-CD2 4.06Å; E43-F45 HydrophobicContact CB-CE2 4.2Å; F45-S47 PolarHBondContact O-N 3.22Å; F45-S47 VanDerWaalsContact O-N 3.1Å; F45-Q112 WeakPolarHBondContact O-CG 3.32Å; F45-Q112 PolarHBondContact O-NE2 3.07Å; F45-L116 HydrophobicContact CB-CD2 4.3Å; F45-A165 HydrophobicContact CE2-CB 3.88Å; F45-A165 HydrophobicContact CZ-CB 4.22Å; F45-S172 WeakPolarHBondContact CA-OG 3.39Å; F45-I175 HydrophobicContact CD1-CB 4.43Å; F45-I175 HydrophobicContact CE1-CB 4.24Å; F45-I175 HydrophobicContact CE1-CD1 4.37Å; F45-F235 HydrophobicContact CE2-CE1 4.48Å
46Y94.1Very high80.6Confident0 Ų047.2 Ų47.20%026%0.263CS..THydrogen-bonded Turntrans56.416-176.1-62.3-70.9000116G44 Y48 L49 M115 L116 S172 V173 I175 F176G44-Y46 PolarHBondContact O-N 3.29Å; Y46-Y48 AromaticContact CD1-CE1 3.8Å; Y46-Y48 HydrophobicContact CD1-CE1 3.8Å; Y46-Y48 AromaticContact CD1-CZ 3.78Å; Y46-Y48 VanDerWaalsContact CD1-OH 3.32Å; Y46-Y48 WeakPolarHBondContact CD1-OH 3.29Å; Y46-Y48 WeakPolarHBondContact CE1-OH 3.36Å; Y46-Y48 PolarHBondContact O-N 3.15Å; Y46-L49 HydrophobicContact CD1-CD1 3.92Å; Y46-L49 HydrophobicContact CG-CD1 4.29Å; Y46-L49 WeakPolarHBondContact O-CB 3.47Å; Y46-L49 PolarHBondContact O-N 3.42Å; Y46-M115 HydrophobicContact CD1-CB 4.4Å; Y46-M115 HydrophobicContact CD2-CB 4.1Å; Y46-M115 HydrophobicContact CE1-CB 4.47Å; Y46-M115 HydrophobicContact CE1-CE 3.9Å; Y46-M115 HydrophobicContact CE2-CB 4.15Å; Y46-M115 HydrophobicContact CG-CB 4.22Å; Y46-L116 HydrophobicContact CD2-CD2 3.72Å; Y46-L116 HydrophobicContact CD2-CG 3.95Å; Y46-L116 HydrophobicContact CE2-CD2 3.95Å; Y46-L116 HydrophobicContact CE2-CG 4.48Å; Y46-S172 PolarHBondContact N-OG 2.76Å; Y46-S172 PolarHBondContact OH-O 3.46Å; Y46-V173 HydrophobicContact CE1-CG2 4.42Å; Y46-V173 WeakPolarHBondContact OH-CA 3.12Å; Y46-I175 HydrophobicContact CE2-CG2 3.9Å; Y46-F176 WeakPolarHBondContact OH-CD2 3.24Å; Y46-F176 WeakPolarHBondContact OH-CE2 3.2Å
47S90.7Very high77.8Confident8 Ų852.3 Ų52.36%0.05630%0.299CS..G310 helixtrans-61.8-26.8178.1-171.90000112.4G44 F45 L49 C50 L107G44-S47 WeakPolarHBondContact O-CB 3.1Å; G44-S47 PolarHBondContact O-N 3.48Å; F45-S47 PolarHBondContact O-N 3.22Å; F45-S47 VanDerWaalsContact O-N 3.1Å; S47-L49 PolarHBondContact O-N 3.19Å; S47-L49 VanDerWaalsContact O-N 3.16Å; S47-C50 WeakPolarHBondContact O-CB 3.4Å; S47-C50 PolarHBondContact O-N 2.86Å; S47-L107 PolarHBondContact OG-N 3.24Å; S47-L107 VanDerWaalsContact OG-N 3.11Å; S47-L107 PolarHBondContact OG-O 3.23Å
48Y89.9Confident75.2Confident105 Ų10557.6 Ų57.641%0.41234%0.336SS..G310 helixtrans-63.7-14.6175.370-93.2000114.8Y46 C50 N169Y46-Y48 AromaticContact CD1-CE1 3.8Å; Y46-Y48 HydrophobicContact CD1-CE1 3.8Å; Y46-Y48 AromaticContact CD1-CZ 3.78Å; Y46-Y48 VanDerWaalsContact CD1-OH 3.32Å; Y46-Y48 WeakPolarHBondContact CD1-OH 3.29Å; Y46-Y48 WeakPolarHBondContact CE1-OH 3.36Å; Y46-Y48 PolarHBondContact O-N 3.15Å; Y48-C50 VanDerWaalsContact C-N 3.3Å; Y48-N169 WeakPolarHBondContact CE1-O 3.25Å
49L89.3Confident72.4Confident54 Ų5466.4 Ų66.428%0.28337%0.369SS..G310 helixtrans-77.5-22.8172.5-64.3177.8000111.4Y46 S47 E111 M115Y46-L49 HydrophobicContact CD1-CD1 3.92Å; Y46-L49 HydrophobicContact CG-CD1 4.29Å; Y46-L49 WeakPolarHBondContact O-CB 3.47Å; Y46-L49 PolarHBondContact O-N 3.42Å; S47-L49 PolarHBondContact O-N 3.19Å; S47-L49 VanDerWaalsContact O-N 3.16Å; L49-E111 HydrophobicContact CB-CB 4.5Å; L49-M115 HydrophobicContact CD1-CG 3.79Å
50C88.3Confident69.3Low9 Ų973.7 Ų73.76%0.06141%0.408CS..  trans-83.7119.2-176.7-52.30000110.4S47 Y48 L107 C109S47-C50 WeakPolarHBondContact O-CB 3.4Å; S47-C50 PolarHBondContact O-N 2.86Å; Y48-C50 VanDerWaalsContact C-N 3.3Å; C50-L107 HydrophobicContact CB-CB 3.69Å; C50-C109 WeakPolarHBondContact CA-SG 3.42Å; C50-C109 HydrophobicContact CB-CB 3.64Å; C50-C109 WeakPolarHBondContact CB-SG 3.48Å; C50-C109 WeakPolarHBondContact SG-CB 3.37Å; C50-C109 PolarHBondContact SG-N 2.96Å; C50-C109 CovalentContact SG-SG 2.04Å; C50-C109 PolarHBondContact SG-SG 3.09Å
51N81.5Confident66.2Low134 Ų13484.6 Ų84.672%0.71745%0.45SS*.  trans-87.7145.4172.5-66.8-32.7000110.7E53N51-E53 PolarHBondContact O-N 3.44Å
52E63.3Low63.2Low116 Ų11688.3 Ų88.354%0.54248%0.478SS..SBendtrans-72.6-11176.4-65.3-163.2142.800113.6G54 R102 L107E52-G54 PolarHBondContact O-N 3.44Å; E52-R102 IonicContact OE1-CZ 3.73Å; E52-R102 IonicContact OE1-NH2 3.57Å; E52-R102 PolarHBondContact OE1-NH2 3.27Å; E52-L107 HydrophobicContact CG-CD1 3.52Å; E52-L107 HydrophobicContact CG-CD2 4.11Å; E52-L107 HydrophobicContact CG-CG 4.46Å
53E48.8Very low60.2Low160 Ų16097 Ų9775%0.74852%0.517SS*.  trans-93.292.5-168.5-67.9-171.8167.900113.4N51 N55N51-E53 PolarHBondContact O-N 3.44Å; E53-N55 PolarHBondContact O-N 3.01Å
54G44.7Very low56.9Low82 Ų82100.6 Ų100.685%0.84555%0.546SS*.  trans-77.164.2145.900000111.3E52E52-G54 PolarHBondContact O-N 3.44Å
55N41.7Very low53.8Low139 Ų139105.2 Ų105.274%0.74359%0.585SS**  trans-168.782158.1-140.34.5000114.4E53E53-N55 PolarHBondContact O-N 3.01Å
56S32.3Very low50.6Low105 Ų105109.5 Ų109.573%0.73462%0.62SS**  trans-159.897.4137.8-11.70000110.3S58S56-S58 PolarHBondContact O-N 2.92Å
57S35.4Very low47.4Very low108 Ų108115.9 Ų115.976%0.75566%0.659SS**  trans-51.4123159.5-42.40000109Y59S57-Y59 PolarHBondContact O-N 3.42Å
58S38.2Very low44.6Very low112 Ų112121.1 Ų121.178%0.78369%0.693SS**SBendtrans-60.982.216452.30000110.3S56S56-S58 PolarHBondContact O-N 2.92Å
59Y32.4Very low41.6Very low204 Ų204123.5 Ų123.580%0.871%0.711SS**  trans-163.397161.7-101.2-78.9000110.3S57S57-Y59 PolarHBondContact O-N 3.42Å
60N26.8Very low39.1Very low154 Ų154126.1 Ų126.182%0.82473%0.731SS**  -180135.4107-95.2-27.4000114.2
61R30.5Very low36.2Very low229 Ų229133.7 Ų133.786%0.86477%0.766SS**  trans-56.5136.4165.5-97.6178.3-176.5171.31.2112.4
62S28.3Very low33.6Very low94 Ų94133.3 Ų133.366%0.65776%0.764SS**  trans36.8113.5137.761.40000120.3
63H28Very low32.1Very low187 Ų187137.6 Ų137.687%0.86678%0.776SS**  173.8154.3107.2-109.6-88.4000112.6
64S25.5Very low31Very low112 Ų112134.3 Ų134.378%0.78378%0.777SS**  trans-62.3154.3-170.5-480000118.6
65A26Very low30.1Very low97 Ų97138.2 Ų138.280%0.80278%0.778SS**  141.6113.7113.300000115.1
66A26.4Very low29.4Very low91 Ų91135.2 Ų135.275%0.75277%0.773SS**  trans25.8145.5145.500000125.2
67T26.4Very low29.2Very low133 Ų133139.5 Ų139.582%0.81678%0.779SS**  trans95.3153.314023.30000119.9
68P33.1Very low28.9Very low118 Ų118143.1 Ų143.177%0.76678%0.784SS**  -123.6175.1-95.635.6-15.4000115.1
69I27.7Very low28.3Very low156 Ų156143.1 Ų143.180%0.878%0.783SS**  trans-57.4156178.5-31.3175.1000112.4
70P36Very low28.2Very low108 Ų108141.2 Ų141.270%0.70179%0.787SS**  -145.2150.589.119.74.2000117.5
71H27.4Very low28.2Very low168 Ų168142.6 Ų142.678%0.77879%0.789SS**  trans52.3122147.7-70.1-80.6000120.8
72D26.6Very low28.1Very low127 Ų127136.5 Ų136.568%0.67978%0.781SS**  179.6151.895.5-119.9-10.2000114.2
73Y31.8Very low28Very low205 Ų205140.3 Ų140.380%0.80479%0.793SS**  trans76.889172.6-57.5-75.2000119.6
74A26.2Very low28.2Very low92 Ų92137.7 Ų137.776%0.7679%0.79SS**  trans-79.1137.9143.900000109.2
75D25.7Very low28.3Very low163 Ų163138.1 Ų138.187%0.87279%0.793SS**  trans-163.8132.9143-103-25.4000111.8
76A27.1Very low28.4Very low76 Ų76139 Ų13963%0.62879%0.793SS**  trans85.188.814100000119.5
77F28.3Very low28.4Very low196 Ų196138 Ų13886%0.8679%0.791SS**  156.7115.892.6-101.9-79.6000111.6
78E28.1Very low28.6Very low184 Ų184140 Ų14086%0.8680%0.797SS**  trans-74.4139152.1-74.7176.4137.600109.2
79S26.5Very low28.5Very low111 Ų111137.7 Ų137.778%0.77680%0.795SS**  178.6114.7124.430.90000110.5
80D29.1Very low29Very low165 Ų165136.7 Ų136.788%0.88280%0.796SS**  trans-81119.4159.1-160.69.4000106.3
81E26.6Very low28.8Very low183 Ų183139.2 Ų139.286%0.85580%0.798SS**  trans-150.9123.4159.2-129-17514800112
82S29.3Very low29.1Very low101 Ų101136.4 Ų136.471%0.70679%0.787SS**  trans-59.9136.9177510000113.8
83L25.8Very low29.4Very low173 Ų173138.5 Ų138.591%0.90679%0.79SS**  trans-140.5122.6156.3-125.5117000112.5
84V32.8Very low29.8Very low133 Ų133134.7 Ų134.781%0.80679%0.791SS**  trans-69.3132.5171.2175.60000109.4
85S26.6Very low30.3Very low120 Ų120136.9 Ų136.984%0.83979%0.794SS**  trans-139.1129.7158.6-169.30000111.2
86S28Very low30.9Very low115 Ų115133.1 Ų133.180%0.80479%0.785SS**  trans-84.8146.7171.1-68.20000110.7
87G27.7Very low32Very low70 Ų70135.4 Ų135.472%0.72279%0.794SS**  trans111.8114.6155.100000117.1
88D30.7Very low32.7Very low175 Ų175135.7 Ų135.794%0.93680%0.798SS**  trans59.4119147.9-66.5-19.5000122
89G30.5Very low34.1Very low70 Ų70129.6 Ų129.672%0.72278%0.784SS**  trans116.6112.2157.300000114.1E91G89-E91 VanDerWaalsContact C-N 3.29Å; G89-E91 PolarHBondContact O-N 3.01Å
90V38.5Very low36.1Very low136 Ų136127.3 Ų127.382%0.82477%0.767SS**  trans-71.391.5162178.20000107M92V90-M92 HydrophobicContact CG1-CE 4.46Å; V90-M92 HydrophobicContact CG1-CG 4.44Å
91E30.7Very low38.5Very low160 Ų160123.5 Ų123.575%0.74875%0.746SS**  trans-103100.2171.4-164.8178.7157.300108.5G89 K93G89-E91 VanDerWaalsContact C-N 3.29Å; G89-E91 PolarHBondContact O-N 3.01Å; E91-K93 PolarHBondContact O-N 3.45Å
92M35.2Very low41.1Very low110 Ų110120.9 Ų120.954%0.54273%0.728SS.*  trans-81108.2168.2-68.7-165.3-169.600108.5V90V90-M92 HydrophobicContact CG1-CE 4.46Å; V90-M92 HydrophobicContact CG1-CG 4.44Å
93K32.6Very low43.8Very low171 Ų171117.8 Ų117.874%0.74370%0.703SS**PPolyproline II helixtrans-83.3126.4174.4-124.8176.5-175172.60109.5E91 V95E91-K93 PolarHBondContact O-N 3.45Å; K93-V95 PolarHBondContact O-N 3.24Å
94P39.1Very low46.6Very low125 Ų125113.8 Ų113.881%0.81268%0.683SS**PPolyproline II helixtrans-80.3117.3171.731.3-28.2000108.6
95V36.6Very low49Very low137 Ų137110 Ų11083%0.8367%0.671SS**PPolyproline II helixtrans-91.4127.8160-179.10000106.8K93K93-V95 PolarHBondContact O-N 3.24Å
96A39.5Very low52Low84 Ų84108.6 Ų108.669%0.69465%0.647SS**PPolyproline II helixtrans-55.2163.5177.500000112.6E98A96-E98 PolarHBondContact O-N 3.22Å
97P49.3Very low54.9Low124 Ų124104.3 Ų104.381%0.80562%0.615SS**SBendtrans-90.892-141.435.3-33.4000112
98E43.3Very low57.8Low203 Ų203101.8 Ų101.895%0.94959%0.585SS**SBendtrans-160.432.4162.3-113170.5-13800111A96A96-E98 PolarHBondContact O-N 3.22Å
99G57.9Low60.5Low55 Ų5595 Ų9557%0.56755%0.551SS**SBendtrans-124.2153.817300000110.5L101G99-L101 PolarHBondContact O-N 3.43Å
100P68.3Low63.1Low63 Ų6396.6 Ų96.641%0.40954%0.538SS..  trans-59.4133.6174.326.1-33.3000109.7R102 L107P100-R102 PolarHBondContact O-N 2.84Å; P100-L107 HydrophobicContact CB-CD2 3.55Å; P100-L107 HydrophobicContact CG-CD2 3.7Å
101L78.8Confident65.4Low86 Ų8695.1 Ų95.145%0.4552%0.522SS..  trans-59131.4177.6-76.6158000109.3G99 I108G99-L101 PolarHBondContact O-N 3.43Å; L101-I108 HydrophobicContact CB-CD1 3.79Å; L101-I108 HydrophobicContact CB-CG1 3.42Å; L101-I108 VanDerWaalsContact CB-CG1 3.42Å; L101-I108 WeakPolarHBondContact O-CG1 3.2Å; L101-I108 PolarHBondContact O-N 3.34Å
102R82Confident68.3Low127 Ų12787.5 Ų87.548%0.47949%0.486SS..EExtended strand (participates in β ladder)trans-128.7145.8179.9-72-176.6174.8-154.55.6111.8E52 P100 W106 L107E52-R102 IonicContact OE1-CZ 3.73Å; E52-R102 IonicContact OE1-NH2 3.57Å; E52-R102 PolarHBondContact OE1-NH2 3.27Å; P100-R102 PolarHBondContact O-N 2.84Å; R102-W106 CarbonylContact C-O 3.45Å; R102-W106 WeakPolarHBondContact CA-O 3.38Å; R102-W106 WeakPolarHBondContact CB-O 3.39Å; R102-L107 HydrophobicContact CG-CD2 3.92Å
103M85Confident70.9Confident37 Ų3782.5 Ų82.518%0.18246%0.462CS..EExtended strand (participates in β ladder)trans-130.9118.7176-169.6179.1178.400109.4I38 K41 G105 W106 I108I38-M103 HydrophobicContact CB-CE 4.4Å; I38-M103 HydrophobicContact CG2-CE 3.29Å; I38-M103 HydrophobicContact CG2-SD 4.36Å; I38-M103 WeakPolarHBondContact O-CE 3.45Å; K41-M103 HydrophobicContact CB-SD 3.81Å; M103-G105 PolarHBondContact O-N 2.87Å; M103-G105 VanDerWaalsContact O-N 3.16Å; M103-W106 PolarHBondContact N-O 2.95Å; M103-W106 WeakPolarHBondContact O-CB 3.26Å; M103-W106 PolarHBondContact O-N 3.29Å; M103-I108 HydrophobicContact CB-CG2 3.86Å
104N85.5Confident73.6Confident89 Ų8977.3 Ų77.348%0.47644%0.44SS..THydrogen-bonded Turntrans48.238.8-173-74.1-2.4000114S42 W106S42-N104 WeakPolarHBondContact CB-ND2 3.37Å; N104-W106 VanDerWaalsContact C-N 3.32Å; N104-W106 PolarHBondContact O-N 2.89Å
105G83.1Confident76.2Confident54 Ų5474.3 Ų74.356%0.55742%0.416SS*.THydrogen-bonded Turntrans86.1-8.8179.600000115.4M103M103-G105 PolarHBondContact O-N 2.87Å; M103-G105 VanDerWaalsContact O-N 3.16Å
106W89.1Confident78.9Confident90 Ų9067.8 Ų67.834%0.34138%0.376SS..EExtended strand (participates in β ladder)trans-94.3143.8178.4-62.1103.1000112.3S42 R102 M103 N104 P168S42-W106 VanDerWaalsContact O-CD1 3.24Å; R102-W106 CarbonylContact C-O 3.45Å; R102-W106 WeakPolarHBondContact CA-O 3.38Å; R102-W106 WeakPolarHBondContact CB-O 3.39Å; M103-W106 PolarHBondContact N-O 2.95Å; M103-W106 WeakPolarHBondContact O-CB 3.26Å; M103-W106 PolarHBondContact O-N 3.29Å; N104-W106 VanDerWaalsContact C-N 3.32Å; N104-W106 PolarHBondContact O-N 2.89Å; W106-P168 HydrophobicContact CH2-CG 4.3Å; W106-P168 HydrophobicContact CZ2-CG 4.36Å
107L89.8Confident81.5Confident24 Ų2463.9 Ų63.913%0.12634%0.344CS..EExtended strand (participates in β ladder)trans-71.1138.6175.1-65.8163000110.5S47 C50 E52 P100 R102S47-L107 PolarHBondContact OG-N 3.24Å; S47-L107 VanDerWaalsContact OG-N 3.11Å; S47-L107 PolarHBondContact OG-O 3.23Å; C50-L107 HydrophobicContact CB-CB 3.69Å; E52-L107 HydrophobicContact CG-CD1 3.52Å; E52-L107 HydrophobicContact CG-CD2 4.11Å; E52-L107 HydrophobicContact CG-CG 4.46Å; P100-L107 HydrophobicContact CB-CD2 3.55Å; P100-L107 HydrophobicContact CG-CD2 3.7Å; R102-L107 HydrophobicContact CG-CD2 3.92Å
108I88.3Confident83.6Confident18 Ų1860.9 Ų60.99%0.09232%0.321CS..  trans-116.4139.4173.363.5170.2000110.9K41 L101 M103 L382K41-I108 HydrophobicContact CB-CG2 4.35Å; K41-I108 HydrophobicContact CD-CG2 4.19Å; L101-I108 HydrophobicContact CB-CD1 3.79Å; L101-I108 HydrophobicContact CB-CG1 3.42Å; L101-I108 VanDerWaalsContact CB-CG1 3.42Å; L101-I108 WeakPolarHBondContact O-CG1 3.2Å; L101-I108 PolarHBondContact O-N 3.34Å; M103-I108 HydrophobicContact CB-CG2 3.86Å; I108-L382 HydrophobicContact CD1-CD1 4.32Å; I108-L382 HydrophobicContact CD1-CD2 4.3Å
109C87.4Confident86Confident33 Ų3351.2 Ų51.222%0.22328%0.276CS..  trans-152.7167.3-176.662.10000111.9C50 E111 Q112 D113C50-C109 WeakPolarHBondContact CA-SG 3.42Å; C50-C109 HydrophobicContact CB-CB 3.64Å; C50-C109 WeakPolarHBondContact CB-SG 3.48Å; C50-C109 WeakPolarHBondContact SG-CB 3.37Å; C50-C109 PolarHBondContact SG-N 2.96Å; C50-C109 CovalentContact SG-SG 2.04Å; C50-C109 PolarHBondContact SG-SG 3.09Å; C109-E111 VanDerWaalsContact C-N 3.35Å; C109-E111 PolarHBondContact O-N 3.31Å; C109-Q112 WeakPolarHBondContact O-CB 3.33Å; C109-Q112 PolarHBondContact O-N 3.5Å; C109-D113 PolarHBondContact O-N 2.94Å
110K84.4Confident87.8Confident103 Ų10348.6 Ų48.645%0.44825%0.249SC..Hα-helixtrans-62.6-38.6-179.2-63.3-173.4175-173.40112.8Q112 D113 E114 M530K110-Q112 VanDerWaalsContact C-N 3.3Å; K110-Q112 PolarHBondContact O-N 3.07Å; K110-D113 WeakPolarHBondContact O-CB 3.49Å; K110-D113 PolarHBondContact O-N 2.91Å; K110-D113 VanDerWaalsContact O-N 3.11Å; K110-E114 WeakPolarHBondContact O-CG 3.32Å; K110-E114 PolarHBondContact O-N 3.23Å; K110-M530 HydrophobicContact CB-CE 4.23Å; K110-M530 HydrophobicContact CD-CE 4.09Å; K110-M530 HydrophobicContact CG-CE 3.8Å
111E88.1Confident89Confident104 Ų10445.9 Ų45.949%0.48623%0.231SC..Hα-helixtrans-64.7-35.1-179.4-66.1154.2174.400112.2L49 C109 E114 M115L49-E111 HydrophobicContact CB-CB 4.5Å; C109-E111 VanDerWaalsContact C-N 3.35Å; C109-E111 PolarHBondContact O-N 3.31Å; E111-E114 PolarHBondContact O-N 3.32Å; E111-M115 PolarHBondContact O-N 3.34Å; E111-M115 VanDerWaalsContact O-N 3.16Å
112Q91.6Very high89.8Confident0 Ų044.5 Ų44.50%022%0.223CC..Hα-helixtrans-61.4-44.9172.2-177.9-170.944.800111F45 C109 K110 M115 L116F45-Q112 WeakPolarHBondContact O-CG 3.32Å; F45-Q112 PolarHBondContact O-NE2 3.07Å; C109-Q112 WeakPolarHBondContact O-CB 3.33Å; C109-Q112 PolarHBondContact O-N 3.5Å; K110-Q112 VanDerWaalsContact C-N 3.3Å; K110-Q112 PolarHBondContact O-N 3.07Å; Q112-M115 PolarHBondContact O-N 3.19Å; Q112-L116 HydrophobicContact CG-CD1 3.97Å; Q112-L116 WeakPolarHBondContact O-CB 3.23Å; Q112-L116 WeakPolarHBondContact O-CG 3.5Å; Q112-L116 PolarHBondContact O-N 3.48Å
113D89.3Confident90.3Very high6 Ų638.4 Ų38.43%0.03220%0.2CC..Hα-helixtrans-64.2-38.7176.9-82.8-40.7000112.8K41 C109 K110 N117 F526K41-D113 WeakPolarHBondContact CE-OD1 3.5Å; K41-D113 IonicContact NZ-OD1 2.63Å; K41-D113 PolarHBondContact NZ-OD1 3.05Å; K41-D113 IonicContact NZ-OD2 2.6Å; K41-D113 PolarHBondContact NZ-OD2 2.64Å; C109-D113 PolarHBondContact O-N 2.94Å; K110-D113 WeakPolarHBondContact O-CB 3.49Å; K110-D113 PolarHBondContact O-N 2.91Å; K110-D113 VanDerWaalsContact O-N 3.11Å; D113-N117 WeakPolarHBondContact O-CB 3.21Å; D113-N117 PolarHBondContact O-N 2.97Å; D113-N117 PolarHBondContact O-ND2 2.88Å; D113-F526 HydrophobicContact CB-CZ 4.3Å
114E90.1Very high90.7Very high62 Ų6236.8 Ų36.829%0.2919%0.192SC..Hα-helixtrans-62.3-45.4177.5-70.4-179.3-178.700112K110 E111 L118 Q523 F526 L527K110-E114 WeakPolarHBondContact O-CG 3.32Å; K110-E114 PolarHBondContact O-N 3.23Å; E111-E114 PolarHBondContact O-N 3.32Å; E114-L118 WeakPolarHBondContact O-CB 3.48Å; E114-L118 PolarHBondContact O-N 3.14Å; E114-Q523 PolarHBondContact O-NE2 2.85Å; E114-F526 HydrophobicContact CG-CE1 4.26Å; E114-L527 HydrophobicContact CB-CD2 4.35Å; E114-L527 VanDerWaalsContact CD-CD2 3.49Å; E114-L527 HydrophobicContact CG-CD2 3.79Å
115M92.9Very high91.1Very high61 Ų6135.2 Ų35.230%0.318%0.182SC..Hα-helixtrans-66.7-43178.9-73.6-62.6-66.500112.3Y46 L49 E111 Q112 L118 A119 F176Y46-M115 HydrophobicContact CD1-CB 4.4Å; Y46-M115 HydrophobicContact CD2-CB 4.1Å; Y46-M115 HydrophobicContact CE1-CB 4.47Å; Y46-M115 HydrophobicContact CE1-CE 3.9Å; Y46-M115 HydrophobicContact CE2-CB 4.15Å; Y46-M115 HydrophobicContact CG-CB 4.22Å; L49-M115 HydrophobicContact CD1-CG 3.79Å; E111-M115 PolarHBondContact O-N 3.34Å; E111-M115 VanDerWaalsContact O-N 3.16Å; Q112-M115 PolarHBondContact O-N 3.19Å; M115-L118 PolarHBondContact O-N 3.44Å; M115-A119 PolarHBondContact O-N 3.18Å; M115-A119 VanDerWaalsContact O-N 3.14Å; M115-F176 HydrophobicContact CE-CE2 3.76Å; M115-F176 HydrophobicContact CE-CZ 3.81Å
116L93.9Very high91.6Very high0 Ų034.4 Ų34.40%016%0.164CC..Hα-helixtrans-68.2-42.2178.2-69.8172.2000111.4W33 L37 L40 K41 F45 Y46 Q112 L118 A119 F120W33-L116 HydrophobicContact CH2-CB 4.15Å; W33-L116 VanDerWaalsContact CH2-O 3.28Å; W33-L116 WeakPolarHBondContact CH2-O 3.45Å; W33-L116 VanDerWaalsContact CZ2-C 3.48Å; W33-L116 HydrophobicContact CZ2-CB 3.86Å; W33-L116 WeakPolarHBondContact CZ2-O 3.37Å; L37-L116 HydrophobicContact CD1-CB 3.73Å; L37-L116 HydrophobicContact CD1-CD1 3.58Å; L37-L116 HydrophobicContact CD1-CG 4.26Å; L40-L116 HydrophobicContact CB-CD2 4.47Å; L40-L116 HydrophobicContact CD1-CD2 4.1Å; K41-L116 HydrophobicContact CG-CD1 4.26Å; F45-L116 HydrophobicContact CB-CD2 4.3Å; Y46-L116 HydrophobicContact CD2-CD2 3.72Å; Y46-L116 HydrophobicContact CD2-CG 3.95Å; Y46-L116 HydrophobicContact CE2-CD2 3.95Å; Y46-L116 HydrophobicContact CE2-CG 4.48Å; Q112-L116 HydrophobicContact CG-CD1 3.97Å; Q112-L116 WeakPolarHBondContact O-CB 3.23Å; Q112-L116 WeakPolarHBondContact O-CG 3.5Å; Q112-L116 PolarHBondContact O-N 3.48Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 2.89Å; L116-A119 WeakPolarHBondContact O-CB 3.47Å; L116-A119 PolarHBondContact O-N 2.76Å; L116-A119 VanDerWaalsContact O-N 3.1Å; L116-F120 PolarHBondContact O-N 3.32Å
117N92.6Very high91.7Very high3 Ų330.2 Ų30.22%0.01615%0.148CC..Hα-helixtrans-68.3-29.5176.4-78.2-47.6000113W33 D113 A119 F120 T121 G368 F526W33-N117 PolarHBondContact NE1-OD1 3.5Å; D113-N117 WeakPolarHBondContact O-CB 3.21Å; D113-N117 PolarHBondContact O-N 2.97Å; D113-N117 PolarHBondContact O-ND2 2.88Å; N117-A119 VanDerWaalsContact C-N 3.32Å; N117-F120 PolarHBondContact O-N 3.37Å; N117-T121 WeakPolarHBondContact O-CB 3.23Å; N117-T121 PolarHBondContact O-N 2.85Å; N117-T121 PolarHBondContact O-OG1 2.65Å; N117-G368 PolarHBondContact OD1-O 3.14Å; N117-F526 HydrophobicContact CB-CD1 4.23Å; N117-F526 HydrophobicContact CB-CE1 4.18Å; N117-F526 HydrophobicContact CB-CZ 4.48Å; N117-F526 WeakPolarHBondContact ND2-CE1 3.32Å; N117-F526 VanDerWaalsContact ND2-CE2 3.33Å; N117-F526 WeakPolarHBondContact ND2-CE2 3.43Å; N117-F526 WeakPolarHBondContact ND2-CZ 3.42Å
118L93.6Very high91.7Very high60 Ų6029.6 Ų29.631%0.31415%0.146SC..Hα-helixtrans-62.9-41.9168.9-176.963.7000111E114 M115 L116 T121 I122 F176 Q523E114-L118 WeakPolarHBondContact O-CB 3.48Å; E114-L118 PolarHBondContact O-N 3.14Å; M115-L118 PolarHBondContact O-N 3.44Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 2.89Å; L118-T121 WeakPolarHBondContact O-CB 3.47Å; L118-T121 PolarHBondContact O-N 3.13Å; L118-I122 HydrophobicContact CG-CD1 4.29Å; L118-I122 WeakPolarHBondContact O-CG1 3.15Å; L118-I122 PolarHBondContact O-N 2.74Å; L118-F176 HydrophobicContact CB-CE1 4.17Å; L118-F176 HydrophobicContact CB-CZ 4.47Å; L118-F176 HydrophobicContact CD2-CE1 4.03Å; L118-F176 HydrophobicContact CD2-CZ 4.09Å; L118-F176 HydrophobicContact CG-CE1 3.89Å; L118-F176 HydrophobicContact CG-CZ 4.36Å; L118-Q523 HydrophobicContact CD1-CG 3.97Å
119A94.8Very high91.8Very high0 Ų029.2 Ų29.20%015%0.146CC..Hα-helixtrans-64.5-42.1177.400000111.4M115 L116 N117 T121 I122 G123 I175 F176 L179M115-A119 PolarHBondContact O-N 3.18Å; M115-A119 VanDerWaalsContact O-N 3.14Å; L116-A119 WeakPolarHBondContact O-CB 3.47Å; L116-A119 PolarHBondContact O-N 2.76Å; L116-A119 VanDerWaalsContact O-N 3.1Å; N117-A119 VanDerWaalsContact C-N 3.32Å; A119-T121 VanDerWaalsContact C-N 3.32Å; A119-T121 PolarHBondContact O-N 2.81Å; A119-I122 PolarHBondContact O-N 3.42Å; A119-G123 PolarHBondContact O-N 3.01Å; A119-I175 HydrophobicContact CB-CG2 3.98Å; A119-F176 HydrophobicContact CB-CD1 3.67Å; A119-F176 HydrophobicContact CB-CE1 3.6Å; A119-F176 HydrophobicContact CB-CG 4.36Å; A119-F176 HydrophobicContact CB-CZ 4.24Å; A119-L179 VanDerWaalsContact C-CD1 3.48Å; A119-L179 HydrophobicContact CB-CD1 3.66Å; A119-L179 WeakPolarHBondContact O-CD1 3.35Å
120F94.8Very high92Very high1 Ų129.2 Ų29.20%0.00414%0.143CC..Hα-helixtrans-58.7-42170.2169.4-111.6000112.3L30 W33 L116 N117 I122 G123 S124 L364 M367L30-F120 VanDerWaalsContact O-CE2 3.26Å; L30-F120 WeakPolarHBondContact O-CE2 3.28Å; W33-F120 HydrophobicContact CB-CD2 3.75Å; W33-F120 HydrophobicContact CB-CE2 3.77Å; W33-F120 HydrophobicContact CB-CG 4.33Å; W33-F120 HydrophobicContact CB-CZ 4.34Å; W33-F120 HydrophobicContact CD2-CB 3.66Å; W33-F120 AromaticContact CD2-CD2 3.79Å; W33-F120 HydrophobicContact CD2-CD2 3.79Å; W33-F120 AromaticContact CD2-CG 3.79Å; W33-F120 HydrophobicContact CD2-CG 3.79Å; W33-F120 HydrophobicContact CE3-CB 3.89Å; W33-F120 AromaticContact CE3-CD2 3.97Å; W33-F120 HydrophobicContact CE3-CD2 3.97Å; W33-F120 HydrophobicContact CE3-CG 4.23Å; W33-F120 HydrophobicContact CG-CB 4.22Å; W33-F120 HydrophobicContact CG-CD1 4.38Å; W33-F120 AromaticContact CG-CD2 3.7Å; W33-F120 HydrophobicContact CG-CD2 3.7Å; W33-F120 HydrophobicContact CG-CE2 4.17Å; W33-F120 AromaticContact CG-CG 3.82Å; W33-F120 HydrophobicContact CG-CG 3.82Å; W33-F120 HydrophobicContact CH2-CB 4.01Å; W33-F120 HydrophobicContact CZ2-CB 3.77Å; W33-F120 HydrophobicContact CZ3-CB 4.06Å; L116-F120 PolarHBondContact O-N 3.32Å; N117-F120 PolarHBondContact O-N 3.37Å; F120-I122 PolarHBondContact O-N 3.04Å; F120-G123 PolarHBondContact O-N 3.44Å; F120-S124 WeakPolarHBondContact O-CB 3.38Å; F120-S124 PolarHBondContact O-N 3.14Å; F120-S124 PolarHBondContact O-OG 2.79Å; F120-L364 HydrophobicContact CZ-CD2 4.2Å; F120-M367 HydrophobicContact CZ-CB 4.31Å
121T94.5Very high92.2Very high5 Ų524.6 Ų24.63%0.03112%0.124CC..Hα-helixtrans-61.1-44177.9-66.30000111.8N117 L118 A119 S124 F125 L520 Q522 Q523N117-T121 WeakPolarHBondContact O-CB 3.23Å; N117-T121 PolarHBondContact O-N 2.85Å; N117-T121 PolarHBondContact O-OG1 2.65Å; L118-T121 WeakPolarHBondContact O-CB 3.47Å; L118-T121 PolarHBondContact O-N 3.13Å; A119-T121 VanDerWaalsContact C-N 3.32Å; A119-T121 PolarHBondContact O-N 2.81Å; T121-S124 WeakPolarHBondContact CA-OG 3.23Å; T121-S124 PolarHBondContact O-OG 2.99Å; T121-S124 VanDerWaalsContact O-OG 3.13Å; T121-F125 WeakPolarHBondContact O-CB 3.35Å; T121-F125 PolarHBondContact O-N 3.39Å; T121-L520 HydrophobicContact CG2-CD2 3.96Å; T121-Q522 HydrophobicContact CG2-CG 4.05Å; T121-Q522 WeakPolarHBondContact OG1-CG 3.05Å; T121-Q522 PolarHBondContact OG1-NE2 2.9Å; T121-Q523 HydrophobicContact CG2-CB 4.29Å; T121-Q523 PolarHBondContact OG1-OE1 2.89Å
122I94.3Very high92.1Very high57 Ų5721.7 Ų21.729%0.29211%0.111SC..Hα-helixtrans-66-44.6177.8-69.2164.2000111.2L118 A119 F120 F125 L126 F176L118-I122 HydrophobicContact CG-CD1 4.29Å; L118-I122 WeakPolarHBondContact O-CG1 3.15Å; L118-I122 PolarHBondContact O-N 2.74Å; A119-I122 PolarHBondContact O-N 3.42Å; F120-I122 PolarHBondContact O-N 3.04Å; I122-F125 PolarHBondContact O-N 3.26Å; I122-L126 HydrophobicContact CG2-CD1 4.43Å; I122-L126 PolarHBondContact O-N 2.65Å; I122-L126 VanDerWaalsContact O-N 3.09Å; I122-F176 HydrophobicContact CD1-CD1 3.6Å; I122-F176 HydrophobicContact CD1-CE1 3.85Å
123G94Very high92Very high0 Ų024.1 Ų24.10%013%0.127CC..Hα-helixtrans-63.1-46.5178.100000112.8A119 F120 L126 L127A119-G123 PolarHBondContact O-N 3.01Å; F120-G123 PolarHBondContact O-N 3.44Å; G123-L126 PolarHBondContact O-N 3.43Å; G123-L127 WeakPolarHBondContact O-CB 3.35Å; G123-L127 PolarHBondContact O-N 3.25Å
124S93.1Very high91.8Very high2 Ų224 Ų241%0.01413%0.127CC..Hα-helixtrans-69.1-33178.457.90000113F120 T121 L127 S128 Q522F120-S124 WeakPolarHBondContact O-CB 3.38Å; F120-S124 PolarHBondContact O-N 3.14Å; F120-S124 PolarHBondContact O-OG 2.79Å; T121-S124 WeakPolarHBondContact CA-OG 3.23Å; T121-S124 PolarHBondContact O-OG 2.99Å; T121-S124 VanDerWaalsContact O-OG 3.13Å; S124-L127 WeakPolarHBondContact O-CB 3.35Å; S124-L127 PolarHBondContact O-N 2.81Å; S124-S128 PolarHBondContact O-N 3.19Å; S124-S128 PolarHBondContact O-OG 2.82Å; S124-Q522 PolarHBondContact OG-NE2 3.07Å
125F93.9Very high91.4Very high57 Ų5721.6 Ų21.625%0.2512%0.118CC..Hα-helixtrans-59.3-51.2169.9169-101.3000111T121 I122 L127 S128 A129 A516 V517 L520T121-F125 WeakPolarHBondContact O-CB 3.35Å; T121-F125 PolarHBondContact O-N 3.39Å; I122-F125 PolarHBondContact O-N 3.26Å; F125-L127 VanDerWaalsContact C-N 3.31Å; F125-L127 PolarHBondContact O-N 3.18Å; F125-S128 PolarHBondContact O-N 2.77Å; F125-A129 HydrophobicContact CD1-CB 4.37Å; F125-A129 HydrophobicContact CD2-CB 4.26Å; F125-A129 HydrophobicContact CE1-CB 3.94Å; F125-A129 HydrophobicContact CE2-CB 3.84Å; F125-A129 HydrophobicContact CZ-CB 3.66Å; F125-A129 VanDerWaalsContact O-CB 3.27Å; F125-A129 WeakPolarHBondContact O-CB 3.42Å; F125-A129 PolarHBondContact O-N 3.28Å; F125-A516 HydrophobicContact CD2-CB 3.91Å; F125-A516 HydrophobicContact CE2-CB 4.13Å; F125-V517 HydrophobicContact CE2-CG2 4.18Å; F125-L520 HydrophobicContact CB-CD2 3.88Å; F125-L520 HydrophobicContact CD2-CD1 4.04Å; F125-L520 HydrophobicContact CD2-CD2 3.73Å; F125-L520 HydrophobicContact CD2-CG 3.85Å; F125-L520 HydrophobicContact CE2-CD1 4.03Å; F125-L520 HydrophobicContact CE2-CG 4.34Å; F125-L520 HydrophobicContact CG-CD2 3.89Å
126L92.7Very high90.9Very high36 Ų3623.8 Ų23.819%0.18813%0.13CC..Hα-helixtrans-64.8-35.6179.1-79.3167.1000112.8I122 G123 S128 I130 T180I122-L126 HydrophobicContact CG2-CD1 4.43Å; I122-L126 PolarHBondContact O-N 2.65Å; I122-L126 VanDerWaalsContact O-N 3.09Å; G123-L126 PolarHBondContact O-N 3.43Å; L126-S128 PolarHBondContact O-N 3.31Å; L126-S128 VanDerWaalsContact O-N 3.13Å; L126-I130 WeakPolarHBondContact O-CB 3.47Å; L126-I130 WeakPolarHBondContact O-CG2 3.29Å; L126-I130 PolarHBondContact O-N 3.01Å; L126-T180 HydrophobicContact CD1-CG2 3.2Å
127L91.1Very high90.5Very high2 Ų226.5 Ų26.51%0.0115%0.146CC..Hα-helixtrans-58.5-19171.4-168.684000112.4S27 A28 L31 G123 S124 F125 M187S27-L127 WeakPolarHBondContact O-CD1 3.48Å; A28-L127 HydrophobicContact CB-CD2 4.17Å; L31-L127 HydrophobicContact CD1-CD2 3.93Å; L31-L127 HydrophobicContact CD2-CD2 4.27Å; L31-L127 HydrophobicContact CG-CD2 4.06Å; G123-L127 WeakPolarHBondContact O-CB 3.35Å; G123-L127 PolarHBondContact O-N 3.25Å; S124-L127 WeakPolarHBondContact O-CB 3.35Å; S124-L127 PolarHBondContact O-N 2.81Å; F125-L127 VanDerWaalsContact C-N 3.31Å; F125-L127 PolarHBondContact O-N 3.18Å; L127-M187 HydrophobicContact CB-CG 4.29Å; L127-M187 HydrophobicContact CD1-CG 3.73Å; L127-M187 HydrophobicContact CD1-SD 3.94Å; L127-M187 HydrophobicContact CG-CG 3.91Å; L127-M187 HydrophobicContact CG-SD 3.92Å; L127-M187 WeakPolarHBondContact O-CE 3.37Å; L127-M187 WeakPolarHBondContact O-CG 3.49Å
128S90.2Very high90Very high11 Ų1127.1 Ų27.18%0.07715%0.149CC..Hα-helixtrans-113.3-41.1179.9-59.10000112.4S124 F125 L126 I130 T131 A516S124-S128 PolarHBondContact O-N 3.19Å; S124-S128 PolarHBondContact O-OG 2.82Å; F125-S128 PolarHBondContact O-N 2.77Å; L126-S128 PolarHBondContact O-N 3.31Å; L126-S128 VanDerWaalsContact O-N 3.13Å; S128-I130 PolarHBondContact O-N 2.65Å; S128-T131 WeakPolarHBondContact O-CB 3.42Å; S128-T131 PolarHBondContact O-N 3.1Å; S128-T131 PolarHBondContact O-OG1 3.41Å; S128-A516 VanDerWaalsContact CB-CB 3.47Å
129A91.5Very high89.2Confident10 Ų1029.8 Ų29.88%0.08316%0.164CC..Hα-helixtrans-67.1-33-175.200000113.3F125 T131 L513 A516F125-A129 HydrophobicContact CD1-CB 4.37Å; F125-A129 HydrophobicContact CD2-CB 4.26Å; F125-A129 HydrophobicContact CE1-CB 3.94Å; F125-A129 HydrophobicContact CE2-CB 3.84Å; F125-A129 HydrophobicContact CZ-CB 3.66Å; F125-A129 VanDerWaalsContact O-CB 3.27Å; F125-A129 WeakPolarHBondContact O-CB 3.42Å; F125-A129 PolarHBondContact O-N 3.28Å; A129-T131 PolarHBondContact O-N 3.3Å; A129-L513 HydrophobicContact CB-CD1 3.82Å; A129-A516 HydrophobicContact CB-CB 3.93Å
130I91.1Very high88.5Confident33 Ų3337.2 Ų37.217%0.16920%0.196CC..THydrogen-bonded Turntrans-73.9-10.1-176.8-153.279.9000112.9L126 S128 L132 P133 L134 F184 M187L126-I130 WeakPolarHBondContact O-CB 3.47Å; L126-I130 WeakPolarHBondContact O-CG2 3.29Å; L126-I130 PolarHBondContact O-N 3.01Å; S128-I130 PolarHBondContact O-N 2.65Å; I130-L132 VanDerWaalsContact C-N 3.31Å; I130-L132 PolarHBondContact O-N 3.03Å; I130-P133 HydrophobicContact CD1-CG 3.82Å; I130-P133 HydrophobicContact CG1-CG 4.02Å; I130-P133 WeakPolarHBondContact O-CD 3.36Å; I130-P133 VanDerWaalsContact O-CG 3.27Å; I130-P133 WeakPolarHBondContact O-CG 3.36Å; I130-L134 HydrophobicContact CB-CD1 4.47Å; I130-L134 HydrophobicContact CB-CG 4.37Å; I130-L134 HydrophobicContact CG1-CD1 4.3Å; I130-L134 HydrophobicContact CG1-CD2 4.21Å; I130-L134 HydrophobicContact CG1-CG 3.79Å; I130-L134 HydrophobicContact CG2-CD1 3.59Å; I130-L134 HydrophobicContact CG2-CG 4Å; I130-L134 VanDerWaalsContact O-CB 3.26Å; I130-L134 WeakPolarHBondContact O-CB 3.41Å; I130-L134 WeakPolarHBondContact O-CG 3.19Å; I130-L134 PolarHBondContact O-N 3.02Å; I130-F184 HydrophobicContact CD1-CD2 3.99Å; I130-F184 HydrophobicContact CD1-CE2 4.02Å; I130-F184 HydrophobicContact CG1-CD2 3.72Å; I130-F184 HydrophobicContact CG1-CE2 3.8Å; I130-M187 HydrophobicContact CG2-CB 3.7Å; I130-M187 HydrophobicContact CG2-CG 4.08Å
131T87.6Confident87.9Confident7 Ų742.9 Ų42.94%0.04322%0.218CC..Hα-helixtrans-56.4-42.5-177.5-48.80000112.8S128 A129 G135 M187 F191S128-T131 WeakPolarHBondContact O-CB 3.42Å; S128-T131 PolarHBondContact O-N 3.1Å; S128-T131 PolarHBondContact O-OG1 3.41Å; A129-T131 PolarHBondContact O-N 3.3Å; T131-G135 PolarHBondContact O-N 2.82Å; T131-M187 HydrophobicContact CG2-CE 4.46Å; T131-M187 VanDerWaalsContact OG1-CE 3.26Å; T131-M187 WeakPolarHBondContact OG1-CE 3.48Å; T131-F191 HydrophobicContact CG2-CD2 4.17Å; T131-F191 HydrophobicContact CG2-CE2 4Å
132L86.7Confident87.4Confident42 Ų4242.8 Ų42.822%0.2222%0.219CC..Hα-helixtrans-66.3-54.4178.5-176.8142.4000112.9I130 L134 G135 I136 M510I130-L132 VanDerWaalsContact C-N 3.31Å; I130-L132 PolarHBondContact O-N 3.03Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 2.98Å; L132-G135 PolarHBondContact O-N 3.16Å; L132-G135 VanDerWaalsContact O-N 3.15Å; L132-I136 HydrophobicContact CD2-CD1 4.13Å; L132-I136 PolarHBondContact O-N 3.47Å; L132-M510 HydrophobicContact CD1-CB 4.1Å; L132-M510 HydrophobicContact CD1-CE 3.67Å; L132-M510 HydrophobicContact CD1-SD 4.16Å
133P88.9Confident87Confident51 Ų5140.1 Ų40.133%0.33121%0.205SC..Hα-helixtrans-64.7-34.9177.422.3-32000112.5I130 G135 I136 V137I130-P133 HydrophobicContact CD1-CG 3.82Å; I130-P133 HydrophobicContact CG1-CG 4.02Å; I130-P133 WeakPolarHBondContact O-CD 3.36Å; I130-P133 VanDerWaalsContact O-CG 3.27Å; I130-P133 WeakPolarHBondContact O-CG 3.36Å; P133-G135 VanDerWaalsContact C-N 3.29Å; P133-G135 PolarHBondContact O-N 3.49Å; P133-I136 PolarHBondContact O-N 3.08Å; P133-V137 WeakPolarHBondContact O-CB 3.23Å; P133-V137 VanDerWaalsContact O-CG2 3.25Å; P133-V137 WeakPolarHBondContact O-CG2 3.46Å; P133-V137 PolarHBondContact O-N 3.12Å
134L86.4Confident86.8Confident5 Ų542.3 Ų42.33%0.02621%0.213CC..Hα-helixtrans-61.9-37.4172.8-72.6-175.8000111.9I130 L132 V137 M138 L146 F184 M187 C188 F191I130-L134 HydrophobicContact CB-CD1 4.47Å; I130-L134 HydrophobicContact CB-CG 4.37Å; I130-L134 HydrophobicContact CG1-CD1 4.3Å; I130-L134 HydrophobicContact CG1-CD2 4.21Å; I130-L134 HydrophobicContact CG1-CG 3.79Å; I130-L134 HydrophobicContact CG2-CD1 3.59Å; I130-L134 HydrophobicContact CG2-CG 4Å; I130-L134 VanDerWaalsContact O-CB 3.26Å; I130-L134 WeakPolarHBondContact O-CB 3.41Å; I130-L134 WeakPolarHBondContact O-CG 3.19Å; I130-L134 PolarHBondContact O-N 3.02Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 2.98Å; L134-V137 PolarHBondContact O-N 3.44Å; L134-M138 WeakPolarHBondContact O-CB 3.47Å; L134-M138 PolarHBondContact O-N 3.02Å; L134-L146 HydrophobicContact CB-CD2 4.37Å; L134-L146 HydrophobicContact CD2-CD1 3.6Å; L134-L146 HydrophobicContact CD2-CD2 4.02Å; L134-L146 HydrophobicContact CD2-CG 4.12Å; L134-F184 HydrophobicContact CD2-CE2 4.13Å; L134-F184 HydrophobicContact CD2-CZ 4.46Å; L134-M187 HydrophobicContact CD1-CB 3.88Å; L134-C188 VanDerWaalsContact CD2-SG 3.55Å; L134-F191 HydrophobicContact CB-CD1 4.43Å
135G81.3Confident86.7Confident10 Ų1048.1 Ų48.110%0.10324%0.238CC..Hα-helixtrans-49.9-59170.700000112.3T131 L132 P133 V137 M138 D139T131-G135 PolarHBondContact O-N 2.82Å; L132-G135 PolarHBondContact O-N 3.16Å; L132-G135 VanDerWaalsContact O-N 3.15Å; P133-G135 VanDerWaalsContact C-N 3.29Å; P133-G135 PolarHBondContact O-N 3.49Å; G135-V137 VanDerWaalsContact C-N 3.33Å; G135-V137 PolarHBondContact O-N 3.09Å; G135-M138 WeakPolarHBondContact O-CB 3.46Å; G135-M138 PolarHBondContact O-N 3.46Å; G135-D139 VanDerWaalsContact O-CG 3.31Å; G135-D139 PolarHBondContact O-N 2.79Å; G135-D139 VanDerWaalsContact O-N 3.08Å
136I81.7Confident86.5Confident108 Ų10845.8 Ų45.855%0.55423%0.228SC*.Hα-helixtrans-62.8-40.9-177.8-58.6167.9000111.4L132 P133 D139 K140L132-I136 HydrophobicContact CD2-CD1 4.13Å; L132-I136 PolarHBondContact O-N 3.47Å; P133-I136 PolarHBondContact O-N 3.08Å; I136-D139 PolarHBondContact O-N 3.12Å; I136-K140 PolarHBondContact O-N 3.37Å
137V85.2Confident86.5Confident56 Ų5644 Ų4434%0.33922%0.219SC..Hα-helixtrans-68-39.4179169.70000111P133 L134 G135 D139 K140 Y141 L146P133-V137 WeakPolarHBondContact O-CB 3.23Å; P133-V137 VanDerWaalsContact O-CG2 3.25Å; P133-V137 WeakPolarHBondContact O-CG2 3.46Å; P133-V137 PolarHBondContact O-N 3.12Å; L134-V137 PolarHBondContact O-N 3.44Å; G135-V137 VanDerWaalsContact C-N 3.33Å; G135-V137 PolarHBondContact O-N 3.09Å; V137-D139 VanDerWaalsContact C-N 3.33Å; V137-K140 PolarHBondContact O-N 3.4Å; V137-Y141 HydrophobicContact CG1-CD2 3.89Å; V137-Y141 WeakPolarHBondContact O-CB 3.43Å; V137-Y141 PolarHBondContact O-N 3.39Å; V137-L146 HydrophobicContact CG1-CD1 3.77Å
138M82.1Confident86.6Confident17 Ų1745.2 Ų45.28%0.08423%0.225CC..Hα-helixtrans-63.2-41.6177.7-173.5178.176.300111L134 G135 K140 G142 L146 F191 T195L134-M138 WeakPolarHBondContact O-CB 3.47Å; L134-M138 PolarHBondContact O-N 3.02Å; G135-M138 WeakPolarHBondContact O-CB 3.46Å; G135-M138 PolarHBondContact O-N 3.46Å; M138-K140 VanDerWaalsContact C-N 3.3Å; M138-K140 PolarHBondContact O-N 3.43Å; M138-G142 VanDerWaalsContact O-CA 3.27Å; M138-G142 WeakPolarHBondContact O-CA 3.33Å; M138-G142 PolarHBondContact O-N 2.87Å; M138-L146 HydrophobicContact CB-CD2 3.92Å; M138-L146 HydrophobicContact CG-CD2 4.43Å; M138-F191 HydrophobicContact CB-CD1 4.3Å; M138-F191 HydrophobicContact CB-CE1 4.13Å; M138-F191 HydrophobicContact CE-CD1 3.79Å; M138-F191 HydrophobicContact CE-CE1 3.23Å; M138-F191 HydrophobicContact CE-CZ 4.04Å; M138-F191 HydrophobicContact CG-CD1 4.48Å; M138-F191 HydrophobicContact CG-CE1 4.46Å; M138-F191 HydrophobicContact SD-CD1 3.37Å; M138-F191 WeakPolarHBondContact SD-CD1 3.26Å; M138-F191 HydrophobicContact SD-CE1 3.49Å; M138-F191 WeakPolarHBondContact SD-CE1 3.43Å; M138-F191 HydrophobicContact SD-CG 4.49Å; M138-T195 HydrophobicContact CE-CG2 3.65Å; M138-T195 HydrophobicContact SD-CG2 3.64Å
139D78.2Confident86.9Confident116 Ų11648.6 Ų48.662%0.6224%0.242SC*.Hα-helixtrans-64.7-34.2177.9-65.2-18.6000112.1G135 I136 V137G135-D139 VanDerWaalsContact O-CG 3.31Å; G135-D139 PolarHBondContact O-N 2.79Å; G135-D139 VanDerWaalsContact O-N 3.08Å; I136-D139 PolarHBondContact O-N 3.12Å; V137-D139 VanDerWaalsContact C-N 3.33Å
140K80.3Confident87Confident156 Ų15648.1 Ų48.168%0.67824%0.238SC*.Hα-helixtrans-86.1-42.4-178-173.8175.2179.9-178.20114.3I136 V137 M138I136-K140 PolarHBondContact O-N 3.37Å; V137-K140 PolarHBondContact O-N 3.4Å; M138-K140 VanDerWaalsContact C-N 3.3Å; M138-K140 PolarHBondContact O-N 3.43Å
141Y81.9Confident87.2Confident119 Ų11946.7 Ų46.747%0.46723%0.231SC..Hα-helixtrans-108.2-7-169.8-66.7-74000114V137V137-Y141 HydrophobicContact CG1-CD2 3.89Å; V137-Y141 WeakPolarHBondContact O-CB 3.43Å; V137-Y141 PolarHBondContact O-N 3.39Å
142G83.1Confident87.6Confident4 Ų449.5 Ų49.54%0.04125%0.248CC..  trans77.8166-178.500000113.6M138M138-G142 VanDerWaalsContact O-CA 3.27Å; M138-G142 WeakPolarHBondContact O-CA 3.33Å; M138-G142 PolarHBondContact O-N 2.87Å
143P85.9Confident88.1Confident1 Ų148.1 Ų48.11%0.00624%0.242CC..Hα-helixtrans-72.5-33.4-170.927.3-34.8000113.6L146 R147 T192P143-L146 PolarHBondContact O-N 2.9Å; P143-R147 WeakPolarHBondContact O-CB 3.42Å; P143-R147 PolarHBondContact O-N 3.14Å; P143-T192 HydrophobicContact CB-CG2 3.98Å; P143-T192 VanDerWaalsContact O-CG2 3.3Å; P143-T192 WeakPolarHBondContact O-CG2 3.45Å
144R89.6Confident88.5Confident45 Ų4545.7 Ų45.717%0.1723%0.226CC..Hα-helixtrans-63.4-46.8-175.6176.5176175.2-175.1-6.3113.2L146 R147 L148 F254 W257 P258R144-L146 VanDerWaalsContact C-N 3.28Å; R144-L146 PolarHBondContact O-N 3.02Å; R144-R147 PolarHBondContact O-N 3.24Å; R144-L148 HydrophobicContact CG-CD1 4.12Å; R144-L148 HydrophobicContact CG-CG 4.44Å; R144-L148 VanDerWaalsContact O-CG 3.3Å; R144-L148 WeakPolarHBondContact O-CG 3.43Å; R144-L148 PolarHBondContact O-N 2.85Å; R144-F254 PolarHBondContact NE-O 3.33Å; R144-F254 VanDerWaalsContact NH2-CD2 3.32Å; R144-F254 PolarHBondContact NH2-O 2.87Å; R144-W257 HydrophobicContact CB-CB 4.35Å; R144-W257 WeakPolarHBondContact CD-O 3.48Å; R144-W257 HydrophobicContact CG-CB 4.41Å; R144-P258 VanDerWaalsContact CB-O 3.23Å; R144-P258 WeakPolarHBondContact CB-O 3.44Å
145K90.4Very high89Confident125 Ų12546 Ų4654%0.54323%0.23SC..Hα-helixtrans-62.3-40.6-179.7-68.9-177.2-179.7177.50111.2L149K145-L149 WeakPolarHBondContact O-CB 3.5Å; K145-L149 PolarHBondContact O-N 3.49Å
146L90.5Very high89.8Confident7 Ų750.2 Ų50.24%0.03725%0.246CC..Hα-helixtrans-66.9-42.7178.7-161.660.7000112.1L134 V137 M138 P143 R144 L149 G150 C188 T192L134-L146 HydrophobicContact CB-CD2 4.37Å; L134-L146 HydrophobicContact CD2-CD1 3.6Å; L134-L146 HydrophobicContact CD2-CD2 4.02Å; L134-L146 HydrophobicContact CD2-CG 4.12Å; V137-L146 HydrophobicContact CG1-CD1 3.77Å; M138-L146 HydrophobicContact CB-CD2 3.92Å; M138-L146 HydrophobicContact CG-CD2 4.43Å; P143-L146 PolarHBondContact O-N 2.9Å; R144-L146 VanDerWaalsContact C-N 3.28Å; R144-L146 PolarHBondContact O-N 3.02Å; L146-L149 PolarHBondContact O-N 2.98Å; L146-G150 PolarHBondContact O-N 3.48Å; L146-C188 HydrophobicContact CG-CB 4.45Å; L146-T192 HydrophobicContact CB-CG2 3.97Å; L146-T192 HydrophobicContact CD2-CG2 4.1Å; L146-T192 HydrophobicContact CG-CG2 4.29Å
147R92.3Very high90.5Very high0 Ų045.1 Ų45.10%022%0.22CC..Hα-helixtrans-65.9-40.8177.2-168.5178.2-164.791.7-5.1112E22 P143 R144 G150 S151 M189 T192 S193 C253E22-R147 IonicContact OE2-CZ 2.71Å; E22-R147 IonicContact OE2-NE 3.78Å; E22-R147 PolarHBondContact OE2-NE 3.21Å; E22-R147 IonicContact OE2-NH2 2.77Å; E22-R147 PolarHBondContact OE2-NH2 3.31Å; P143-R147 WeakPolarHBondContact O-CB 3.42Å; P143-R147 PolarHBondContact O-N 3.14Å; R144-R147 PolarHBondContact O-N 3.24Å; R147-G150 PolarHBondContact O-N 2.96Å; R147-S151 WeakPolarHBondContact O-CB 3.22Å; R147-S151 PolarHBondContact O-N 3.42Å; R147-M189 PolarHBondContact NH1-O 2.9Å; R147-T192 HydrophobicContact CB-CG2 4.14Å; R147-T192 PolarHBondContact NH1-OG1 2.92Å; R147-S193 PolarHBondContact NH1-OG 2.68Å; R147-S193 PolarHBondContact NH2-OG 2.88Å; R147-C253 VanDerWaalsContact CB-SG 3.6Å; R147-C253 HydrophobicContact CG-CB 4.21Å
148L94.4Very high91.1Very high27 Ų2742.4 Ų42.414%0.14120%0.203CC..Hα-helixtrans-60.7-47.7174.2-70173.7000111.5R144 G150 S151 T152 F250 C253 F254R144-L148 HydrophobicContact CG-CD1 4.12Å; R144-L148 HydrophobicContact CG-CG 4.44Å; R144-L148 VanDerWaalsContact O-CG 3.3Å; R144-L148 WeakPolarHBondContact O-CG 3.43Å; R144-L148 PolarHBondContact O-N 2.85Å; L148-G150 VanDerWaalsContact C-N 3.34Å; L148-G150 PolarHBondContact O-N 3.38Å; L148-S151 PolarHBondContact O-N 3.41Å; L148-T152 WeakPolarHBondContact O-CG2 3.35Å; L148-T152 PolarHBondContact O-N 3.23Å; L148-T152 PolarHBondContact O-OG1 3.48Å; L148-F250 HydrophobicContact CB-CD2 4.16Å; L148-F250 HydrophobicContact CB-CE2 3.83Å; L148-F250 HydrophobicContact CD2-CD1 4.19Å; L148-F250 HydrophobicContact CD2-CD2 3.57Å; L148-F250 HydrophobicContact CD2-CE1 4.16Å; L148-F250 HydrophobicContact CD2-CE2 3.57Å; L148-F250 HydrophobicContact CD2-CG 3.91Å; L148-F250 HydrophobicContact CD2-CZ 3.87Å; L148-F250 WeakPolarHBondContact CD2-O 3.42Å; L148-F250 HydrophobicContact CG-CD2 4.46Å; L148-F250 HydrophobicContact CG-CE2 4.19Å; L148-C253 HydrophobicContact CD2-CB 3.96Å; L148-F254 HydrophobicContact CD1-CD2 4.32Å; L148-F254 HydrophobicContact CD2-CB 4.13Å
149L94.9Very high91.8Very high82 Ų8245.7 Ų45.743%0.42922%0.221SC..Hα-helixtrans-58.8-46.7175.817963.5000111.1K145 L146 S151 T152 C153 F184K145-L149 WeakPolarHBondContact O-CB 3.5Å; K145-L149 PolarHBondContact O-N 3.49Å; L146-L149 PolarHBondContact O-N 2.98Å; L149-S151 PolarHBondContact O-N 2.8Å; L149-T152 WeakPolarHBondContact CA-OG1 3.25Å; L149-T152 PolarHBondContact O-N 2.92Å; L149-T152 PolarHBondContact O-OG1 3.02Å; L149-C153 PolarHBondContact O-N 3.41Å; L149-C153 PolarHBondContact O-SG 3.2Å; L149-C153 VanDerWaalsContact O-SG 3.33Å; L149-F184 HydrophobicContact CD2-CE1 4.09Å; L149-F184 HydrophobicContact CD2-CZ 4Å; L149-F184 HydrophobicContact CG-CE1 4.09Å; L149-F184 HydrophobicContact CG-CZ 4.49Å
150G94.6Very high92.7Very high0 Ų041.2 Ų41.20%020%0.197CC..Hα-helixtrans-57.6-47.417800000113.3L146 R147 L148 T152 C153 F154 G185 C188L146-G150 PolarHBondContact O-N 3.48Å; R147-G150 PolarHBondContact O-N 2.96Å; L148-G150 VanDerWaalsContact C-N 3.34Å; L148-G150 PolarHBondContact O-N 3.38Å; G150-T152 PolarHBondContact O-N 3.04Å; G150-C153 PolarHBondContact O-N 3.47Å; G150-F154 PolarHBondContact O-N 3.42Å; G150-G185 VanDerWaalsContact O-CA 3.25Å; G150-G185 WeakPolarHBondContact O-CA 3.06Å; G150-C188 VanDerWaalsContact CA-CB 3.49Å
151S95.4Very high93.4Very high2 Ų233.8 Ų33.81%0.01417%0.165CC..Hα-helixtrans-61.3-42.1178-153.70000112R147 L148 L149 F154 G155 A246 F250R147-S151 WeakPolarHBondContact O-CB 3.22Å; R147-S151 PolarHBondContact O-N 3.42Å; L148-S151 PolarHBondContact O-N 3.41Å; L149-S151 PolarHBondContact O-N 2.8Å; S151-F154 PolarHBondContact O-N 2.87Å; S151-G155 PolarHBondContact O-N 2.89Å; S151-A246 PolarHBondContact OG-O 2.97Å; S151-F250 PolarHBondContact OG-N 3.44Å
152T96.5Very high94.1Very high66 Ų6628.4 Ų28.441%0.40514%0.144SC..Hα-helixtrans-66.5-41.8176.451.40000112.5L148 L149 G150 F154 G155 F156 F250L148-T152 WeakPolarHBondContact O-CG2 3.35Å; L148-T152 PolarHBondContact O-N 3.23Å; L148-T152 PolarHBondContact O-OG1 3.48Å; L149-T152 WeakPolarHBondContact CA-OG1 3.25Å; L149-T152 PolarHBondContact O-N 2.92Å; L149-T152 PolarHBondContact O-OG1 3.02Å; G150-T152 PolarHBondContact O-N 3.04Å; T152-F154 VanDerWaalsContact C-N 3.34Å; T152-F154 PolarHBondContact O-N 3.25Å; T152-G155 PolarHBondContact O-N 2.76Å; T152-F156 VanDerWaalsContact O-CB 3.29Å; T152-F156 WeakPolarHBondContact O-CB 3.3Å; T152-F156 PolarHBondContact O-N 3.39Å; T152-F250 HydrophobicContact CG2-CD2 3.61Å; T152-F250 HydrophobicContact CG2-CE2 3.57Å
153C96.6Very high94.7Very high14 Ų1434.6 Ų34.610%0.09517%0.168CC..Hα-helixtrans-63.9-40.3176.6-70.60000111.6L149 G150 F156 S157 F181 F184L149-C153 PolarHBondContact O-N 3.41Å; L149-C153 PolarHBondContact O-SG 3.2Å; L149-C153 VanDerWaalsContact O-SG 3.33Å; G150-C153 PolarHBondContact O-N 3.47Å; C153-F156 PolarHBondContact O-N 2.87Å; C153-S157 WeakPolarHBondContact O-CB 3.11Å; C153-S157 PolarHBondContact O-N 3.43Å; C153-F181 HydrophobicContact CB-CB 4.5Å; C153-F181 HydrophobicContact CB-CD1 4Å; C153-F184 HydrophobicContact CB-CD1 3.96Å; C153-F184 HydrophobicContact CB-CE1 4.45Å
154F96.8Very high95.1Very high0 Ų034.6 Ų34.60%017%0.168CC..Hα-helixtrans-66.7-44.7177.2-165.6-76.3000112.1F26 V29 G150 S151 T152 F156 S157 C158 N182 M189 W242 A246F26-F154 HydrophobicContact CB-CD2 4.44Å; F26-F154 HydrophobicContact CB-CE2 4.31Å; F26-F154 HydrophobicContact CB-CZ 4.34Å; F26-F154 AromaticContact CD1-CD1 3.65Å; F26-F154 HydrophobicContact CD1-CD1 3.65Å; F26-F154 AromaticContact CD1-CE1 3.48Å; F26-F154 HydrophobicContact CD1-CE1 3.48Å; F26-F154 VanDerWaalsContact CD1-CE1 3.48Å; F26-F154 HydrophobicContact CD1-CG 4.35Å; F26-F154 HydrophobicContact CD1-CZ 4.03Å; F26-F154 HydrophobicContact CE1-CD1 4.38Å; F26-F154 HydrophobicContact CE1-CE1 4.19Å; F26-F154 HydrophobicContact CG-CE1 4.46Å; F26-F154 VanDerWaalsContact O-CD2 3.29Å; F26-F154 WeakPolarHBondContact O-CD2 3.29Å; F26-F154 WeakPolarHBondContact O-CE2 3.38Å; V29-F154 HydrophobicContact CG1-CE2 4.5Å; V29-F154 HydrophobicContact CG1-CZ 4.26Å; V29-F154 HydrophobicContact CG2-CE2 3.83Å; V29-F154 HydrophobicContact CG2-CZ 3.81Å; G150-F154 PolarHBondContact O-N 3.42Å; S151-F154 PolarHBondContact O-N 2.87Å; T152-F154 VanDerWaalsContact C-N 3.34Å; T152-F154 PolarHBondContact O-N 3.25Å; F154-F156 VanDerWaalsContact C-N 3.34Å; F154-F156 PolarHBondContact O-N 3.26Å; F154-S157 WeakPolarHBondContact O-CB 3.45Å; F154-S157 PolarHBondContact O-N 3.36Å; F154-C158 WeakPolarHBondContact CE1-SG 3.08Å; F154-C158 PolarHBondContact O-N 3.39Å; F154-C158 VanDerWaalsContact O-N 3.09Å; F154-C158 PolarHBondContact O-SG 3.12Å; F154-C158 VanDerWaalsContact O-SG 3.33Å; F154-N182 WeakPolarHBondContact CE2-ND2 3.46Å; F154-M189 HydrophobicContact CB-CE 3.53Å; F154-M189 HydrophobicContact CD2-CE 3.87Å; F154-M189 HydrophobicContact CG-CE 3.79Å; F154-W242 HydrophobicContact CE1-CD2 4.25Å; F154-W242 AromaticContact CE1-CE2 3.87Å; F154-W242 HydrophobicContact CE1-CH2 4.44Å; F154-W242 HydrophobicContact CE1-CZ2 4Å; F154-W242 HydrophobicContact CZ-CH2 4.01Å; F154-W242 AromaticContact CZ-CZ2 3.69Å; F154-W242 HydrophobicContact CZ-CZ2 3.69Å; F154-A246 HydrophobicContact CD1-CB 4.3Å
155G97.1Very high95.3Very high10 Ų1032.9 Ų32.910%0.10316%0.163CC..Hα-helixtrans-60.8-43.7174.800000112S151 T152 S157 C158 L159S151-G155 PolarHBondContact O-N 2.89Å; T152-G155 PolarHBondContact O-N 2.76Å; G155-S157 PolarHBondContact O-N 2.91Å; G155-C158 PolarHBondContact O-N 2.93Å; G155-L159 WeakPolarHBondContact O-CG 3.36Å; G155-L159 PolarHBondContact O-N 3.31Å
156F97.4Very high95.4Very high100 Ų10034.6 Ų34.644%0.43917%0.167SC..Hα-helixtrans-61.4-42.8175.4-175.8-118.5000112.1T152 C153 F154 C158 L159 L160 F181T152-F156 VanDerWaalsContact O-CB 3.29Å; T152-F156 WeakPolarHBondContact O-CB 3.3Å; T152-F156 PolarHBondContact O-N 3.39Å; C153-F156 PolarHBondContact O-N 2.87Å; F154-F156 VanDerWaalsContact C-N 3.34Å; F154-F156 PolarHBondContact O-N 3.26Å; F156-C158 PolarHBondContact O-N 3.25Å; F156-L159 PolarHBondContact O-N 3.39Å; F156-L160 HydrophobicContact CD1-CD1 3.9Å; F156-L160 HydrophobicContact CD1-CG 4.3Å; F156-L160 HydrophobicContact CE1-CD1 3.54Å; F156-L160 HydrophobicContact CE1-CD2 4.26Å; F156-L160 HydrophobicContact CE1-CG 4.03Å; F156-L160 HydrophobicContact CE2-CD2 4.11Å; F156-L160 HydrophobicContact CE2-CG 4.31Å; F156-L160 HydrophobicContact CZ-CD1 3.98Å; F156-L160 HydrophobicContact CZ-CD2 3.81Å; F156-L160 HydrophobicContact CZ-CG 4.03Å; F156-L160 WeakPolarHBondContact O-CG 3.49Å; F156-L160 PolarHBondContact O-N 3.18Å; F156-F181 AromaticContact CD1-CD2 3.9Å; F156-F181 HydrophobicContact CD1-CD2 3.9Å; F156-F181 HydrophobicContact CD1-CE2 4.03Å; F156-F181 HydrophobicContact CD1-CG 4.25Å; F156-F181 HydrophobicContact CD1-CZ 4.48Å; F156-F181 HydrophobicContact CE1-CD2 4.03Å; F156-F181 AromaticContact CE1-CE2 3.79Å; F156-F181 HydrophobicContact CE1-CE2 3.79Å; F156-F181 HydrophobicContact CE1-CZ 4.35Å
157S97.3Very high95.4Very high0 Ų039.4 Ų39.40%019%0.188CC..Hα-helixtrans-54.1-49.7173.3169.50000112.2C153 F154 G155 L159 L160 I161 A178 N182C153-S157 WeakPolarHBondContact O-CB 3.11Å; C153-S157 PolarHBondContact O-N 3.43Å; F154-S157 WeakPolarHBondContact O-CB 3.45Å; F154-S157 PolarHBondContact O-N 3.36Å; G155-S157 PolarHBondContact O-N 2.91Å; S157-L159 VanDerWaalsContact C-N 3.3Å; S157-L159 PolarHBondContact O-N 3.25Å; S157-L160 WeakPolarHBondContact O-CB 3.07Å; S157-L160 PolarHBondContact O-N 3.39Å; S157-L160 VanDerWaalsContact O-N 3.1Å; S157-I161 WeakPolarHBondContact O-CG1 3.37Å; S157-I161 PolarHBondContact O-N 3.39Å; S157-A178 VanDerWaalsContact CB-O 3.25Å; S157-A178 WeakPolarHBondContact CB-O 3.26Å; S157-A178 PolarHBondContact OG-O 3.14Å; S157-N182 VanDerWaalsContact OG-CB 3.26Å; S157-N182 WeakPolarHBondContact OG-CB 3.38Å; S157-N182 PolarHBondContact OG-ND2 2.99Å
158C96.9Very high95.3Very high0 Ų040 Ų400%019%0.192CC..Hα-helixtrans-60-40.6179.7-64.20000112.1F154 G155 F156 I161 A162 A243F154-C158 WeakPolarHBondContact CE1-SG 3.08Å; F154-C158 PolarHBondContact O-N 3.39Å; F154-C158 VanDerWaalsContact O-N 3.09Å; F154-C158 PolarHBondContact O-SG 3.12Å; F154-C158 VanDerWaalsContact O-SG 3.33Å; G155-C158 PolarHBondContact O-N 2.93Å; F156-C158 PolarHBondContact O-N 3.25Å; C158-I161 PolarHBondContact O-N 2.57Å; C158-A162 WeakPolarHBondContact O-CB 3.39Å; C158-A162 PolarHBondContact O-N 3.21Å; C158-A243 HydrophobicContact CB-CB 3.87Å
159L97.3Very high94.9Very high85 Ų8542.8 Ų42.845%0.44521%0.207SC..Hα-helixtrans-66.3-36.4175.8-65.2176.1000112.5G155 F156 S157 A162 Y163 V240 A243G155-L159 WeakPolarHBondContact O-CG 3.36Å; G155-L159 PolarHBondContact O-N 3.31Å; F156-L159 PolarHBondContact O-N 3.39Å; S157-L159 VanDerWaalsContact C-N 3.3Å; S157-L159 PolarHBondContact O-N 3.25Å; L159-A162 PolarHBondContact O-N 3.1Å; L159-Y163 WeakPolarHBondContact O-CB 3.3Å; L159-Y163 PolarHBondContact O-N 3.2Å; L159-V240 HydrophobicContact CD2-CG2 4.24Å; L159-A243 HydrophobicContact CD2-CB 3.89Å; L159-A243 HydrophobicContact CG-CB 3.92Å
160L96.6Very high94.7Very high22 Ų2246.1 Ų46.112%0.11522%0.22CC..Hα-helixtrans-66-41.3174.8-69.9-178.9000112F156 S157 A162 Y163 G164 L174 V177 A178 F181F156-L160 HydrophobicContact CD1-CD1 3.9Å; F156-L160 HydrophobicContact CD1-CG 4.3Å; F156-L160 HydrophobicContact CE1-CD1 3.54Å; F156-L160 HydrophobicContact CE1-CD2 4.26Å; F156-L160 HydrophobicContact CE1-CG 4.03Å; F156-L160 HydrophobicContact CE2-CD2 4.11Å; F156-L160 HydrophobicContact CE2-CG 4.31Å; F156-L160 HydrophobicContact CZ-CD1 3.98Å; F156-L160 HydrophobicContact CZ-CD2 3.81Å; F156-L160 HydrophobicContact CZ-CG 4.03Å; F156-L160 WeakPolarHBondContact O-CG 3.49Å; F156-L160 PolarHBondContact O-N 3.18Å; S157-L160 WeakPolarHBondContact O-CB 3.07Å; S157-L160 PolarHBondContact O-N 3.39Å; S157-L160 VanDerWaalsContact O-N 3.1Å; L160-A162 VanDerWaalsContact C-N 3.32Å; L160-Y163 PolarHBondContact O-N 3.41Å; L160-G164 PolarHBondContact O-N 2.55Å; L160-L174 HydrophobicContact CB-CD2 4.14Å; L160-L174 HydrophobicContact CB-CG 4.12Å; L160-L174 HydrophobicContact CD2-CD1 4.06Å; L160-L174 HydrophobicContact CD2-CD2 3.86Å; L160-L174 HydrophobicContact CD2-CG 4.12Å; L160-L174 WeakPolarHBondContact O-CD2 3.29Å; L160-V177 HydrophobicContact CD1-CB 4.48Å; L160-V177 HydrophobicContact CD1-CG1 3.91Å; L160-A178 HydrophobicContact CB-CB 3.74Å; L160-A178 HydrophobicContact CD1-CB 4.4Å; L160-F181 HydrophobicContact CD1-CD2 4.22Å
161I95.8Very high94.6Very high1 Ų147.9 Ų47.91%0.00523%0.229CC..Hα-helixtrans-62.6-43.8174.5-56.5177.8000109.8L40 S157 C158 Y163 G164 A165 I175 A178 L179 F235 L239L40-I161 HydrophobicContact CD2-CG2 4.3Å; S157-I161 WeakPolarHBondContact O-CG1 3.37Å; S157-I161 PolarHBondContact O-N 3.39Å; C158-I161 PolarHBondContact O-N 2.57Å; I161-Y163 VanDerWaalsContact C-N 3.34Å; I161-Y163 PolarHBondContact O-N 3.01Å; I161-G164 PolarHBondContact O-N 3.49Å; I161-A165 PolarHBondContact O-N 2.9Å; I161-I175 HydrophobicContact CD1-CD1 4.31Å; I161-I175 HydrophobicContact CG1-CD1 3.96Å; I161-I175 HydrophobicContact CG2-CD1 4.23Å; I161-A178 HydrophobicContact CD1-CB 4.42Å; I161-A178 HydrophobicContact CG1-CB 3.56Å; I161-L179 HydrophobicContact CD1-CD2 4.34Å; I161-F235 HydrophobicContact CG2-CE1 3.94Å; I161-F235 HydrophobicContact CG2-CZ 4Å; I161-L239 HydrophobicContact CB-CD1 3.78Å; I161-L239 HydrophobicContact CG2-CD1 3.47Å; I161-L239 VanDerWaalsContact CG2-CD1 3.47Å; I161-L239 HydrophobicContact CG2-CD2 4.45Å
162A96Very high94.5Very high5 Ų547.8 Ų47.84%0.04123%0.229CC..Hα-helixtrans-62.6-41178.900000112C158 L159 L160 A165 Y166 I236 L239 V240C158-A162 WeakPolarHBondContact O-CB 3.39Å; C158-A162 PolarHBondContact O-N 3.21Å; L159-A162 PolarHBondContact O-N 3.1Å; L160-A162 VanDerWaalsContact C-N 3.32Å; A162-A165 PolarHBondContact O-N 2.76Å; A162-Y166 PolarHBondContact O-N 3.17Å; A162-I236 HydrophobicContact CB-CG2 4.29Å; A162-L239 HydrophobicContact CB-CB 3.88Å; A162-L239 HydrophobicContact CB-CD1 4.01Å; A162-V240 HydrophobicContact CB-CG2 4.4Å
163Y95.4Very high94.3Very high135 Ų13548.6 Ų48.653%0.52923%0.233SC..Hα-helixtrans-67.9-36.8175.4-173.1-111.9000112.2L159 L160 I161 A165 Y166 L171 L174L159-Y163 WeakPolarHBondContact O-CB 3.3Å; L159-Y163 PolarHBondContact O-N 3.2Å; L160-Y163 PolarHBondContact O-N 3.41Å; I161-Y163 VanDerWaalsContact C-N 3.34Å; I161-Y163 PolarHBondContact O-N 3.01Å; Y163-A165 VanDerWaalsContact C-N 3.33Å; Y163-A165 PolarHBondContact O-N 3.46Å; Y163-Y166 WeakPolarHBondContact O-CB 3.4Å; Y163-Y166 PolarHBondContact O-N 3.23Å; Y163-L171 HydrophobicContact CD1-CD1 3.87Å; Y163-L171 HydrophobicContact CE1-CD1 3.52Å; Y163-L171 HydrophobicContact CE1-CD2 3.98Å; Y163-L171 HydrophobicContact CE1-CG 4.39Å; Y163-L171 HydrophobicContact CE2-CD1 4.37Å; Y163-L171 HydrophobicContact CG-CD1 4.42Å; Y163-L171 WeakPolarHBondContact O-CD1 3.37Å; Y163-L174 HydrophobicContact CD1-CD2 3.67Å
164G94.6Very high94.3Very high1 Ų149.9 Ų49.91%0.0124%0.239CC..Hα-helixtrans-59.7-41.7172.200000112.9L160 I161 Y166 K167 P168L160-G164 PolarHBondContact O-N 2.55Å; I161-G164 PolarHBondContact O-N 3.49Å; G164-Y166 VanDerWaalsContact C-N 3.28Å; G164-Y166 PolarHBondContact O-N 2.72Å; G164-K167 CarbonylContact O-C 3.57Å; G164-K167 PolarHBondContact O-N 2.86Å; G164-P168 WeakPolarHBondContact O-CA 3.3Å
165A93.4Very high94.2Very high8 Ų850 Ų507%0.06624%0.239CC..Hα-helixtrans-68.7-23.4178.400000113.6F45 I161 A162 Y163 K167 F235 I236F45-A165 HydrophobicContact CE2-CB 3.88Å; F45-A165 HydrophobicContact CZ-CB 4.22Å; I161-A165 PolarHBondContact O-N 2.9Å; A162-A165 PolarHBondContact O-N 2.76Å; Y163-A165 VanDerWaalsContact C-N 3.33Å; Y163-A165 PolarHBondContact O-N 3.46Å; A165-K167 VanDerWaalsContact C-N 3.35Å; A165-K167 PolarHBondContact O-N 2.85Å; A165-F235 HydrophobicContact CB-CD1 3.7Å; A165-F235 HydrophobicContact CB-CE1 3.97Å; A165-I236 HydrophobicContact CB-CG1 4.08Å
166Y92.9Very high94.1Very high161 Ų16151.1 Ų51.163%0.63124%0.242SC*.Hα-helixtrans-66.3-35178.3-178.4-105.3000113A162 Y163 G164 I236A162-Y166 PolarHBondContact O-N 3.17Å; Y163-Y166 WeakPolarHBondContact O-CB 3.4Å; Y163-Y166 PolarHBondContact O-N 3.23Å; G164-Y166 VanDerWaalsContact C-N 3.28Å; G164-Y166 PolarHBondContact O-N 2.72Å; Y166-I236 HydrophobicContact CD2-CD1 4.44Å
167K91.6Very high94.1Very high108 Ų10849.6 Ų49.647%0.4724%0.241SC..SBendtrans-139.180.6173.6-72.3-176.2175.5-171.60110.3G164 A165 N169 E170 L171G164-K167 CarbonylContact O-C 3.57Å; G164-K167 PolarHBondContact O-N 2.86Å; A165-K167 VanDerWaalsContact C-N 3.35Å; A165-K167 PolarHBondContact O-N 2.85Å; K167-N169 VanDerWaalsContact C-N 3.34Å; K167-N169 PolarHBondContact O-N 2.62Å; K167-E170 PolarHBondContact O-N 3.34Å; K167-L171 HydrophobicContact CB-CD1 3.89Å; K167-L171 HydrophobicContact CB-CG 4.21Å; K167-L171 VanDerWaalsContact O-CB 3.31Å; K167-L171 WeakPolarHBondContact O-CB 3.17Å; K167-L171 PolarHBondContact O-N 3.32Å
168P89.6Confident94Very high14 Ų1449.6 Ų49.69%0.09124%0.241CC..Hα-helixtrans-61.6-38.6-170.922.8-33000112.8E43 W106 G164 E170 S172E43-P168 WeakPolarHBondContact O-CB 3.24Å; E43-P168 WeakPolarHBondContact O-CG 3.2Å; W106-P168 HydrophobicContact CH2-CG 4.3Å; W106-P168 HydrophobicContact CZ2-CG 4.36Å; G164-P168 WeakPolarHBondContact O-CA 3.3Å; P168-E170 VanDerWaalsContact C-N 3.31Å; P168-E170 PolarHBondContact O-N 3.47Å; P168-S172 VanDerWaalsContact O-CB 3.26Å; P168-S172 WeakPolarHBondContact O-CB 3.33Å; P168-S172 PolarHBondContact O-N 2.75Å; P168-S172 PolarHBondContact O-OG 3.49Å
169N87Confident94Very high84 Ų8449.6 Ų49.645%0.44924%0.241SC..Hα-helixtrans-61.9-32.6-175.4-66.1-21.1000114.7Y48 K167Y48-N169 WeakPolarHBondContact CE1-O 3.25Å; K167-N169 VanDerWaalsContact C-N 3.34Å; K167-N169 PolarHBondContact O-N 2.62Å
170E90.1Very high93.9Very high153 Ų15347.6 Ų47.672%0.71523%0.232SC*.Hα-helixtrans-104.9-31.9-178.8-66.7177.1-171.500112.3K167 P168K167-E170 PolarHBondContact O-N 3.34Å; P168-E170 VanDerWaalsContact C-N 3.31Å; P168-E170 PolarHBondContact O-N 3.47Å
171L93.2Very high93.9Very high37 Ų3749.8 Ų49.819%0.19424%0.241CC..Hα-helixtrans-102.50.4-170.7-59.5175.5000114Y163 K167 V173 L174Y163-L171 HydrophobicContact CD1-CD1 3.87Å; Y163-L171 HydrophobicContact CE1-CD1 3.52Å; Y163-L171 HydrophobicContact CE1-CD2 3.98Å; Y163-L171 HydrophobicContact CE1-CG 4.39Å; Y163-L171 HydrophobicContact CE2-CD1 4.37Å; Y163-L171 HydrophobicContact CG-CD1 4.42Å; Y163-L171 WeakPolarHBondContact O-CD1 3.37Å; K167-L171 HydrophobicContact CB-CD1 3.89Å; K167-L171 HydrophobicContact CB-CG 4.21Å; K167-L171 VanDerWaalsContact O-CB 3.31Å; K167-L171 WeakPolarHBondContact O-CB 3.17Å; K167-L171 PolarHBondContact O-N 3.32Å; L171-V173 PolarHBondContact O-N 3.13Å; L171-V173 VanDerWaalsContact O-N 3.11Å; L171-L174 WeakPolarHBondContact O-CB 3.43Å; L171-L174 PolarHBondContact O-N 2.88Å
172S92.3Very high93.9Very high0 Ų049.8 Ų49.80%024%0.241CC..THydrogen-bonded Turntrans-52.8-34.5177.2-75.10000113F45 Y46 P168 L174 I175F45-S172 WeakPolarHBondContact CA-OG 3.39Å; Y46-S172 PolarHBondContact N-OG 2.76Å; Y46-S172 PolarHBondContact OH-O 3.46Å; P168-S172 VanDerWaalsContact O-CB 3.26Å; P168-S172 WeakPolarHBondContact O-CB 3.33Å; P168-S172 PolarHBondContact O-N 2.75Å; P168-S172 PolarHBondContact O-OG 3.49Å; S172-L174 PolarHBondContact O-N 3.39Å; S172-L174 VanDerWaalsContact O-N 3.09Å; S172-I175 WeakPolarHBondContact O-CB 3.37Å; S172-I175 WeakPolarHBondContact O-CG2 3.29Å; S172-I175 PolarHBondContact O-N 3.48Å
173V93.3Very high93.8Very high83 Ų8349.6 Ų49.650%0.50324%0.239SC..THydrogen-bonded Turntrans-58.3-24.5178.3-179.10000113Y46 L171 I175 F176Y46-V173 HydrophobicContact CE1-CG2 4.42Å; Y46-V173 WeakPolarHBondContact OH-CA 3.12Å; L171-V173 PolarHBondContact O-N 3.13Å; L171-V173 VanDerWaalsContact O-N 3.11Å; V173-I175 PolarHBondContact O-N 3.27Å; V173-I175 VanDerWaalsContact O-N 3.13Å; V173-F176 HydrophobicContact CG1-CD2 4.4Å; V173-F176 WeakPolarHBondContact O-CD2 3.42Å; V173-F176 PolarHBondContact O-N 2.98Å
174L94.9Very high93.7Very high41 Ų4145.2 Ų45.222%0.21522%0.223CC..Hα-helixtrans-63.2-20.6178.6-162.960.2000112.9L160 Y163 L171 S172 F176 V177 A178L160-L174 HydrophobicContact CB-CD2 4.14Å; L160-L174 HydrophobicContact CB-CG 4.12Å; L160-L174 HydrophobicContact CD2-CD1 4.06Å; L160-L174 HydrophobicContact CD2-CD2 3.86Å; L160-L174 HydrophobicContact CD2-CG 4.12Å; L160-L174 WeakPolarHBondContact O-CD2 3.29Å; Y163-L174 HydrophobicContact CD1-CD2 3.67Å; L171-L174 WeakPolarHBondContact O-CB 3.43Å; L171-L174 PolarHBondContact O-N 2.88Å; S172-L174 PolarHBondContact O-N 3.39Å; S172-L174 VanDerWaalsContact O-N 3.09Å; L174-F176 PolarHBondContact O-N 3.39Å; L174-V177 HydrophobicContact CD1-CB 4.41Å; L174-V177 PolarHBondContact O-N 3.05Å; L174-V177 VanDerWaalsContact O-N 3.14Å; L174-A178 WeakPolarHBondContact O-CB 3.46Å; L174-A178 PolarHBondContact O-N 2.73Å
175I95.3Very high93.7Very high1 Ų145.2 Ų45.21%0.00522%0.222CC..Hα-helixtrans-57.2-35.9177.5-161.859.8000111.9L40 F45 Y46 A119 I161 S172 V173 V177 A178 L179L40-I175 HydrophobicContact CD1-CD1 4.21Å; L40-I175 HydrophobicContact CD1-CG1 4.4Å; L40-I175 HydrophobicContact CD2-CD1 4.19Å; F45-I175 HydrophobicContact CD1-CB 4.43Å; F45-I175 HydrophobicContact CE1-CB 4.24Å; F45-I175 HydrophobicContact CE1-CD1 4.37Å; Y46-I175 HydrophobicContact CE2-CG2 3.9Å; A119-I175 HydrophobicContact CB-CG2 3.98Å; I161-I175 HydrophobicContact CD1-CD1 4.31Å; I161-I175 HydrophobicContact CG1-CD1 3.96Å; I161-I175 HydrophobicContact CG2-CD1 4.23Å; S172-I175 WeakPolarHBondContact O-CB 3.37Å; S172-I175 WeakPolarHBondContact O-CG2 3.29Å; S172-I175 PolarHBondContact O-N 3.48Å; V173-I175 PolarHBondContact O-N 3.27Å; V173-I175 VanDerWaalsContact O-N 3.13Å; I175-V177 PolarHBondContact O-N 3.48Å; I175-A178 PolarHBondContact O-N 3.5Å; I175-L179 HydrophobicContact CD1-CD1 4.47Å; I175-L179 HydrophobicContact CD1-CD2 4.18Å; I175-L179 HydrophobicContact CD1-CG 4.12Å; I175-L179 HydrophobicContact CG1-CD1 4.03Å; I175-L179 HydrophobicContact CG1-CG 4.07Å; I175-L179 VanDerWaalsContact O-CG 3.29Å; I175-L179 WeakPolarHBondContact O-CG 3.37Å; I175-L179 PolarHBondContact O-N 2.71Å
176F95.7Very high93.7Very high35 Ų3544.8 Ų44.815%0.15422%0.219CC..Hα-helixtrans-60.8-45.6177.7-73.5-71.5000112.3Y46 M115 L118 A119 I122 V173 L174 T180Y46-F176 WeakPolarHBondContact OH-CD2 3.24Å; Y46-F176 WeakPolarHBondContact OH-CE2 3.2Å; M115-F176 HydrophobicContact CE-CE2 3.76Å; M115-F176 HydrophobicContact CE-CZ 3.81Å; L118-F176 HydrophobicContact CB-CE1 4.17Å; L118-F176 HydrophobicContact CB-CZ 4.47Å; L118-F176 HydrophobicContact CD2-CE1 4.03Å; L118-F176 HydrophobicContact CD2-CZ 4.09Å; L118-F176 HydrophobicContact CG-CE1 3.89Å; L118-F176 HydrophobicContact CG-CZ 4.36Å; A119-F176 HydrophobicContact CB-CD1 3.67Å; A119-F176 HydrophobicContact CB-CE1 3.6Å; A119-F176 HydrophobicContact CB-CG 4.36Å; A119-F176 HydrophobicContact CB-CZ 4.24Å; I122-F176 HydrophobicContact CD1-CD1 3.6Å; I122-F176 HydrophobicContact CD1-CE1 3.85Å; V173-F176 HydrophobicContact CG1-CD2 4.4Å; V173-F176 WeakPolarHBondContact O-CD2 3.42Å; V173-F176 PolarHBondContact O-N 2.98Å; L174-F176 PolarHBondContact O-N 3.39Å; F176-T180 WeakPolarHBondContact O-CB 3.33Å; F176-T180 PolarHBondContact O-N 3.39Å; F176-T180 VanDerWaalsContact O-N 3.17Å; F176-T180 PolarHBondContact O-OG1 3.24Å
177V96.4Very high93.6Very high68 Ų6837.7 Ų37.741%0.41219%0.192SC..Hα-helixtrans-69.3-40.5177.5-178.40000109.9L160 L174 I175 T180 F181L160-V177 HydrophobicContact CD1-CB 4.48Å; L160-V177 HydrophobicContact CD1-CG1 3.91Å; L174-V177 HydrophobicContact CD1-CB 4.41Å; L174-V177 PolarHBondContact O-N 3.05Å; L174-V177 VanDerWaalsContact O-N 3.14Å; I175-V177 PolarHBondContact O-N 3.48Å; V177-T180 WeakPolarHBondContact O-CB 3.4Å; V177-T180 PolarHBondContact O-N 3.29Å; V177-F181 HydrophobicContact CG1-CD2 3.84Å; V177-F181 HydrophobicContact CG1-CE2 3.66Å; V177-F181 VanDerWaalsContact O-CD2 3.28Å; V177-F181 WeakPolarHBondContact O-CD2 3.33Å; V177-F181 PolarHBondContact O-N 2.9Å; V177-F181 VanDerWaalsContact O-N 3.13Å
178A96.6Very high93.6Very high0 Ų032.6 Ų32.60%017%0.169CC..Hα-helixtrans-62.5-49.1179.300000112.1S157 L160 I161 L174 I175 T180 F181 N182S157-A178 VanDerWaalsContact CB-O 3.25Å; S157-A178 WeakPolarHBondContact CB-O 3.26Å; S157-A178 PolarHBondContact OG-O 3.14Å; L160-A178 HydrophobicContact CB-CB 3.74Å; L160-A178 HydrophobicContact CD1-CB 4.4Å; I161-A178 HydrophobicContact CD1-CB 4.42Å; I161-A178 HydrophobicContact CG1-CB 3.56Å; L174-A178 WeakPolarHBondContact O-CB 3.46Å; L174-A178 PolarHBondContact O-N 2.73Å; I175-A178 PolarHBondContact O-N 3.5Å; A178-T180 VanDerWaalsContact C-N 3.29Å; A178-T180 PolarHBondContact O-N 3.01Å; A178-F181 PolarHBondContact O-N 3.16Å; A178-N182 WeakPolarHBondContact O-CB 3.34Å; A178-N182 PolarHBondContact O-N 3.09Å
179L95.6Very high93.7Very high0 Ų031.9 Ų31.90%017%0.165CC..Hα-helixtrans-68.6-29.4-179.9-60.7-177.5000112.3L30 W33 L36 A119 I161 I175 N182 G183L30-L179 HydrophobicContact CD2-CD2 3.56Å; W33-L179 HydrophobicContact CH2-CD1 4.39Å; W33-L179 HydrophobicContact CZ3-CD1 3.99Å; L36-L179 HydrophobicContact CD2-CD2 4.35Å; A119-L179 VanDerWaalsContact C-CD1 3.48Å; A119-L179 HydrophobicContact CB-CD1 3.66Å; A119-L179 WeakPolarHBondContact O-CD1 3.35Å; I161-L179 HydrophobicContact CD1-CD2 4.34Å; I175-L179 HydrophobicContact CD1-CD1 4.47Å; I175-L179 HydrophobicContact CD1-CD2 4.18Å; I175-L179 HydrophobicContact CD1-CG 4.12Å; I175-L179 HydrophobicContact CG1-CD1 4.03Å; I175-L179 HydrophobicContact CG1-CG 4.07Å; I175-L179 VanDerWaalsContact O-CG 3.29Å; I175-L179 WeakPolarHBondContact O-CG 3.37Å; I175-L179 PolarHBondContact O-N 2.71Å; L179-N182 WeakPolarHBondContact O-CB 3.47Å; L179-N182 PolarHBondContact O-N 2.97Å; L179-G183 PolarHBondContact O-N 3.03Å
180T95.8Very high93.8Very high43 Ų4328.3 Ų28.326%0.26415%0.146SC..Hα-helixtrans-59-52.9170.5-67.80000111.1L126 F176 V177 A178 N182 G183 F184L126-T180 HydrophobicContact CD1-CG2 3.2Å; F176-T180 WeakPolarHBondContact O-CB 3.33Å; F176-T180 PolarHBondContact O-N 3.39Å; F176-T180 VanDerWaalsContact O-N 3.17Å; F176-T180 PolarHBondContact O-OG1 3.24Å; V177-T180 WeakPolarHBondContact O-CB 3.4Å; V177-T180 PolarHBondContact O-N 3.29Å; A178-T180 VanDerWaalsContact C-N 3.29Å; A178-T180 PolarHBondContact O-N 3.01Å; T180-N182 VanDerWaalsContact C-N 3.29Å; T180-N182 PolarHBondContact O-N 3.38Å; T180-G183 PolarHBondContact O-N 3.33Å; T180-F184 WeakPolarHBondContact O-CB 3.32Å; T180-F184 PolarHBondContact O-N 3.23Å
181F96.6Very high93.5Very high68 Ų6822.1 Ų22.130%0.29812%0.117SC..Hα-helixtrans-67.3-30.6176.8-78-65.3000112.8C153 F156 L160 V177 A178 G185C153-F181 HydrophobicContact CB-CB 4.5Å; C153-F181 HydrophobicContact CB-CD1 4Å; F156-F181 AromaticContact CD1-CD2 3.9Å; F156-F181 HydrophobicContact CD1-CD2 3.9Å; F156-F181 HydrophobicContact CD1-CE2 4.03Å; F156-F181 HydrophobicContact CD1-CG 4.25Å; F156-F181 HydrophobicContact CD1-CZ 4.48Å; F156-F181 HydrophobicContact CE1-CD2 4.03Å; F156-F181 AromaticContact CE1-CE2 3.79Å; F156-F181 HydrophobicContact CE1-CE2 3.79Å; F156-F181 HydrophobicContact CE1-CZ 4.35Å; L160-F181 HydrophobicContact CD1-CD2 4.22Å; V177-F181 HydrophobicContact CG1-CD2 3.84Å; V177-F181 HydrophobicContact CG1-CE2 3.66Å; V177-F181 VanDerWaalsContact O-CD2 3.28Å; V177-F181 WeakPolarHBondContact O-CD2 3.33Å; V177-F181 PolarHBondContact O-N 2.9Å; V177-F181 VanDerWaalsContact O-N 3.13Å; A178-F181 PolarHBondContact O-N 3.16Å; F181-G185 PolarHBondContact O-N 3.08Å
182N95.3Very high93.2Very high1 Ų120.3 Ų20.31%0.00511%0.108CC..Hα-helixtrans-62.5-54.5175.3-156.2-87.5000111.1V29 L30 F154 S157 A178 L179 T180 F184 G185 G186V29-N182 WeakPolarHBondContact CG2-OD1 3.28Å; L30-N182 HydrophobicContact CD1-CB 4.47Å; L30-N182 HydrophobicContact CD2-CB 4.24Å; L30-N182 HydrophobicContact CG-CB 4.5Å; F154-N182 WeakPolarHBondContact CE2-ND2 3.46Å; S157-N182 VanDerWaalsContact OG-CB 3.26Å; S157-N182 WeakPolarHBondContact OG-CB 3.38Å; S157-N182 PolarHBondContact OG-ND2 2.99Å; A178-N182 WeakPolarHBondContact O-CB 3.34Å; A178-N182 PolarHBondContact O-N 3.09Å; L179-N182 WeakPolarHBondContact O-CB 3.47Å; L179-N182 PolarHBondContact O-N 2.97Å; T180-N182 VanDerWaalsContact C-N 3.29Å; T180-N182 PolarHBondContact O-N 3.38Å; N182-F184 PolarHBondContact O-N 3.03Å; N182-G185 PolarHBondContact O-N 2.88Å; N182-G186 PolarHBondContact O-N 2.63Å
183G93.6Very high93Very high0 Ų020.3 Ų20.30%011%0.108CC..Hα-helixtrans-61.8-43.2179.300000112.3L179 T180 M187L179-G183 PolarHBondContact O-N 3.03Å; T180-G183 PolarHBondContact O-N 3.33Å; G183-M187 PolarHBondContact O-N 3.24Å; G183-M187 VanDerWaalsContact O-N 3.13Å
184F94.6Very high92.5Very high44 Ų4419.2 Ų19.219%0.19310%0.098CC..Hα-helixtrans-62.4-48.1175.2176.7-96.9000112.6I130 L134 L149 C153 T180 N182 M187 C188I130-F184 HydrophobicContact CD1-CD2 3.99Å; I130-F184 HydrophobicContact CD1-CE2 4.02Å; I130-F184 HydrophobicContact CG1-CD2 3.72Å; I130-F184 HydrophobicContact CG1-CE2 3.8Å; L134-F184 HydrophobicContact CD2-CE2 4.13Å; L134-F184 HydrophobicContact CD2-CZ 4.46Å; L149-F184 HydrophobicContact CD2-CE1 4.09Å; L149-F184 HydrophobicContact CD2-CZ 4Å; L149-F184 HydrophobicContact CG-CE1 4.09Å; L149-F184 HydrophobicContact CG-CZ 4.49Å; C153-F184 HydrophobicContact CB-CD1 3.96Å; C153-F184 HydrophobicContact CB-CE1 4.45Å; T180-F184 WeakPolarHBondContact O-CB 3.32Å; T180-F184 PolarHBondContact O-N 3.23Å; N182-F184 PolarHBondContact O-N 3.03Å; F184-M187 PolarHBondContact O-N 3.46Å; F184-C188 PolarHBondContact O-N 2.95Å; F184-C188 VanDerWaalsContact O-N 3.11Å; F184-C188 PolarHBondContact O-SG 3.01Å
185G94.6Very high91.8Very high0 Ų017.9 Ų17.90%09%0.092CC..Hα-helixtrans-63.6-43.1-178.500000112.5G150 F181 N182 C188 M189G150-G185 VanDerWaalsContact O-CA 3.25Å; G150-G185 WeakPolarHBondContact O-CA 3.06Å; F181-G185 PolarHBondContact O-N 3.08Å; N182-G185 PolarHBondContact O-N 2.88Å; G185-C188 WeakPolarHBondContact O-CB 3.24Å; G185-C188 PolarHBondContact O-N 3.18Å; G185-M189 WeakPolarHBondContact O-CE 3.33Å; G185-M189 PolarHBondContact O-N 3.41Å
186G93Very high91.2Very high0 Ų017.9 Ų17.90%09%0.092CC..Hα-helixtrans-66.4-36.7178.900000114.2F26 S27 N182 M189 T190F26-G186 WeakPolarHBondContact O-CA 3.42Å; S27-G186 CarbonylContact O-C 3.58Å; S27-G186 VanDerWaalsContact O-C 3.27Å; S27-G186 WeakPolarHBondContact O-CA 3.3Å; N182-G186 PolarHBondContact O-N 2.63Å; G186-M189 PolarHBondContact O-N 3.06Å; G186-T190 PolarHBondContact O-N 3.13Å; G186-T190 PolarHBondContact O-OG1 3.47Å
187M91.4Very high90.5Very high12 Ų1216.2 Ų16.26%0.0599%0.085CC..Hα-helixtrans-69.6-39.4172.8-75.7-53.4-75.800114L127 I130 T131 L134 G183 F184 M189 T190 F191 Y215L127-M187 HydrophobicContact CB-CG 4.29Å; L127-M187 HydrophobicContact CD1-CG 3.73Å; L127-M187 HydrophobicContact CD1-SD 3.94Å; L127-M187 HydrophobicContact CG-CG 3.91Å; L127-M187 HydrophobicContact CG-SD 3.92Å; L127-M187 WeakPolarHBondContact O-CE 3.37Å; L127-M187 WeakPolarHBondContact O-CG 3.49Å; I130-M187 HydrophobicContact CG2-CB 3.7Å; I130-M187 HydrophobicContact CG2-CG 4.08Å; T131-M187 HydrophobicContact CG2-CE 4.46Å; T131-M187 VanDerWaalsContact OG1-CE 3.26Å; T131-M187 WeakPolarHBondContact OG1-CE 3.48Å; L134-M187 HydrophobicContact CD1-CB 3.88Å; G183-M187 PolarHBondContact O-N 3.24Å; G183-M187 VanDerWaalsContact O-N 3.13Å; F184-M187 PolarHBondContact O-N 3.46Å; M187-M189 PolarHBondContact O-N 2.9Å; M187-T190 PolarHBondContact O-N 3.12Å; M187-F191 WeakPolarHBondContact O-CB 3.49Å; M187-F191 PolarHBondContact O-N 3.05Å; M187-Y215 HydrophobicContact SD-CE2 3.86Å
188C91.9Very high89.5Confident0 Ų014.5 Ų14.50%07%0.073CC..Hα-helixtrans-55.4-42.5173.4-72.40000111.4L134 L146 G150 F184 G185 T192L134-C188 VanDerWaalsContact CD2-SG 3.55Å; L146-C188 HydrophobicContact CG-CB 4.45Å; G150-C188 VanDerWaalsContact CA-CB 3.49Å; F184-C188 PolarHBondContact O-N 2.95Å; F184-C188 VanDerWaalsContact O-N 3.11Å; F184-C188 PolarHBondContact O-SG 3.01Å; G185-C188 WeakPolarHBondContact O-CB 3.24Å; G185-C188 PolarHBondContact O-N 3.18Å; C188-T192 WeakPolarHBondContact O-CB 3.35Å; C188-T192 VanDerWaalsContact O-CG2 3.24Å; C188-T192 WeakPolarHBondContact O-CG2 3.38Å; C188-T192 PolarHBondContact O-N 3.41Å; C188-T192 PolarHBondContact O-OG1 3.42Å
189M90.5Very high88.6Confident0 Ų017.1 Ų17.10%09%0.086CC..Hα-helixtrans-66.9-46.8177.4-72-175.3-100.500112.1F26 R147 F154 G185 G186 M187 F191 T192 S193 V249F26-M189 HydrophobicContact CB-CE 3.58Å; F26-M189 HydrophobicContact CB-SD 3.59Å; F26-M189 VanDerWaalsContact CB-SD 3.59Å; F26-M189 HydrophobicContact CG-CE 4.46Å; F26-M189 HydrophobicContact CG-SD 4.33Å; R147-M189 PolarHBondContact NH1-O 2.9Å; F154-M189 HydrophobicContact CB-CE 3.53Å; F154-M189 HydrophobicContact CD2-CE 3.87Å; F154-M189 HydrophobicContact CG-CE 3.79Å; G185-M189 WeakPolarHBondContact O-CE 3.33Å; G185-M189 PolarHBondContact O-N 3.41Å; G186-M189 PolarHBondContact O-N 3.06Å; M187-M189 PolarHBondContact O-N 2.9Å; M189-F191 PolarHBondContact O-N 3.45Å; M189-T192 PolarHBondContact O-OG1 3.07Å; M189-S193 WeakPolarHBondContact O-CB 3.27Å; M189-S193 PolarHBondContact O-N 3.49Å; M189-S193 PolarHBondContact O-OG 3.36Å; M189-V249 HydrophobicContact SD-CG1 4.19Å
190T88.7Confident87.7Confident9 Ų917.3 Ų17.36%0.0559%0.087CC..Hα-helixtrans-59.2-51.7179-51.60000112.1S27 G186 M187 T192 S193 L194 Y215S27-T190 WeakPolarHBondContact CB-OG1 3.43Å; G186-T190 PolarHBondContact O-N 3.13Å; G186-T190 PolarHBondContact O-OG1 3.47Å; M187-T190 PolarHBondContact O-N 3.12Å; T190-T192 VanDerWaalsContact C-N 3.31Å; T190-T192 PolarHBondContact O-N 3.3Å; T190-S193 WeakPolarHBondContact O-CA 3.3Å; T190-S193 WeakPolarHBondContact O-CB 3.16Å; T190-S193 PolarHBondContact O-N 3.46Å; T190-L194 PolarHBondContact O-N 2.83Å; T190-Y215 HydrophobicContact CG2-CD2 3.45Å; T190-Y215 VanDerWaalsContact CG2-CD2 3.45Å; T190-Y215 HydrophobicContact CG2-CE2 4.11Å; T190-Y215 HydrophobicContact CG2-CG 3.83Å; T190-Y215 VanDerWaalsContact OG1-CD2 3.29Å; T190-Y215 WeakPolarHBondContact OG1-CD2 3.36Å
191F84.3Confident86.6Confident22 Ų2217.8 Ų17.810%0.09610%0.101CC..Hα-helixtrans-67-37.9-170.7-161-103.4000111.2T131 L134 M138 M187 M189 S193 L194T131-F191 HydrophobicContact CG2-CD2 4.17Å; T131-F191 HydrophobicContact CG2-CE2 4Å; L134-F191 HydrophobicContact CB-CD1 4.43Å; M138-F191 HydrophobicContact CB-CD1 4.3Å; M138-F191 HydrophobicContact CB-CE1 4.13Å; M138-F191 HydrophobicContact CE-CD1 3.79Å; M138-F191 HydrophobicContact CE-CE1 3.23Å; M138-F191 HydrophobicContact CE-CZ 4.04Å; M138-F191 HydrophobicContact CG-CD1 4.48Å; M138-F191 HydrophobicContact CG-CE1 4.46Å; M138-F191 HydrophobicContact SD-CD1 3.37Å; M138-F191 WeakPolarHBondContact SD-CD1 3.26Å; M138-F191 HydrophobicContact SD-CE1 3.49Å; M138-F191 WeakPolarHBondContact SD-CE1 3.43Å; M138-F191 HydrophobicContact SD-CG 4.49Å; M187-F191 WeakPolarHBondContact O-CB 3.49Å; M187-F191 PolarHBondContact O-N 3.05Å; M189-F191 PolarHBondContact O-N 3.45Å; F191-S193 VanDerWaalsContact C-N 3.35Å; F191-L194 HydrophobicContact CD2-CD1 4.44Å; F191-L194 PolarHBondContact O-N 3.28Å
192T88Confident85.2Confident0 Ų022.9 Ų22.90%013%0.131CC..Hα-helixtrans-67.6-34.5172.956.50000112.2P143 L146 R147 C188 M189 T190 L194 T195P143-T192 HydrophobicContact CB-CG2 3.98Å; P143-T192 VanDerWaalsContact O-CG2 3.3Å; P143-T192 WeakPolarHBondContact O-CG2 3.45Å; L146-T192 HydrophobicContact CB-CG2 3.97Å; L146-T192 HydrophobicContact CD2-CG2 4.1Å; L146-T192 HydrophobicContact CG-CG2 4.29Å; R147-T192 HydrophobicContact CB-CG2 4.14Å; R147-T192 PolarHBondContact NH1-OG1 2.92Å; C188-T192 WeakPolarHBondContact O-CB 3.35Å; C188-T192 VanDerWaalsContact O-CG2 3.24Å; C188-T192 WeakPolarHBondContact O-CG2 3.38Å; C188-T192 PolarHBondContact O-N 3.41Å; C188-T192 PolarHBondContact O-OG1 3.42Å; M189-T192 PolarHBondContact O-OG1 3.07Å; T190-T192 VanDerWaalsContact C-N 3.31Å; T190-T192 PolarHBondContact O-N 3.3Å; T192-L194 VanDerWaalsContact C-N 3.35Å; T192-L194 PolarHBondContact O-N 3.42Å; T192-T195 PolarHBondContact O-N 2.85Å; T192-T195 PolarHBondContact O-OG1 3.47Å
193S87.9Confident84Confident0 Ų026.8 Ų26.80%015%0.151CC..Hα-helixtrans-66.6-30.8174.2-61.60000113.1N23 R147 M189 T190 F191 T195 L196 P197N23-S193 WeakPolarHBondContact ND2-CB 3.32Å; N23-S193 WeakPolarHBondContact OD1-CB 3.39Å; N23-S193 PolarHBondContact OD1-OG 2.78Å; R147-S193 PolarHBondContact NH1-OG 2.68Å; R147-S193 PolarHBondContact NH2-OG 2.88Å; M189-S193 WeakPolarHBondContact O-CB 3.27Å; M189-S193 PolarHBondContact O-N 3.49Å; M189-S193 PolarHBondContact O-OG 3.36Å; T190-S193 WeakPolarHBondContact O-CA 3.3Å; T190-S193 WeakPolarHBondContact O-CB 3.16Å; T190-S193 PolarHBondContact O-N 3.46Å; F191-S193 VanDerWaalsContact C-N 3.35Å; S193-T195 PolarHBondContact O-N 3.01Å; S193-L196 WeakPolarHBondContact O-CB 3.49Å; S193-L196 PolarHBondContact O-N 3.1Å; S193-P197 WeakPolarHBondContact O-CD 3.49Å
194L81.2Confident83.2Confident59 Ų5930.9 Ų30.931%0.30917%0.167SC..THydrogen-bonded Turntrans-66.7-15.3178.5-70.4174.8000113.9T190 F191 T192 P197 M211 I212T190-L194 PolarHBondContact O-N 2.83Å; F191-L194 HydrophobicContact CD2-CD1 4.44Å; F191-L194 PolarHBondContact O-N 3.28Å; T192-L194 VanDerWaalsContact C-N 3.35Å; T192-L194 PolarHBondContact O-N 3.42Å; L194-P197 WeakPolarHBondContact O-CD 3.19Å; L194-M211 HydrophobicContact CD2-CB 4.05Å; L194-I212 HydrophobicContact CD2-CG1 3.96Å
195T79.9Confident82.1Confident14 Ų1431 Ų319%0.08617%0.173CC..THydrogen-bonded Turntrans-83-23.2175.567.80000113.2M138 T192 S193 N198M138-T195 HydrophobicContact CE-CG2 3.65Å; M138-T195 HydrophobicContact SD-CG2 3.64Å; T192-T195 PolarHBondContact O-N 2.85Å; T192-T195 PolarHBondContact O-OG1 3.47Å; S193-T195 PolarHBondContact O-N 3.01Å; T195-N198 WeakPolarHBondContact O-CB 3.29Å; T195-N198 PolarHBondContact O-N 3.46Å
196L83.4Confident81.3Confident0 Ų035 Ų350%020%0.197CC..G310 helixtrans-64.2-37.6-175.1-174.8142.3000114.5M15 A16 A19 S193 N198 M199 F200 M211 W257M15-L196 HydrophobicContact CB-CD1 3.67Å; A16-L196 HydrophobicContact CB-CD2 3.84Å; A19-L196 HydrophobicContact CB-CD1 4.29Å; S193-L196 WeakPolarHBondContact O-CB 3.49Å; S193-L196 PolarHBondContact O-N 3.1Å; L196-N198 PolarHBondContact O-N 3.43Å; L196-M199 WeakPolarHBondContact O-CB 3.31Å; L196-M199 WeakPolarHBondContact O-CG 3.2Å; L196-M199 PolarHBondContact O-N 3.47Å; L196-M199 VanDerWaalsContact O-N 3.07Å; L196-F200 HydrophobicContact CD2-CD2 4.38Å; L196-F200 HydrophobicContact CD2-CE2 3.78Å; L196-M211 HydrophobicContact CB-CE 4.47Å; L196-M211 HydrophobicContact CD2-CE 3.77Å; L196-W257 HydrophobicContact CB-CZ2 4.5Å; L196-W257 HydrophobicContact CD1-CH2 3.41Å; L196-W257 VanDerWaalsContact CD1-CH2 3.41Å; L196-W257 HydrophobicContact CD1-CZ2 4.01Å; L196-W257 HydrophobicContact CD1-CZ3 3.97Å
197P80.9Confident80.9Confident0 Ų036.1 Ų36.10%020%0.202CC..G310 helixtrans-57.3-20176.7-28.436.4000115.1S193 L194 M199 F200 R204 F207 I208 M211S193-P197 WeakPolarHBondContact O-CD 3.49Å; L194-P197 WeakPolarHBondContact O-CD 3.19Å; P197-M199 PolarHBondContact O-N 3.22Å; P197-F200 WeakPolarHBondContact O-CB 3.34Å; P197-F200 PolarHBondContact O-N 3.01Å; P197-R204 HydrophobicContact CB-CG 4.39Å; P197-F207 HydrophobicContact CB-CB 3.73Å; P197-F207 HydrophobicContact CG-CB 3.96Å; P197-I208 HydrophobicContact CB-CB 4.5Å; P197-I208 HydrophobicContact CB-CD1 4.4Å; P197-I208 HydrophobicContact CB-CG1 3.48Å; P197-I208 VanDerWaalsContact CB-CG1 3.48Å; P197-I208 HydrophobicContact CG-CB 4.5Å; P197-I208 HydrophobicContact CG-CG1 3.76Å; P197-M211 HydrophobicContact CG-CG 3.99Å
198N76.6Confident80.4Confident32 Ų3238.1 Ų38.117%0.17121%0.213CC..G310 helixtrans-60.8-24.9176-68.6-16.6000112.2T195 L196 F200 R204 F262T195-N198 WeakPolarHBondContact O-CB 3.29Å; T195-N198 PolarHBondContact O-N 3.46Å; L196-N198 PolarHBondContact O-N 3.43Å; N198-F200 PolarHBondContact O-N 3.11Å; N198-R204 PolarHBondContact OD1-NE 2.95Å; N198-R204 PolarHBondContact OD1-NH2 3.49Å; N198-F262 HydrophobicContact CB-CB 4.16Å
199M77.3Confident80Confident55 Ų5538.5 Ų38.527%0.27122%0.216SC..G310 helixtrans-68.7-13.4173.5-58.9-178.573.500113.5R12 M15 L196 P197 F262R12-M199 HydrophobicContact CB-CE 4.05Å; R12-M199 HydrophobicContact CG-CE 3.92Å; R12-M199 PolarHBondContact NE-O 2.85Å; R12-M199 PolarHBondContact NH1-O 3.46Å; R12-M199 VanDerWaalsContact NH1-O 3.17Å; R12-M199 PolarHBondContact NH2-O 3.3Å; M15-M199 HydrophobicContact CE-CE 3.75Å; M15-M199 HydrophobicContact CE-SD 3.76Å; L196-M199 WeakPolarHBondContact O-CB 3.31Å; L196-M199 WeakPolarHBondContact O-CG 3.2Å; L196-M199 PolarHBondContact O-N 3.47Å; L196-M199 VanDerWaalsContact O-N 3.07Å; P197-M199 PolarHBondContact O-N 3.22Å; M199-F262 HydrophobicContact CE-CE1 3.97Å; M199-F262 HydrophobicContact CE-CZ 4.42Å; M199-F262 HydrophobicContact CG-CD1 3.58Å; M199-F262 HydrophobicContact CG-CE1 3.48Å; M199-F262 VanDerWaalsContact CG-CE1 3.48Å; M199-F262 HydrophobicContact CG-CE2 4.45Å; M199-F262 HydrophobicContact CG-CG 4.12Å; M199-F262 HydrophobicContact CG-CZ 3.92Å; M199-F262 HydrophobicContact SD-CD1 4.01Å; M199-F262 HydrophobicContact SD-CE1 3.24Å; M199-F262 WeakPolarHBondContact SD-CE1 3.41Å; M199-F262 HydrophobicContact SD-CE2 4.15Å; M199-F262 HydrophobicContact SD-CZ 3.29Å; M199-F262 WeakPolarHBondContact SD-CZ 3.48Å
200F75.6Confident79.8Confident5 Ų540.7 Ų40.72%0.02223%0.227CC..G310 helixtrans-99.96-165.7-73.9-94.6000116.9R12 W13 A16 L196 P197 N198 N202 L203 F207R12-F200 HydrophobicContact CG-CE1 4.17Å; R12-F200 HydrophobicContact CG-CE2 3.91Å; R12-F200 HydrophobicContact CG-CZ 3.52Å; R12-F200 VanDerWaalsContact NE-CE1 3.33Å; R12-F200 VanDerWaalsContact NH2-CA 3.34Å; W13-F200 HydrophobicContact CZ2-CE1 4.5Å; A16-F200 HydrophobicContact CB-CE2 4.03Å; A16-F200 HydrophobicContact CB-CZ 3.7Å; L196-F200 HydrophobicContact CD2-CD2 4.38Å; L196-F200 HydrophobicContact CD2-CE2 3.78Å; P197-F200 WeakPolarHBondContact O-CB 3.34Å; P197-F200 PolarHBondContact O-N 3.01Å; N198-F200 PolarHBondContact O-N 3.11Å; F200-N202 PolarHBondContact O-N 3.03Å; F200-L203 HydrophobicContact CB-CB 4.21Å; F200-L203 PolarHBondContact O-N 3.14Å; F200-F207 HydrophobicContact CB-CD2 3.79Å; F200-F207 HydrophobicContact CB-CE2 4.28Å; F200-F207 HydrophobicContact CB-CG 4.39Å; F200-F207 AromaticContact CD1-CD2 3.62Å; F200-F207 HydrophobicContact CD1-CD2 3.62Å; F200-F207 HydrophobicContact CD1-CE1 4.44Å; F200-F207 AromaticContact CD1-CE2 3.23Å; F200-F207 HydrophobicContact CD1-CE2 3.23Å; F200-F207 HydrophobicContact CD1-CG 4.38Å; F200-F207 AromaticContact CD1-CZ 3.69Å; F200-F207 HydrophobicContact CD1-CZ 3.69Å; F200-F207 HydrophobicContact CD2-CD2 4.25Å; F200-F207 HydrophobicContact CD2-CE2 4.48Å; F200-F207 HydrophobicContact CD2-CG 4.28Å; F200-F207 HydrophobicContact CE1-CD2 4.29Å; F200-F207 HydrophobicContact CE1-CE1 4.18Å; F200-F207 AromaticContact CE1-CE2 3.6Å; F200-F207 HydrophobicContact CE1-CE2 3.6Å; F200-F207 AromaticContact CE1-CZ 3.52Å; F200-F207 HydrophobicContact CE1-CZ 3.52Å; F200-F207 HydrophobicContact CE2-CE1 4.49Å; F200-F207 AromaticContact CG-CD2 3.62Å; F200-F207 HydrophobicContact CG-CD2 3.62Å; F200-F207 AromaticContact CG-CE2 3.75Å; F200-F207 HydrophobicContact CG-CE2 3.75Å; F200-F207 HydrophobicContact CG-CG 4.1Å; F200-F207 HydrophobicContact CG-CZ 4.32Å; F200-F207 HydrophobicContact CZ-CE1 4.2Å; F200-F207 HydrophobicContact CZ-CE2 4.36Å; F200-F207 HydrophobicContact CZ-CZ 4Å
201G72.9Confident79.7Confident53 Ų5340.2 Ų40.255%0.54623%0.225SC..G310 helixtrans46.1-114.1171.400000112.4L203 R204G201-L203 PolarHBondContact O-N 3.39Å; G201-L203 VanDerWaalsContact O-N 3.15Å; G201-R204 WeakPolarHBondContact O-CB 3.23Å; G201-R204 PolarHBondContact O-N 3.44Å
202N67.9Low79.9Confident174 Ų17440.7 Ų40.793%0.9323%0.228SC*.G310 helixtrans-60.5-21.9179.2-65.2-13.6000115.2F200F200-N202 PolarHBondContact O-N 3.03Å
203L70.8Confident79.9Confident84 Ų8440.7 Ų40.744%0.4423%0.228SC..G310 helixtrans-98.43.2177.4-61.1174.5000112.7F200 G201 S205 T206 F207F200-L203 HydrophobicContact CB-CB 4.21Å; F200-L203 PolarHBondContact O-N 3.14Å; G201-L203 PolarHBondContact O-N 3.39Å; G201-L203 VanDerWaalsContact O-N 3.15Å; L203-S205 PolarHBondContact O-N 3.07Å; L203-T206 PolarHBondContact O-N 3.23Å; L203-F207 HydrophobicContact CB-CD2 3.89Å; L203-F207 HydrophobicContact CB-CE2 4.05Å; L203-F207 HydrophobicContact CD1-CE2 4.3Å; L203-F207 WeakPolarHBondContact O-CD2 3.37Å; L203-F207 PolarHBondContact O-N 2.68Å
204R75.5Confident80.1Confident86 Ų8640.7 Ų40.733%0.32523%0.228SC..Hα-helixtrans-52.7-50.2-175.7176.8178.9-175.3-130.84.7112.5P197 N198 G201 T206 F207 I208 P265P197-R204 HydrophobicContact CB-CG 4.39Å; N198-R204 PolarHBondContact OD1-NE 2.95Å; N198-R204 PolarHBondContact OD1-NH2 3.49Å; G201-R204 WeakPolarHBondContact O-CB 3.23Å; G201-R204 PolarHBondContact O-N 3.44Å; R204-T206 PolarHBondContact O-N 3.02Å; R204-F207 PolarHBondContact O-N 3.17Å; R204-I208 HydrophobicContact CG-CD1 3.83Å; R204-I208 HydrophobicContact CG-CG1 4.41Å; R204-I208 VanDerWaalsContact O-CG1 3.32Å; R204-I208 WeakPolarHBondContact O-CG1 3.04Å; R204-I208 PolarHBondContact O-N 3.23Å; R204-P265 VanDerWaalsContact NH1-CG 3.27Å
205S71Confident80.6Confident46 Ų4638.7 Ų38.732%0.32222%0.216SC..Hα-helixtrans-60-44.7-178.4-176.90000112.1L203 F207 I208 A209 D411L203-S205 PolarHBondContact O-N 3.07Å; S205-F207 PolarHBondContact O-N 2.91Å; S205-I208 PolarHBondContact O-N 3.15Å; S205-A209 PolarHBondContact O-N 3.45Å; S205-D411 VanDerWaalsContact CB-OD2 3.24Å; S205-D411 WeakPolarHBondContact CB-OD2 3.44Å; S205-D411 PolarHBondContact OG-OD2 3.03Å
206T79.6Confident81Confident83 Ų8338.1 Ų38.151%0.50921%0.212SC..Hα-helixtrans-61.8-43.5176.9-50.20000112L203 R204 A209 L210L203-T206 PolarHBondContact O-N 3.23Å; R204-T206 PolarHBondContact O-N 3.02Å; T206-A209 PolarHBondContact O-N 2.98Å; T206-L210 VanDerWaalsContact O-CB 3.32Å; T206-L210 WeakPolarHBondContact O-CB 3.46Å; T206-L210 PolarHBondContact O-N 3.03Å
207F82.9Confident81.4Confident25 Ų2538.1 Ų38.111%0.1121%0.212CC..Hα-helixtrans-68-35.7176.8-87.7-82.6000112.5W13 A16 P197 F200 L203 R204 S205 L210 M211W13-F207 HydrophobicContact CH2-CZ 4.2Å; W13-F207 AromaticContact CZ3-CZ 4Å; W13-F207 HydrophobicContact CZ3-CZ 4Å; A16-F207 HydrophobicContact CB-CE1 3.91Å; P197-F207 HydrophobicContact CB-CB 3.73Å; P197-F207 HydrophobicContact CG-CB 3.96Å; F200-F207 HydrophobicContact CB-CD2 3.79Å; F200-F207 HydrophobicContact CB-CE2 4.28Å; F200-F207 HydrophobicContact CB-CG 4.39Å; F200-F207 AromaticContact CD1-CD2 3.62Å; F200-F207 HydrophobicContact CD1-CD2 3.62Å; F200-F207 HydrophobicContact CD1-CE1 4.44Å; F200-F207 AromaticContact CD1-CE2 3.23Å; F200-F207 HydrophobicContact CD1-CE2 3.23Å; F200-F207 HydrophobicContact CD1-CG 4.38Å; F200-F207 AromaticContact CD1-CZ 3.69Å; F200-F207 HydrophobicContact CD1-CZ 3.69Å; F200-F207 HydrophobicContact CD2-CD2 4.25Å; F200-F207 HydrophobicContact CD2-CE2 4.48Å; F200-F207 HydrophobicContact CD2-CG 4.28Å; F200-F207 HydrophobicContact CE1-CD2 4.29Å; F200-F207 HydrophobicContact CE1-CE1 4.18Å; F200-F207 AromaticContact CE1-CE2 3.6Å; F200-F207 HydrophobicContact CE1-CE2 3.6Å; F200-F207 AromaticContact CE1-CZ 3.52Å; F200-F207 HydrophobicContact CE1-CZ 3.52Å; F200-F207 HydrophobicContact CE2-CE1 4.49Å; F200-F207 AromaticContact CG-CD2 3.62Å; F200-F207 HydrophobicContact CG-CD2 3.62Å; F200-F207 AromaticContact CG-CE2 3.75Å; F200-F207 HydrophobicContact CG-CE2 3.75Å; F200-F207 HydrophobicContact CG-CG 4.1Å; F200-F207 HydrophobicContact CG-CZ 4.32Å; F200-F207 HydrophobicContact CZ-CE1 4.2Å; F200-F207 HydrophobicContact CZ-CE2 4.36Å; F200-F207 HydrophobicContact CZ-CZ 4Å; L203-F207 HydrophobicContact CB-CD2 3.89Å; L203-F207 HydrophobicContact CB-CE2 4.05Å; L203-F207 HydrophobicContact CD1-CE2 4.3Å; L203-F207 WeakPolarHBondContact O-CD2 3.37Å; L203-F207 PolarHBondContact O-N 2.68Å; R204-F207 PolarHBondContact O-N 3.17Å; S205-F207 PolarHBondContact O-N 2.91Å; F207-L210 PolarHBondContact O-N 3.31Å; F207-M211 WeakPolarHBondContact O-CB 3.4Å; F207-M211 VanDerWaalsContact O-CG 3.23Å; F207-M211 WeakPolarHBondContact O-CG 3.25Å; F207-M211 PolarHBondContact O-N 3.33Å
208I81.9Confident82Confident54 Ų5438.1 Ų38.128%0.27721%0.212SC..Hα-helixtrans-61.6-49.7172.4-69.1171.4000110.1P197 R204 S205 L210 M211 I212P197-I208 HydrophobicContact CB-CB 4.5Å; P197-I208 HydrophobicContact CB-CD1 4.4Å; P197-I208 HydrophobicContact CB-CG1 3.48Å; P197-I208 VanDerWaalsContact CB-CG1 3.48Å; P197-I208 HydrophobicContact CG-CB 4.5Å; P197-I208 HydrophobicContact CG-CG1 3.76Å; R204-I208 HydrophobicContact CG-CD1 3.83Å; R204-I208 HydrophobicContact CG-CG1 4.41Å; R204-I208 VanDerWaalsContact O-CG1 3.32Å; R204-I208 WeakPolarHBondContact O-CG1 3.04Å; R204-I208 PolarHBondContact O-N 3.23Å; S205-I208 PolarHBondContact O-N 3.15Å; I208-L210 VanDerWaalsContact C-N 3.28Å; I208-L210 PolarHBondContact O-N 3.01Å; I208-M211 PolarHBondContact O-N 2.94Å; I208-I212 HydrophobicContact CG2-CD1 3.87Å; I208-I212 WeakPolarHBondContact O-CG1 3.29Å; I208-I212 PolarHBondContact O-N 2.78Å
209A82.4Confident82.7Confident8 Ų836.6 Ų36.67%0.06620%0.204CC..Hα-helixtrans-60.4-39.9178.900000111.7S205 T206 I212 G213 T403S205-A209 PolarHBondContact O-N 3.45Å; T206-A209 PolarHBondContact O-N 2.98Å; A209-I212 PolarHBondContact O-N 3.48Å; A209-G213 PolarHBondContact O-N 3.01Å; A209-T403 WeakPolarHBondContact O-CG2 3.47Å
210L86.5Confident83.4Confident45 Ų4535 Ų3524%0.23620%0.197CC..Hα-helixtrans-71.5-34.2178.4-167.3140.5000112.4I20 T206 F207 I208 G213 S214I20-L210 HydrophobicContact CB-CD2 4.33Å; I20-L210 HydrophobicContact CD1-CD2 3.17Å; I20-L210 HydrophobicContact CG1-CD2 3.38Å; I20-L210 HydrophobicContact CG2-CD2 3.97Å; T206-L210 VanDerWaalsContact O-CB 3.32Å; T206-L210 WeakPolarHBondContact O-CB 3.46Å; T206-L210 PolarHBondContact O-N 3.03Å; F207-L210 PolarHBondContact O-N 3.31Å; I208-L210 VanDerWaalsContact C-N 3.28Å; I208-L210 PolarHBondContact O-N 3.01Å; L210-G213 PolarHBondContact O-N 3.49Å; L210-S214 WeakPolarHBondContact O-CB 3.36Å; L210-S214 PolarHBondContact O-N 2.89Å; L210-S214 PolarHBondContact O-OG 3.47Å
211M88.3Confident84.3Confident0 Ų035.3 Ų35.30%020%0.2CC..Hα-helixtrans-64.4-46.6171.6-73-62.417800111.7A19 I20 N23 L194 L196 P197 F207 I208 G213 S214 Y215A19-M211 HydrophobicContact CB-CE 3.73Å; A19-M211 HydrophobicContact CB-SD 4.37Å; I20-M211 HydrophobicContact CG1-CE 4.1Å; I20-M211 HydrophobicContact CG1-SD 4.19Å; N23-M211 PolarHBondContact ND2-SD 3.44Å; L194-M211 HydrophobicContact CD2-CB 4.05Å; L196-M211 HydrophobicContact CB-CE 4.47Å; L196-M211 HydrophobicContact CD2-CE 3.77Å; P197-M211 HydrophobicContact CG-CG 3.99Å; F207-M211 WeakPolarHBondContact O-CB 3.4Å; F207-M211 VanDerWaalsContact O-CG 3.23Å; F207-M211 WeakPolarHBondContact O-CG 3.25Å; F207-M211 PolarHBondContact O-N 3.33Å; I208-M211 PolarHBondContact O-N 2.94Å; M211-G213 VanDerWaalsContact C-N 3.31Å; M211-G213 PolarHBondContact O-N 3.32Å; M211-S214 PolarHBondContact O-N 3.04Å; M211-S214 PolarHBondContact O-OG 3.39Å; M211-Y215 PolarHBondContact O-N 3.49Å
212I86.5Confident85.2Confident31 Ų3132.9 Ų32.916%0.15917%0.174CC..Hα-helixtrans-62.3-41.6175.7-64.9169.5000110.4L194 I208 A209 Y215 A216 T403 H488L194-I212 HydrophobicContact CD2-CG1 3.96Å; I208-I212 HydrophobicContact CG2-CD1 3.87Å; I208-I212 WeakPolarHBondContact O-CG1 3.29Å; I208-I212 PolarHBondContact O-N 2.78Å; A209-I212 PolarHBondContact O-N 3.48Å; I212-Y215 WeakPolarHBondContact O-CB 3.37Å; I212-Y215 PolarHBondContact O-N 2.9Å; I212-A216 PolarHBondContact O-N 2.99Å; I212-T403 HydrophobicContact CB-CG2 4.1Å; I212-T403 HydrophobicContact CG2-CG2 3.93Å; I212-H488 HydrophobicContact CG2-CB 4.17Å
213G89.3Confident86.2Confident0 Ų024.7 Ų24.70%013%0.131CC..Hα-helixtrans-62.4-42175.700000112.7A209 L210 M211 A216 S217 T403A209-G213 PolarHBondContact O-N 3.01Å; L210-G213 PolarHBondContact O-N 3.49Å; M211-G213 VanDerWaalsContact C-N 3.31Å; M211-G213 PolarHBondContact O-N 3.32Å; G213-A216 PolarHBondContact O-N 2.9Å; G213-S217 VanDerWaalsContact O-CB 3.3Å; G213-S217 WeakPolarHBondContact O-CB 3.26Å; G213-S217 PolarHBondContact O-N 3.24Å; G213-S217 PolarHBondContact O-OG 3.18Å; G213-T403 WeakPolarHBondContact CA-OG1 3.35Å
214S91.9Very high87.2Confident0 Ų022.3 Ų22.30%013%0.127CC..Hα-helixtrans-63.6-40.9176.170.50000112.1N23 L210 M211 S217 S218N23-S214 VanDerWaalsContact CB-OG 3.29Å; N23-S214 WeakPolarHBondContact CB-OG 3.3Å; N23-S214 PolarHBondContact ND2-OG 3.05Å; L210-S214 WeakPolarHBondContact O-CB 3.36Å; L210-S214 PolarHBondContact O-N 2.89Å; L210-S214 PolarHBondContact O-OG 3.47Å; M211-S214 PolarHBondContact O-N 3.04Å; M211-S214 PolarHBondContact O-OG 3.39Å; S214-S217 PolarHBondContact O-N 3.28Å; S214-S218 PolarHBondContact O-N 2.91Å; S214-S218 VanDerWaalsContact O-N 3.12Å
215Y90.8Very high88Confident18 Ų1818.8 Ų18.87%0.07112%0.115CC..Hα-helixtrans-60.5-50.6173.5164.8-98.6000111.6A28 M187 T190 M211 I212 S217 S218A28-Y215 HydrophobicContact CB-CD2 3.67Å; A28-Y215 HydrophobicContact CB-CE2 3.34Å; A28-Y215 HydrophobicContact CB-CG 4.43Å; M187-Y215 HydrophobicContact SD-CE2 3.86Å; T190-Y215 HydrophobicContact CG2-CD2 3.45Å; T190-Y215 VanDerWaalsContact CG2-CD2 3.45Å; T190-Y215 HydrophobicContact CG2-CE2 4.11Å; T190-Y215 HydrophobicContact CG2-CG 3.83Å; T190-Y215 VanDerWaalsContact OG1-CD2 3.29Å; T190-Y215 WeakPolarHBondContact OG1-CD2 3.36Å; M211-Y215 PolarHBondContact O-N 3.49Å; I212-Y215 WeakPolarHBondContact O-CB 3.37Å; I212-Y215 PolarHBondContact O-N 2.9Å; Y215-S217 VanDerWaalsContact C-N 3.26Å; Y215-S217 PolarHBondContact O-N 3.34Å; Y215-S218 WeakPolarHBondContact O-CB 3.45Å; Y215-S218 PolarHBondContact O-N 3.21Å; Y215-S218 PolarHBondContact O-OG 2.99Å
216A88.7Confident89Confident1 Ų116.7 Ų16.71%0.00810%0.1CC..Hα-helixtrans-64.9-31179.400000112.5I212 G213 S218 C399 R484I212-A216 PolarHBondContact O-N 2.99Å; G213-A216 PolarHBondContact O-N 2.9Å; A216-S218 VanDerWaalsContact C-N 3.35Å; A216-C399 HydrophobicContact CB-CB 3.78Å; A216-R484 PolarHBondContact O-NH2 3.02Å
217S92.3Very high89.5Confident0 Ų016.6 Ų16.60%010%0.099CC..Hα-helixtrans-78.9-15.1178.4-53.90000113.8G213 S214 Y215 A219 V220 Q396 C399 L400G213-S217 VanDerWaalsContact O-CB 3.3Å; G213-S217 WeakPolarHBondContact O-CB 3.26Å; G213-S217 PolarHBondContact O-N 3.24Å; G213-S217 PolarHBondContact O-OG 3.18Å; S214-S217 PolarHBondContact O-N 3.28Å; Y215-S217 VanDerWaalsContact C-N 3.26Å; Y215-S217 PolarHBondContact O-N 3.34Å; S217-A219 PolarHBondContact O-N 3.1Å; S217-V220 WeakPolarHBondContact O-CB 3.4Å; S217-V220 WeakPolarHBondContact O-CG1 3.28Å; S217-V220 PolarHBondContact O-N 3.4Å; S217-Q396 PolarHBondContact OG-O 3.48Å; S217-C399 VanDerWaalsContact OG-CB 3.29Å; S217-C399 WeakPolarHBondContact OG-CB 3.42Å; S217-L400 PolarHBondContact OG-N 2.86Å
218S93.5Very high90Very high0 Ų019.6 Ų19.60%012%0.115CC..G310 helixtrans-62.9-16.1-171.963.60000115.6N23 L24 S27 A28 S214 Y215 A216 V220 T221N23-S218 VanDerWaalsContact O-CB 3.26Å; N23-S218 WeakPolarHBondContact O-CB 3.48Å; L24-S218 WeakPolarHBondContact O-CA 3.22Å; L24-S218 WeakPolarHBondContact O-CB 3.19Å; S27-S218 WeakPolarHBondContact OG-CB 3.23Å; S27-S218 PolarHBondContact OG-OG 3.47Å; S27-S218 VanDerWaalsContact OG-OG 3.12Å; A28-S218 VanDerWaalsContact C-OG 3.23Å; A28-S218 WeakPolarHBondContact CA-OG 3.31Å; A28-S218 WeakPolarHBondContact CB-OG 3.44Å; A28-S218 PolarHBondContact N-OG 3.09Å; S214-S218 PolarHBondContact O-N 2.91Å; S214-S218 VanDerWaalsContact O-N 3.12Å; Y215-S218 WeakPolarHBondContact O-CB 3.45Å; Y215-S218 PolarHBondContact O-N 3.21Å; Y215-S218 PolarHBondContact O-OG 2.99Å; A216-S218 VanDerWaalsContact C-N 3.35Å; S218-V220 PolarHBondContact O-N 3.08Å; S218-T221 WeakPolarHBondContact O-CB 3.44Å; S218-T221 PolarHBondContact O-N 3.05Å; S218-T221 VanDerWaalsContact O-N 3.1Å; S218-T221 PolarHBondContact O-OG1 3.25Å
219A91.1Very high90.5Very high0 Ų018.5 Ų18.50%011%0.108CC..G310 helixtrans-59.9-19.7170.400000114.2L31 G32 S217 T221 P223 Q396L31-A219 VanDerWaalsContact C-CB 3.42Å; L31-A219 HydrophobicContact CB-CB 4.05Å; G32-A219 VanDerWaalsContact CA-O 3.28Å; G32-A219 WeakPolarHBondContact CA-O 3.37Å; S217-A219 PolarHBondContact O-N 3.1Å; A219-T221 PolarHBondContact O-N 3.02Å; A219-P223 WeakPolarHBondContact O-CD 3.22Å; A219-Q396 HydrophobicContact CB-CB 4.26Å; A219-Q396 HydrophobicContact CB-CG 4.22Å
220V93Very high90.8Very high21 Ų2122.7 Ų22.713%0.12713%0.129CC..G310 helixtrans-62.6-19.7173.271.30000112.7L24 S217 S218 F222 P223 G224 L397L24-V220 HydrophobicContact CD1-CG1 4.07Å; L24-V220 HydrophobicContact CG-CG1 4.46Å; S217-V220 WeakPolarHBondContact O-CB 3.4Å; S217-V220 WeakPolarHBondContact O-CG1 3.28Å; S217-V220 PolarHBondContact O-N 3.4Å; S218-V220 PolarHBondContact O-N 3.08Å; V220-F222 PolarHBondContact O-N 3.03Å; V220-P223 VanDerWaalsContact O-CD 3.23Å; V220-P223 WeakPolarHBondContact O-CD 3.48Å; V220-G224 PolarHBondContact O-N 3.35Å; V220-L397 HydrophobicContact CB-CD2 4.2Å; V220-L397 HydrophobicContact CB-CG 4.01Å; V220-L397 HydrophobicContact CG1-CD2 3.77Å; V220-L397 HydrophobicContact CG1-CG 4.15Å; V220-L397 HydrophobicContact CG2-CD1 3.9Å; V220-L397 HydrophobicContact CG2-CD2 4.3Å; V220-L397 HydrophobicContact CG2-CG 3.78Å
221T93.5Very high91Very high12 Ų1226.5 Ų26.57%0.07415%0.154CC..Hα-helixtrans-63.3-42.4-174.7-52.60000112.4L24 L25 V29 S218 A219 G224 V225 W242L24-T221 PolarHBondContact O-OG1 2.76Å; L25-T221 HydrophobicContact CD2-CG2 4.28Å; V29-T221 HydrophobicContact CG1-CG2 4.35Å; S218-T221 WeakPolarHBondContact O-CB 3.44Å; S218-T221 PolarHBondContact O-N 3.05Å; S218-T221 VanDerWaalsContact O-N 3.1Å; S218-T221 PolarHBondContact O-OG1 3.25Å; A219-T221 PolarHBondContact O-N 3.02Å; T221-G224 PolarHBondContact O-N 2.88Å; T221-V225 HydrophobicContact CG2-CG2 4.49Å; T221-V225 WeakPolarHBondContact O-CG2 3.49Å; T221-V225 PolarHBondContact O-N 2.75Å; T221-W242 HydrophobicContact CG2-CH2 4.11Å; T221-W242 HydrophobicContact CG2-CZ2 3.41Å; T221-W242 VanDerWaalsContact CG2-CZ2 3.41Å
222F91.8Very high91.1Very high2 Ų229.5 Ų29.51%0.00919%0.185CC..Hα-helixtrans-66.4-42.5176.6-76.5-49.1000114.3V29 L30 L36 M39 V220 G224 V225 K226 W242V29-F222 HydrophobicContact CB-CD2 4.34Å; V29-F222 HydrophobicContact CB-CE2 3.89Å; V29-F222 HydrophobicContact CB-CZ 4.15Å; V29-F222 HydrophobicContact CG2-CE2 3.84Å; V29-F222 HydrophobicContact CG2-CZ 3.79Å; V29-F222 WeakPolarHBondContact O-CD2 3.42Å; V29-F222 WeakPolarHBondContact O-CE2 3.31Å; L30-F222 HydrophobicContact CD2-CE2 4.42Å; L36-F222 HydrophobicContact CB-CB 4.41Å; L36-F222 HydrophobicContact CB-CD1 4.01Å; L36-F222 HydrophobicContact CB-CD2 3.93Å; L36-F222 HydrophobicContact CB-CE1 4.24Å; L36-F222 HydrophobicContact CB-CE2 4.2Å; L36-F222 HydrophobicContact CB-CG 3.89Å; L36-F222 HydrophobicContact CB-CZ 4.39Å; L36-F222 HydrophobicContact CD1-CD1 4.11Å; L36-F222 HydrophobicContact CD1-CE1 3.84Å; L36-F222 HydrophobicContact CD1-CZ 4.37Å; L36-F222 HydrophobicContact CD2-CD2 4.4Å; L36-F222 HydrophobicContact CD2-CE1 3.92Å; L36-F222 HydrophobicContact CD2-CE2 3.8Å; L36-F222 HydrophobicContact CD2-CZ 3.58Å; L36-F222 HydrophobicContact CG-CD1 4.43Å; L36-F222 HydrophobicContact CG-CE1 4.21Å; L36-F222 HydrophobicContact CG-CZ 4.32Å; M39-F222 HydrophobicContact CE-CD1 4.32Å; V220-F222 PolarHBondContact O-N 3.03Å; F222-G224 VanDerWaalsContact C-N 3.3Å; F222-G224 PolarHBondContact O-N 2.83Å; F222-V225 PolarHBondContact O-N 2.72Å; F222-K226 WeakPolarHBondContact O-CB 3.46Å; F222-K226 PolarHBondContact O-N 3.28Å; F222-W242 HydrophobicContact CD1-CH2 4.11Å; F222-W242 HydrophobicContact CD1-CZ3 4.23Å; F222-W242 AromaticContact CE1-CH2 3.53Å; F222-W242 HydrophobicContact CE1-CH2 3.53Å; F222-W242 AromaticContact CE1-CZ3 3.49Å; F222-W242 HydrophobicContact CE1-CZ3 3.49Å; F222-W242 VanDerWaalsContact CE1-CZ3 3.49Å; F222-W242 AromaticContact CZ-CH2 3.88Å; F222-W242 HydrophobicContact CZ-CH2 3.88Å; F222-W242 HydrophobicContact CZ-CZ3 4.11Å
223P89.9Confident91.5Very high2 Ų229.6 Ų29.61%0.01319%0.191CC..Hα-helixtrans-54.7-43.2166.8-25.328.1000113S35 A219 V220 K226 V227S35-P223 WeakPolarHBondContact OG-CG 3.23Å; A219-P223 WeakPolarHBondContact O-CD 3.22Å; V220-P223 VanDerWaalsContact O-CD 3.23Å; V220-P223 WeakPolarHBondContact O-CD 3.48Å; P223-K226 WeakPolarHBondContact O-CB 3.37Å; P223-K226 PolarHBondContact O-N 2.96Å; P223-V227 WeakPolarHBondContact O-CG2 3.38Å; P223-V227 PolarHBondContact O-N 3.34Å
224G91.3Very high91.8Very high35 Ų3533.3 Ų33.336%0.36122%0.215SC..Hα-helixtrans-62.2-43.7175.200000112.7V220 T221 F222 K226 V227 I228V220-G224 PolarHBondContact O-N 3.35Å; T221-G224 PolarHBondContact O-N 2.88Å; F222-G224 VanDerWaalsContact C-N 3.3Å; F222-G224 PolarHBondContact O-N 2.83Å; G224-K226 VanDerWaalsContact C-N 3.32Å; G224-V227 PolarHBondContact O-N 3.3Å; G224-I228 WeakPolarHBondContact O-CG1 3.08Å; G224-I228 PolarHBondContact O-N 2.83Å
225V92.7Very high91.8Very high12 Ų1233.4 Ų33.47%0.07322%0.215CC..Hα-helixtrans-62.4-40.1173.8165.10000111.3M39 T221 F222 I228 Y229 I238M39-V225 HydrophobicContact CE-CB 4.47Å; M39-V225 HydrophobicContact CE-CG1 3.9Å; M39-V225 HydrophobicContact SD-CG1 3.9Å; T221-V225 HydrophobicContact CG2-CG2 4.49Å; T221-V225 WeakPolarHBondContact O-CG2 3.49Å; T221-V225 PolarHBondContact O-N 2.75Å; F222-V225 PolarHBondContact O-N 2.72Å; V225-I228 WeakPolarHBondContact O-CB 3.33Å; V225-I228 PolarHBondContact O-N 3.41Å; V225-Y229 PolarHBondContact O-N 2.97Å; V225-I238 HydrophobicContact CB-CG2 4.46Å; V225-I238 HydrophobicContact CG1-CG2 3.72Å; V225-I238 HydrophobicContact CG2-CG2 4.25Å
226K90.8Very high92.1Very high1 Ų135.5 Ų35.50%0.00423%0.227CC..Hα-helixtrans-62.8-43.8176.5179.2180175-177.20111.8M39 F222 P223 G224 I228 Y229 D230 S386 S390M39-K226 HydrophobicContact CE-CB 4.14Å; M39-K226 HydrophobicContact CG-CB 4.37Å; M39-K226 HydrophobicContact CG-CG 4.34Å; M39-K226 VanDerWaalsContact SD-CA 3.55Å; M39-K226 HydrophobicContact SD-CB 3.84Å; M39-K226 HydrophobicContact SD-CG 4.4Å; F222-K226 WeakPolarHBondContact O-CB 3.46Å; F222-K226 PolarHBondContact O-N 3.28Å; P223-K226 WeakPolarHBondContact O-CB 3.37Å; P223-K226 PolarHBondContact O-N 2.96Å; G224-K226 VanDerWaalsContact C-N 3.32Å; K226-I228 PolarHBondContact O-N 2.91Å; K226-Y229 CarbonylContact O-C 3.58Å; K226-Y229 WeakPolarHBondContact O-CA 3.06Å; K226-Y229 WeakPolarHBondContact O-CB 3.47Å; K226-Y229 PolarHBondContact O-N 3.41Å; K226-D230 PolarHBondContact O-N 3.08Å; K226-S386 VanDerWaalsContact CE-OG 3.28Å; K226-S386 WeakPolarHBondContact CE-OG 3.48Å; K226-S386 PolarHBondContact NZ-O 2.93Å; K226-S386 VanDerWaalsContact NZ-O 3.09Å; K226-S386 PolarHBondContact NZ-OG 2.97Å; K226-S390 PolarHBondContact NZ-OG 3.33Å
227V91.5Very high92.4Very high82 Ų8239.1 Ų39.150%0.49725%0.249SC..Hα-helixtrans-58.4-39.4174.2171.50000111.2P223 G224 Y229 D230 V231P223-V227 WeakPolarHBondContact O-CG2 3.38Å; P223-V227 PolarHBondContact O-N 3.34Å; G224-V227 PolarHBondContact O-N 3.3Å; V227-Y229 VanDerWaalsContact C-N 3.35Å; V227-D230 PolarHBondContact O-N 2.86Å; V227-V231 VanDerWaalsContact O-CG2 3.28Å; V227-V231 WeakPolarHBondContact O-CG2 3.35Å; V227-V231 PolarHBondContact O-N 2.91Å
228I92.6Very high92.6Very high88 Ų8839.9 Ų39.945%0.45125%0.253SS..Hα-helixtrans-66.1-39.6176-63165.1000111G224 V225 K226 V231 A233 I238G224-I228 WeakPolarHBondContact O-CG1 3.08Å; G224-I228 PolarHBondContact O-N 2.83Å; V225-I228 WeakPolarHBondContact O-CB 3.33Å; V225-I228 PolarHBondContact O-N 3.41Å; K226-I228 PolarHBondContact O-N 2.91Å; I228-V231 PolarHBondContact O-N 3.39Å; I228-A233 HydrophobicContact CG2-CB 3.78Å; I228-A233 WeakPolarHBondContact O-CB 3.1Å; I228-A233 PolarHBondContact O-N 3.38Å; I228-I238 HydrophobicContact CB-CD1 4.32Å; I228-I238 HydrophobicContact CG2-CD1 3.88Å; I228-I238 HydrophobicContact CG2-CG1 3.99Å
229Y92.4Very high92.7Very high30 Ų3039.9 Ų39.912%0.11825%0.253CS..Hα-helixtrans-63.8-45.5175.5-179.1-106.2000112.1M39 S42 E43 V225 K226 V227 V231 G232 A233 F235 I238M39-Y229 HydrophobicContact CG-CD1 4.08Å; M39-Y229 HydrophobicContact CG-CG 4.42Å; M39-Y229 HydrophobicContact SD-CG 4.39Å; S42-Y229 WeakPolarHBondContact OG-CE1 3.16Å; S42-Y229 PolarHBondContact OG-OH 2.98Å; E43-Y229 WeakPolarHBondContact OE1-CE2 3.43Å; E43-Y229 VanDerWaalsContact OE1-CZ 3.31Å; E43-Y229 PolarHBondContact OE1-OH 3.49Å; V225-Y229 PolarHBondContact O-N 2.97Å; K226-Y229 CarbonylContact O-C 3.58Å; K226-Y229 WeakPolarHBondContact O-CA 3.06Å; K226-Y229 WeakPolarHBondContact O-CB 3.47Å; K226-Y229 PolarHBondContact O-N 3.41Å; V227-Y229 VanDerWaalsContact C-N 3.35Å; Y229-V231 PolarHBondContact O-N 3.31Å; Y229-G232 WeakPolarHBondContact O-CA 3.26Å; Y229-G232 PolarHBondContact O-N 3.01Å; Y229-A233 WeakPolarHBondContact CD2-O 3.26Å; Y229-F235 HydrophobicContact CD2-CB 4.04Å; Y229-F235 HydrophobicContact CD2-CD2 4.41Å; Y229-F235 HydrophobicContact CE2-CB 3.75Å; Y229-I238 HydrophobicContact CD2-CD1 4.33Å
230D89Confident93Very high96 Ų9642.9 Ų42.951%0.51327%0.271SS..Hα-helixtrans-65.3-25.7180-63.8-17000112.3K226 V227 G232K226-D230 PolarHBondContact O-N 3.08Å; V227-D230 PolarHBondContact O-N 2.86Å; D230-G232 PolarHBondContact O-N 3.28Å
231V90.7Very high93.1Very high125 Ų12545.8 Ų45.876%0.75829%0.289SS*.THydrogen-bonded Turntrans-72.9-6.7172.2171.20000112.5V227 I228 Y229V227-V231 VanDerWaalsContact O-CG2 3.28Å; V227-V231 WeakPolarHBondContact O-CG2 3.35Å; V227-V231 PolarHBondContact O-N 2.91Å; I228-V231 PolarHBondContact O-N 3.39Å; Y229-V231 PolarHBondContact O-N 3.31Å
232G90.8Very high93.2Very high64 Ų6446 Ų4666%0.6629%0.288SS*.THydrogen-bonded Turntrans102.511.5175.300000114.5Y229 D230Y229-G232 WeakPolarHBondContact O-CA 3.26Å; Y229-G232 PolarHBondContact O-N 3.01Å; D230-G232 PolarHBondContact O-N 3.28Å
233A93.9Very high93.5Very high32 Ų3246.5 Ų46.526%0.26429%0.293SS..  trans-75.5132.1173.300000110.7I228 Y229 F235 I238I228-A233 HydrophobicContact CG2-CB 3.78Å; I228-A233 WeakPolarHBondContact O-CB 3.1Å; I228-A233 PolarHBondContact O-N 3.38Å; Y229-A233 WeakPolarHBondContact CD2-O 3.26Å; A233-F235 PolarHBondContact O-N 2.91Å; A233-I238 HydrophobicContact CB-CD1 4.04Å; A233-I238 HydrophobicContact CB-CG1 4.06Å
234P94.6Very high93.8Very high78 Ų7850 Ų5051%0.50632%0.317SS..  trans-68.2135.7-176.924.5-31.6000111.8I236 T237 I238P234-I236 VanDerWaalsContact C-N 3.32Å; P234-I236 PolarHBondContact O-N 2.9Å; P234-T237 WeakPolarHBondContact CG-OG1 3.28Å; P234-T237 WeakPolarHBondContact O-CB 3.29Å; P234-T237 PolarHBondContact O-N 2.94Å; P234-I238 PolarHBondContact O-N 2.98Å
235F93.9Very high94Very high2 Ų250.6 Ų50.61%0.00932%0.315CS..Hα-helixtrans-52.3-45.2-174-175.4-112.9000113.6L36 M39 L40 E43 F45 I161 A165 Y229 A233 T237 I238 L239L36-F235 HydrophobicContact CD1-CZ 4.45Å; M39-F235 HydrophobicContact CB-CD2 4.31Å; M39-F235 HydrophobicContact CB-CE2 3.88Å; M39-F235 HydrophobicContact SD-CD2 4.46Å; M39-F235 HydrophobicContact SD-CE2 4.25Å; L40-F235 HydrophobicContact CD2-CE1 4.42Å; L40-F235 HydrophobicContact CD2-CZ 4.08Å; E43-F235 VanDerWaalsContact CD-CB 3.42Å; E43-F235 HydrophobicContact CG-CB 3.89Å; E43-F235 HydrophobicContact CG-CD1 3.66Å; E43-F235 HydrophobicContact CG-CD2 4.36Å; E43-F235 HydrophobicContact CG-CE1 4.21Å; E43-F235 HydrophobicContact CG-CG 3.74Å; E43-F235 WeakPolarHBondContact OE1-CB 3.48Å; F45-F235 HydrophobicContact CE2-CE1 4.48Å; I161-F235 HydrophobicContact CG2-CE1 3.94Å; I161-F235 HydrophobicContact CG2-CZ 4Å; A165-F235 HydrophobicContact CB-CD1 3.7Å; A165-F235 HydrophobicContact CB-CE1 3.97Å; Y229-F235 HydrophobicContact CD2-CB 4.04Å; Y229-F235 HydrophobicContact CD2-CD2 4.41Å; Y229-F235 HydrophobicContact CE2-CB 3.75Å; A233-F235 PolarHBondContact O-N 2.91Å; F235-T237 VanDerWaalsContact C-N 3.31Å; F235-T237 PolarHBondContact O-N 3.5Å; F235-I238 PolarHBondContact O-N 3.48Å; F235-L239 HydrophobicContact CD1-CD1 3.79Å; F235-L239 HydrophobicContact CE1-CD1 3.39Å; F235-L239 HydrophobicContact CE1-CG 4.41Å; F235-L239 HydrophobicContact CE2-CD1 4.3Å; F235-L239 HydrophobicContact CG-CD1 4.42Å; F235-L239 HydrophobicContact CZ-CD1 3.68Å; F235-L239 HydrophobicContact CZ-CG 4.36Å; F235-L239 PolarHBondContact O-N 3.48Å; F235-L239 VanDerWaalsContact O-N 3.12Å
236I95.3Very high94.1Very high62 Ų6250.1 Ų50.132%0.31831%0.312SS..Hα-helixtrans-58-42.6177.9-62.7176.7000111.3A162 A165 Y166 P234 L239 V240A162-I236 HydrophobicContact CB-CG2 4.29Å; A165-I236 HydrophobicContact CB-CG1 4.08Å; Y166-I236 HydrophobicContact CD2-CD1 4.44Å; P234-I236 VanDerWaalsContact C-N 3.32Å; P234-I236 PolarHBondContact O-N 2.9Å; I236-L239 PolarHBondContact O-N 3.28Å; I236-V240 HydrophobicContact CG2-CG2 4.45Å; I236-V240 VanDerWaalsContact O-CG2 3.3Å; I236-V240 WeakPolarHBondContact O-CG2 3.41Å; I236-V240 PolarHBondContact O-N 3.37Å
237T95.7Very high94.3Very high77 Ų7751.7 Ų51.747%0.47233%0.329SS..Hα-helixtrans-67-41.1-179.2-63.10000110.9P234 F235 L239 V240 V241P234-T237 WeakPolarHBondContact CG-OG1 3.28Å; P234-T237 WeakPolarHBondContact O-CB 3.29Å; P234-T237 PolarHBondContact O-N 2.94Å; F235-T237 VanDerWaalsContact C-N 3.31Å; F235-T237 PolarHBondContact O-N 3.5Å; T237-L239 VanDerWaalsContact C-N 3.33Å; T237-L239 PolarHBondContact O-N 3.2Å; T237-V240 PolarHBondContact O-N 3.43Å; T237-V241 HydrophobicContact CG2-CG2 4.32Å; T237-V241 WeakPolarHBondContact O-CB 3.47Å; T237-V241 VanDerWaalsContact O-CG2 3.28Å; T237-V241 WeakPolarHBondContact O-CG2 3.08Å; T237-V241 PolarHBondContact O-N 3.38Å
238I96.3Very high94.4Very high16 Ų1653.1 Ų53.18%0.08233%0.333CS..Hα-helixtrans-60.4-45178.4-56.5167.5000110.6V225 I228 Y229 A233 P234 F235 V241 W242V225-I238 HydrophobicContact CB-CG2 4.46Å; V225-I238 HydrophobicContact CG1-CG2 3.72Å; V225-I238 HydrophobicContact CG2-CG2 4.25Å; I228-I238 HydrophobicContact CB-CD1 4.32Å; I228-I238 HydrophobicContact CG2-CD1 3.88Å; I228-I238 HydrophobicContact CG2-CG1 3.99Å; Y229-I238 HydrophobicContact CD2-CD1 4.33Å; A233-I238 HydrophobicContact CB-CD1 4.04Å; A233-I238 HydrophobicContact CB-CG1 4.06Å; P234-I238 PolarHBondContact O-N 2.98Å; F235-I238 PolarHBondContact O-N 3.48Å; I238-V241 PolarHBondContact O-N 2.98Å; I238-W242 WeakPolarHBondContact O-CB 3.29Å; I238-W242 PolarHBondContact O-N 3.14Å
239L96.1Very high94.5Very high1 Ų149.2 Ų49.21%0.00531%0.313CS..Hα-helixtrans-66.7-38.5179-69.8173.9000113.3I161 A162 F235 I236 T237 W242 A243I161-L239 HydrophobicContact CB-CD1 3.78Å; I161-L239 HydrophobicContact CG2-CD1 3.47Å; I161-L239 VanDerWaalsContact CG2-CD1 3.47Å; I161-L239 HydrophobicContact CG2-CD2 4.45Å; A162-L239 HydrophobicContact CB-CB 3.88Å; A162-L239 HydrophobicContact CB-CD1 4.01Å; F235-L239 HydrophobicContact CD1-CD1 3.79Å; F235-L239 HydrophobicContact CE1-CD1 3.39Å; F235-L239 HydrophobicContact CE1-CG 4.41Å; F235-L239 HydrophobicContact CE2-CD1 4.3Å; F235-L239 HydrophobicContact CG-CD1 4.42Å; F235-L239 HydrophobicContact CZ-CD1 3.68Å; F235-L239 HydrophobicContact CZ-CG 4.36Å; F235-L239 PolarHBondContact O-N 3.48Å; F235-L239 VanDerWaalsContact O-N 3.12Å; I236-L239 PolarHBondContact O-N 3.28Å; T237-L239 VanDerWaalsContact C-N 3.33Å; T237-L239 PolarHBondContact O-N 3.2Å; L239-W242 HydrophobicContact CD2-CE3 4.09Å; L239-W242 HydrophobicContact CD2-CZ3 4.45Å; L239-W242 PolarHBondContact O-N 3.49Å; L239-A243 WeakPolarHBondContact O-CB 3.21Å; L239-A243 PolarHBondContact O-N 3.14Å
240V96.8Very high94.6Very high63 Ų6351 Ų5138%0.38232%0.322SS..Hα-helixtrans-67.4-40.4175.9170.90000111.3L159 A162 I236 T237 W242 A243 S244L159-V240 HydrophobicContact CD2-CG2 4.24Å; A162-V240 HydrophobicContact CB-CG2 4.4Å; I236-V240 HydrophobicContact CG2-CG2 4.45Å; I236-V240 VanDerWaalsContact O-CG2 3.3Å; I236-V240 WeakPolarHBondContact O-CG2 3.41Å; I236-V240 PolarHBondContact O-N 3.37Å; T237-V240 PolarHBondContact O-N 3.43Å; V240-W242 VanDerWaalsContact C-N 3.31Å; V240-W242 PolarHBondContact O-N 3.05Å; V240-A243 PolarHBondContact O-N 3.11Å; V240-S244 PolarHBondContact O-N 3.31Å; V240-S244 PolarHBondContact O-OG 3.3Å
241V96.6Very high94.9Very high81 Ų8150.6 Ų50.649%0.49132%0.319SS..Hα-helixtrans-61.8-42.9172.9169.70000110.1T237 I238 A243 S244 C245T237-V241 HydrophobicContact CG2-CG2 4.32Å; T237-V241 WeakPolarHBondContact O-CB 3.47Å; T237-V241 VanDerWaalsContact O-CG2 3.28Å; T237-V241 WeakPolarHBondContact O-CG2 3.08Å; T237-V241 PolarHBondContact O-N 3.38Å; I238-V241 PolarHBondContact O-N 2.98Å; V241-A243 PolarHBondContact O-N 3.29Å; V241-S244 WeakPolarHBondContact O-CA 3.35Å; V241-S244 VanDerWaalsContact O-CB 3.3Å; V241-S244 WeakPolarHBondContact O-CB 3.05Å; V241-S244 PolarHBondContact O-N 3.08Å; V241-S244 VanDerWaalsContact O-N 3.11Å; V241-C245 PolarHBondContact O-N 3.27Å; V241-C245 PolarHBondContact O-SG 2.96Å; V241-C245 VanDerWaalsContact O-SG 3.33Å
242W95.5Very high95Very high18 Ų1845.6 Ų45.67%0.06829%0.288CS..Hα-helixtrans-66.6-38.4179-162.820.3000112.9L25 F26 V29 F154 T221 F222 I238 L239 V240 S244 C245 A246L25-W242 WeakPolarHBondContact O-CZ2 3.25Å; L25-W242 PolarHBondContact O-NE1 3.05Å; F26-W242 AromaticContact CD1-NE1 3.73Å; F26-W242 AromaticContact CE1-CD1 3.47Å; F26-W242 VanDerWaalsContact CE1-CD1 3.47Å; F26-W242 AromaticContact CE1-NE1 3.39Å; V29-W242 HydrophobicContact CB-CH2 4Å; V29-W242 HydrophobicContact CB-CZ2 4.21Å; V29-W242 HydrophobicContact CG1-CH2 4.14Å; V29-W242 HydrophobicContact CG1-CZ2 3.81Å; V29-W242 HydrophobicContact CG2-CH2 3.86Å; V29-W242 HydrophobicContact CG2-CZ2 4.28Å; F154-W242 HydrophobicContact CE1-CD2 4.25Å; F154-W242 AromaticContact CE1-CE2 3.87Å; F154-W242 HydrophobicContact CE1-CH2 4.44Å; F154-W242 HydrophobicContact CE1-CZ2 4Å; F154-W242 HydrophobicContact CZ-CH2 4.01Å; F154-W242 AromaticContact CZ-CZ2 3.69Å; F154-W242 HydrophobicContact CZ-CZ2 3.69Å; T221-W242 HydrophobicContact CG2-CH2 4.11Å; T221-W242 HydrophobicContact CG2-CZ2 3.41Å; T221-W242 VanDerWaalsContact CG2-CZ2 3.41Å; F222-W242 HydrophobicContact CD1-CH2 4.11Å; F222-W242 HydrophobicContact CD1-CZ3 4.23Å; F222-W242 AromaticContact CE1-CH2 3.53Å; F222-W242 HydrophobicContact CE1-CH2 3.53Å; F222-W242 AromaticContact CE1-CZ3 3.49Å; F222-W242 HydrophobicContact CE1-CZ3 3.49Å; F222-W242 VanDerWaalsContact CE1-CZ3 3.49Å; F222-W242 AromaticContact CZ-CH2 3.88Å; F222-W242 HydrophobicContact CZ-CH2 3.88Å; F222-W242 HydrophobicContact CZ-CZ3 4.11Å; I238-W242 WeakPolarHBondContact O-CB 3.29Å; I238-W242 PolarHBondContact O-N 3.14Å; L239-W242 HydrophobicContact CD2-CE3 4.09Å; L239-W242 HydrophobicContact CD2-CZ3 4.45Å; L239-W242 PolarHBondContact O-N 3.49Å; V240-W242 VanDerWaalsContact C-N 3.31Å; V240-W242 PolarHBondContact O-N 3.05Å; W242-S244 VanDerWaalsContact C-N 3.28Å; W242-S244 PolarHBondContact O-N 3.21Å; W242-C245 WeakPolarHBondContact O-CB 3.38Å; W242-C245 PolarHBondContact O-N 3.46Å; W242-A246 PolarHBondContact O-N 3Å
243A96.9Very high95Very high12 Ų1242.5 Ų42.510%0.09926%0.257CS..Hα-helixtrans-60.1-39.2170.200000111.7C158 L159 L239 V240 V241 A246 G247C158-A243 HydrophobicContact CB-CB 3.87Å; L159-A243 HydrophobicContact CD2-CB 3.89Å; L159-A243 HydrophobicContact CG-CB 3.92Å; L239-A243 WeakPolarHBondContact O-CB 3.21Å; L239-A243 PolarHBondContact O-N 3.14Å; V240-A243 PolarHBondContact O-N 3.11Å; V241-A243 PolarHBondContact O-N 3.29Å; A243-A246 WeakPolarHBondContact O-CB 3.47Å; A243-A246 PolarHBondContact O-N 3.23Å; A243-G247 PolarHBondContact O-N 2.86Å
244S95.9Very high94.9Very high74 Ų7445.4 Ų45.452%0.51726%0.264SS..Hα-helixtrans-65.5-39.9175.6-55.60000111.6V240 V241 W242 A246 G247 L248V240-S244 PolarHBondContact O-N 3.31Å; V240-S244 PolarHBondContact O-OG 3.3Å; V241-S244 WeakPolarHBondContact O-CA 3.35Å; V241-S244 VanDerWaalsContact O-CB 3.3Å; V241-S244 WeakPolarHBondContact O-CB 3.05Å; V241-S244 PolarHBondContact O-N 3.08Å; V241-S244 VanDerWaalsContact O-N 3.11Å; W242-S244 VanDerWaalsContact C-N 3.28Å; W242-S244 PolarHBondContact O-N 3.21Å; S244-A246 VanDerWaalsContact C-N 3.33Å; S244-A246 PolarHBondContact O-N 2.93Å; S244-G247 VanDerWaalsContact O-CA 3.32Å; S244-G247 WeakPolarHBondContact O-CA 3.12Å; S244-G247 PolarHBondContact O-N 3.44Å; S244-L248 PolarHBondContact O-N 3.3Å; S244-L248 VanDerWaalsContact O-N 3.09Å
245C95.6Very high94.6Very high48 Ų4848 Ų4832%0.32427%0.267SS..Hα-helixtrans-62.6-38.5172.6-63.80000111.8F26 V241 W242 G247 L248 V249F26-C245 HydrophobicContact CE1-CB 4.29Å; F26-C245 HydrophobicContact CZ-CB 3.69Å; V241-C245 PolarHBondContact O-N 3.27Å; V241-C245 PolarHBondContact O-SG 2.96Å; V241-C245 VanDerWaalsContact O-SG 3.33Å; W242-C245 WeakPolarHBondContact O-CB 3.38Å; W242-C245 PolarHBondContact O-N 3.46Å; C245-G247 PolarHBondContact O-N 3.36Å; C245-L248 WeakPolarHBondContact O-CB 3.3Å; C245-L248 PolarHBondContact O-N 3.37Å; C245-V249 PolarHBondContact O-N 2.93Å; C245-V249 VanDerWaalsContact O-N 3.08Å
246A95.3Very high94.3Very high2 Ų249.8 Ų49.82%0.01728%0.277CS..Hα-helixtrans-63.1-29.5170.900000112.2F26 S151 F154 W242 A243 S244 V249 F250F26-A246 HydrophobicContact CD1-CB 4.23Å; F26-A246 HydrophobicContact CE1-CB 3.87Å; S151-A246 PolarHBondContact OG-O 2.97Å; F154-A246 HydrophobicContact CD1-CB 4.3Å; W242-A246 PolarHBondContact O-N 3Å; A243-A246 WeakPolarHBondContact O-CB 3.47Å; A243-A246 PolarHBondContact O-N 3.23Å; S244-A246 VanDerWaalsContact C-N 3.33Å; S244-A246 PolarHBondContact O-N 2.93Å; A246-V249 PolarHBondContact O-N 3.24Å; A246-F250 PolarHBondContact O-N 3.35Å
247G95Very high93.7Very high34 Ų3447 Ų4735%0.35126%0.262SS..Hα-helixtrans-64.2-37.8168.600000113.3A243 S244 C245 F250 L251A243-G247 PolarHBondContact O-N 2.86Å; S244-G247 VanDerWaalsContact O-CA 3.32Å; S244-G247 WeakPolarHBondContact O-CA 3.12Å; S244-G247 PolarHBondContact O-N 3.44Å; C245-G247 PolarHBondContact O-N 3.36Å; G247-F250 WeakPolarHBondContact O-CB 3.33Å; G247-F250 PolarHBondContact O-N 2.89Å; G247-L251 WeakPolarHBondContact O-CG 3.47Å; G247-L251 PolarHBondContact O-N 3.22Å
248L94.6Very high92.8Very high112 Ų11245 Ų4559%0.58625%0.251SS*.Hα-helixtrans-66.1-39.1173.6-62.7176000111.8S244 C245 F250 L251 N252S244-L248 PolarHBondContact O-N 3.3Å; S244-L248 VanDerWaalsContact O-N 3.09Å; C245-L248 WeakPolarHBondContact O-CB 3.3Å; C245-L248 PolarHBondContact O-N 3.37Å; L248-F250 VanDerWaalsContact C-N 3.3Å; L248-F250 PolarHBondContact O-N 2.98Å; L248-L251 PolarHBondContact O-N 3.13Å; L248-N252 WeakPolarHBondContact O-CB 3.47Å; L248-N252 PolarHBondContact O-N 3.31Å
249V93.8Very high91.7Very high7 Ų749.5 Ų49.54%0.04227%0.274CS..Hα-helixtrans-60.9-41.4173.1176.80000111.1E22 F26 M189 C245 A246 L251 N252 C253E22-V249 HydrophobicContact CG-CB 4.41Å; E22-V249 HydrophobicContact CG-CG1 3.93Å; E22-V249 HydrophobicContact CG-CG2 3.71Å; F26-V249 HydrophobicContact CD2-CG2 3.87Å; F26-V249 HydrophobicContact CE2-CG2 3.5Å; F26-V249 HydrophobicContact CZ-CG2 4.04Å; M189-V249 HydrophobicContact SD-CG1 4.19Å; C245-V249 PolarHBondContact O-N 2.93Å; C245-V249 VanDerWaalsContact O-N 3.08Å; A246-V249 PolarHBondContact O-N 3.24Å; V249-L251 PolarHBondContact O-N 3.37Å; V249-N252 PolarHBondContact O-N 2.95Å; V249-C253 VanDerWaalsContact O-CB 3.29Å; V249-C253 WeakPolarHBondContact O-CB 3.46Å; V249-C253 PolarHBondContact O-N 3.42Å
250F95.3Very high90.5Very high68 Ų6857 Ų5730%0.29831%0.309SS..Hα-helixtrans-58.9-47.1174.6-179.6-83.5000111.5L148 S151 T152 A246 G247 L248 C253 F254L148-F250 HydrophobicContact CB-CD2 4.16Å; L148-F250 HydrophobicContact CB-CE2 3.83Å; L148-F250 HydrophobicContact CD2-CD1 4.19Å; L148-F250 HydrophobicContact CD2-CD2 3.57Å; L148-F250 HydrophobicContact CD2-CE1 4.16Å; L148-F250 HydrophobicContact CD2-CE2 3.57Å; L148-F250 HydrophobicContact CD2-CG 3.91Å; L148-F250 HydrophobicContact CD2-CZ 3.87Å; L148-F250 WeakPolarHBondContact CD2-O 3.42Å; L148-F250 HydrophobicContact CG-CD2 4.46Å; L148-F250 HydrophobicContact CG-CE2 4.19Å; S151-F250 PolarHBondContact OG-N 3.44Å; T152-F250 HydrophobicContact CG2-CD2 3.61Å; T152-F250 HydrophobicContact CG2-CE2 3.57Å; A246-F250 PolarHBondContact O-N 3.35Å; G247-F250 WeakPolarHBondContact O-CB 3.33Å; G247-F250 PolarHBondContact O-N 2.89Å; L248-F250 VanDerWaalsContact C-N 3.3Å; L248-F250 PolarHBondContact O-N 2.98Å; F250-C253 PolarHBondContact O-N 3.2Å; F250-F254 WeakPolarHBondContact O-CB 3.4Å; F250-F254 PolarHBondContact O-N 3.22Å
251L94.4Very high89.1Confident86 Ų8656.9 Ų56.945%0.4531%0.31SS..Hα-helixtrans-63.5-45.8177.1-67.2175.3000111.6G247 L248 V249 C253 F254 F255G247-L251 WeakPolarHBondContact O-CG 3.47Å; G247-L251 PolarHBondContact O-N 3.22Å; L248-L251 PolarHBondContact O-N 3.13Å; V249-L251 PolarHBondContact O-N 3.37Å; L251-C253 VanDerWaalsContact C-N 3.31Å; L251-C253 PolarHBondContact O-N 3.02Å; L251-F254 PolarHBondContact O-N 3.12Å; L251-F254 VanDerWaalsContact O-N 3.13Å; L251-F255 HydrophobicContact CD2-CE2 4.41Å; L251-F255 WeakPolarHBondContact O-CD2 3.25Å; L251-F255 PolarHBondContact O-N 2.95Å
252N92.6Very high87.7Confident20 Ų2054.7 Ų54.711%0.10729%0.294CS..Hα-helixtrans-58-45.4176.9-174.143000111W14 T18 E22 L248 V249 F254 F255 N256W14-N252 PolarHBondContact NE1-OD1 3.01Å; T18-N252 VanDerWaalsContact CB-ND2 3.35Å; T18-N252 WeakPolarHBondContact CB-ND2 3.31Å; T18-N252 PolarHBondContact OG1-ND2 3.45Å; T18-N252 VanDerWaalsContact OG1-ND2 3.1Å; E22-N252 PolarHBondContact OE1-ND2 3.1Å; L248-N252 WeakPolarHBondContact O-CB 3.47Å; L248-N252 PolarHBondContact O-N 3.31Å; V249-N252 PolarHBondContact O-N 2.95Å; N252-F254 PolarHBondContact O-N 3.35Å; N252-F255 PolarHBondContact O-N 3.33Å; N252-N256 VanDerWaalsContact O-CB 3.28Å; N252-N256 WeakPolarHBondContact O-CB 3.33Å; N252-N256 PolarHBondContact O-N 3.06Å; N252-N256 PolarHBondContact OD1-ND2 3.08Å
253C91.2Very high86Confident0 Ų057 Ų570%031%0.311CS..Hα-helixtrans-62-42.7175.4176.20000112.1R147 L148 V249 F250 L251 F255 W257R147-C253 VanDerWaalsContact CB-SG 3.6Å; R147-C253 HydrophobicContact CG-CB 4.21Å; L148-C253 HydrophobicContact CD2-CB 3.96Å; V249-C253 VanDerWaalsContact O-CB 3.29Å; V249-C253 WeakPolarHBondContact O-CB 3.46Å; V249-C253 PolarHBondContact O-N 3.42Å; F250-C253 PolarHBondContact O-N 3.2Å; L251-C253 VanDerWaalsContact C-N 3.31Å; L251-C253 PolarHBondContact O-N 3.02Å; C253-F255 PolarHBondContact O-N 3.44Å; C253-W257 WeakPolarHBondContact O-CB 3.26Å; C253-W257 PolarHBondContact O-N 2.84Å; C253-W257 VanDerWaalsContact O-N 3.14Å
254F91.7Very high84.2Confident93 Ų9357.2 Ų57.241%0.40831%0.314SS..Hα-helixtrans-62-41.9-179.9-173.9-95.8000112.1R144 L148 F250 L251 N252R144-F254 PolarHBondContact NE-O 3.33Å; R144-F254 VanDerWaalsContact NH2-CD2 3.32Å; R144-F254 PolarHBondContact NH2-O 2.87Å; L148-F254 HydrophobicContact CD1-CD2 4.32Å; L148-F254 HydrophobicContact CD2-CB 4.13Å; F250-F254 WeakPolarHBondContact O-CB 3.4Å; F250-F254 PolarHBondContact O-N 3.22Å; L251-F254 PolarHBondContact O-N 3.12Å; L251-F254 VanDerWaalsContact O-N 3.13Å; N252-F254 PolarHBondContact O-N 3.35Å
255F89Confident82.1Confident133 Ų13356.1 Ų56.158%0.58331%0.305SS*.Hα-helixtrans-86-41.5-178.5-66.6-66.1000113.4R11 L251 N252 C253R11-F255 PolarHBondContact NH2-O 3.16Å; R11-F255 VanDerWaalsContact NH2-O 3.13Å; L251-F255 HydrophobicContact CD2-CE2 4.41Å; L251-F255 WeakPolarHBondContact O-CD2 3.25Å; L251-F255 PolarHBondContact O-N 2.95Å; N252-F255 PolarHBondContact O-N 3.33Å; C253-F255 PolarHBondContact O-N 3.44Å
256N86.1Confident80Confident39 Ų3959.4 Ų59.421%0.20932%0.316CS..Hα-helixtrans-97.9-26.5-166.3-67.6-54.7000114.2R11 W14 M15 N252R11-N256 PolarHBondContact NE-O 3.47Å; R11-N256 VanDerWaalsContact NH2-C 3.31Å; R11-N256 PolarHBondContact NH2-O 3.37Å; W14-N256 PolarHBondContact NE1-ND2 2.94Å; M15-N256 HydrophobicContact CG-CB 4.24Å; N252-N256 VanDerWaalsContact O-CB 3.28Å; N252-N256 WeakPolarHBondContact O-CB 3.33Å; N252-N256 PolarHBondContact O-N 3.06Å; N252-N256 PolarHBondContact OD1-ND2 3.08Å
257W83.8Confident77.8Confident2 Ų264.1 Ų64.11%0.00834%0.341CS..SBendtrans-82.3140.9-173.4-136.5-100.3000113.4M15 A19 R144 L196 C253M15-W257 HydrophobicContact CB-CZ3 4.22Å; A19-W257 HydrophobicContact CB-CH2 3.83Å; A19-W257 HydrophobicContact CB-CZ3 4.28Å; R144-W257 HydrophobicContact CB-CB 4.35Å; R144-W257 WeakPolarHBondContact CD-O 3.48Å; R144-W257 HydrophobicContact CG-CB 4.41Å; L196-W257 HydrophobicContact CB-CZ2 4.5Å; L196-W257 HydrophobicContact CD1-CH2 3.41Å; L196-W257 VanDerWaalsContact CD1-CH2 3.41Å; L196-W257 HydrophobicContact CD1-CZ2 4.01Å; L196-W257 HydrophobicContact CD1-CZ3 3.97Å; C253-W257 WeakPolarHBondContact O-CB 3.26Å; C253-W257 PolarHBondContact O-N 2.84Å; C253-W257 VanDerWaalsContact O-N 3.14Å
258P77.5Confident75.6Confident36 Ų3666.5 Ų66.523%0.23434%0.344CS..  trans-73.815017731-36.9000112.9R144 F262R144-P258 VanDerWaalsContact CB-O 3.23Å; R144-P258 WeakPolarHBondContact CB-O 3.44Å; P258-F262 HydrophobicContact CG-CE1 3.84Å; P258-F262 HydrophobicContact CG-CE2 3.81Å; P258-F262 HydrophobicContact CG-CZ 3.4Å; P258-F262 VanDerWaalsContact CG-CZ 3.4Å
259L72.3Confident73.1Confident111 Ų11166.1 Ų66.158%0.58134%0.342SS*.SBendtrans-72.2-38.6175.9-77.5145.8000112.3
260E70Confident70.5Confident157 Ų15773.6 Ų73.673%0.73437%0.371SS*.SBendtrans-93.7147.1-179.9-67.4176.3-176.600110.7
261P67.3Low67.8Low61 Ų6173.6 Ų73.640%0.39638%0.377SS..PPolyproline II helixtrans-63.6147.8173.825.9-31.6000111.1
262F67.4Low65Low36 Ų3673 Ų7316%0.15838%0.376CS..PPolyproline II helixtrans-68.3125.8174.8-64.5-72.5000109.7N198 M199 P258N198-F262 HydrophobicContact CB-CB 4.16Å; M199-F262 HydrophobicContact CE-CE1 3.97Å; M199-F262 HydrophobicContact CE-CZ 4.42Å; M199-F262 HydrophobicContact CG-CD1 3.58Å; M199-F262 HydrophobicContact CG-CE1 3.48Å; M199-F262 VanDerWaalsContact CG-CE1 3.48Å; M199-F262 HydrophobicContact CG-CE2 4.45Å; M199-F262 HydrophobicContact CG-CG 4.12Å; M199-F262 HydrophobicContact CG-CZ 3.92Å; M199-F262 HydrophobicContact SD-CD1 4.01Å; M199-F262 HydrophobicContact SD-CE1 3.24Å; M199-F262 WeakPolarHBondContact SD-CE1 3.41Å; M199-F262 HydrophobicContact SD-CE2 4.15Å; M199-F262 HydrophobicContact SD-CZ 3.29Å; M199-F262 WeakPolarHBondContact SD-CZ 3.48Å; P258-F262 HydrophobicContact CG-CE1 3.84Å; P258-F262 HydrophobicContact CG-CE2 3.81Å; P258-F262 HydrophobicContact CG-CZ 3.4Å; P258-F262 VanDerWaalsContact CG-CZ 3.4Å
263P59.7Low62.1Low65 Ų6578.4 Ų78.442%0.42240%0.399SS..PPolyproline II helixtrans-58.3142.2177.423.2-31.9000110.3D267 M268P263-D267 HydrophobicContact CB-CB 4.11Å; P263-M268 HydrophobicContact CB-CG 4.17Å; P263-M268 HydrophobicContact CG-CG 4.01Å; P263-M268 HydrophobicContact CG-SD 4.44Å
264G59.7Low59.9Low17 Ų1782.9 Ų82.918%0.17542%0.422CS..PPolyproline II helixtrans-65.6162.3172.700000110.9E266 D267 M268G264-E266 VanDerWaalsContact C-N 3.26Å; G264-E266 PolarHBondContact O-N 2.71Å; G264-D267 PolarHBondContact N-OD2 2.84Å; G264-D267 PolarHBondContact O-N 2.99Å; G264-D267 VanDerWaalsContact O-N 3.14Å; G264-M268 WeakPolarHBondContact O-CG 3.38Å; G264-M268 PolarHBondContact O-N 3.32Å
265P51.1Low57.1Low51 Ų5186 Ų8633%0.33144%0.436SS..Hα-helixtrans-61.2-34.917824.9-33.8000112.8R204 D267 M268 D269R204-P265 VanDerWaalsContact NH1-CG 3.27Å; P265-D267 VanDerWaalsContact C-N 3.33Å; P265-D267 PolarHBondContact O-N 2.66Å; P265-M268 WeakPolarHBondContact O-CB 3.49Å; P265-M268 PolarHBondContact O-N 2.9Å; P265-D269 PolarHBondContact O-N 3.12Å
266E51.4Low54.3Low118 Ų11888.2 Ų88.255%0.55145%0.445SS*.Hα-helixtrans-66.5-36.1176-65.1179.2-16600111.7G264 Y270 S501G264-E266 VanDerWaalsContact C-N 3.26Å; G264-E266 PolarHBondContact O-N 2.71Å; E266-Y270 PolarHBondContact O-N 2.87Å; E266-Y270 VanDerWaalsContact O-N 3.15Å; E266-S501 VanDerWaalsContact CD-OG 3.29Å; E266-S501 WeakPolarHBondContact OE1-CB 3.37Å; E266-S501 WeakPolarHBondContact OE2-CB 3.27Å; E266-S501 PolarHBondContact OE2-OG 3.32Å
267D50.6Low51.8Low100 Ų10091.6 Ų91.654%0.53547%0.472SS..Hα-helixtrans-72.6-30.8173.5-58.5-46.2000112P263 G264 P265 T271P263-D267 HydrophobicContact CB-CB 4.11Å; G264-D267 PolarHBondContact N-OD2 2.84Å; G264-D267 PolarHBondContact O-N 2.99Å; G264-D267 VanDerWaalsContact O-N 3.14Å; P265-D267 VanDerWaalsContact C-N 3.33Å; P265-D267 PolarHBondContact O-N 2.66Å; D267-T271 WeakPolarHBondContact O-CB 3.42Å; D267-T271 PolarHBondContact O-N 3.36Å; D267-T271 PolarHBondContact O-OG1 2.91Å
268M48.5Very low49.4Very low85 Ų8598.6 Ų98.642%0.41950%0.498SS..Hα-helixtrans-67.7-44.7173.7-69.2-140.472.500111.1P263 G264 P265 Y270 T271 V272P263-M268 HydrophobicContact CB-CG 4.17Å; P263-M268 HydrophobicContact CG-CG 4.01Å; P263-M268 HydrophobicContact CG-SD 4.44Å; G264-M268 WeakPolarHBondContact O-CG 3.38Å; G264-M268 PolarHBondContact O-N 3.32Å; P265-M268 WeakPolarHBondContact O-CB 3.49Å; P265-M268 PolarHBondContact O-N 2.9Å; M268-Y270 VanDerWaalsContact C-N 3.29Å; M268-Y270 PolarHBondContact O-N 3.5Å; M268-T271 WeakPolarHBondContact CA-OG1 3.39Å; M268-T271 PolarHBondContact O-N 3.35Å; M268-T271 PolarHBondContact O-OG1 3.41Å; M268-V272 VanDerWaalsContact O-CB 3.25Å; M268-V272 WeakPolarHBondContact O-CB 3.38Å; M268-V272 WeakPolarHBondContact O-CG2 3.44Å; M268-V272 PolarHBondContact O-N 2.91Å
269D41.5Very low47.4Very low103 Ų103104.9 Ų104.955%0.55153%0.529SS*.Hα-helixtrans-62.8-39176.6-71.6-22.7000110.9P265 K273P265-D269 PolarHBondContact O-N 3.12Å; D269-K273 VanDerWaalsContact O-CB 3.28Å; D269-K273 WeakPolarHBondContact O-CB 3.29Å; D269-K273 WeakPolarHBondContact O-CG 3.28Å; D269-K273 PolarHBondContact O-N 3.41Å
270Y39.4Very low45.7Very low165 Ų165102.2 Ų102.265%0.64753%0.528SS*.Hα-helixtrans-67.9-43.6175.3-145.8-92.5000112.3E266 M268 K273 I274E266-Y270 PolarHBondContact O-N 2.87Å; E266-Y270 VanDerWaalsContact O-N 3.15Å; M268-Y270 VanDerWaalsContact C-N 3.29Å; M268-Y270 PolarHBondContact O-N 3.5Å; Y270-K273 PolarHBondContact O-N 3.03Å; Y270-I274 HydrophobicContact CD1-CD1 3.52Å; Y270-I274 HydrophobicContact CD1-CG1 4.21Å; Y270-I274 HydrophobicContact CE1-CD1 3.74Å; Y270-I274 HydrophobicContact CE1-CG1 4.37Å; Y270-I274 WeakPolarHBondContact O-CB 3.47Å; Y270-I274 VanDerWaalsContact O-CG1 3.22Å; Y270-I274 WeakPolarHBondContact O-CG1 3.33Å; Y270-I274 PolarHBondContact O-N 2.95Å
271T39.1Very low43.8Very low68 Ų68104.3 Ų104.342%0.41754%0.535SS..Hα-helixtrans-71.5-30.3177.4370000113.4D267 M268 K275D267-T271 WeakPolarHBondContact O-CB 3.42Å; D267-T271 PolarHBondContact O-N 3.36Å; D267-T271 PolarHBondContact O-OG1 2.91Å; M268-T271 WeakPolarHBondContact CA-OG1 3.39Å; M268-T271 PolarHBondContact O-N 3.35Å; M268-T271 PolarHBondContact O-OG1 3.41Å; T271-K275 VanDerWaalsContact O-CB 3.31Å; T271-K275 WeakPolarHBondContact O-CB 3.3Å; T271-K275 WeakPolarHBondContact O-CG 3.45Å; T271-K275 PolarHBondContact O-N 3.06Å
272V35.3Very low42.1Very low72 Ų72107.1 Ų107.144%0.43655%0.547SS..Hα-helixtrans-72.5-42.9173.2172.60000110.1M268 I274 K275 F276M268-V272 VanDerWaalsContact O-CB 3.25Å; M268-V272 WeakPolarHBondContact O-CB 3.38Å; M268-V272 WeakPolarHBondContact O-CG2 3.44Å; M268-V272 PolarHBondContact O-N 2.91Å; V272-I274 VanDerWaalsContact C-N 3.34Å; V272-I274 PolarHBondContact O-N 3.26Å; V272-K275 PolarHBondContact O-N 2.81Å; V272-F276 HydrophobicContact CG1-CD2 4.45Å; V272-F276 PolarHBondContact O-N 2.89Å
273K32Very low40.3Very low134 Ų134113.6 Ų113.658%0.58358%0.577SS**Hα-helixtrans-60.4-40.3171.9-78.9-175.3178.2-175.90111.7D269 Y270 F276 S277 E421D269-K273 VanDerWaalsContact O-CB 3.28Å; D269-K273 WeakPolarHBondContact O-CB 3.29Å; D269-K273 WeakPolarHBondContact O-CG 3.28Å; D269-K273 PolarHBondContact O-N 3.41Å; Y270-K273 PolarHBondContact O-N 3.03Å; K273-F276 PolarHBondContact O-N 3.31Å; K273-S277 PolarHBondContact O-N 2.79Å; K273-E421 IonicContact NZ-OE2 2.79Å
274I45.4Very low39.3Very low95 Ų95120 Ų12049%0.48760%0.598SS.*Hα-helixtrans-66.8-40.9173.7-68.3167.6000111.5Y270 V272 F276 S277 W278Y270-I274 HydrophobicContact CD1-CD1 3.52Å; Y270-I274 HydrophobicContact CD1-CG1 4.21Å; Y270-I274 HydrophobicContact CE1-CD1 3.74Å; Y270-I274 HydrophobicContact CE1-CG1 4.37Å; Y270-I274 WeakPolarHBondContact O-CB 3.47Å; Y270-I274 VanDerWaalsContact O-CG1 3.22Å; Y270-I274 WeakPolarHBondContact O-CG1 3.33Å; Y270-I274 PolarHBondContact O-N 2.95Å; V272-I274 VanDerWaalsContact C-N 3.34Å; V272-I274 PolarHBondContact O-N 3.26Å; I274-F276 VanDerWaalsContact C-N 3.33Å; I274-F276 PolarHBondContact O-N 2.76Å; I274-S277 PolarHBondContact O-N 2.85Å; I274-W278 PolarHBondContact O-N 3.11Å
275K32.9Very low38.1Very low159 Ų159124.9 Ų124.969%0.69162%0.62SS**Hα-helixtrans-69-28.1178.5-84.7-177.1174.2-178.90113.4T271 V272 W278T271-K275 VanDerWaalsContact O-CB 3.31Å; T271-K275 WeakPolarHBondContact O-CB 3.3Å; T271-K275 WeakPolarHBondContact O-CG 3.45Å; T271-K275 PolarHBondContact O-N 3.06Å; V272-K275 PolarHBondContact O-N 2.81Å; K275-W278 PolarHBondContact O-N 3.35Å
276F29.3Very low37.6Very low178 Ų178127.7 Ų127.778%0.78164%0.636SS**Hα-helixtrans-79-19.3174.8-110.1-89000113.7V272 K273 I274 W278V272-F276 HydrophobicContact CG1-CD2 4.45Å; V272-F276 PolarHBondContact O-N 2.89Å; K273-F276 PolarHBondContact O-N 3.31Å; I274-F276 VanDerWaalsContact C-N 3.33Å; I274-F276 PolarHBondContact O-N 2.76Å; F276-W278 VanDerWaalsContact C-N 3.31Å
277S32.8Very low37.1Very low110 Ų110124 Ų12477%0.76963%0.629SS**Hα-helixtrans-82.6-10.7169.5-161.20000112.7K273 I274 L279K273-S277 PolarHBondContact O-N 2.79Å; I274-S277 PolarHBondContact O-N 2.85Å; S277-L279 PolarHBondContact O-N 2.96Å
278W33.8Very low36.6Very low149 Ų149128.5 Ų128.556%0.56464%0.644SS**  trans-102.954.7-174.4-165.378000112.3I274 K275 F276I274-W278 PolarHBondContact O-N 3.11Å; K275-W278 PolarHBondContact O-N 3.35Å; F276-W278 VanDerWaalsContact C-N 3.31Å
279L35.7Very low35.8Very low169 Ų169131.5 Ų131.589%0.88566%0.657SS**  trans-107.332.6165.3-121.6152.1000111.1S277S277-L279 PolarHBondContact O-N 2.96Å
280G35.6Very low35.6Very low54 Ų54132 Ų13256%0.55766%0.655SS**SBendtrans-150.693178.900000112.4
281F30.7Very low35.7Very low202 Ų202132.5 Ų132.589%0.88666%0.656SS**  trans72.7122.2161.5-86.9-94.3000121
282D33Very low35.5Very low120 Ų120138.5 Ų138.564%0.64267%0.671SS**  trans-65.1126173.8-105.9-46.3000113.9
283H29.2Very low35.4Very low172 Ų172141.4 Ų141.480%0.79668%0.68SS**  -159133.8121.9-125.458.2000113.9I285H283-I285 PolarHBondContact O-N 3.43Å
284K38Very low35.8Very low198 Ų198138.5 Ų138.586%0.86167%0.674SS**  trans-71.691-177.3-171.8-175.9-171.3-176.40111.3
285I34.1Very low35.9Very low121 Ų121138.1 Ų138.162%0.62168%0.676SS**  trans-138.2120.6163.9-58.3-178.9000109.9H283 G287H283-I285 PolarHBondContact O-N 3.43Å; I285-G287 PolarHBondContact O-N 3.49Å; I285-G287 VanDerWaalsContact O-N 3.17Å
286T42.1Very low36.1Very low110 Ų110134 Ų13468%0.67566%0.664SS**  trans-51.4111.5179.8-450000111.9K288 Q289T286-K288 PolarHBondContact O-N 3.24Å; T286-Q289 PolarHBondContact O-N 2.98Å
287G40.5Very low36.6Very low40 Ų40129.3 Ų129.341%0.41265%0.65SS.*Hα-helixtrans-55.6-25.1-169.500000116.3I285 Q289 Y291I285-G287 PolarHBondContact O-N 3.49Å; I285-G287 VanDerWaalsContact O-N 3.17Å; G287-Q289 PolarHBondContact O-N 3.39Å; G287-Y291 WeakPolarHBondContact O-CD2 3.35Å; G287-Y291 PolarHBondContact O-N 2.88Å
288K39.1Very low36.9Very low195 Ų195126 Ų12685%0.84863%0.633SS**Hα-helixtrans-73.5-25.2-177-66.7-173.7179-178.90114.4T286T286-K288 PolarHBondContact O-N 3.24Å
289Q32.7Very low37Very low147 Ų147128.4 Ų128.469%0.68764%0.642SS**Hα-helixtrans-89.8-33.1176-80.4178-27.200112.3T286 G287 R292 Q293T286-Q289 PolarHBondContact O-N 2.98Å; G287-Q289 PolarHBondContact O-N 3.39Å; Q289-R292 PolarHBondContact O-N 3.2Å; Q289-Q293 PolarHBondContact O-N 3.33Å
290F37Very low37Very low115 Ų115130 Ų13050%0.50464%0.636SS.*Hα-helixtrans-64.4-47.7177.1-172.4-104.1000111.8R292 Q293 V294F290-R292 VanDerWaalsContact C-N 3.28Å; F290-R292 PolarHBondContact O-N 3.11Å; F290-Q293 PolarHBondContact O-N 3.37Å; F290-V294 HydrophobicContact CD1-CG2 3.9Å; F290-V294 HydrophobicContact CD2-CG2 4.16Å; F290-V294 HydrophobicContact CE1-CG2 3.63Å; F290-V294 HydrophobicContact CE2-CG2 3.9Å; F290-V294 HydrophobicContact CG-CG2 4.17Å; F290-V294 HydrophobicContact CZ-CG2 3.63Å; F290-V294 WeakPolarHBondContact O-CB 3.42Å; F290-V294 VanDerWaalsContact O-CG2 3.25Å; F290-V294 WeakPolarHBondContact O-CG2 3.35Å; F290-V294 PolarHBondContact O-N 2.93Å
291Y40.2Very low37Very low174 Ų174134.2 Ų134.268%0.68265%0.645SS**Hα-helixtrans-61.9-34.7177.9-88-87.9000113G287 T295G287-Y291 WeakPolarHBondContact O-CD2 3.35Å; G287-Y291 PolarHBondContact O-N 2.88Å; Y291-T295 WeakPolarHBondContact O-CB 3.22Å; Y291-T295 VanDerWaalsContact O-CG2 3.29Å; Y291-T295 WeakPolarHBondContact O-CG2 3.44Å; Y291-T295 PolarHBondContact O-N 3.3Å; Y291-T295 PolarHBondContact O-OG1 3.46Å
292R36Very low37.5Very low194 Ų194128.8 Ų128.873%0.73263%0.633SS**Hα-helixtrans-73-36.3176.7-171.4173.7161.9179.2-5.3112.4Q289 F290 T295 T296Q289-R292 PolarHBondContact O-N 3.2Å; F290-R292 VanDerWaalsContact C-N 3.28Å; F290-R292 PolarHBondContact O-N 3.11Å; R292-T295 WeakPolarHBondContact CA-OG1 3.5Å; R292-T295 PolarHBondContact O-OG1 3.05Å; R292-T296 WeakPolarHBondContact O-CB 3.36Å; R292-T296 PolarHBondContact O-N 2.98Å; R292-T296 VanDerWaalsContact O-N 3.1Å; R292-T296 PolarHBondContact O-OG1 3.44Å
293Q32.4Very low38Very low133 Ų133128.3 Ų128.362%0.62163%0.634SS**Hα-helixtrans-72.3-40.3173-94.1-179.9-50.400112.2Q289 F290 T296 V297Q289-Q293 PolarHBondContact O-N 3.33Å; F290-Q293 PolarHBondContact O-N 3.37Å; Q293-T296 PolarHBondContact O-N 3.15Å; Q293-V297 VanDerWaalsContact O-CB 3.24Å; Q293-V297 WeakPolarHBondContact O-CB 3.39Å; Q293-V297 WeakPolarHBondContact O-CG2 3.34Å; Q293-V297 PolarHBondContact O-N 2.84Å
294V41.3Very low37.9Very low73 Ų73124.9 Ų124.944%0.44263%0.629SS.*Hα-helixtrans-69.7-38-179.9176.10000111.6F290 G298F290-V294 HydrophobicContact CD1-CG2 3.9Å; F290-V294 HydrophobicContact CD2-CG2 4.16Å; F290-V294 HydrophobicContact CE1-CG2 3.63Å; F290-V294 HydrophobicContact CE2-CG2 3.9Å; F290-V294 HydrophobicContact CG-CG2 4.17Å; F290-V294 HydrophobicContact CZ-CG2 3.63Å; F290-V294 WeakPolarHBondContact O-CB 3.42Å; F290-V294 VanDerWaalsContact O-CG2 3.25Å; F290-V294 WeakPolarHBondContact O-CG2 3.35Å; F290-V294 PolarHBondContact O-N 2.93Å; V294-G298 PolarHBondContact O-N 3.05Å
295T46.4Very low37.4Very low88 Ų88122 Ų12254%0.5462%0.623SS.*Hα-helixtrans-69.3-37172490000112.4Y291 R292 R299Y291-T295 WeakPolarHBondContact O-CB 3.22Å; Y291-T295 VanDerWaalsContact O-CG2 3.29Å; Y291-T295 WeakPolarHBondContact O-CG2 3.44Å; Y291-T295 PolarHBondContact O-N 3.3Å; Y291-T295 PolarHBondContact O-OG1 3.46Å; R292-T295 WeakPolarHBondContact CA-OG1 3.5Å; R292-T295 PolarHBondContact O-OG1 3.05Å; T295-R299 VanDerWaalsContact O-CB 3.25Å; T295-R299 WeakPolarHBondContact O-CB 3.26Å; T295-R299 PolarHBondContact O-N 2.86Å
296T37.4Very low37.6Very low72 Ų72124.2 Ų124.244%0.44264%0.636SS.*Hα-helixtrans-71.7-36.7176.8-58.30000112R292 Q293 R300R292-T296 WeakPolarHBondContact O-CB 3.36Å; R292-T296 PolarHBondContact O-N 2.98Å; R292-T296 VanDerWaalsContact O-N 3.1Å; R292-T296 PolarHBondContact O-OG1 3.44Å; Q293-T296 PolarHBondContact O-N 3.15Å; T296-R300 WeakPolarHBondContact O-CB 3.42Å; T296-R300 WeakPolarHBondContact O-CG 3.18Å; T296-R300 PolarHBondContact O-N 2.72Å
297V39.7Very low37Very low79 Ų79125.7 Ų125.748%0.47965%0.645SS.*Hα-helixtrans-74.3-40.7176.7172.90000110.5Q293 R299 R300 L301Q293-V297 VanDerWaalsContact O-CB 3.24Å; Q293-V297 WeakPolarHBondContact O-CB 3.39Å; Q293-V297 WeakPolarHBondContact O-CG2 3.34Å; Q293-V297 PolarHBondContact O-N 2.84Å; V297-R299 VanDerWaalsContact C-N 3.31Å; V297-R299 PolarHBondContact O-N 3.47Å; V297-R300 PolarHBondContact O-N 3.22Å; V297-R300 VanDerWaalsContact O-N 3.16Å; V297-L301 HydrophobicContact CG1-CD1 3.73Å; V297-L301 HydrophobicContact CG1-CG 4.26Å; V297-L301 WeakPolarHBondContact O-CB 3.47Å; V297-L301 VanDerWaalsContact O-CG 3.29Å; V297-L301 WeakPolarHBondContact O-CG 3.46Å; V297-L301 PolarHBondContact O-N 3.26Å
298G40.9Very low36.3Very low40 Ų40132.9 Ų132.941%0.41267%0.665SS.*Hα-helixtrans-59.8-39.3171.900000112.7V294 L301 S302V294-G298 PolarHBondContact O-N 3.05Å; G298-L301 PolarHBondContact O-N 3.44Å; G298-S302 WeakPolarHBondContact O-CB 3.49Å; G298-S302 PolarHBondContact O-N 3.37Å
299R35Very low36.1Very low200 Ų200132.6 Ų132.676%0.75567%0.666SS**Hα-helixtrans-75.5-22.2176-155.6174.7-167.1168.34.1113.8T295 V297 S302 V303T295-R299 VanDerWaalsContact O-CB 3.25Å; T295-R299 WeakPolarHBondContact O-CB 3.26Å; T295-R299 PolarHBondContact O-N 2.86Å; V297-R299 VanDerWaalsContact C-N 3.31Å; V297-R299 PolarHBondContact O-N 3.47Å; R299-S302 PolarHBondContact O-OG 2.88Å; R299-V303 WeakPolarHBondContact O-CG2 3.44Å
300R35.1Very low35.7Very low202 Ų202134.4 Ų134.476%0.76267%0.672SS**Hα-helixtrans-83.8-31.2172.4-73.3-101.1-173.6169.40.1112T296 V297T296-R300 WeakPolarHBondContact O-CB 3.42Å; T296-R300 WeakPolarHBondContact O-CG 3.18Å; T296-R300 PolarHBondContact O-N 2.72Å; V297-R300 PolarHBondContact O-N 3.22Å; V297-R300 VanDerWaalsContact O-N 3.16Å
301L37.1Very low35.4Very low143 Ų143137.2 Ų137.275%0.74969%0.686SS**Hα-helixtrans-77.8-24.4173.7-71.4168.2000112.3V297 G298 V303V297-L301 HydrophobicContact CG1-CD1 3.73Å; V297-L301 HydrophobicContact CG1-CG 4.26Å; V297-L301 WeakPolarHBondContact O-CB 3.47Å; V297-L301 VanDerWaalsContact O-CG 3.29Å; V297-L301 WeakPolarHBondContact O-CG 3.46Å; V297-L301 PolarHBondContact O-N 3.26Å; G298-L301 PolarHBondContact O-N 3.44Å; L301-V303 VanDerWaalsContact C-N 3.27Å; L301-V303 PolarHBondContact O-N 3.33Å
302S39.5Very low34.7Very low89 Ų89135 Ų13562%0.62269%0.691SS**THydrogen-bonded Turntrans-82.40.9172.880.10000114G298 R299G298-S302 WeakPolarHBondContact O-CB 3.49Å; G298-S302 PolarHBondContact O-N 3.37Å; R299-S302 PolarHBondContact O-OG 2.88Å
303V43.8Very low34.7Very low110 Ų110132.7 Ų132.767%0.66770%0.698SS**  trans-129.877.5178-1740000109.4R299 L301R299-V303 WeakPolarHBondContact O-CG2 3.44Å; L301-V303 VanDerWaalsContact C-N 3.27Å; L301-V303 PolarHBondContact O-N 3.33Å
304S27.1Very low34.4Very low99 Ų99129.4 Ų129.469%0.69270%0.7SS**  trans-156.3115.9148.4-1410000112.7
305N27.6Very low34.2Very low139 Ų139135.7 Ų135.774%0.74372%0.721SS**  trans7992.7152.2-64.2-13.3000120.6V307N305-V307 PolarHBondContact O-N 2.94Å
306N37.9Very low33.5Very low166 Ų166138.6 Ų138.689%0.88873%0.734SS**  19.995127.3-86.8-42.9000116.5
307V29.8Very low33.4Very low142 Ų142139.7 Ų139.786%0.86176%0.759SS**  trans-132.7114.6147.3-1780000109.1N305N305-V307 PolarHBondContact O-N 2.94Å
308K26.1Very low32.8Very low191 Ų191146.9 Ų146.983%0.8378%0.777SS**  trans-24.3128.3172.8-66.1170177.7177.90115.4K310K308-K310 PolarHBondContact O-N 3.41Å; K308-K310 VanDerWaalsContact O-N 3.08Å
309Q34.7Very low32Very low189 Ų189151.6 Ų151.688%0.88380%0.798SS**  trans-39.7110149.6-166.71697.400109.6
310K24.9Very low31.5Very low185 Ų185150 Ų15080%0.80480%0.804SS**  trans-132101.7169.4-131.2-178.2-176.2-176.30107.2K308 V312K308-K310 PolarHBondContact O-N 3.41Å; K308-K310 VanDerWaalsContact O-N 3.08Å; K310-V312 PolarHBondContact O-N 3.06Å
311E30.1Very low31.1Very low173 Ų173145.6 Ų145.681%0.80880%0.803SS**  trans-55.3125.9162.6-66.9177.8161.700108.3
312V26.2Very low30.6Very low128 Ų128146.6 Ų146.678%0.77681%0.808SS**  trans-124.499.5166.2-178.50000106.8K310K310-V312 PolarHBondContact O-N 3.06Å
313V34.8Very low30.1Very low145 Ų145146 Ų14688%0.87980%0.804SS**  trans-73.5119.5163.5169.20000107.5
314G27.9Very low29.4Very low64 Ų64147.1 Ų147.166%0.6681%0.811SS**  trans-126.4133.8171.900000110D316G314-D316 PolarHBondContact O-N 2.79Å
315K36.3Very low29.7Very low205 Ų205149.1 Ų149.189%0.89181%0.811SS**SBendtrans-60.9104.9-167.9-75169.5167.3172.40113.6
316D31.9Very low29.8Very low150 Ų150150.1 Ų150.180%0.80282%0.817SS**SBendtrans160.6115.5136.3-83.4-16.1000106.1G314 R318G314-D316 PolarHBondContact O-N 2.79Å; D316-R318 VanDerWaalsContact C-N 3.3Å; D316-R318 PolarHBondContact O-N 3.22Å
317G35.5Very low29.5Very low94 Ų94150 Ų15097%0.96982%0.815SS**SBendtrans-63.171.3-161.900000116.8
318R26.7Very low29.3Very low231 Ų231151.5 Ų151.587%0.87281%0.813SS**  trans-139106163.3-72.1-174.5-174.4175.92.1110.1D316 L320D316-R318 VanDerWaalsContact C-N 3.3Å; D316-R318 PolarHBondContact O-N 3.22Å; R318-L320 PolarHBondContact O-N 3.39Å
319T23.7Very low29.4Very low138 Ų138150.3 Ų150.385%0.84781%0.812SS**  trans-75.8102.3161.826.50000108.8C321T319-C321 PolarHBondContact O-N 2.96Å
320L25.6Very low28.8Very low168 Ų168146.9 Ų146.988%0.8880%0.8SS**  trans-76.693.7159.7-97.3156.9000107.5R318 L322R318-L320 PolarHBondContact O-N 3.39Å; L320-L322 PolarHBondContact O-N 3.38Å
321C26.2Very low28.9Very low109 Ų109143.2 Ų143.274%0.73680%0.796SS**  trans-69.5111158.7-75.20000107T319 S323T319-C321 PolarHBondContact O-N 2.96Å; C321-S323 PolarHBondContact O-N 3.32Å
322L26.4Very low28.4Very low163 Ų163142.2 Ų142.285%0.85379%0.789SS**  trans-63.197.2160.9-166.581.2000105.7L320 T324L320-L322 PolarHBondContact O-N 3.38Å; L322-T324 PolarHBondContact O-N 3.25Å
323S27.8Very low28.4Very low77 Ų77141.3 Ų141.354%0.53879%0.786SS.*  trans-61.2104.6177.4-177.90000108.2C321 M325C321-S323 PolarHBondContact O-N 3.32Å; S323-M325 PolarHBondContact O-N 3.39Å; S323-M325 WeakPolarHBondContact OG-CB 3.36Å; S323-M325 PolarHBondContact OG-N 3.23Å
324T30.2Very low28.1Very low134 Ų134143.1 Ų143.182%0.82279%0.785SS**  trans-80.131.8155510000110.5L322L322-T324 PolarHBondContact O-N 3.25Å
325M34.2Very low28.2Very low140 Ų140149 Ų14969%0.6980%0.795SS**  trans-96.385.1161.4-54.5172.772.700106.9S323S323-M325 PolarHBondContact O-N 3.39Å; S323-M325 WeakPolarHBondContact OG-CB 3.36Å; S323-M325 PolarHBondContact OG-N 3.23Å
326D28.1Very low28Very low161 Ų161148 Ų14886%0.86179%0.794SS**SBendtrans-16423.1156.3-96.6-25.2000112
327L32Very low28.4Very low163 Ų163145.3 Ų145.385%0.85379%0.787SS**  trans-141.424.9171.4-105.5140.6000112.5M329L327-M329 PolarHBondContact O-N 3.33Å
328E26Very low29.2Very low174 Ų174145.4 Ų145.481%0.81376%0.762SS**  trans-80.680.8141.5-76.6178.4155.800105.5D330E328-D330 PolarHBondContact O-N 2.91Å
329M28Very low31.1Very low166 Ų166137.9 Ų137.982%0.81875%0.745SS**  trans-55.6111.1146-87.1-161.486.600103.6L327 C331L327-M329 PolarHBondContact O-N 3.33Å; M329-C331 PolarHBondContact O-N 3.1Å
330D22.9Very low33.7Very low116 Ų116134.6 Ų134.662%0.6272%0.719SS**  trans-56.485.7166.1-159.74.4000105.9E328 K332E328-D330 PolarHBondContact O-N 2.91Å; D330-K332 PolarHBondContact O-N 3.38Å
331C25.4Very low36.3Very low108 Ų108132 Ų13273%0.7371%0.706SS**  trans-60.992.4154.3-75.10000101.7M329 P333M329-C331 PolarHBondContact O-N 3.1Å; C331-P333 WeakPolarHBondContact O-CD 3.45Å
332K21Very low39Very low152 Ų152133 Ų13366%0.66170%0.697SS**  trans-34.6116.5154.1-86-175.4175.7176.50104D330 Q334D330-K332 PolarHBondContact O-N 3.38Å; K332-Q334 VanDerWaalsContact C-N 3.31Å; K332-Q334 PolarHBondContact O-N 2.99Å
333P24.6Very low41.8Very low110 Ų110125.3 Ų125.371%0.71466%0.657SS**  trans-49.8112.7-179.418.1-29.3000103.7C331 E335C331-P333 WeakPolarHBondContact O-CD 3.45Å; P333-E335 WeakPolarHBondContact O-CA 3.34Å; P333-E335 PolarHBondContact O-N 2.89Å
334Q28.5Very low44.6Very low183 Ų183123 Ų12386%0.85564%0.638SS**  trans-37.9106.3-176.6177.5179.24.200104.9K332 E336K332-Q334 VanDerWaalsContact C-N 3.31Å; K332-Q334 PolarHBondContact O-N 2.99Å; Q334-E336 VanDerWaalsContact C-N 3.33Å; Q334-E336 WeakPolarHBondContact O-CA 3.32Å; Q334-E336 PolarHBondContact O-N 3.29Å
335E31.1Very low47.4Very low188 Ų188123.5 Ų123.588%0.87963%0.633SS**  trans-40.6108.3-169.9-97-176160.500105P333 S337P333-E335 WeakPolarHBondContact O-CA 3.34Å; P333-E335 PolarHBondContact O-N 2.89Å; E335-S337 PolarHBondContact O-N 3.24Å
336E31.9Very low50Low182 Ų182117.5 Ų117.585%0.8561%0.607SS**  trans-48.9116.4-169.7-79.6-174.7149.400104.4Q334 E338Q334-E336 VanDerWaalsContact C-N 3.33Å; Q334-E336 WeakPolarHBondContact O-CA 3.32Å; Q334-E336 PolarHBondContact O-N 3.29Å; E336-E338 WeakPolarHBondContact O-CA 3.05Å; E336-E338 PolarHBondContact O-N 2.89Å
337S40.6Very low53Low95 Ų95112.8 Ų112.866%0.66459%0.585SS**  trans-44.7111.4-176.4610000105.7E335 S339E335-S337 PolarHBondContact O-N 3.24Å; S337-S339 WeakPolarHBondContact O-CA 3.47Å; S337-S339 PolarHBondContact O-N 3.49Å
338E53.1Low55.8Low96 Ų96105.5 Ų105.545%0.44955%0.547SS..  trans-46.5118.9-172.2-85-157.5117.300106.1E336 F340 K342 Q503E336-E338 WeakPolarHBondContact O-CA 3.05Å; E336-E338 PolarHBondContact O-N 2.89Å; E338-F340 PolarHBondContact O-N 3.32Å; E338-K342 IonicContact OE1-NZ 3.25Å; E338-K342 PolarHBondContact OE1-NZ 2.95Å; E338-Q503 PolarHBondContact O-NE2 2.81Å
339S66.4Low59Low72 Ų7297.5 Ų97.550%0.50351%0.51SS..  trans-46.7125.5-167.1174.20000108.2S337 L341 K342 S343S337-S339 WeakPolarHBondContact O-CA 3.47Å; S337-S339 PolarHBondContact O-N 3.49Å; S339-L341 CarbonylContact O-C 3.59Å; S339-L341 PolarHBondContact O-N 2.73Å; S339-K342 VanDerWaalsContact O-CA 3.3Å; S339-K342 WeakPolarHBondContact O-CA 3.28Å; S339-K342 WeakPolarHBondContact O-CB 3.49Å; S339-K342 PolarHBondContact O-N 3.03Å; S339-S343 PolarHBondContact O-N 3.49Å; S339-S343 VanDerWaalsContact O-N 3.16Å
340F76.9Confident62.2Low69 Ų6994.1 Ų94.130%0.30349%0.494SS..Hα-helixtrans-51.4-31.4-173.1174.3-110.9000112.2E338 S343 I344 L507 M510E338-F340 PolarHBondContact O-N 3.32Å; F340-S343 WeakPolarHBondContact O-CB 3.3Å; F340-S343 PolarHBondContact O-N 3.39Å; F340-I344 HydrophobicContact CD1-CD1 3.74Å; F340-I344 HydrophobicContact CE1-CD1 3.25Å; F340-I344 HydrophobicContact CE1-CG1 4.32Å; F340-I344 HydrophobicContact CE2-CD1 4.16Å; F340-I344 HydrophobicContact CE2-CG1 4.43Å; F340-I344 HydrophobicContact CG-CD1 4.39Å; F340-I344 HydrophobicContact CZ-CD1 3.49Å; F340-I344 VanDerWaalsContact CZ-CD1 3.49Å; F340-I344 HydrophobicContact CZ-CG1 4.19Å; F340-I344 WeakPolarHBondContact O-CG1 3.19Å; F340-I344 PolarHBondContact O-N 3.48Å; F340-L507 HydrophobicContact CE2-CD2 4.09Å; F340-L507 HydrophobicContact CE2-CG 4.24Å; F340-M510 HydrophobicContact CE1-CE 4.48Å
341L80.3Confident65.6Low115 Ų11590.2 Ų90.260%0.60247%0.473SS*.Hα-helixtrans-64.2-40.6171.8-73.2169.4000113.4S339 S343 I344 M345S339-L341 CarbonylContact O-C 3.59Å; S339-L341 PolarHBondContact O-N 2.73Å; L341-S343 VanDerWaalsContact C-N 3.31Å; L341-S343 PolarHBondContact O-N 3.2Å; L341-I344 PolarHBondContact O-N 2.83Å; L341-M345 WeakPolarHBondContact O-CB 3.43Å; L341-M345 VanDerWaalsContact O-CG 3.31Å; L341-M345 WeakPolarHBondContact O-CG 3.3Å; L341-M345 PolarHBondContact O-N 2.95Å
342K84.3Confident68.9Low128 Ų12885 Ų8556%0.55744%0.439SS*.Hα-helixtrans-62-39.4173.4-167.7-170.7176.4-152.80110.9E338 S339 M345 G346E338-K342 IonicContact OE1-NZ 3.25Å; E338-K342 PolarHBondContact OE1-NZ 2.95Å; S339-K342 VanDerWaalsContact O-CA 3.3Å; S339-K342 WeakPolarHBondContact O-CA 3.28Å; S339-K342 WeakPolarHBondContact O-CB 3.49Å; S339-K342 PolarHBondContact O-N 3.03Å; K342-M345 PolarHBondContact O-N 3.32Å; K342-G346 PolarHBondContact O-N 3.39Å; K342-G346 VanDerWaalsContact O-N 3.08Å
343S84.4Confident72.4Confident3 Ų378.2 Ų78.22%0.02141%0.411CS..Hα-helixtrans-64.2-43.1174.8-60.40000112.4S339 F340 L341 G346 Y499 Q503S339-S343 PolarHBondContact O-N 3.49Å; S339-S343 VanDerWaalsContact O-N 3.16Å; F340-S343 WeakPolarHBondContact O-CB 3.3Å; F340-S343 PolarHBondContact O-N 3.39Å; L341-S343 VanDerWaalsContact C-N 3.31Å; L341-S343 PolarHBondContact O-N 3.2Å; S343-G346 PolarHBondContact O-N 3.42Å; S343-Y499 PolarHBondContact O-OH 3.29Å; S343-Q503 PolarHBondContact OG-OE1 3.46Å
344I87.2Confident75.8Confident28 Ų2876 Ų7614%0.14439%0.392CS..Hα-helixtrans-66.8-41.6176.6-71.9168.9000111.8F340 L341 G346 F349 L507 M510F340-I344 HydrophobicContact CD1-CD1 3.74Å; F340-I344 HydrophobicContact CE1-CD1 3.25Å; F340-I344 HydrophobicContact CE1-CG1 4.32Å; F340-I344 HydrophobicContact CE2-CD1 4.16Å; F340-I344 HydrophobicContact CE2-CG1 4.43Å; F340-I344 HydrophobicContact CG-CD1 4.39Å; F340-I344 HydrophobicContact CZ-CD1 3.49Å; F340-I344 VanDerWaalsContact CZ-CD1 3.49Å; F340-I344 HydrophobicContact CZ-CG1 4.19Å; F340-I344 WeakPolarHBondContact O-CG1 3.19Å; F340-I344 PolarHBondContact O-N 3.48Å; L341-I344 PolarHBondContact O-N 2.83Å; I344-G346 PolarHBondContact O-N 3.31Å; I344-F349 HydrophobicContact CB-CD1 4.43Å; I344-F349 HydrophobicContact CB-CE1 4.43Å; I344-F349 HydrophobicContact CG1-CE1 4.43Å; I344-F349 HydrophobicContact CG2-CD1 4.16Å; I344-F349 HydrophobicContact CG2-CE1 3.92Å; I344-F349 WeakPolarHBondContact O-CD1 3.47Å; I344-L507 HydrophobicContact CG1-CD2 4.04Å; I344-M510 HydrophobicContact CD1-CE 3.95Å; I344-M510 HydrophobicContact CD1-CG 4.16Å; I344-M510 HydrophobicContact CG1-CG 4.49Å
345M87.6Confident79Confident144 Ų14467.3 Ų67.371%0.70935%0.352SS*.THydrogen-bonded Turntrans-75.9-2.2177.1-66.8-175.773.400112.6L341 K342L341-M345 WeakPolarHBondContact O-CB 3.43Å; L341-M345 VanDerWaalsContact O-CG 3.31Å; L341-M345 WeakPolarHBondContact O-CG 3.3Å; L341-M345 PolarHBondContact O-N 2.95Å; K342-M345 PolarHBondContact O-N 3.32Å
346G89.2Confident82Confident14 Ų1458.4 Ų58.414%0.14431%0.31CS..SBendtrans-62.6137.4175.400000111.5K342 S343 I344 I348 F349 L350K342-G346 PolarHBondContact O-N 3.39Å; K342-G346 VanDerWaalsContact O-N 3.08Å; S343-G346 PolarHBondContact O-N 3.42Å; I344-G346 PolarHBondContact O-N 3.31Å; G346-I348 PolarHBondContact O-N 2.96Å; G346-F349 PolarHBondContact O-N 3.44Å; G346-F349 VanDerWaalsContact O-N 3.15Å; G346-L350 PolarHBondContact O-N 3.4Å
347P90.9Very high85Confident62 Ų6250.3 Ų50.340%0.40327%0.273SS..Hα-helixtrans-61.4-32.1-177.923.7-34.2000112.9L351 Y557P347-L351 VanDerWaalsContact O-CB 3.3Å; P347-L351 WeakPolarHBondContact O-CB 3.33Å; P347-L351 VanDerWaalsContact O-CG 3.25Å; P347-L351 WeakPolarHBondContact O-CG 2.88Å; P347-L351 PolarHBondContact O-N 2.99Å; P347-Y557 HydrophobicContact CB-CE1 4.18Å; P347-Y557 HydrophobicContact CB-CE2 4.11Å; P347-Y557 HydrophobicContact CG-CE1 4.01Å; P347-Y557 HydrophobicContact CG-CE2 4.23Å; P347-Y557 WeakPolarHBondContact CG-OH 3.49Å
348I91.9Very high87.6Confident11 Ų1145.9 Ų45.96%0.05624%0.242CC..Hα-helixtrans-63.1-49176.3-60.3174.5000110.3G346 S352 L494 V498 Y557 L558 Y561G346-I348 PolarHBondContact O-N 2.96Å; I348-S352 VanDerWaalsContact O-CB 3.3Å; I348-S352 WeakPolarHBondContact O-CB 3.34Å; I348-S352 PolarHBondContact O-N 2.88Å; I348-S352 PolarHBondContact O-OG 3.08Å; I348-S352 VanDerWaalsContact O-OG 3.14Å; I348-L494 HydrophobicContact CG2-CD1 4.22Å; I348-L494 HydrophobicContact CG2-CD2 4Å; I348-L494 HydrophobicContact CG2-CG 4.29Å; I348-V498 HydrophobicContact CD1-CG1 3.82Å; I348-V498 HydrophobicContact CD1-CG2 4.31Å; I348-Y557 HydrophobicContact CD1-CE1 4.35Å; I348-Y557 HydrophobicContact CG1-CD1 4.04Å; I348-Y557 HydrophobicContact CG1-CE1 3.55Å; I348-L558 HydrophobicContact CG2-CD2 4.48Å; I348-Y561 HydrophobicContact CD1-CD1 4.11Å; I348-Y561 HydrophobicContact CD1-CD2 4.32Å; I348-Y561 HydrophobicContact CD1-CE1 4.01Å; I348-Y561 HydrophobicContact CD1-CE2 4.24Å; I348-Y561 HydrophobicContact CD1-CG 4.26Å
349F93.4Very high89.6Confident6 Ų641.3 Ų41.33%0.02622%0.221CC..Hα-helixtrans-61.3-51.7177.6-179.7-94000111I344 G346 L351 S352 A353 Y495 Y499 L507 M510 Q511I344-F349 HydrophobicContact CB-CD1 4.43Å; I344-F349 HydrophobicContact CB-CE1 4.43Å; I344-F349 HydrophobicContact CG1-CE1 4.43Å; I344-F349 HydrophobicContact CG2-CD1 4.16Å; I344-F349 HydrophobicContact CG2-CE1 3.92Å; I344-F349 WeakPolarHBondContact O-CD1 3.47Å; G346-F349 PolarHBondContact O-N 3.44Å; G346-F349 VanDerWaalsContact O-N 3.15Å; F349-L351 PolarHBondContact O-N 2.9Å; F349-S352 WeakPolarHBondContact CA-OG 3.03Å; F349-S352 CarbonylContact O-C 3.36Å; F349-S352 PolarHBondContact O-N 3.03Å; F349-S352 VanDerWaalsContact O-N 3.12Å; F349-S352 PolarHBondContact O-OG 3.45Å; F349-A353 HydrophobicContact CE1-CB 4.35Å; F349-A353 WeakPolarHBondContact O-CB 3.07Å; F349-A353 PolarHBondContact O-N 3.25Å; F349-Y495 AromaticContact CD2-CE1 3.92Å; F349-Y495 HydrophobicContact CD2-CE1 3.92Å; F349-Y495 AromaticContact CD2-CZ 3.69Å; F349-Y495 WeakPolarHBondContact CD2-OH 3.39Å; F349-Y495 HydrophobicContact CE2-CE2 4.49Å; F349-Y495 AromaticContact CE2-CZ 3.87Å; F349-Y495 WeakPolarHBondContact CE2-OH 3.21Å; F349-Y499 WeakPolarHBondContact CB-OH 3.42Å; F349-Y499 PolarHBondContact N-OH 2.77Å; F349-L507 HydrophobicContact CD2-CB 4.5Å; F349-L507 HydrophobicContact CD2-CD2 3.77Å; F349-L507 HydrophobicContact CE2-CB 4.16Å; F349-L507 HydrophobicContact CE2-CD2 3.81Å; F349-M510 HydrophobicContact CE1-CG 4.37Å; F349-M510 HydrophobicContact CZ-CB 4.05Å; F349-M510 HydrophobicContact CZ-CG 3.87Å; F349-Q511 HydrophobicContact CE2-CB 4.25Å; F349-Q511 HydrophobicContact CZ-CB 4.32Å
350L94.3Very high90.9Very high94 Ų9438.3 Ų38.349%0.49220%0.199SC..Hα-helixtrans-58.8-43.8-178.3-68.6175.1000112.8G346 A353 L354G346-L350 PolarHBondContact O-N 3.4Å; L350-A353 PolarHBondContact O-N 3.48Å; L350-L354 WeakPolarHBondContact O-CB 3.46Å; L350-L354 PolarHBondContact O-N 3.26Å
351L94.8Very high91.8Very high34 Ų3435.2 Ų35.218%0.17819%0.186CC..Hα-helixtrans-68.8-35.3177.2-71.5172.1000112.3P347 F349 T355 L553 L554 Y557P347-L351 VanDerWaalsContact O-CB 3.3Å; P347-L351 WeakPolarHBondContact O-CB 3.33Å; P347-L351 VanDerWaalsContact O-CG 3.25Å; P347-L351 WeakPolarHBondContact O-CG 2.88Å; P347-L351 PolarHBondContact O-N 2.99Å; F349-L351 PolarHBondContact O-N 2.9Å; L351-T355 WeakPolarHBondContact O-CB 3.17Å; L351-T355 PolarHBondContact O-N 3.34Å; L351-T355 PolarHBondContact O-OG1 2.95Å; L351-L553 HydrophobicContact CD2-CB 3.83Å; L351-L554 HydrophobicContact CB-CB 3.97Å; L351-L554 HydrophobicContact CB-CD1 3.74Å; L351-L554 HydrophobicContact CB-CG 4.47Å; L351-Y557 VanDerWaalsContact CD1-CB 3.47Å; L351-Y557 HydrophobicContact CD1-CD1 4.16Å; L351-Y557 HydrophobicContact CD1-CD2 4.2Å; L351-Y557 HydrophobicContact CD1-CG 3.67Å
352S94.7Very high92.5Very high0 Ų029.9 Ų29.90%016%0.157CC..Hα-helixtrans-69.5-39.5174.2710000112.6I348 F349 T355 M356 Y495I348-S352 VanDerWaalsContact O-CB 3.3Å; I348-S352 WeakPolarHBondContact O-CB 3.34Å; I348-S352 PolarHBondContact O-N 2.88Å; I348-S352 PolarHBondContact O-OG 3.08Å; I348-S352 VanDerWaalsContact O-OG 3.14Å; F349-S352 WeakPolarHBondContact CA-OG 3.03Å; F349-S352 CarbonylContact O-C 3.36Å; F349-S352 PolarHBondContact O-N 3.03Å; F349-S352 VanDerWaalsContact O-N 3.12Å; F349-S352 PolarHBondContact O-OG 3.45Å; S352-T355 PolarHBondContact O-N 3.39Å; S352-M356 WeakPolarHBondContact O-CB 3.41Å; S352-M356 PolarHBondContact O-N 3.22Å; S352-Y495 PolarHBondContact OG-OH 3.32Å; S352-Y495 VanDerWaalsContact OG-OH 3.08Å
353A94.6Very high93Very high9 Ų923.8 Ų23.87%0.07413%0.131CC..Hα-helixtrans-64.3-44.2173.700000111F349 L350 T355 M356 C357 Q511F349-A353 HydrophobicContact CE1-CB 4.35Å; F349-A353 WeakPolarHBondContact O-CB 3.07Å; F349-A353 PolarHBondContact O-N 3.25Å; L350-A353 PolarHBondContact O-N 3.48Å; A353-T355 PolarHBondContact O-N 3.32Å; A353-M356 PolarHBondContact O-N 3.08Å; A353-C357 WeakPolarHBondContact O-CB 3.46Å; A353-C357 PolarHBondContact O-N 2.85Å; A353-C357 PolarHBondContact O-SG 2.96Å; A353-Q511 HydrophobicContact CB-CG 4.2Å
354L95.4Very high93.4Very high63 Ų6323.7 Ų23.733%0.3313%0.13SC..Hα-helixtrans-57.6-49174.1-179.565.7000111.6L350 M356 C357 I358 L553L350-L354 WeakPolarHBondContact O-CB 3.46Å; L350-L354 PolarHBondContact O-N 3.26Å; L354-M356 VanDerWaalsContact C-N 3.31Å; L354-M356 PolarHBondContact O-N 3.17Å; L354-C357 PolarHBondContact O-N 3.18Å; L354-I358 HydrophobicContact CD1-CD1 3.83Å; L354-I358 HydrophobicContact CD1-CG1 4.36Å; L354-I358 HydrophobicContact CG-CD1 3.87Å; L354-I358 VanDerWaalsContact O-CG1 3.3Å; L354-I358 WeakPolarHBondContact O-CG1 3.2Å; L354-I358 PolarHBondContact O-N 3.15Å; L354-L553 HydrophobicContact CD2-CD1 4.42Å
355T95Very high93.8Very high1 Ų122.7 Ų22.71%0.00613%0.125CC..Hα-helixtrans-60.4-42.9178.5-550000111.1L351 S352 A353 T359 F451 I487L351-T355 WeakPolarHBondContact O-CB 3.17Å; L351-T355 PolarHBondContact O-N 3.34Å; L351-T355 PolarHBondContact O-OG1 2.95Å; S352-T355 PolarHBondContact O-N 3.39Å; A353-T355 PolarHBondContact O-N 3.32Å; T355-T359 VanDerWaalsContact O-CB 3.31Å; T355-T359 WeakPolarHBondContact O-CB 3.38Å; T355-T359 PolarHBondContact O-N 2.96Å; T355-T359 PolarHBondContact O-OG1 3.45Å; T355-F451 HydrophobicContact CG2-CD1 4.43Å; T355-F451 HydrophobicContact CG2-CE1 4.48Å; T355-I487 HydrophobicContact CG2-CD1 4.16Å
356M94.3Very high94Very high1 Ų116.4 Ų16.41%0.0059%0.094CC..Hα-helixtrans-62.7-49.1176-175.369.8-166.200111.7S352 A353 L354 I358 T359 Q360 I487 H488 Q511S352-M356 WeakPolarHBondContact O-CB 3.41Å; S352-M356 PolarHBondContact O-N 3.22Å; A353-M356 PolarHBondContact O-N 3.08Å; L354-M356 VanDerWaalsContact C-N 3.31Å; L354-M356 PolarHBondContact O-N 3.17Å; M356-I358 VanDerWaalsContact C-N 3.35Å; M356-I358 PolarHBondContact O-N 3.04Å; M356-T359 PolarHBondContact O-N 2.9Å; M356-Q360 HydrophobicContact CE-CB 4.27Å; M356-Q360 HydrophobicContact CE-CG 4.43Å; M356-Q360 WeakPolarHBondContact O-CB 3.47Å; M356-Q360 PolarHBondContact O-N 3.19Å; M356-I487 HydrophobicContact SD-CG1 3.7Å; M356-I487 HydrophobicContact SD-CG2 4.33Å; M356-H488 WeakPolarHBondContact CE-CE1 3.13Å; M356-Q511 HydrophobicContact CB-CG 4.1Å; M356-Q511 HydrophobicContact CG-CG 4.16Å; M356-Q511 VanDerWaalsContact CG-NE2 3.31Å
357C95.8Very high94.1Very high11 Ų1115.9 Ų15.97%0.0749%0.087CC..Hα-helixtrans-55.6-48.8179.8-72.60000111.7A353 L354 L361 S515 F518A353-C357 WeakPolarHBondContact O-CB 3.46Å; A353-C357 PolarHBondContact O-N 2.85Å; A353-C357 PolarHBondContact O-SG 2.96Å; L354-C357 PolarHBondContact O-N 3.18Å; C357-L361 VanDerWaalsContact O-CB 3.28Å; C357-L361 WeakPolarHBondContact O-CB 3.13Å; C357-L361 PolarHBondContact O-N 2.81Å; C357-S515 VanDerWaalsContact SG-CA 3.54Å; C357-F518 HydrophobicContact CB-CB 3.88Å; C357-F518 HydrophobicContact CB-CD1 3.61Å; C357-F518 HydrophobicContact CB-CD2 4.49Å; C357-F518 HydrophobicContact CB-CE1 4.23Å; C357-F518 HydrophobicContact CB-CG 3.74Å; C357-F518 WeakPolarHBondContact O-CD1 3.37Å
358I95.1Very high94.1Very high2 Ų213.2 Ų13.21%0.017%0.071CC..Hα-helixtrans-65.9-47-178.7-64.8168.6000110.9L354 M356 R362 L547 L550L354-I358 HydrophobicContact CD1-CD1 3.83Å; L354-I358 HydrophobicContact CD1-CG1 4.36Å; L354-I358 HydrophobicContact CG-CD1 3.87Å; L354-I358 VanDerWaalsContact O-CG1 3.3Å; L354-I358 WeakPolarHBondContact O-CG1 3.2Å; L354-I358 PolarHBondContact O-N 3.15Å; M356-I358 VanDerWaalsContact C-N 3.35Å; M356-I358 PolarHBondContact O-N 3.04Å; I358-R362 PolarHBondContact O-N 2.8Å; I358-R362 VanDerWaalsContact O-N 3.12Å; I358-L547 HydrophobicContact CB-CD2 4.49Å; I358-L547 HydrophobicContact CB-CG 4.41Å; I358-L547 HydrophobicContact CD1-CD1 4.24Å; I358-L547 HydrophobicContact CD1-CG 3.99Å; I358-L547 HydrophobicContact CG1-CD1 4.39Å; I358-L547 HydrophobicContact CG1-CD2 4.02Å; I358-L547 HydrophobicContact CG1-CG 3.84Å; I358-L547 HydrophobicContact CG2-CB 4.28Å; I358-L547 HydrophobicContact CG2-CD2 4.05Å; I358-L547 HydrophobicContact CG2-CG 3.79Å; I358-L550 HydrophobicContact CD1-CB 3.86Å; I358-L550 HydrophobicContact CD1-CD1 4.25Å
359T95.2Very high94Very high1 Ų112.7 Ų12.71%0.0067%0.068CC..Hα-helixtrans-62.3-48.2179.4-550000110.6T355 M356 R362 L363 L458 V483 I487T355-T359 VanDerWaalsContact O-CB 3.31Å; T355-T359 WeakPolarHBondContact O-CB 3.38Å; T355-T359 PolarHBondContact O-N 2.96Å; T355-T359 PolarHBondContact O-OG1 3.45Å; M356-T359 PolarHBondContact O-N 2.9Å; T359-R362 PolarHBondContact O-N 3.27Å; T359-L363 HydrophobicContact CG2-CD1 3.93Å; T359-L363 HydrophobicContact CG2-CG 4.37Å; T359-L363 VanDerWaalsContact O-CG 3.28Å; T359-L363 WeakPolarHBondContact O-CG 3.47Å; T359-L363 PolarHBondContact O-N 2.93Å; T359-L458 HydrophobicContact CG2-CD1 4.25Å; T359-L458 HydrophobicContact CG2-CD2 4.19Å; T359-L458 WeakPolarHBondContact OG1-CD2 3.26Å; T359-V483 HydrophobicContact CG2-CG1 3.81Å; T359-I487 HydrophobicContact CG2-CB 4.18Å; T359-I487 HydrophobicContact CG2-CG1 4.08Å; T359-I487 HydrophobicContact CG2-CG2 4.17Å
360Q93.9Very high93.8Very high8 Ų812.5 Ų12.54%0.0377%0.068CC..Hα-helixtrans-63.6-44.4-178.4-168.967.412.400111.9M356 R362 L363 L364M356-Q360 HydrophobicContact CE-CB 4.27Å; M356-Q360 HydrophobicContact CE-CG 4.43Å; M356-Q360 WeakPolarHBondContact O-CB 3.47Å; M356-Q360 PolarHBondContact O-N 3.19Å; Q360-R362 VanDerWaalsContact C-N 3.31Å; Q360-R362 PolarHBondContact O-N 3.48Å; Q360-L363 PolarHBondContact O-N 3.41Å; Q360-L364 HydrophobicContact CG-CD1 3.83Å; Q360-L364 HydrophobicContact CG-CG 4.34Å; Q360-L364 WeakPolarHBondContact O-CB 3.46Å; Q360-L364 WeakPolarHBondContact O-CG 3.49Å; Q360-L364 PolarHBondContact O-N 3.3Å
361L95.1Very high93.6Very high4 Ų48.5 Ų8.52%0.0215%0.047CC..Hα-helixtrans-56.6-46.9175.3173.963.1000110.9C357 F365 F518 L521 Q522 L544C357-L361 VanDerWaalsContact O-CB 3.28Å; C357-L361 WeakPolarHBondContact O-CB 3.13Å; C357-L361 PolarHBondContact O-N 2.81Å; L361-F365 WeakPolarHBondContact O-CB 3.39Å; L361-F365 PolarHBondContact O-N 2.95Å; L361-F518 HydrophobicContact CB-CD1 4.04Å; L361-F518 HydrophobicContact CB-CE1 4.18Å; L361-F518 HydrophobicContact CD2-CD1 3.98Å; L361-F518 HydrophobicContact CD2-CE1 3.51Å; L361-F518 HydrophobicContact CD2-CZ 4.33Å; L361-F518 HydrophobicContact CG-CE1 4.47Å; L361-L521 HydrophobicContact CD1-CB 3.96Å; L361-L521 HydrophobicContact CD2-CB 4.21Å; L361-L521 HydrophobicContact CD2-CD1 4.48Å; L361-Q522 HydrophobicContact CD1-CB 3.94Å; L361-L544 HydrophobicContact CD2-CD2 4.21Å; L361-L544 HydrophobicContact CG-CD2 4.34Å
362R95.4Very high93.2Very high3 Ų37.2 Ų7.21%0.0114%0.04CC..Hα-helixtrans-63.3-46.2-179.4-167.5-172.1-168.213822.9112.4I358 T359 Q360 Y366 L458 F461 L544 S548I358-R362 PolarHBondContact O-N 2.8Å; I358-R362 VanDerWaalsContact O-N 3.12Å; T359-R362 PolarHBondContact O-N 3.27Å; Q360-R362 VanDerWaalsContact C-N 3.31Å; Q360-R362 PolarHBondContact O-N 3.48Å; R362-Y366 WeakPolarHBondContact O-CB 3.26Å; R362-Y366 PolarHBondContact O-N 2.85Å; R362-L458 PolarHBondContact NH1-O 3.46Å; R362-F461 HydrophobicContact CG-CE1 4.07Å; R362-L544 HydrophobicContact CG-CB 4.32Å; R362-L544 HydrophobicContact CG-CD1 4.35Å; R362-S548 PolarHBondContact NH1-OG 3.05Å
363L94.4Very high92.9Very high0 Ų07.9 Ų7.90%04%0.044CC..Hα-helixtrans-64.6-44.8-179.7-65.3173.3000111.2T359 Q360 Y366 M367 F461 H480 V483 R484T359-L363 HydrophobicContact CG2-CD1 3.93Å; T359-L363 HydrophobicContact CG2-CG 4.37Å; T359-L363 VanDerWaalsContact O-CG 3.28Å; T359-L363 WeakPolarHBondContact O-CG 3.47Å; T359-L363 PolarHBondContact O-N 2.93Å; Q360-L363 PolarHBondContact O-N 3.41Å; L363-Y366 PolarHBondContact O-N 3.26Å; L363-M367 HydrophobicContact CB-CE 4.12Å; L363-M367 VanDerWaalsContact O-CE 3.31Å; L363-M367 WeakPolarHBondContact O-CE 3.42Å; L363-M367 WeakPolarHBondContact O-CG 2.87Å; L363-M367 PolarHBondContact O-N 3.22Å; L363-F461 HydrophobicContact CD2-CE1 4.46Å; L363-H480 WeakPolarHBondContact CD2-CD2 3.21Å; L363-H480 PolarHBondContact O-NE2 3.34Å; L363-V483 HydrophobicContact CD2-CG1 4.39Å; L363-R484 HydrophobicContact CD1-CB 3.86Å; L363-R484 HydrophobicContact CD1-CG 4.23Å
364L93.4Very high92.7Very high2 Ų27.5 Ų7.51%0.014%0.041CC..Hα-helixtrans-68.8-43.1179.8-70.2174.5000112.3L31 F120 Q360 Y366 M367 G368 A519 Q522L31-L364 HydrophobicContact CD2-CD2 3.5Å; F120-L364 HydrophobicContact CZ-CD2 4.2Å; Q360-L364 HydrophobicContact CG-CD1 3.83Å; Q360-L364 HydrophobicContact CG-CG 4.34Å; Q360-L364 WeakPolarHBondContact O-CB 3.46Å; Q360-L364 WeakPolarHBondContact O-CG 3.49Å; Q360-L364 PolarHBondContact O-N 3.3Å; L364-Y366 VanDerWaalsContact C-N 3.32Å; L364-Y366 PolarHBondContact O-N 3.46Å; L364-M367 HydrophobicContact CD2-CE 4.11Å; L364-M367 PolarHBondContact O-N 3.4Å; L364-G368 PolarHBondContact O-N 2.74Å; L364-A519 HydrophobicContact CD1-CB 3.63Å; L364-Q522 VanDerWaalsContact CB-OE1 3.26Å; L364-Q522 PolarHBondContact O-OE1 3.18Å
365F94.3Very high92.3Very high7 Ų76.7 Ų6.73%0.0314%0.035CC..Hα-helixtrans-56.8-46.5173.5170.7-100.4000111.3L361 M367 G368 A369 Q522 L525 F526 M529 V540 L544L361-F365 WeakPolarHBondContact O-CB 3.39Å; L361-F365 PolarHBondContact O-N 2.95Å; F365-M367 PolarHBondContact O-N 3.08Å; F365-G368 PolarHBondContact O-N 3.26Å; F365-A369 HydrophobicContact CE1-CB 4.36Å; F365-A369 HydrophobicContact CE2-CB 4.2Å; F365-A369 HydrophobicContact CZ-CB 4.06Å; F365-A369 VanDerWaalsContact O-CB 3.27Å; F365-A369 WeakPolarHBondContact O-CB 3.19Å; F365-A369 PolarHBondContact O-N 2.78Å; F365-Q522 HydrophobicContact CB-CB 4.41Å; F365-L525 HydrophobicContact CD2-CB 3.84Å; F365-L525 HydrophobicContact CE2-CB 3.89Å; F365-F526 HydrophobicContact CE2-CB 4.47Å; F365-M529 HydrophobicContact CZ-SD 3.89Å; F365-V540 HydrophobicContact CE1-CG1 3.8Å; F365-V540 HydrophobicContact CE2-CG1 4.12Å; F365-V540 HydrophobicContact CZ-CB 4.29Å; F365-V540 HydrophobicContact CZ-CG1 3.53Å; F365-L544 HydrophobicContact CB-CD1 4.48Å; F365-L544 HydrophobicContact CD1-CD1 3.45Å; F365-L544 VanDerWaalsContact CD1-CD1 3.45Å; F365-L544 HydrophobicContact CE1-CD1 3.9Å; F365-L544 HydrophobicContact CG-CD1 4.08Å
366Y93.3Very high91.8Very high12 Ų1210.4 Ų10.45%0.0476%0.058CC..Hα-helixtrans-59.9-45.7177.1-173.8-100000111.6R362 L363 L364 G368 A369 M370 F392 F461 C465 Q473 F477 H480R362-Y366 WeakPolarHBondContact O-CB 3.26Å; R362-Y366 PolarHBondContact O-N 2.85Å; L363-Y366 PolarHBondContact O-N 3.26Å; L364-Y366 VanDerWaalsContact C-N 3.32Å; L364-Y366 PolarHBondContact O-N 3.46Å; Y366-G368 VanDerWaalsContact C-N 3.33Å; Y366-G368 PolarHBondContact O-N 3.22Å; Y366-A369 PolarHBondContact O-N 2.81Å; Y366-M370 HydrophobicContact CE1-CG 4.39Å; Y366-M370 HydrophobicContact CE1-SD 4.39Å; Y366-M370 WeakPolarHBondContact O-CA 3.39Å; Y366-M370 WeakPolarHBondContact O-CB 3.47Å; Y366-M370 PolarHBondContact O-N 3.12Å; Y366-F392 HydrophobicContact CD1-CE2 4.45Å; Y366-F392 HydrophobicContact CE1-CE2 4.09Å; Y366-F461 HydrophobicContact CD1-CE2 4.32Å; Y366-F461 HydrophobicContact CD1-CZ 4Å; Y366-F461 HydrophobicContact CD2-CE2 4.25Å; Y366-F461 AromaticContact CD2-CZ 3.81Å; Y366-F461 HydrophobicContact CD2-CZ 3.81Å; Y366-F461 HydrophobicContact CE1-CE2 4.28Å; Y366-F461 HydrophobicContact CE1-CZ 4.41Å; Y366-F461 HydrophobicContact CE2-CE2 4.21Å; Y366-F461 HydrophobicContact CE2-CZ 4.23Å; Y366-F461 HydrophobicContact CG-CE2 4.29Å; Y366-F461 AromaticContact CG-CZ 3.66Å; Y366-F461 HydrophobicContact CG-CZ 3.66Å; Y366-C465 VanDerWaalsContact CE2-SG 3.57Å; Y366-Q473 PolarHBondContact OH-OE1 3.42Å; Y366-F477 HydrophobicContact CE1-CD1 4.13Å; Y366-F477 HydrophobicContact CE1-CE1 4.27Å; Y366-F477 VanDerWaalsContact OH-CD1 3.3Å; Y366-F477 WeakPolarHBondContact OH-CD1 3.39Å; Y366-F477 WeakPolarHBondContact OH-CE1 3.38Å; Y366-H480 AromaticContact CD1-CD2 3.82Å
367M91Very high91.4Very high3 Ų312.5 Ų12.52%0.0157%0.069CC..Hα-helixtrans-61.5-37.3177.2-75.8-177.3-92.600113.4L31 F120 L363 L364 F365 F392L31-M367 HydrophobicContact CB-SD 3.9Å; L31-M367 HydrophobicContact CD2-CE 4.2Å; L31-M367 HydrophobicContact CD2-SD 4.28Å; F120-M367 HydrophobicContact CZ-CB 4.31Å; L363-M367 HydrophobicContact CB-CE 4.12Å; L363-M367 VanDerWaalsContact O-CE 3.31Å; L363-M367 WeakPolarHBondContact O-CE 3.42Å; L363-M367 WeakPolarHBondContact O-CG 2.87Å; L363-M367 PolarHBondContact O-N 3.22Å; L364-M367 HydrophobicContact CD2-CE 4.11Å; L364-M367 PolarHBondContact O-N 3.4Å; F365-M367 PolarHBondContact O-N 3.08Å; M367-F392 HydrophobicContact CG-CE1 4.08Å; M367-F392 HydrophobicContact CG-CZ 3.86Å
368G89.9Confident90.9Very high5 Ų512.8 Ų12.85%0.0527%0.071CC..Hα-helixtrans-71.1-41.7175.800000113.2N117 L364 F365 Y366N117-G368 PolarHBondContact OD1-O 3.14Å; L364-G368 PolarHBondContact O-N 2.74Å; F365-G368 PolarHBondContact O-N 3.26Å; Y366-G368 VanDerWaalsContact C-N 3.33Å; Y366-G368 PolarHBondContact O-N 3.22Å
369A90.3Very high90.2Very high1 Ų120.3 Ų20.31%0.00811%0.111CC..Hα-helixtrans-88-13.9-175.200000114.5F365 Y366 N371 S372 V373 F526 M529F365-A369 HydrophobicContact CE1-CB 4.36Å; F365-A369 HydrophobicContact CE2-CB 4.2Å; F365-A369 HydrophobicContact CZ-CB 4.06Å; F365-A369 VanDerWaalsContact O-CB 3.27Å; F365-A369 WeakPolarHBondContact O-CB 3.19Å; F365-A369 PolarHBondContact O-N 2.78Å; Y366-A369 PolarHBondContact O-N 2.81Å; A369-N371 VanDerWaalsContact C-N 3.34Å; A369-N371 PolarHBondContact O-N 2.97Å; A369-S372 PolarHBondContact O-N 3.49Å; A369-S372 VanDerWaalsContact O-N 3.09Å; A369-V373 HydrophobicContact CB-CG2 4.29Å; A369-V373 WeakPolarHBondContact O-CG2 3.45Å; A369-V373 PolarHBondContact O-N 3.18Å; A369-F526 HydrophobicContact CB-CD2 4.11Å; A369-F526 HydrophobicContact CB-CE2 4.31Å; A369-M529 HydrophobicContact CB-CE 3.78Å; A369-M529 HydrophobicContact CB-SD 3.93Å
370M89.5Confident89.2Confident2 Ų221.6 Ų21.61%0.0113%0.125CC..Hα-helixtrans-54.1-45.4-167.5-177.8-175.567.100113.3Y366 V373 L374 S389 F392 F477Y366-M370 HydrophobicContact CE1-CG 4.39Å; Y366-M370 HydrophobicContact CE1-SD 4.39Å; Y366-M370 WeakPolarHBondContact O-CA 3.39Å; Y366-M370 WeakPolarHBondContact O-CB 3.47Å; Y366-M370 PolarHBondContact O-N 3.12Å; M370-V373 PolarHBondContact O-N 2.97Å; M370-L374 HydrophobicContact CG-CD1 3.8Å; M370-L374 HydrophobicContact CG-CG 4.26Å; M370-L374 WeakPolarHBondContact O-CB 3.47Å; M370-L374 VanDerWaalsContact O-CG 3.29Å; M370-L374 WeakPolarHBondContact O-CG 3.16Å; M370-L374 PolarHBondContact O-N 2.96Å; M370-L374 HydrophobicContact SD-CD1 4.39Å; M370-S389 WeakPolarHBondContact CE-OG 3.25Å; M370-F392 HydrophobicContact CE-CB 4.17Å; M370-F392 HydrophobicContact CE-CD1 3.52Å; M370-F392 HydrophobicContact CE-CE1 4.14Å; M370-F392 HydrophobicContact CE-CG 4.04Å; M370-F392 HydrophobicContact SD-CB 3.71Å; M370-F392 HydrophobicContact SD-CD1 3.38Å; M370-F392 WeakPolarHBondContact SD-CD1 3.3Å; M370-F392 HydrophobicContact SD-CD2 3.98Å; M370-F392 HydrophobicContact SD-CE1 3.88Å; M370-F392 HydrophobicContact SD-CE2 4.43Å; M370-F392 HydrophobicContact SD-CG 3.4Å; M370-F392 WeakPolarHBondContact SD-CG 3.44Å; M370-F392 HydrophobicContact SD-CZ 4.38Å; M370-F477 HydrophobicContact CG-CE1 4.46Å; M370-F477 HydrophobicContact SD-CE1 3.94Å; M370-F477 HydrophobicContact SD-CZ 4.36Å
371N89.6Confident88.9Confident10 Ų1024.8 Ų24.85%0.05314%0.142CC..Hα-helixtrans-64.6-42.8-178.3-72.7-7.5000111.3G34 L37 A369 L374 E375 V385 S389G34-N371 PolarHBondContact O-ND2 3.23Å; L37-N371 HydrophobicContact CD2-CB 4.26Å; A369-N371 VanDerWaalsContact C-N 3.34Å; A369-N371 PolarHBondContact O-N 2.97Å; N371-L374 PolarHBondContact O-N 2.61Å; N371-E375 WeakPolarHBondContact O-CB 3.3Å; N371-E375 PolarHBondContact O-N 3.45Å; N371-V385 HydrophobicContact CB-CG1 4.45Å; N371-S389 PolarHBondContact OD1-OG 3.16Å
372S87.6Confident88.4Confident6 Ų627.3 Ų27.34%0.04216%0.155CC..Hα-helixtrans-65.1-39.3176.1-49.60000111.7A369 E375 V376A369-S372 PolarHBondContact O-N 3.49Å; A369-S372 VanDerWaalsContact O-N 3.09Å; S372-E375 PolarHBondContact O-N 3.29Å; S372-V376 WeakPolarHBondContact O-CG2 3.33Å; S372-V376 PolarHBondContact O-N 3.08Å; S372-V376 VanDerWaalsContact O-N 3.17Å
373V88.7Confident87.9Confident14 Ų1431.7 Ų31.79%0.08518%0.179CC..Hα-helixtrans-64.3-43.4174.8171.50000111.3A369 M370 E375 V376 L377 M529 P537A369-V373 HydrophobicContact CB-CG2 4.29Å; A369-V373 WeakPolarHBondContact O-CG2 3.45Å; A369-V373 PolarHBondContact O-N 3.18Å; M370-V373 PolarHBondContact O-N 2.97Å; V373-E375 VanDerWaalsContact C-N 3.34Å; V373-V376 PolarHBondContact O-N 3.26Å; V373-L377 HydrophobicContact CG1-CD1 3.99Å; V373-L377 VanDerWaalsContact O-CG 3.3Å; V373-L377 WeakPolarHBondContact O-CG 3.3Å; V373-L377 PolarHBondContact O-N 3.23Å; V373-L377 VanDerWaalsContact O-N 3.12Å; V373-M529 HydrophobicContact CG2-SD 4.23Å; V373-P537 HydrophobicContact CG1-CG 4.1Å; V373-P537 HydrophobicContact CG2-CB 3.76Å; V373-P537 HydrophobicContact CG2-CG 3.89Å
374L89.1Confident87.6Confident2 Ų233.5 Ų33.51%0.0119%0.19CC..Hα-helixtrans-67-36.1177-73.5171.4000111.8M370 N371 L377 C378 V385 Y388 L470 F477M370-L374 HydrophobicContact CG-CD1 3.8Å; M370-L374 HydrophobicContact CG-CG 4.26Å; M370-L374 WeakPolarHBondContact O-CB 3.47Å; M370-L374 VanDerWaalsContact O-CG 3.29Å; M370-L374 WeakPolarHBondContact O-CG 3.16Å; M370-L374 PolarHBondContact O-N 2.96Å; M370-L374 HydrophobicContact SD-CD1 4.39Å; N371-L374 PolarHBondContact O-N 2.61Å; L374-L377 PolarHBondContact O-N 3.22Å; L374-C378 WeakPolarHBondContact O-CB 3.47Å; L374-C378 PolarHBondContact O-N 3.32Å; L374-C378 PolarHBondContact O-SG 2.96Å; L374-V385 HydrophobicContact CB-CB 4.48Å; L374-V385 HydrophobicContact CB-CG1 4.11Å; L374-V385 HydrophobicContact CB-CG2 4.09Å; L374-Y388 HydrophobicContact CD2-CD1 4.36Å; L374-Y388 HydrophobicContact CD2-CG 4.43Å; L374-L470 HydrophobicContact CD2-CD1 4.3Å; L374-F477 HydrophobicContact CD1-CZ 4.44Å; L374-F477 HydrophobicContact CD2-CZ 4.41Å
375E86.5Confident87.4Confident45 Ų4533.8 Ų33.821%0.2119%0.192CC..Hα-helixtrans-60.8-44.7177-173.8176.6177.200111.4N371 S372 V373 L377 C378 D379 G380 V385N371-E375 WeakPolarHBondContact O-CB 3.3Å; N371-E375 PolarHBondContact O-N 3.45Å; S372-E375 PolarHBondContact O-N 3.29Å; V373-E375 VanDerWaalsContact C-N 3.34Å; E375-L377 VanDerWaalsContact C-N 3.35Å; E375-L377 PolarHBondContact O-N 3.21Å; E375-C378 PolarHBondContact O-N 2.92Å; E375-D379 PolarHBondContact O-N 3.12Å; E375-G380 PolarHBondContact O-N 3.15Å; E375-V385 HydrophobicContact CB-CG2 4.25Å
376V84.9Confident87.2Confident80 Ų8034.8 Ų34.849%0.48520%0.2SC..Hα-helixtrans-64.2-38.3173.8175.10000111.7S372 V373 C378S372-V376 WeakPolarHBondContact O-CG2 3.33Å; S372-V376 PolarHBondContact O-N 3.08Å; S372-V376 VanDerWaalsContact O-N 3.17Å; V373-V376 PolarHBondContact O-N 3.26Å; V376-C378 VanDerWaalsContact C-N 3.35Å
377L85.7Confident87Confident45 Ų4539.1 Ų39.124%0.23622%0.223CC..Hα-helixtrans-75.3-20.1179.7-71.1170.9000114.3V373 L374 E375 P468 Q473V373-L377 HydrophobicContact CG1-CD1 3.99Å; V373-L377 VanDerWaalsContact O-CG 3.3Å; V373-L377 WeakPolarHBondContact O-CG 3.3Å; V373-L377 PolarHBondContact O-N 3.23Å; V373-L377 VanDerWaalsContact O-N 3.12Å; L374-L377 PolarHBondContact O-N 3.22Å; E375-L377 VanDerWaalsContact C-N 3.35Å; E375-L377 PolarHBondContact O-N 3.21Å; L377-P468 HydrophobicContact CD2-CB 3.69Å; L377-Q473 HydrophobicContact CD1-CG 4Å
378C85.8Confident87Confident16 Ų1640.2 Ų40.211%0.10823%0.227CC..THydrogen-bonded Turntrans-104.814.7-177.5-60.10000112.7L374 E375 V376 G380 N381 V385L374-C378 WeakPolarHBondContact O-CB 3.47Å; L374-C378 PolarHBondContact O-N 3.32Å; L374-C378 PolarHBondContact O-SG 2.96Å; E375-C378 PolarHBondContact O-N 2.92Å; V376-C378 VanDerWaalsContact C-N 3.35Å; C378-G380 PolarHBondContact O-N 3.42Å; C378-G380 VanDerWaalsContact O-N 3.15Å; C378-N381 HydrophobicContact CB-CB 4.27Å; C378-N381 VanDerWaalsContact O-CB 3.31Å; C378-N381 WeakPolarHBondContact O-CB 3.33Å; C378-N381 PolarHBondContact O-N 3.35Å; C378-V385 HydrophobicContact CB-CG2 4.22Å
379D80.5Confident87Confident161 Ų16140 Ų4086%0.86123%0.225SC*.THydrogen-bonded Turntrans49.937.4-175.7-61.1-41.8000112.8E375E375-D379 PolarHBondContact O-N 3.12Å
380G75.4Confident87Confident28 Ų2841 Ų4129%0.28923%0.232SC..THydrogen-bonded Turntrans81.47.1-179.700000116E375 C378 L382E375-G380 PolarHBondContact O-N 3.15Å; C378-G380 PolarHBondContact O-N 3.42Å; C378-G380 VanDerWaalsContact O-N 3.15Å; G380-L382 PolarHBondContact O-N 3.22Å
381N85.8Confident87.1Confident75 Ų7543.4 Ų43.440%0.40124%0.244SC..  trans-72.699176.5-173.2-38.5000112.1C378 D383 T384 V385C378-N381 HydrophobicContact CB-CB 4.27Å; C378-N381 VanDerWaalsContact O-CB 3.31Å; C378-N381 WeakPolarHBondContact O-CB 3.33Å; C378-N381 PolarHBondContact O-N 3.35Å; N381-D383 VanDerWaalsContact C-N 3.33Å; N381-D383 PolarHBondContact O-N 3.4Å; N381-D383 PolarHBondContact OD1-N 3.22Å; N381-D383 VanDerWaalsContact OD1-N 3.14Å; N381-T384 PolarHBondContact O-N 3.45Å; N381-T384 PolarHBondContact OD1-N 3.13Å; N381-T384 VanDerWaalsContact OD1-N 3.15Å; N381-T384 PolarHBondContact OD1-OG1 2.75Å; N381-V385 WeakPolarHBondContact O-CG2 3.21Å; N381-V385 PolarHBondContact O-N 3.41Å
382L84.8Confident87.2Confident56 Ų5643.1 Ų43.129%0.29324%0.243SC..Hα-helixtrans-62.7-32-177.1-63.5176.2000114I108 G380 V385 S386I108-L382 HydrophobicContact CD1-CD1 4.32Å; I108-L382 HydrophobicContact CD1-CD2 4.3Å; G380-L382 PolarHBondContact O-N 3.22Å; L382-V385 PolarHBondContact O-N 3.41Å; L382-S386 VanDerWaalsContact O-CB 3.26Å; L382-S386 WeakPolarHBondContact O-CB 3.25Å; L382-S386 PolarHBondContact O-N 3.36Å
383D85.5Confident87.3Confident95 Ų9543 Ų4351%0.50824%0.242SC..Hα-helixtrans-67-41.6179.1-65.7-34.1000111.1N381 S386 L387N381-D383 VanDerWaalsContact C-N 3.33Å; N381-D383 PolarHBondContact O-N 3.4Å; N381-D383 PolarHBondContact OD1-N 3.22Å; N381-D383 VanDerWaalsContact OD1-N 3.14Å; D383-S386 WeakPolarHBondContact O-CB 3.38Å; D383-S386 PolarHBondContact O-N 2.76Å; D383-L387 WeakPolarHBondContact O-CB 3.22Å; D383-L387 PolarHBondContact O-N 2.91Å
384T88.8Confident87.4Confident38 Ų3846.3 Ų46.323%0.23326%0.262CS..Hα-helixtrans-68.5-40.8178-53.20000110.6N381 S386 L387 Y388 L470N381-T384 PolarHBondContact O-N 3.45Å; N381-T384 PolarHBondContact OD1-N 3.13Å; N381-T384 VanDerWaalsContact OD1-N 3.15Å; N381-T384 PolarHBondContact OD1-OG1 2.75Å; T384-S386 VanDerWaalsContact C-N 3.32Å; T384-S386 PolarHBondContact O-N 3.28Å; T384-L387 PolarHBondContact O-N 2.88Å; T384-Y388 HydrophobicContact CG2-CD2 3.92Å; T384-Y388 HydrophobicContact CG2-CE2 4.01Å; T384-Y388 WeakPolarHBondContact O-CD2 3.27Å; T384-Y388 PolarHBondContact O-N 3.47Å; T384-L470 HydrophobicContact CG2-CD2 4.01Å
385V89.2Confident87.6Confident8 Ų847.7 Ų47.75%0.04827%0.269CS..Hα-helixtrans-59.2-45.3172.7175.70000110.7N371 L374 E375 C378 N381 L382 L387 Y388 S389N371-V385 HydrophobicContact CB-CG1 4.45Å; L374-V385 HydrophobicContact CB-CB 4.48Å; L374-V385 HydrophobicContact CB-CG1 4.11Å; L374-V385 HydrophobicContact CB-CG2 4.09Å; E375-V385 HydrophobicContact CB-CG2 4.25Å; C378-V385 HydrophobicContact CB-CG2 4.22Å; N381-V385 WeakPolarHBondContact O-CG2 3.21Å; N381-V385 PolarHBondContact O-N 3.41Å; L382-V385 PolarHBondContact O-N 3.41Å; V385-L387 PolarHBondContact O-N 3.29Å; V385-Y388 PolarHBondContact O-N 3.46Å; V385-S389 WeakPolarHBondContact O-CB 3.42Å; V385-S389 PolarHBondContact O-N 3.05Å
386S88.9Confident87.8Confident29 Ų2945.6 Ų45.620%0.20326%0.259CS..Hα-helixtrans-58.8-46.7178.1-175.80000111.8K226 L382 D383 T384 S390K226-S386 VanDerWaalsContact CE-OG 3.28Å; K226-S386 WeakPolarHBondContact CE-OG 3.48Å; K226-S386 PolarHBondContact NZ-O 2.93Å; K226-S386 VanDerWaalsContact NZ-O 3.09Å; K226-S386 PolarHBondContact NZ-OG 2.97Å; L382-S386 VanDerWaalsContact O-CB 3.26Å; L382-S386 WeakPolarHBondContact O-CB 3.25Å; L382-S386 PolarHBondContact O-N 3.36Å; D383-S386 WeakPolarHBondContact O-CB 3.38Å; D383-S386 PolarHBondContact O-N 2.76Å; T384-S386 VanDerWaalsContact C-N 3.32Å; T384-S386 PolarHBondContact O-N 3.28Å; S386-S390 PolarHBondContact O-N 3.32Å; S386-S390 PolarHBondContact O-OG 3.18Å; S386-S390 VanDerWaalsContact O-OG 3.07Å
387L89.9Confident88.2Confident102 Ų10245.3 Ų45.353%0.53426%0.255SS..Hα-helixtrans-61.8-50.6177.2-179.966.9000111.9D383 T384 V385 S389 S390 I391D383-L387 WeakPolarHBondContact O-CB 3.22Å; D383-L387 PolarHBondContact O-N 2.91Å; T384-L387 PolarHBondContact O-N 2.88Å; V385-L387 PolarHBondContact O-N 3.29Å; L387-S389 PolarHBondContact O-N 3.32Å; L387-S390 WeakPolarHBondContact O-CB 3.17Å; L387-S390 PolarHBondContact O-N 2.92Å; L387-I391 HydrophobicContact CD1-CD1 4.4Å; L387-I391 HydrophobicContact CG-CD1 4.02Å; L387-I391 WeakPolarHBondContact O-CG1 3.47Å; L387-I391 PolarHBondContact O-N 3.34Å
388Y91.4Very high88.4Confident27 Ų2746.3 Ų46.311%0.10626%0.26CS..Hα-helixtrans-66.4-36.3-178.8-88.9-104000112.6L374 T384 V385 S390 I391 F392 L470 I474 F477L374-Y388 HydrophobicContact CD2-CD1 4.36Å; L374-Y388 HydrophobicContact CD2-CG 4.43Å; T384-Y388 HydrophobicContact CG2-CD2 3.92Å; T384-Y388 HydrophobicContact CG2-CE2 4.01Å; T384-Y388 WeakPolarHBondContact O-CD2 3.27Å; T384-Y388 PolarHBondContact O-N 3.47Å; V385-Y388 PolarHBondContact O-N 3.46Å; Y388-S390 VanDerWaalsContact C-N 3.33Å; Y388-I391 PolarHBondContact O-N 3.23Å; Y388-F392 PolarHBondContact O-N 3.43Å; Y388-L470 HydrophobicContact CD1-CD1 4Å; Y388-L470 HydrophobicContact CD2-CD1 4.18Å; Y388-L470 HydrophobicContact CE1-CD1 3.77Å; Y388-L470 HydrophobicContact CE1-CG 3.85Å; Y388-L470 VanDerWaalsContact CE1-O 3.3Å; Y388-L470 WeakPolarHBondContact CE1-O 3.27Å; Y388-L470 HydrophobicContact CE2-CD1 3.96Å; Y388-L470 HydrophobicContact CE2-CD2 3.87Å; Y388-L470 HydrophobicContact CE2-CG 3.89Å; Y388-L470 HydrophobicContact CG-CD1 4.21Å; Y388-L470 VanDerWaalsContact CZ-CG 3.47Å; Y388-L470 WeakPolarHBondContact OH-CG 3.29Å; Y388-I474 HydrophobicContact CE1-CD1 4.33Å; Y388-I474 HydrophobicContact CE1-CG1 3.95Å; Y388-F477 AromaticContact CD1-CE2 3.83Å; Y388-F477 HydrophobicContact CD1-CE2 3.83Å; Y388-F477 HydrophobicContact CD1-CZ 4.12Å
389S90.1Very high88.7Confident1 Ų145.5 Ų45.51%0.00726%0.255CS..Hα-helixtrans-62.8-40.6173.5-166.80000111.6G34 M370 N371 V385 L387 G393G34-S389 PolarHBondContact O-OG 3.49Å; M370-S389 WeakPolarHBondContact CE-OG 3.25Å; N371-S389 PolarHBondContact OD1-OG 3.16Å; V385-S389 WeakPolarHBondContact O-CB 3.42Å; V385-S389 PolarHBondContact O-N 3.05Å; L387-S389 PolarHBondContact O-N 3.32Å; S389-G393 PolarHBondContact O-N 3.09Å; S389-G393 VanDerWaalsContact O-N 3.08Å
390S89.9Confident89.1Confident21 Ų2139.9 Ų39.915%0.14722%0.224CC..Hα-helixtrans-66.9-41.5173.6-62.90000112.1K226 S386 L387 Y388 G393 V394K226-S390 PolarHBondContact NZ-OG 3.33Å; S386-S390 PolarHBondContact O-N 3.32Å; S386-S390 PolarHBondContact O-OG 3.18Å; S386-S390 VanDerWaalsContact O-OG 3.07Å; L387-S390 WeakPolarHBondContact O-CB 3.17Å; L387-S390 PolarHBondContact O-N 2.92Å; Y388-S390 VanDerWaalsContact C-N 3.33Å; S390-G393 PolarHBondContact O-N 3.48Å; S390-V394 WeakPolarHBondContact O-CG2 3.31Å; S390-V394 PolarHBondContact O-N 3.03Å
391I91.9Very high89.7Confident52 Ų5244.4 Ų44.427%0.26724%0.239SC..Hα-helixtrans-60.1-49.5175.6-69.7166.7000110.8L387 Y388 G393 V394 L395 F477L387-I391 HydrophobicContact CD1-CD1 4.4Å; L387-I391 HydrophobicContact CG-CD1 4.02Å; L387-I391 WeakPolarHBondContact O-CG1 3.47Å; L387-I391 PolarHBondContact O-N 3.34Å; Y388-I391 PolarHBondContact O-N 3.23Å; I391-G393 PolarHBondContact O-N 3.33Å; I391-V394 PolarHBondContact O-N 3.28Å; I391-L395 HydrophobicContact CG2-CD1 3.8Å; I391-L395 HydrophobicContact CG2-CG 4.26Å; I391-L395 WeakPolarHBondContact O-CB 3.46Å; I391-L395 VanDerWaalsContact O-CG 3.3Å; I391-L395 WeakPolarHBondContact O-CG 3.22Å; I391-L395 PolarHBondContact O-N 3.48Å; I391-F477 HydrophobicContact CG2-CD2 4.35Å
392F91.7Very high89.9Confident5 Ų542 Ų422%0.02223%0.227CC..Hα-helixtrans-54.3-45.1175.5171-107.3000111.3Y366 M367 M370 Y388 L395 Q396 F477 H480Y366-F392 HydrophobicContact CD1-CE2 4.45Å; Y366-F392 HydrophobicContact CE1-CE2 4.09Å; M367-F392 HydrophobicContact CG-CE1 4.08Å; M367-F392 HydrophobicContact CG-CZ 3.86Å; M370-F392 HydrophobicContact CE-CB 4.17Å; M370-F392 HydrophobicContact CE-CD1 3.52Å; M370-F392 HydrophobicContact CE-CE1 4.14Å; M370-F392 HydrophobicContact CE-CG 4.04Å; M370-F392 HydrophobicContact SD-CB 3.71Å; M370-F392 HydrophobicContact SD-CD1 3.38Å; M370-F392 WeakPolarHBondContact SD-CD1 3.3Å; M370-F392 HydrophobicContact SD-CD2 3.98Å; M370-F392 HydrophobicContact SD-CE1 3.88Å; M370-F392 HydrophobicContact SD-CE2 4.43Å; M370-F392 HydrophobicContact SD-CG 3.4Å; M370-F392 WeakPolarHBondContact SD-CG 3.44Å; M370-F392 HydrophobicContact SD-CZ 4.38Å; Y388-F392 PolarHBondContact O-N 3.43Å; F392-L395 PolarHBondContact O-N 2.88Å; F392-Q396 VanDerWaalsContact O-CG 3.26Å; F392-Q396 WeakPolarHBondContact O-CG 3.37Å; F392-Q396 PolarHBondContact O-N 3.28Å; F392-F477 HydrophobicContact CB-CD1 4.12Å; F392-F477 HydrophobicContact CB-CD2 3.92Å; F392-F477 HydrophobicContact CB-CE1 4.16Å; F392-F477 HydrophobicContact CB-CE2 3.98Å; F392-F477 HydrophobicContact CB-CG 4Å; F392-F477 HydrophobicContact CB-CZ 4.1Å; F392-F477 HydrophobicContact CD2-CB 3.79Å; F392-F477 AromaticContact CD2-CD1 3.46Å; F392-F477 HydrophobicContact CD2-CD1 3.46Å; F392-F477 VanDerWaalsContact CD2-CD1 3.46Å; F392-F477 HydrophobicContact CD2-CD2 4.42Å; F392-F477 HydrophobicContact CD2-CE1 4.1Å; F392-F477 AromaticContact CD2-CG 3.65Å; F392-F477 HydrophobicContact CD2-CG 3.65Å; F392-F477 HydrophobicContact CE2-CD1 4.24Å; F392-F477 HydrophobicContact CG-CD1 4.16Å; F392-F477 HydrophobicContact CG-CE1 4.42Å; F392-F477 HydrophobicContact CG-CG 4.31Å; F392-H480 AromaticContact CE2-CE1 3.93Å; F392-H480 AromaticContact CE2-CG 3.99Å; F392-H480 AromaticContact CE2-ND1 3.52Å; F392-H480 AromaticContact CZ-CE1 3.59Å; F392-H480 AromaticContact CZ-ND1 3.68Å
393G89.6Confident90.1Very high2 Ų239.3 Ų39.32%0.02121%0.214CC..Hα-helixtrans-57.3-49.1176.200000114.8S389 S390 I391 Q396S389-G393 PolarHBondContact O-N 3.09Å; S389-G393 VanDerWaalsContact O-N 3.08Å; S390-G393 PolarHBondContact O-N 3.48Å; I391-G393 PolarHBondContact O-N 3.33Å; G393-Q396 WeakPolarHBondContact O-CB 3.22Å; G393-Q396 PolarHBondContact O-N 3.44Å
394V90.8Very high90.1Very high84 Ų8436.3 Ų36.351%0.50920%0.199SC..Hα-helixtrans-66.9-39.8177.8173.60000111.4S390 I391 Q396 L397S390-V394 WeakPolarHBondContact O-CG2 3.31Å; S390-V394 PolarHBondContact O-N 3.03Å; I391-V394 PolarHBondContact O-N 3.28Å; V394-Q396 PolarHBondContact O-N 2.99Å; V394-Q396 VanDerWaalsContact O-N 3.11Å; V394-L397 WeakPolarHBondContact O-CB 3.46Å; V394-L397 PolarHBondContact O-N 3.45Å
395L92.3Very high90.1Very high32 Ų3237.8 Ų37.817%0.16821%0.208CC..Hα-helixtrans-59-24176.9-74.9172.3000112.4I391 F392 L397 L398 I474 F477 I478 T481I391-L395 HydrophobicContact CG2-CD1 3.8Å; I391-L395 HydrophobicContact CG2-CG 4.26Å; I391-L395 WeakPolarHBondContact O-CB 3.46Å; I391-L395 VanDerWaalsContact O-CG 3.3Å; I391-L395 WeakPolarHBondContact O-CG 3.22Å; I391-L395 PolarHBondContact O-N 3.48Å; F392-L395 PolarHBondContact O-N 2.88Å; L395-L397 PolarHBondContact O-N 2.91Å; L395-L397 VanDerWaalsContact O-N 3.14Å; L395-L398 HydrophobicContact CB-CD1 4.48Å; L395-L398 HydrophobicContact CD2-CD1 3.72Å; L395-L398 WeakPolarHBondContact O-CB 3.44Å; L395-L398 WeakPolarHBondContact O-CG 3.41Å; L395-L398 PolarHBondContact O-N 2.87Å; L395-I474 HydrophobicContact CD1-CG2 4.34Å; L395-F477 HydrophobicContact CD1-CB 3.63Å; L395-F477 HydrophobicContact CD1-CD2 4.04Å; L395-F477 HydrophobicContact CD1-CG 4.36Å; L395-I478 HydrophobicContact CD1-CG1 4.26Å; L395-I478 HydrophobicContact CD2-CG1 4.25Å; L395-T481 WeakPolarHBondContact O-CG2 3.29Å
396Q91.3Very high90Very high1 Ų137.4 Ų37.41%0.00521%0.205CC..THydrogen-bonded Turntrans-61.6-21.3175.9-57.3-146.625.600113.8L31 S217 A219 F392 G393 V394 L398 C399L31-Q396 PolarHBondContact O-NE2 3.49Å; L31-Q396 VanDerWaalsContact O-NE2 3.17Å; S217-Q396 PolarHBondContact OG-O 3.48Å; A219-Q396 HydrophobicContact CB-CB 4.26Å; A219-Q396 HydrophobicContact CB-CG 4.22Å; F392-Q396 VanDerWaalsContact O-CG 3.26Å; F392-Q396 WeakPolarHBondContact O-CG 3.37Å; F392-Q396 PolarHBondContact O-N 3.28Å; G393-Q396 WeakPolarHBondContact O-CB 3.22Å; G393-Q396 PolarHBondContact O-N 3.44Å; V394-Q396 PolarHBondContact O-N 2.99Å; V394-Q396 VanDerWaalsContact O-N 3.11Å; Q396-L398 PolarHBondContact O-N 3.25Å; Q396-C399 VanDerWaalsContact O-CB 3.25Å; Q396-C399 WeakPolarHBondContact O-CB 3.13Å; Q396-C399 PolarHBondContact O-N 3.24Å; Q396-C399 VanDerWaalsContact O-N 3.08Å
397L91.9Very high89.7Confident73 Ų7336.5 Ų36.538%0.38220%0.201SC..THydrogen-bonded Turntrans-60.3-23.2170.5-75.7171.5000113.1L24 V220 V394 L395 C399 L400L24-L397 HydrophobicContact CD1-CD2 4.14Å; V220-L397 HydrophobicContact CB-CD2 4.2Å; V220-L397 HydrophobicContact CB-CG 4.01Å; V220-L397 HydrophobicContact CG1-CD2 3.77Å; V220-L397 HydrophobicContact CG1-CG 4.15Å; V220-L397 HydrophobicContact CG2-CD1 3.9Å; V220-L397 HydrophobicContact CG2-CD2 4.3Å; V220-L397 HydrophobicContact CG2-CG 3.78Å; V394-L397 WeakPolarHBondContact O-CB 3.46Å; V394-L397 PolarHBondContact O-N 3.45Å; L395-L397 PolarHBondContact O-N 2.91Å; L395-L397 VanDerWaalsContact O-N 3.14Å; L397-C399 PolarHBondContact O-N 3.32Å; L397-L400 VanDerWaalsContact O-CB 3.3Å; L397-L400 WeakPolarHBondContact O-CB 3.48Å; L397-L400 PolarHBondContact O-N 3.26Å
398L91.6Very high89.4Confident66 Ų6638.1 Ų38.135%0.34621%0.206SC..Hα-helixtrans-60.3-24.9175.3-62.7174.8000111.7L395 Q396 L400 M401 T402 I478 T481L395-L398 HydrophobicContact CB-CD1 4.48Å; L395-L398 HydrophobicContact CD2-CD1 3.72Å; L395-L398 WeakPolarHBondContact O-CB 3.44Å; L395-L398 WeakPolarHBondContact O-CG 3.41Å; L395-L398 PolarHBondContact O-N 2.87Å; Q396-L398 PolarHBondContact O-N 3.25Å; L398-L400 PolarHBondContact O-N 3.32Å; L398-M401 PolarHBondContact O-N 3.43Å; L398-T402 VanDerWaalsContact O-CG2 3.26Å; L398-T402 WeakPolarHBondContact O-CG2 3.13Å; L398-T402 PolarHBondContact O-N 3.47Å; L398-T402 PolarHBondContact O-OG1 3.05Å; L398-T402 VanDerWaalsContact O-OG1 3.08Å; L398-I478 HydrophobicContact CD1-CG1 4.42Å; L398-T481 HydrophobicContact CB-CG2 4.08Å
399C90.4Very high89.1Confident0 Ų038.7 Ų38.70%021%0.21CC..Hα-helixtrans-53.7-36.5172-79.10000112.7A216 S217 Q396 L397 M401 T402 T403 T481A216-C399 HydrophobicContact CB-CB 3.78Å; S217-C399 VanDerWaalsContact OG-CB 3.29Å; S217-C399 WeakPolarHBondContact OG-CB 3.42Å; Q396-C399 VanDerWaalsContact O-CB 3.25Å; Q396-C399 WeakPolarHBondContact O-CB 3.13Å; Q396-C399 PolarHBondContact O-N 3.24Å; Q396-C399 VanDerWaalsContact O-N 3.08Å; L397-C399 PolarHBondContact O-N 3.32Å; C399-M401 PolarHBondContact O-N 2.69Å; C399-T402 WeakPolarHBondContact CA-OG1 3.3Å; C399-T403 VanDerWaalsContact O-CB 3.26Å; C399-T403 WeakPolarHBondContact O-CB 3.19Å; C399-T403 PolarHBondContact O-N 2.94Å; C399-T403 PolarHBondContact O-OG1 3.46Å; C399-T481 HydrophobicContact CB-CG2 4.39Å; C399-T481 WeakPolarHBondContact SG-CG2 3.39Å; C399-T481 PolarHBondContact SG-O 3.42Å
400L89.8Confident88.7Confident43 Ų4339.5 Ų39.523%0.22521%0.214CC..Hα-helixtrans-62.4-33.7179.4-162.687.9000111.6S217 L397 L398 P404S217-L400 PolarHBondContact OG-N 2.86Å; L397-L400 VanDerWaalsContact O-CB 3.3Å; L397-L400 WeakPolarHBondContact O-CB 3.48Å; L397-L400 PolarHBondContact O-N 3.26Å; L398-L400 PolarHBondContact O-N 3.32Å; L400-P404 WeakPolarHBondContact O-CD 3.42Å; L400-P404 WeakPolarHBondContact O-CG 3.35Å
401M88.9Confident88.3Confident122 Ų12241.8 Ų41.860%0.60123%0.225SC*.Hα-helixtrans-90.4-37-178.9-66.9-66.4104.300112.5L398 C399 P404L398-M401 PolarHBondContact O-N 3.43Å; C399-M401 PolarHBondContact O-N 2.69Å; M401-P404 WeakPolarHBondContact O-CD 3.48Å
402T89.1Confident87.7Confident25 Ų2545.7 Ų45.715%0.15324%0.236CC..Hα-helixtrans-77.6-34.6-175.759.70000111.8L398 C399 V405 I406 V482 F486L398-T402 VanDerWaalsContact O-CG2 3.26Å; L398-T402 WeakPolarHBondContact O-CG2 3.13Å; L398-T402 PolarHBondContact O-N 3.47Å; L398-T402 PolarHBondContact O-OG1 3.05Å; L398-T402 VanDerWaalsContact O-OG1 3.08Å; C399-T402 WeakPolarHBondContact CA-OG1 3.3Å; T402-V405 WeakPolarHBondContact O-CB 3.47Å; T402-V405 PolarHBondContact O-N 3.29Å; T402-I406 PolarHBondContact O-N 3.44Å; T402-V482 HydrophobicContact CG2-CG2 3.99Å; T402-F486 VanDerWaalsContact O-CE1 3.31Å; T402-F486 WeakPolarHBondContact O-CE1 3.27Å
403T88.3Confident86.9Confident0 Ų050.1 Ų50.10%026%0.255CS..Hα-helixtrans-61.6-41.5-179.1-51.20000113.3A209 I212 G213 C399 V405 I406 G407 S489A209-T403 WeakPolarHBondContact O-CG2 3.47Å; I212-T403 HydrophobicContact CB-CG2 4.1Å; I212-T403 HydrophobicContact CG2-CG2 3.93Å; G213-T403 WeakPolarHBondContact CA-OG1 3.35Å; C399-T403 VanDerWaalsContact O-CB 3.26Å; C399-T403 WeakPolarHBondContact O-CB 3.19Å; C399-T403 PolarHBondContact O-N 2.94Å; C399-T403 PolarHBondContact O-OG1 3.46Å; T403-V405 VanDerWaalsContact C-N 3.3Å; T403-V405 PolarHBondContact O-N 3.27Å; T403-I406 WeakPolarHBondContact O-CG2 3.35Å; T403-I406 PolarHBondContact O-N 3.26Å; T403-G407 PolarHBondContact O-N 3.3Å; T403-G407 VanDerWaalsContact O-N 3.13Å; T403-S489 WeakPolarHBondContact CG2-OG 3.33Å
404P87.4Confident86.1Confident31 Ų3151.3 Ų51.320%0.20126%0.261CS..Hα-helixtrans-59.3-35.2169.4-2835.7000114.5L400 M401 G407 Q408L400-P404 WeakPolarHBondContact O-CD 3.42Å; L400-P404 WeakPolarHBondContact O-CG 3.35Å; M401-P404 WeakPolarHBondContact O-CD 3.48Å; P404-G407 PolarHBondContact O-N 2.9Å; P404-Q408 WeakPolarHBondContact O-CG 3.46Å; P404-Q408 PolarHBondContact O-N 2.91Å
405V88.7Confident84.9Confident69 Ų6957 Ų5742%0.41828%0.279SS..Hα-helixtrans-64.8-45-179.7177.20000110.9T402 T403 G407 Q408 I409T402-V405 WeakPolarHBondContact O-CB 3.47Å; T402-V405 PolarHBondContact O-N 3.29Å; T403-V405 VanDerWaalsContact C-N 3.3Å; T403-V405 PolarHBondContact O-N 3.27Å; V405-G407 VanDerWaalsContact C-N 3.32Å; V405-G407 PolarHBondContact O-N 3.32Å; V405-Q408 WeakPolarHBondContact O-CB 3.28Å; V405-Q408 PolarHBondContact O-N 3.01Å; V405-I409 HydrophobicContact CG1-CD1 4.49Å; V405-I409 WeakPolarHBondContact O-CG1 3.26Å; V405-I409 PolarHBondContact O-N 3.02Å; V405-I409 VanDerWaalsContact O-N 3.09Å
406I85.6Confident83.6Confident0 Ų061.1 Ų61.10%030%0.301CS..Hα-helixtrans-66.7-36175.2-168.365.2000111.3T402 T403 Q408 I409 M410 A450 F486T402-I406 PolarHBondContact O-N 3.44Å; T403-I406 WeakPolarHBondContact O-CG2 3.35Å; T403-I406 PolarHBondContact O-N 3.26Å; I406-Q408 VanDerWaalsContact C-N 3.33Å; I406-Q408 PolarHBondContact O-N 3.1Å; I406-I409 HydrophobicContact CD1-CB 4.37Å; I406-I409 HydrophobicContact CD1-CD1 4.12Å; I406-I409 WeakPolarHBondContact O-CB 3.38Å; I406-I409 PolarHBondContact O-N 2.85Å; I406-I409 VanDerWaalsContact O-N 3.12Å; I406-M410 VanDerWaalsContact O-CG 3.3Å; I406-M410 WeakPolarHBondContact O-CG 3.28Å; I406-M410 PolarHBondContact O-N 3.27Å; I406-A450 HydrophobicContact CD1-CB 3.74Å; I406-A450 HydrophobicContact CG1-CB 4.39Å; I406-F486 HydrophobicContact CB-CD1 3.69Å; I406-F486 HydrophobicContact CB-CD2 4.43Å; I406-F486 HydrophobicContact CB-CE1 3.77Å; I406-F486 HydrophobicContact CB-CG 4.03Å; I406-F486 HydrophobicContact CB-CZ 4.19Å; I406-F486 HydrophobicContact CD1-CD2 4.04Å; I406-F486 HydrophobicContact CD1-CE2 4.26Å; I406-F486 HydrophobicContact CD1-CG 4.29Å; I406-F486 HydrophobicContact CG1-CB 4.4Å; I406-F486 HydrophobicContact CG1-CD1 4.26Å; I406-F486 HydrophobicContact CG1-CD2 4.35Å; I406-F486 HydrophobicContact CG1-CG 4.09Å; I406-F486 HydrophobicContact CG2-CD1 3.7Å; I406-F486 HydrophobicContact CG2-CE1 4.05Å; I406-F486 HydrophobicContact CG2-CG 4.31Å
407G82.3Confident82.2Confident11 Ų1161.6 Ų61.611%0.11331%0.305CS..Hα-helixtrans-58.2-43.2172.300000112.5T403 P404 V405 I409 M410 D411T403-G407 PolarHBondContact O-N 3.3Å; T403-G407 VanDerWaalsContact O-N 3.13Å; P404-G407 PolarHBondContact O-N 2.9Å; V405-G407 VanDerWaalsContact C-N 3.32Å; V405-G407 PolarHBondContact O-N 3.32Å; G407-I409 VanDerWaalsContact C-N 3.34Å; G407-I409 PolarHBondContact O-N 2.96Å; G407-M410 PolarHBondContact O-N 3.01Å; G407-M410 VanDerWaalsContact O-N 3.14Å; G407-D411 PolarHBondContact O-N 2.8Å
408Q83.8Confident80.4Confident136 Ų13662.4 Ų62.464%0.63631%0.309SS*.Hα-helixtrans-63.3-36.8174.3-71.8175.8-20.800112.8P404 V405 I406 M410 D411 W412P404-Q408 WeakPolarHBondContact O-CG 3.46Å; P404-Q408 PolarHBondContact O-N 2.91Å; V405-Q408 WeakPolarHBondContact O-CB 3.28Å; V405-Q408 PolarHBondContact O-N 3.01Å; I406-Q408 VanDerWaalsContact C-N 3.33Å; I406-Q408 PolarHBondContact O-N 3.1Å; Q408-M410 VanDerWaalsContact C-N 3.31Å; Q408-D411 CarbonylContact O-C 3.59Å; Q408-D411 PolarHBondContact O-N 3.18Å; Q408-W412 PolarHBondContact O-N 3.35Å
409I85.8Confident78.1Confident38 Ų3863.7 Ų63.720%0.19532%0.316CS..Hα-helixtrans-64.4-38.3173.7-66.5167.9000110.6V405 I406 G407 W412 L453V405-I409 HydrophobicContact CG1-CD1 4.49Å; V405-I409 WeakPolarHBondContact O-CG1 3.26Å; V405-I409 PolarHBondContact O-N 3.02Å; V405-I409 VanDerWaalsContact O-N 3.09Å; I406-I409 HydrophobicContact CD1-CB 4.37Å; I406-I409 HydrophobicContact CD1-CD1 4.12Å; I406-I409 WeakPolarHBondContact O-CB 3.38Å; I406-I409 PolarHBondContact O-N 2.85Å; I406-I409 VanDerWaalsContact O-N 3.12Å; G407-I409 VanDerWaalsContact C-N 3.34Å; G407-I409 PolarHBondContact O-N 2.96Å; I409-W412 WeakPolarHBondContact O-CB 3.47Å; I409-W412 PolarHBondContact O-N 3.33Å; I409-L453 HydrophobicContact CD1-CD2 3.99Å
410M81.8Confident76.1Confident18 Ų1867.8 Ų67.89%0.08936%0.359CS..Hα-helixtrans-71.2-35.8178.7-65.7-174.289.300112.7I406 G407 Q408 W412 N446 A450 A490I406-M410 VanDerWaalsContact O-CG 3.3Å; I406-M410 WeakPolarHBondContact O-CG 3.28Å; I406-M410 PolarHBondContact O-N 3.27Å; G407-M410 PolarHBondContact O-N 3.01Å; G407-M410 VanDerWaalsContact O-N 3.14Å; Q408-M410 VanDerWaalsContact C-N 3.31Å; M410-W412 VanDerWaalsContact C-N 3.29Å; M410-W412 PolarHBondContact O-N 3.46Å; M410-N446 WeakPolarHBondContact O-CB 3.4Å; M410-N446 PolarHBondContact O-ND2 2.94Å; M410-A450 HydrophobicContact CG-CB 4.19Å; M410-A490 VanDerWaalsContact CE-O 3.29Å; M410-A490 WeakPolarHBondContact CE-O 3.28Å
411D80.4Confident73.9Confident69 Ų6972.4 Ų72.437%0.36938%0.379SS..THydrogen-bonded Turntrans-87.64.7176.7-69.2-19.6000113.3S205 G407 Q408 K413 L414S205-D411 VanDerWaalsContact CB-OD2 3.24Å; S205-D411 WeakPolarHBondContact CB-OD2 3.44Å; S205-D411 PolarHBondContact OG-OD2 3.03Å; G407-D411 PolarHBondContact O-N 2.8Å; Q408-D411 CarbonylContact O-C 3.59Å; Q408-D411 PolarHBondContact O-N 3.18Å; D411-K413 PolarHBondContact O-N 2.99Å; D411-L414 WeakPolarHBondContact O-CB 3.31Å; D411-L414 PolarHBondContact O-N 3.33Å; D411-L414 VanDerWaalsContact O-N 3.15Å
412W80.1Confident71.5Confident135 Ų13575 Ų7551%0.51139%0.39SS..THydrogen-bonded Turntrans-59123.2-175.9-172.5-59.6000111.6Q408 I409 M410 L414 N446Q408-W412 PolarHBondContact O-N 3.35Å; I409-W412 WeakPolarHBondContact O-CB 3.47Å; I409-W412 PolarHBondContact O-N 3.33Å; M410-W412 VanDerWaalsContact C-N 3.29Å; M410-W412 PolarHBondContact O-N 3.46Å; W412-L414 PolarHBondContact O-N 2.84Å; W412-L414 VanDerWaalsContact O-N 3.12Å; W412-N446 PolarHBondContact O-ND2 3.17Å
413K75.9Confident68.8Low97 Ų9780.7 Ų80.742%0.42242%0.419SS..THydrogen-bonded Turntrans5523.2-179.9-71.4179.7173.7-167.50114.3D411 K415 D416D411-K413 PolarHBondContact O-N 2.99Å; K413-K415 VanDerWaalsContact C-N 3.33Å; K413-D416 WeakPolarHBondContact CG-OD2 3.25Å
414L72.8Confident66.2Low28 Ų2890.9 Ų90.915%0.14746%0.464CS..  trans-74.9-26.7175.1-136.179.9000112.6D411 W412 D416 C417 Q442 K443D411-L414 WeakPolarHBondContact O-CB 3.31Å; D411-L414 PolarHBondContact O-N 3.33Å; D411-L414 VanDerWaalsContact O-N 3.15Å; W412-L414 PolarHBondContact O-N 2.84Å; W412-L414 VanDerWaalsContact O-N 3.12Å; L414-D416 VanDerWaalsContact C-N 3.27Å; L414-C417 PolarHBondContact O-N 2.91Å; L414-Q442 HydrophobicContact CD1-CG 4.26Å; L414-K443 HydrophobicContact CD1-CB 4.47Å; L414-K443 HydrophobicContact CD1-CG 3.6Å; L414-K443 HydrophobicContact CD2-CG 4.16Å; L414-K443 HydrophobicContact CG-CG 4.34Å
415K64.9Low63.5Low204 Ų20497.1 Ų97.189%0.88749%0.49SS*.THydrogen-bonded Turntrans-72.9-18.3176.7-65.9-178.7178.8178.80113.5K413 C417K413-K415 VanDerWaalsContact C-N 3.33Å; K415-C417 VanDerWaalsContact C-N 3.27Å
416D64.1Low60.8Low117 Ų117100 Ų10063%0.62651%0.51SS*.THydrogen-bonded Turntrans-90.36.6178.7-51.8-29.4000111.9K413 L414K413-D416 WeakPolarHBondContact CG-OD2 3.25Å; L414-D416 VanDerWaalsContact C-N 3.27Å
417C62.5Low58.3Low11 Ų11108.3 Ų108.37%0.07455%0.554CS.*SBendtrans-100.3135.7178.8-74.80000110L414 K415 D419 R437 R439L414-C417 PolarHBondContact O-N 2.91Å; K415-C417 VanDerWaalsContact C-N 3.27Å; C417-D419 PolarHBondContact O-N 2.89Å; C417-R437 PolarHBondContact SG-O 3.39Å; C417-R437 VanDerWaalsContact SG-O 3.42Å; C417-R439 HydrophobicContact CB-CB 3.85Å; C417-R439 HydrophobicContact CB-CG 3.99Å
418D54.1Low55.9Low91 Ų91113 Ų11349%0.48758%0.584SS.*PPolyproline II helixtrans-58.5124.4178-138.26.7000110R436D418-R436 IonicContact OD2-CZ 3.52Å; D418-R436 IonicContact OD2-NE 3.38Å; D418-R436 PolarHBondContact OD2-NE 3.29Å; D418-R436 IonicContact OD2-NH2 2.78Å; D418-R436 PolarHBondContact OD2-NH2 3.18Å
419D44.4Very low53.6Low92 Ų92116.9 Ų116.949%0.49260%0.599SS.*PPolyproline II helixtrans-80.5126.4155.9-77.4-29.1000105.5C417 E421 R439C417-D419 PolarHBondContact O-N 2.89Å; D419-E421 PolarHBondContact O-N 2.93Å; D419-R439 IonicContact OD1-CZ 3.35Å; D419-R439 VanDerWaalsContact OD1-CZ 3.25Å; D419-R439 IonicContact OD1-NE 3.32Å; D419-R439 IonicContact OD1-NH1 2.62Å; D419-R439 PolarHBondContact OD1-NH1 3.47Å
420G47.2Very low51.2Low86 Ų86118.7 Ų118.789%0.88763%0.628SS**SBendtrans-64.113.8-172.500000116
421E44Very low48.8Very low140 Ų140126.9 Ų126.965%0.65467%0.666SS**SBendtrans-133.2128.2174.5-69.3-171.1149.600108.8K273 D419K273-E421 IonicContact NZ-OE2 2.79Å; D419-E421 PolarHBondContact O-N 2.93Å
422E38.2Very low46.5Very low177 Ų177128.9 Ų128.983%0.82769%0.685SS**SBendtrans8280.7168.4-55.1-176.717400118
423D32.1Very low44.3Very low144 Ų144132.3 Ų132.377%0.7770%0.703SS**  173101.9100.8-90.5-26.9000110.3E425D423-E425 PolarHBondContact O-N 3.33Å
424K35Very low42.6Very low215 Ų215134.1 Ų134.194%0.93572%0.723SS**  trans-78.274.5163.1-73.6-177.5179.2174.70108.4
425E29.4Very low41.3Very low162 Ų162141.7 Ų141.776%0.75776%0.755SS**  trans-78.7132.6158-75.1-150149.100109.7D423 L427D423-E425 PolarHBondContact O-N 3.33Å; E425-L427 PolarHBondContact O-N 3.47Å; E425-L427 VanDerWaalsContact O-N 3.15Å
426P32.6Very low40.9Very low128 Ų128142.3 Ų142.383%0.83175%0.751SS**  trans-68.4114.3177.627.1-30.7000109.5S428P426-S428 PolarHBondContact O-N 2.9Å
427L33.4Very low40.9Very low175 Ų175141.9 Ų141.992%0.91674%0.741SS**  trans-59.7122.1-176.2-149.380.8000111.8E425E425-L427 PolarHBondContact O-N 3.47Å; E425-L427 VanDerWaalsContact O-N 3.15Å
428S31.5Very low41.6Very low109 Ų109144.4 Ų144.476%0.76275%0.754SS**  trans-74142.6166.573.50000110.8P426 G430P426-S428 PolarHBondContact O-N 2.9Å; S428-G430 PolarHBondContact O-N 3.41Å
429K35.4Very low42.7Very low219 Ų219144.9 Ų144.995%0.95275%0.749SS**THydrogen-bonded Turntrans-67.2115.8-176.9-73.8174.4174.7174.40110.8
430G35.5Very low44.3Very low76 Ų76145.1 Ų145.178%0.78475%0.745SS**THydrogen-bonded Turntrans167.1-26.9161.300000119.9S428S428-G430 PolarHBondContact O-N 3.41Å
431E31.5Very low46Very low190 Ų190142.4 Ų142.489%0.88871%0.71SS**  trans-101.2142.1-168-68.1-170.8134.100114.6K433E431-K433 PolarHBondContact O-N 3.22Å
432S31.5Very low48Very low110 Ų110136.4 Ų136.477%0.76968%0.682SS**  trans-57.1124.2-178.162.70000111T434S432-T434 PolarHBondContact O-N 2.97Å
433K34.1Very low50.2Low207 Ų207130.8 Ų130.890%0.966%0.655SS**  trans-50.697.9177.8-69.4178.7176.8177.60111.8E431 K435E431-K433 PolarHBondContact O-N 3.22Å; K433-K435 PolarHBondContact O-N 3.48Å
434T40Very low52.8Low136 Ų136124 Ų12483%0.83462%0.618SS**  trans-61.3118.1161.3-6.40000106.5S432 R436S432-T434 PolarHBondContact O-N 2.97Å; T434-R436 PolarHBondContact O-N 2.92Å
435K46.8Very low55.3Low187 Ų187114 Ų11481%0.81358%0.576SS**  trans-51.1108.8-179.1-94.9179.7173.8175.60109.7K433 R437K433-K435 PolarHBondContact O-N 3.48Å; K435-R437 PolarHBondContact O-N 3.15Å
436R56.4Low58.2Low216 Ų216106.3 Ų106.382%0.81554%0.54SS*.  trans-53.3120.7172.3-159.7174.6-174.3-178.12108.8D418 T434D418-R436 IonicContact OD2-CZ 3.52Å; D418-R436 IonicContact OD2-NE 3.38Å; D418-R436 PolarHBondContact OD2-NE 3.29Å; D418-R436 IonicContact OD2-NH2 2.78Å; D418-R436 PolarHBondContact OD2-NH2 3.18Å; T434-R436 PolarHBondContact O-N 2.92Å
437R63.6Low60.9Low108 Ų108100.3 Ų100.341%0.40850%0.501SS..  trans-111.3126.7-174.7-79.1173.7-178.4-154.7-6.9110.8C417 K435 R439C417-R437 PolarHBondContact SG-O 3.39Å; C417-R437 VanDerWaalsContact SG-O 3.42Å; K435-R437 PolarHBondContact O-N 3.15Å; R437-R439 PolarHBondContact O-N 3.36Å
438D77.8Confident63.7Low65 Ų6592.5 Ų92.535%0.34846%0.46SS..  trans-66.8128.5172-172.7-55.9000110.6K440 I441 Q442 L569D438-K440 VanDerWaalsContact C-N 3.34Å; D438-K440 PolarHBondContact O-N 3.46Å; D438-K440 WeakPolarHBondContact OD1-CA 3.29Å; D438-K440 WeakPolarHBondContact OD1-CB 3.48Å; D438-K440 PolarHBondContact OD1-N 3.04Å; D438-I441 HydrophobicContact CB-CB 4.2Å; D438-I441 HydrophobicContact CB-CD1 3.98Å; D438-I441 HydrophobicContact CB-CG1 4.34Å; D438-I441 PolarHBondContact O-N 3.48Å; D438-I441 PolarHBondContact OD1-N 3.09Å; D438-Q442 PolarHBondContact O-N 3.07Å; D438-L569 HydrophobicContact CB-CD1 3.95Å; D438-L569 WeakPolarHBondContact OD2-CD1 3.47Å
439R77.2Confident66.6Low100 Ų10093.9 Ų93.938%0.37745%0.448SS..Hα-helixtrans-61-40.1-177.8-165.5174.1-177.1-163.62112C417 D419 R437 Q442 K443C417-R439 HydrophobicContact CB-CB 3.85Å; C417-R439 HydrophobicContact CB-CG 3.99Å; D419-R439 IonicContact OD1-CZ 3.35Å; D419-R439 VanDerWaalsContact OD1-CZ 3.25Å; D419-R439 IonicContact OD1-NE 3.32Å; D419-R439 IonicContact OD1-NH1 2.62Å; D419-R439 PolarHBondContact OD1-NH1 3.47Å; R437-R439 PolarHBondContact O-N 3.36Å; R439-Q442 PolarHBondContact O-N 2.74Å; R439-K443 WeakPolarHBondContact O-CG 3.48Å; R439-K443 PolarHBondContact O-N 3.44Å
440K77.8Confident69.2Low98 Ų9883.5 Ų83.543%0.42640%0.403SS..Hα-helixtrans-66.9-44.4-178.7-169.3173.6-176.3174.80110.7D438 Q442 K443 V444D438-K440 VanDerWaalsContact C-N 3.34Å; D438-K440 PolarHBondContact O-N 3.46Å; D438-K440 WeakPolarHBondContact OD1-CA 3.29Å; D438-K440 WeakPolarHBondContact OD1-CB 3.48Å; D438-K440 PolarHBondContact OD1-N 3.04Å; K440-Q442 VanDerWaalsContact C-N 3.35Å; K440-Q442 PolarHBondContact O-N 3.07Å; K440-K443 PolarHBondContact O-N 3.37Å; K440-V444 WeakPolarHBondContact O-CG2 3.5Å; K440-V444 PolarHBondContact O-N 3.01Å; K440-V444 VanDerWaalsContact O-N 3.07Å
441I83.2Confident72Confident28 Ų2879.9 Ų79.914%0.14437%0.366CS..Hα-helixtrans-62.5-42.8175.6-76.5168.2000111.7D438 V444 T445 L565 H566 L569D438-I441 HydrophobicContact CB-CB 4.2Å; D438-I441 HydrophobicContact CB-CD1 3.98Å; D438-I441 HydrophobicContact CB-CG1 4.34Å; D438-I441 PolarHBondContact O-N 3.48Å; D438-I441 PolarHBondContact OD1-N 3.09Å; I441-V444 PolarHBondContact O-N 3.27Å; I441-T445 WeakPolarHBondContact O-CB 3.34Å; I441-T445 PolarHBondContact O-N 3.36Å; I441-T445 PolarHBondContact O-OG1 3.23Å; I441-L565 HydrophobicContact CG1-CB 4.36Å; I441-H566 WeakPolarHBondContact CD1-ND1 3.43Å; I441-H566 WeakPolarHBondContact CG2-CE1 3.48Å; I441-L569 HydrophobicContact CD1-CD1 3.18Å; I441-L569 HydrophobicContact CD1-CG 4.43Å; I441-L569 HydrophobicContact CG1-CD1 4.27Å
442Q84.7Confident75.1Confident14 Ų1473.6 Ų73.67%0.06534%0.338CS..Hα-helixtrans-65.6-43.7-179.2-171.962.245.100110.6L414 D438 R439 K440 V444 T445 N446L414-Q442 HydrophobicContact CD1-CG 4.26Å; D438-Q442 PolarHBondContact O-N 3.07Å; R439-Q442 PolarHBondContact O-N 2.74Å; K440-Q442 VanDerWaalsContact C-N 3.35Å; K440-Q442 PolarHBondContact O-N 3.07Å; Q442-V444 PolarHBondContact O-N 2.98Å; Q442-T445 PolarHBondContact O-N 3.37Å; Q442-N446 PolarHBondContact NE2-OD1 2.81Å; Q442-N446 VanDerWaalsContact O-CG 3.26Å; Q442-N446 PolarHBondContact O-N 3.15Å; Q442-N446 PolarHBondContact O-OD1 3.42Å
443K84.4Confident78.1Confident59 Ų5971.4 Ų71.426%0.25732%0.317SS..Hα-helixtrans-56.8-49.1174.1-72.7-176.3-180-179.10112.1L414 R439 K440 T445 N446 A447 A497L414-K443 HydrophobicContact CD1-CB 4.47Å; L414-K443 HydrophobicContact CD1-CG 3.6Å; L414-K443 HydrophobicContact CD2-CG 4.16Å; L414-K443 HydrophobicContact CG-CG 4.34Å; R439-K443 WeakPolarHBondContact O-CG 3.48Å; R439-K443 PolarHBondContact O-N 3.44Å; K440-K443 PolarHBondContact O-N 3.37Å; K443-T445 VanDerWaalsContact C-N 3.31Å; K443-T445 PolarHBondContact O-N 3.03Å; K443-N446 PolarHBondContact O-N 3.21Å; K443-A447 WeakPolarHBondContact O-CB 3.44Å; K443-A447 PolarHBondContact O-N 3.3Å; K443-A497 HydrophobicContact CB-CB 3.6Å; K443-A497 HydrophobicContact CD-CB 4.14Å; K443-A497 HydrophobicContact CG-CB 4.44Å
444V87Confident81Confident1 Ų161.5 Ų61.51%0.00627%0.274CS..Hα-helixtrans-62.7-38.3177.6173.30000111.6K440 I441 Q442 A447 L448 V498 L558 Y561 R562K440-V444 WeakPolarHBondContact O-CG2 3.5Å; K440-V444 PolarHBondContact O-N 3.01Å; K440-V444 VanDerWaalsContact O-N 3.07Å; I441-V444 PolarHBondContact O-N 3.27Å; Q442-V444 PolarHBondContact O-N 2.98Å; V444-A447 PolarHBondContact O-N 2.82Å; V444-L448 WeakPolarHBondContact O-CB 3.5Å; V444-L448 PolarHBondContact O-N 2.73Å; V444-V498 HydrophobicContact CG2-CG2 4.48Å; V444-L558 HydrophobicContact CG1-CD2 4.38Å; V444-Y561 HydrophobicContact CG1-CD1 4.15Å; V444-Y561 HydrophobicContact CG2-CE1 4.21Å; V444-R562 HydrophobicContact CG1-CB 4.43Å
445T88.7Confident83.6Confident6 Ų655.1 Ų55.14%0.03724%0.235CC..Hα-helixtrans-66.9-39.9178-56.50000111.9I441 Q442 K443 L448 R449 R562I441-T445 WeakPolarHBondContact O-CB 3.34Å; I441-T445 PolarHBondContact O-N 3.36Å; I441-T445 PolarHBondContact O-OG1 3.23Å; Q442-T445 PolarHBondContact O-N 3.37Å; K443-T445 VanDerWaalsContact C-N 3.31Å; K443-T445 PolarHBondContact O-N 3.03Å; T445-L448 PolarHBondContact O-N 2.8Å; T445-R449 WeakPolarHBondContact O-CG 3.34Å; T445-R449 PolarHBondContact O-N 2.98Å; T445-R449 VanDerWaalsContact O-N 3.14Å; T445-R562 WeakPolarHBondContact OG1-CD 3.47Å; T445-R562 PolarHBondContact OG1-NE 3.21Å
446N89.1Confident86Confident1 Ų151 Ų511%0.00522%0.221CC..Hα-helixtrans-68.1-42.8176.7-67.9-7.5000111M410 W412 Q442 K443 L448 R449 A450M410-N446 WeakPolarHBondContact O-CB 3.4Å; M410-N446 PolarHBondContact O-ND2 2.94Å; W412-N446 PolarHBondContact O-ND2 3.17Å; Q442-N446 PolarHBondContact NE2-OD1 2.81Å; Q442-N446 VanDerWaalsContact O-CG 3.26Å; Q442-N446 PolarHBondContact O-N 3.15Å; Q442-N446 PolarHBondContact O-OD1 3.42Å; K443-N446 PolarHBondContact O-N 3.21Å; N446-L448 PolarHBondContact O-N 3.13Å; N446-R449 PolarHBondContact O-N 2.78Å; N446-A450 PolarHBondContact O-N 3.07Å
447A89.3Confident87.9Confident1 Ų142.6 Ų42.61%0.00819%0.192CC..Hα-helixtrans-60-44.4173.900000111.8K443 V444 R449 A450 F451 L494K443-A447 WeakPolarHBondContact O-CB 3.44Å; K443-A447 PolarHBondContact O-N 3.3Å; V444-A447 PolarHBondContact O-N 2.82Å; A447-R449 VanDerWaalsContact C-N 3.34Å; A447-R449 PolarHBondContact O-N 3.42Å; A447-A450 WeakPolarHBondContact O-CB 3.38Å; A447-A450 PolarHBondContact O-N 2.89Å; A447-F451 VanDerWaalsContact O-CD2 3.31Å; A447-F451 WeakPolarHBondContact O-CD2 3.14Å; A447-F451 PolarHBondContact O-N 2.88Å; A447-L494 HydrophobicContact CB-CB 4.31Å; A447-L494 HydrophobicContact CB-CD1 4.05Å
448L92.1Very high89.5Confident11 Ų1137.5 Ų37.56%0.05817%0.173CC..Hα-helixtrans-54.7-47.8174.2169.663.2000112V444 T445 N446 A450 F451 I452 P555 L558 I559V444-L448 WeakPolarHBondContact O-CB 3.5Å; V444-L448 PolarHBondContact O-N 2.73Å; T445-L448 PolarHBondContact O-N 2.8Å; N446-L448 PolarHBondContact O-N 3.13Å; L448-A450 VanDerWaalsContact C-N 3.35Å; L448-A450 PolarHBondContact O-N 3.47Å; L448-F451 PolarHBondContact O-N 3.14Å; L448-I452 HydrophobicContact CD1-CD1 3.75Å; L448-I452 HydrophobicContact CD1-CG1 4.13Å; L448-I452 HydrophobicContact CG-CD1 4Å; L448-I452 WeakPolarHBondContact O-CG1 3.48Å; L448-I452 PolarHBondContact O-N 3.4Å; L448-P555 HydrophobicContact CD1-CB 3.74Å; L448-P555 VanDerWaalsContact CD1-O 3.23Å; L448-P555 WeakPolarHBondContact CD1-O 3.31Å; L448-L558 HydrophobicContact CB-CB 4.39Å; L448-L558 HydrophobicContact CB-CD1 4.44Å; L448-L558 HydrophobicContact CD1-CB 4.02Å; L448-I559 HydrophobicContact CD1-CD1 4.43Å; L448-I559 HydrophobicContact CD1-CG1 3.93Å; L448-I559 HydrophobicContact CD2-CG1 3.6Å; L448-I559 HydrophobicContact CG-CG1 4.42Å
449R91.7Very high90.4Very high139 Ų13936 Ų3653%0.52517%0.166SC..Hα-helixtrans-63.3-41.6178.4-71.7172.2176.1-171.3-5.4112T445 N446 A447 I452 L453T445-R449 WeakPolarHBondContact O-CG 3.34Å; T445-R449 PolarHBondContact O-N 2.98Å; T445-R449 VanDerWaalsContact O-N 3.14Å; N446-R449 PolarHBondContact O-N 2.78Å; A447-R449 VanDerWaalsContact C-N 3.34Å; A447-R449 PolarHBondContact O-N 3.42Å; R449-I452 PolarHBondContact O-N 3.27Å; R449-L453 WeakPolarHBondContact O-CB 3.3Å; R449-L453 PolarHBondContact O-N 2.78Å
450A92.1Very high91.2Very high0 Ų032.4 Ų32.40%016%0.161CC..Hα-helixtrans-58.9-49.7175.700000111I406 M410 N446 A447 L448 I452 L453 T454 A490I406-A450 HydrophobicContact CD1-CB 3.74Å; I406-A450 HydrophobicContact CG1-CB 4.39Å; M410-A450 HydrophobicContact CG-CB 4.19Å; N446-A450 PolarHBondContact O-N 3.07Å; A447-A450 WeakPolarHBondContact O-CB 3.38Å; A447-A450 PolarHBondContact O-N 2.89Å; L448-A450 VanDerWaalsContact C-N 3.35Å; L448-A450 PolarHBondContact O-N 3.47Å; A450-I452 PolarHBondContact O-N 3.37Å; A450-L453 PolarHBondContact O-N 3.43Å; A450-T454 PolarHBondContact O-N 3.01Å; A450-T454 PolarHBondContact O-OG1 3.06Å; A450-A490 HydrophobicContact CB-CB 4.17Å
451F94Very high92.1Very high0 Ų027.8 Ų27.80%014%0.141CC..Hα-helixtrans-66.7-36.1178.9-82.6-76.1000114T355 A447 L448 N455 I487 A490 V491 L494 L554 P555T355-F451 HydrophobicContact CG2-CD1 4.43Å; T355-F451 HydrophobicContact CG2-CE1 4.48Å; A447-F451 VanDerWaalsContact O-CD2 3.31Å; A447-F451 WeakPolarHBondContact O-CD2 3.14Å; A447-F451 PolarHBondContact O-N 2.88Å; L448-F451 PolarHBondContact O-N 3.14Å; F451-N455 WeakPolarHBondContact O-CB 3.39Å; F451-N455 PolarHBondContact O-N 3.36Å; F451-N455 PolarHBondContact O-ND2 3.18Å; F451-I487 HydrophobicContact CD1-CD1 4.45Å; F451-I487 HydrophobicContact CE1-CD1 3.97Å; F451-A490 HydrophobicContact CD1-CB 4.42Å; F451-A490 HydrophobicContact CD2-CB 4.26Å; F451-A490 HydrophobicContact CE1-CB 4.16Å; F451-A490 HydrophobicContact CE2-CB 3.95Å; F451-A490 WeakPolarHBondContact CE2-O 3.39Å; F451-A490 HydrophobicContact CG-CB 4.47Å; F451-A490 HydrophobicContact CZ-CB 3.92Å; F451-V491 HydrophobicContact CE1-CG2 4.26Å; F451-V491 HydrophobicContact CZ-CG2 3.88Å; F451-L494 HydrophobicContact CE2-CB 3.92Å; F451-L494 HydrophobicContact CE2-CD2 3.69Å; F451-L494 HydrophobicContact CE2-CG 4.34Å; F451-L494 HydrophobicContact CZ-CD2 4.07Å; F451-L554 HydrophobicContact CD1-CD2 3.58Å; F451-L554 HydrophobicContact CD2-CD2 3.91Å; F451-L554 HydrophobicContact CE1-CD2 3.53Å; F451-L554 HydrophobicContact CE2-CD2 3.89Å; F451-L554 HydrophobicContact CG-CD2 3.77Å; F451-L554 HydrophobicContact CZ-CD2 3.7Å; F451-P555 HydrophobicContact CB-CG 3.98Å
452I95.1Very high92.6Very high58 Ų5826.5 Ų26.530%0.29713%0.134SC..Hα-helixtrans-61.9-48.4173.8-70.2170.5000109.9L448 R449 A450 N455 L456 P555L448-I452 HydrophobicContact CD1-CD1 3.75Å; L448-I452 HydrophobicContact CD1-CG1 4.13Å; L448-I452 HydrophobicContact CG-CD1 4Å; L448-I452 WeakPolarHBondContact O-CG1 3.48Å; L448-I452 PolarHBondContact O-N 3.4Å; R449-I452 PolarHBondContact O-N 3.27Å; A450-I452 PolarHBondContact O-N 3.37Å; I452-N455 PolarHBondContact O-N 2.86Å; I452-L456 HydrophobicContact CG2-CD1 3.83Å; I452-L456 HydrophobicContact CG2-CG 4.36Å; I452-L456 WeakPolarHBondContact O-CB 3.25Å; I452-L456 VanDerWaalsContact O-CG 3.28Å; I452-L456 WeakPolarHBondContact O-CG 3.3Å; I452-L456 PolarHBondContact O-N 3.32Å; I452-P555 HydrophobicContact CD1-CB 4.43Å; I452-P555 HydrophobicContact CG1-CB 3.73Å; I452-P555 HydrophobicContact CG1-CG 4.09Å
453L95Very high93.1Very high64 Ų6429.1 Ų29.134%0.33515%0.151SC..Hα-helixtrans-60.3-48.5179.1-179.962.1000111.3I409 R449 A450 N455 L456 L457 F486I409-L453 HydrophobicContact CD1-CD2 3.99Å; R449-L453 WeakPolarHBondContact O-CB 3.3Å; R449-L453 PolarHBondContact O-N 2.78Å; A450-L453 PolarHBondContact O-N 3.43Å; L453-N455 PolarHBondContact O-N 3.47Å; L453-L456 PolarHBondContact O-N 3.43Å; L453-L457 HydrophobicContact CD1-CD1 4.21Å; L453-L457 HydrophobicContact CD1-CG 4.36Å; L453-L457 HydrophobicContact CG-CD1 4.09Å; L453-L457 VanDerWaalsContact O-CG 3.29Å; L453-L457 WeakPolarHBondContact O-CG 3.19Å; L453-L457 PolarHBondContact O-N 3.42Å; L453-F486 HydrophobicContact CD2-CD2 4.46Å; L453-F486 HydrophobicContact CD2-CE2 3.86Å; L453-F486 HydrophobicContact CG-CE2 4.29Å
454T94.6Very high93.5Very high0 Ų027.4 Ų27.40%015%0.145CC..Hα-helixtrans-59.8-44.4179-54.70000112.1A450 L457 L458 V483 F486 I487A450-T454 PolarHBondContact O-N 3.01Å; A450-T454 PolarHBondContact O-OG1 3.06Å; T454-L457 PolarHBondContact O-N 3.36Å; T454-L458 WeakPolarHBondContact O-CB 3.38Å; T454-L458 PolarHBondContact O-N 3Å; T454-V483 HydrophobicContact CG2-CG1 4.28Å; T454-F486 HydrophobicContact CG2-CB 4.05Å; T454-F486 WeakPolarHBondContact OG1-CB 3.37Å; T454-I487 HydrophobicContact CG2-CB 4.13Å; T454-I487 HydrophobicContact CG2-CD1 4.18Å
455N95.7Very high93.7Very high2 Ų227.9 Ų27.91%0.01115%0.148CC..Hα-helixtrans-68.8-37.3179.1-78.7-58.2000112.5F451 I452 L453 L457 L458 V459 G551 F552F451-N455 WeakPolarHBondContact O-CB 3.39Å; F451-N455 PolarHBondContact O-N 3.36Å; F451-N455 PolarHBondContact O-ND2 3.18Å; I452-N455 PolarHBondContact O-N 2.86Å; L453-N455 PolarHBondContact O-N 3.47Å; N455-L457 VanDerWaalsContact C-N 3.35Å; N455-L458 PolarHBondContact O-N 3.28Å; N455-V459 WeakPolarHBondContact O-CG2 3.45Å; N455-V459 PolarHBondContact O-N 3.04Å; N455-G551 PolarHBondContact ND2-O 2.8Å; N455-F552 HydrophobicContact CB-CD1 4.28Å; N455-F552 HydrophobicContact CB-CD2 4.34Å; N455-F552 HydrophobicContact CB-CE1 3.85Å; N455-F552 HydrophobicContact CB-CE2 3.91Å; N455-F552 HydrophobicContact CB-CZ 3.64Å
456L96.6Very high93.8Very high100 Ų10029.3 Ų29.352%0.52416%0.156SC..Hα-helixtrans-62.3-43.2173.6-73.6171.8000111.5I452 L453 L458 V459 G460 F552I452-L456 HydrophobicContact CG2-CD1 3.83Å; I452-L456 HydrophobicContact CG2-CG 4.36Å; I452-L456 WeakPolarHBondContact O-CB 3.25Å; I452-L456 VanDerWaalsContact O-CG 3.28Å; I452-L456 WeakPolarHBondContact O-CG 3.3Å; I452-L456 PolarHBondContact O-N 3.32Å; L453-L456 PolarHBondContact O-N 3.43Å; L456-L458 VanDerWaalsContact C-N 3.35Å; L456-V459 PolarHBondContact O-N 2.87Å; L456-G460 PolarHBondContact O-N 3.35Å; L456-F552 HydrophobicContact CD2-CE1 4.29Å; L456-F552 HydrophobicContact CD2-CZ 4.04Å; L456-F552 HydrophobicContact CG-CE1 4.37Å; L456-F552 HydrophobicContact CG-CZ 4.31Å
457L96.3Very high93.8Very high40 Ų4032.8 Ų32.821%0.20917%0.174CC..Hα-helixtrans-65.7-37175.5-66.8171.3000112L453 T454 N455 G460 F461 L479 V482 V483 F486L453-L457 HydrophobicContact CD1-CD1 4.21Å; L453-L457 HydrophobicContact CD1-CG 4.36Å; L453-L457 HydrophobicContact CG-CD1 4.09Å; L453-L457 VanDerWaalsContact O-CG 3.29Å; L453-L457 WeakPolarHBondContact O-CG 3.19Å; L453-L457 PolarHBondContact O-N 3.42Å; T454-L457 PolarHBondContact O-N 3.36Å; N455-L457 VanDerWaalsContact C-N 3.35Å; L457-G460 PolarHBondContact O-N 2.98Å; L457-F461 WeakPolarHBondContact O-CB 3.43Å; L457-F461 PolarHBondContact O-N 3.41Å; L457-L479 HydrophobicContact CD2-CD2 3.81Å; L457-V482 HydrophobicContact CD1-CG1 3.71Å; L457-V483 HydrophobicContact CB-CG2 3.55Å; L457-F486 HydrophobicContact CD1-CD2 3.91Å; L457-F486 HydrophobicContact CD1-CE2 3.79Å
458L96.6Very high93.5Very high1 Ų137.9 Ų37.91%0.00521%0.207CC..Hα-helixtrans-65.3-40.3175.3178.265000112.3T359 R362 T454 N455 L456 F461 G462 V483T359-L458 HydrophobicContact CG2-CD1 4.25Å; T359-L458 HydrophobicContact CG2-CD2 4.19Å; T359-L458 WeakPolarHBondContact OG1-CD2 3.26Å; R362-L458 PolarHBondContact NH1-O 3.46Å; T454-L458 WeakPolarHBondContact O-CB 3.38Å; T454-L458 PolarHBondContact O-N 3Å; N455-L458 PolarHBondContact O-N 3.28Å; L456-L458 VanDerWaalsContact C-N 3.35Å; L458-F461 HydrophobicContact CD1-CD1 4.3Å; L458-G462 PolarHBondContact O-N 2.8Å; L458-V483 HydrophobicContact CB-CG1 4.14Å; L458-V483 HydrophobicContact CB-CG2 4.32Å; L458-V483 HydrophobicContact CD1-CG1 4.05Å
459V96.5Very high93.3Very high32 Ų3240.1 Ų40.119%0.19422%0.219CC..Hα-helixtrans-65.8-44.6172.6170.40000110.4N455 L456 F461 G462 V463 L545 L549 F552N455-V459 WeakPolarHBondContact O-CG2 3.45Å; N455-V459 PolarHBondContact O-N 3.04Å; L456-V459 PolarHBondContact O-N 2.87Å; V459-F461 PolarHBondContact O-N 3.43Å; V459-G462 CarbonylContact O-C 3.58Å; V459-G462 WeakPolarHBondContact O-CA 3.34Å; V459-G462 PolarHBondContact O-N 2.92Å; V459-V463 HydrophobicContact CG1-CG2 4.39Å; V459-V463 WeakPolarHBondContact O-CG2 3.49Å; V459-V463 PolarHBondContact O-N 2.97Å; V459-L545 HydrophobicContact CG1-CD1 4.25Å; V459-L549 HydrophobicContact CG2-CD2 3.85Å; V459-F552 HydrophobicContact CG2-CE2 3.83Å; V459-F552 HydrophobicContact CG2-CZ 4.38Å
460G95.9Very high93Very high26 Ų2635.5 Ų35.527%0.26820%0.204SC..Hα-helixtrans-55.4-49.8174.900000112.2L456 L457 G462 V463 T464L456-G460 PolarHBondContact O-N 3.35Å; L457-G460 PolarHBondContact O-N 2.98Å; G460-G462 PolarHBondContact O-N 3.02Å; G460-V463 PolarHBondContact O-N 3.32Å; G460-V463 VanDerWaalsContact O-N 3.17Å; G460-T464 WeakPolarHBondContact O-CG2 3.45Å; G460-T464 PolarHBondContact O-N 3.13Å; G460-T464 PolarHBondContact O-OG1 3.44Å
461F96Very high92.8Very high1 Ų141.5 Ų41.50%0.00423%0.232CC..Hα-helixtrans-54.1-41.7173.3167.7-120.6000111.3R362 L363 Y366 L457 L458 V459 T464 C465 S476 L479 H480R362-F461 HydrophobicContact CG-CE1 4.07Å; L363-F461 HydrophobicContact CD2-CE1 4.46Å; Y366-F461 HydrophobicContact CD1-CE2 4.32Å; Y366-F461 HydrophobicContact CD1-CZ 4Å; Y366-F461 HydrophobicContact CD2-CE2 4.25Å; Y366-F461 AromaticContact CD2-CZ 3.81Å; Y366-F461 HydrophobicContact CD2-CZ 3.81Å; Y366-F461 HydrophobicContact CE1-CE2 4.28Å; Y366-F461 HydrophobicContact CE1-CZ 4.41Å; Y366-F461 HydrophobicContact CE2-CE2 4.21Å; Y366-F461 HydrophobicContact CE2-CZ 4.23Å; Y366-F461 HydrophobicContact CG-CE2 4.29Å; Y366-F461 AromaticContact CG-CZ 3.66Å; Y366-F461 HydrophobicContact CG-CZ 3.66Å; L457-F461 WeakPolarHBondContact O-CB 3.43Å; L457-F461 PolarHBondContact O-N 3.41Å; L458-F461 HydrophobicContact CD1-CD1 4.3Å; V459-F461 PolarHBondContact O-N 3.43Å; F461-T464 PolarHBondContact O-N 3.38Å; F461-T464 PolarHBondContact O-OG1 2.88Å; F461-C465 WeakPolarHBondContact CE2-SG 3.48Å; F461-C465 PolarHBondContact O-N 3.39Å; F461-C465 VanDerWaalsContact O-N 3.1Å; F461-C465 PolarHBondContact O-SG 3.09Å; F461-S476 WeakPolarHBondContact CD2-O 3.45Å; F461-L479 HydrophobicContact CB-CB 3.84Å; F461-L479 HydrophobicContact CD2-CB 4.46Å; F461-H480 HydrophobicContact CD2-CB 3.96Å; F461-H480 HydrophobicContact CE2-CB 3.68Å; F461-H480 HydrophobicContact CZ-CB 4.11Å; F461-H480 AromaticContact CZ-CD2 3.85Å
462G93.4Very high92.6Very high0 Ų044.1 Ų44.10%025%0.246CC..Hα-helixtrans-68.9-37179.300000115.6L458 V459 G460 L466L458-G462 PolarHBondContact O-N 2.8Å; V459-G462 CarbonylContact O-C 3.58Å; V459-G462 WeakPolarHBondContact O-CA 3.34Å; V459-G462 PolarHBondContact O-N 2.92Å; G460-G462 PolarHBondContact O-N 3.02Å; G462-L466 WeakPolarHBondContact O-CG 3.26Å; G462-L466 PolarHBondContact O-N 3.3Å
463V94.7Very high92.3Very high70 Ų7041.6 Ų41.642%0.42423%0.233SC..Hα-helixtrans-68.9-41.1175.5173.80000110.4V459 G460 C465 L466 L545V459-V463 HydrophobicContact CG1-CG2 4.39Å; V459-V463 WeakPolarHBondContact O-CG2 3.49Å; V459-V463 PolarHBondContact O-N 2.97Å; G460-V463 PolarHBondContact O-N 3.32Å; G460-V463 VanDerWaalsContact O-N 3.17Å; V463-C465 VanDerWaalsContact C-N 3.31Å; V463-C465 PolarHBondContact O-N 3.37Å; V463-L466 WeakPolarHBondContact O-CB 3.44Å; V463-L466 PolarHBondContact O-N 3.38Å; V463-L466 VanDerWaalsContact O-N 3.15Å; V463-L545 HydrophobicContact CG2-CD2 4.32Å
464T93.5Very high92.2Very high22 Ų2241.4 Ų41.414%0.13523%0.231CC..Hα-helixtrans-66.4-33.2178.557.90000112.2G460 F461 L466 I467 I475 S476 L479G460-T464 WeakPolarHBondContact O-CG2 3.45Å; G460-T464 PolarHBondContact O-N 3.13Å; G460-T464 PolarHBondContact O-OG1 3.44Å; F461-T464 PolarHBondContact O-N 3.38Å; F461-T464 PolarHBondContact O-OG1 2.88Å; T464-L466 VanDerWaalsContact C-N 3.26Å; T464-L466 PolarHBondContact O-N 3.01Å; T464-I467 PolarHBondContact O-N 2.86Å; T464-I475 HydrophobicContact CG2-CG2 4.26Å; T464-S476 WeakPolarHBondContact CB-OG 3.45Å; T464-S476 PolarHBondContact OG1-OG 3.3Å; T464-L479 HydrophobicContact CG2-CD1 4.08Å
465C90.6Very high92.2Very high11 Ų1145.3 Ų45.37%0.07425%0.251CS..THydrogen-bonded Turntrans-69.1-17.5173.8-71.20000114.6Y366 F461 V463Y366-C465 VanDerWaalsContact CE2-SG 3.57Å; F461-C465 WeakPolarHBondContact CE2-SG 3.48Å; F461-C465 PolarHBondContact O-N 3.39Å; F461-C465 VanDerWaalsContact O-N 3.1Å; F461-C465 PolarHBondContact O-SG 3.09Å; V463-C465 VanDerWaalsContact C-N 3.31Å; V463-C465 PolarHBondContact O-N 3.37Å
466L90.4Very high92.1Very high36 Ų3645.2 Ų45.219%0.18825%0.251CS..THydrogen-bonded Turntrans-81.7-18.3176.2-69.8173.8000113.1G462 V463 T464 P468 F538 N541 I542 L545G462-L466 WeakPolarHBondContact O-CG 3.26Å; G462-L466 PolarHBondContact O-N 3.3Å; V463-L466 WeakPolarHBondContact O-CB 3.44Å; V463-L466 PolarHBondContact O-N 3.38Å; V463-L466 VanDerWaalsContact O-N 3.15Å; T464-L466 VanDerWaalsContact C-N 3.26Å; T464-L466 PolarHBondContact O-N 3.01Å; L466-P468 WeakPolarHBondContact O-CD 3.43Å; L466-F538 HydrophobicContact CD2-CD2 4.04Å; L466-F538 HydrophobicContact CD2-CE2 4.14Å; L466-N541 HydrophobicContact CD2-CB 3.71Å; L466-I542 HydrophobicContact CD1-CG1 4.36Å; L466-I542 HydrophobicContact CD2-CG1 3.6Å; L466-L545 HydrophobicContact CD1-CD2 3.64Å
467I89.2Confident92Very high75 Ų7540.4 Ų40.439%0.38523%0.226SC..SBendtrans-92.2115.2-177.2-56.4171000108T464 N469 L472T464-I467 PolarHBondContact O-N 2.86Å; I467-N469 HydrophobicContact CG2-CB 4.12Å; I467-N469 PolarHBondContact O-N 3Å; I467-L472 HydrophobicContact CB-CD1 4.18Å; I467-L472 HydrophobicContact CD1-CD1 4.21Å; I467-L472 HydrophobicContact CG2-CD1 3.67Å
468P84.3Confident91.9Very high108 Ų10841.7 Ų41.770%0.70123%0.232SC*.  trans-77.174.6179.832.4-35000110.1L377 L466L377-P468 HydrophobicContact CD2-CB 3.69Å; L466-P468 WeakPolarHBondContact O-CD 3.43Å
469N87.9Confident91.9Very high58 Ų5843.1 Ų43.131%0.3124%0.239SC..  trans-136.5124.1177.2179-74.2000110.2I467 Q471 L472 Q473I467-N469 HydrophobicContact CG2-CB 4.12Å; I467-N469 PolarHBondContact O-N 3Å; N469-Q471 PolarHBondContact ND2-OE1 3.44Å; N469-Q471 PolarHBondContact O-N 3Å; N469-Q471 PolarHBondContact OD1-N 3.1Å; N469-Q471 PolarHBondContact OD1-OE1 3.32Å; N469-L472 HydrophobicContact CB-CB 4.05Å; N469-L472 HydrophobicContact CB-CD1 3.86Å; N469-L472 HydrophobicContact CB-CG 4.02Å; N469-L472 PolarHBondContact O-N 2.84Å; N469-L472 PolarHBondContact OD1-N 2.64Å; N469-Q473 PolarHBondContact O-N 3.2Å
470L85.1Confident91.8Very high42 Ų4241.6 Ų41.622%0.2223%0.23CC..Hα-helixtrans-63-41.2-174.3-173.465.9000112.6L374 T384 Y388 Q473L374-L470 HydrophobicContact CD2-CD1 4.3Å; T384-L470 HydrophobicContact CG2-CD2 4.01Å; Y388-L470 HydrophobicContact CD1-CD1 4Å; Y388-L470 HydrophobicContact CD2-CD1 4.18Å; Y388-L470 HydrophobicContact CE1-CD1 3.77Å; Y388-L470 HydrophobicContact CE1-CG 3.85Å; Y388-L470 VanDerWaalsContact CE1-O 3.3Å; Y388-L470 WeakPolarHBondContact CE1-O 3.27Å; Y388-L470 HydrophobicContact CE2-CD1 3.96Å; Y388-L470 HydrophobicContact CE2-CD2 3.87Å; Y388-L470 HydrophobicContact CE2-CG 3.89Å; Y388-L470 HydrophobicContact CG-CD1 4.21Å; Y388-L470 VanDerWaalsContact CZ-CG 3.47Å; Y388-L470 WeakPolarHBondContact OH-CG 3.29Å; L470-Q473 WeakPolarHBondContact O-CB 3.37Å; L470-Q473 PolarHBondContact O-N 3.38Å
471Q87.9Confident91.6Very high126 Ų12640.4 Ų40.459%0.58922%0.218SC*.Hα-helixtrans-68.7-37.1178.8-60.588.4-8.900112N469 Q473 I474N469-Q471 PolarHBondContact ND2-OE1 3.44Å; N469-Q471 PolarHBondContact O-N 3Å; N469-Q471 PolarHBondContact OD1-N 3.1Å; N469-Q471 PolarHBondContact OD1-OE1 3.32Å; Q471-Q473 PolarHBondContact O-N 2.95Å; Q471-I474 PolarHBondContact O-N 2.9Å
472L89.4Confident91.5Very high55 Ų5541.3 Ų41.329%0.28822%0.224SC..Hα-helixtrans-66.2-22.4176.3-69.9179.6000112.8I467 N469 I474 I475 S476I467-L472 HydrophobicContact CB-CD1 4.18Å; I467-L472 HydrophobicContact CD1-CD1 4.21Å; I467-L472 HydrophobicContact CG2-CD1 3.67Å; N469-L472 HydrophobicContact CB-CB 4.05Å; N469-L472 HydrophobicContact CB-CD1 3.86Å; N469-L472 HydrophobicContact CB-CG 4.02Å; N469-L472 PolarHBondContact O-N 2.84Å; N469-L472 PolarHBondContact OD1-N 2.64Å; L472-I474 PolarHBondContact O-N 3.13Å; L472-I475 HydrophobicContact CD2-CD1 3.88Å; L472-I475 WeakPolarHBondContact O-CB 3.31Å; L472-I475 PolarHBondContact O-N 2.93Å; L472-S476 PolarHBondContact O-N 3.27Å
473Q89.8Confident91.6Very high4 Ų441.3 Ų41.32%0.01922%0.224CC..Hα-helixtrans-61.8-28.6175.2-66.9-58.4-21.500113Y366 L377 N469 L470 Q471 I475 S476 F477Y366-Q473 PolarHBondContact OH-OE1 3.42Å; L377-Q473 HydrophobicContact CD1-CG 4Å; N469-Q473 PolarHBondContact O-N 3.2Å; L470-Q473 WeakPolarHBondContact O-CB 3.37Å; L470-Q473 PolarHBondContact O-N 3.38Å; Q471-Q473 PolarHBondContact O-N 2.95Å; Q473-I475 PolarHBondContact O-N 3.17Å; Q473-S476 CarbonylContact O-C 3.27Å; Q473-S476 WeakPolarHBondContact O-CA 3.47Å; Q473-S476 VanDerWaalsContact O-CB 3.31Å; Q473-S476 WeakPolarHBondContact O-CB 3.38Å; Q473-S476 PolarHBondContact O-N 2.83Å; Q473-S476 VanDerWaalsContact O-N 3.1Å; Q473-F477 HydrophobicContact CB-CE1 4.27Å; Q473-F477 HydrophobicContact CB-CZ 4.13Å; Q473-F477 VanDerWaalsContact O-CD1 3.22Å; Q473-F477 WeakPolarHBondContact O-CD1 3.46Å; Q473-F477 WeakPolarHBondContact O-CG 3.42Å; Q473-F477 PolarHBondContact O-N 3.28Å
474I92.3Very high91.4Very high60 Ų6038.2 Ų38.231%0.30820%0.204SC..Hα-helixtrans-62.1-37.7174.5-58.1176.8000110.5Y388 L395 Q471 L472 F477 I478Y388-I474 HydrophobicContact CE1-CD1 4.33Å; Y388-I474 HydrophobicContact CE1-CG1 3.95Å; L395-I474 HydrophobicContact CD1-CG2 4.34Å; Q471-I474 PolarHBondContact O-N 2.9Å; L472-I474 PolarHBondContact O-N 3.13Å; I474-F477 WeakPolarHBondContact O-CB 3.42Å; I474-F477 PolarHBondContact O-N 3.39Å; I474-I478 HydrophobicContact CG2-CD1 4.41Å; I474-I478 WeakPolarHBondContact O-CG1 3.48Å; I474-I478 PolarHBondContact O-N 3.5Å; I474-I478 VanDerWaalsContact O-N 3.1Å
475I93.9Very high91.2Very high82 Ų8237.2 Ų37.242%0.42120%0.198SC..Hα-helixtrans-67.4-42.2174.9-57.5178.9000109.9T464 L472 Q473 F477 I478 L479T464-I475 HydrophobicContact CG2-CG2 4.26Å; L472-I475 HydrophobicContact CD2-CD1 3.88Å; L472-I475 WeakPolarHBondContact O-CB 3.31Å; L472-I475 PolarHBondContact O-N 2.93Å; Q473-I475 PolarHBondContact O-N 3.17Å; I475-F477 VanDerWaalsContact C-N 3.29Å; I475-F477 PolarHBondContact O-N 3.35Å; I475-I478 PolarHBondContact O-N 3Å; I475-L479 HydrophobicContact CG2-CD1 3.93Å; I475-L479 HydrophobicContact CG2-CG 4.29Å; I475-L479 WeakPolarHBondContact O-CG 3.4Å; I475-L479 PolarHBondContact O-N 3.44Å
476S93.8Very high91.2Very high0 Ų037.2 Ų37.20%020%0.197CC..Hα-helixtrans-56.6-42.8173-58.40000111.8F461 T464 L472 Q473 I478 L479 H480F461-S476 WeakPolarHBondContact CD2-O 3.45Å; T464-S476 WeakPolarHBondContact CB-OG 3.45Å; T464-S476 PolarHBondContact OG1-OG 3.3Å; L472-S476 PolarHBondContact O-N 3.27Å; Q473-S476 CarbonylContact O-C 3.27Å; Q473-S476 WeakPolarHBondContact O-CA 3.47Å; Q473-S476 VanDerWaalsContact O-CB 3.31Å; Q473-S476 WeakPolarHBondContact O-CB 3.38Å; Q473-S476 PolarHBondContact O-N 2.83Å; Q473-S476 VanDerWaalsContact O-N 3.1Å; S476-I478 PolarHBondContact O-N 3.36Å; S476-L479 PolarHBondContact O-N 3.15Å; S476-H480 WeakPolarHBondContact O-CB 3.39Å; S476-H480 PolarHBondContact O-N 3.43Å
477F94.3Very high91.3Very high0 Ų035.5 Ų35.50%019%0.188CC..Hα-helixtrans-61.6-43.6177.3-60-19.2000112.4Y366 M370 L374 Y388 I391 F392 L395 Q473 I474 I475 T481Y366-F477 HydrophobicContact CE1-CD1 4.13Å; Y366-F477 HydrophobicContact CE1-CE1 4.27Å; Y366-F477 VanDerWaalsContact OH-CD1 3.3Å; Y366-F477 WeakPolarHBondContact OH-CD1 3.39Å; Y366-F477 WeakPolarHBondContact OH-CE1 3.38Å; M370-F477 HydrophobicContact CG-CE1 4.46Å; M370-F477 HydrophobicContact SD-CE1 3.94Å; M370-F477 HydrophobicContact SD-CZ 4.36Å; L374-F477 HydrophobicContact CD1-CZ 4.44Å; L374-F477 HydrophobicContact CD2-CZ 4.41Å; Y388-F477 AromaticContact CD1-CE2 3.83Å; Y388-F477 HydrophobicContact CD1-CE2 3.83Å; Y388-F477 HydrophobicContact CD1-CZ 4.12Å; I391-F477 HydrophobicContact CG2-CD2 4.35Å; F392-F477 HydrophobicContact CB-CD1 4.12Å; F392-F477 HydrophobicContact CB-CD2 3.92Å; F392-F477 HydrophobicContact CB-CE1 4.16Å; F392-F477 HydrophobicContact CB-CE2 3.98Å; F392-F477 HydrophobicContact CB-CG 4Å; F392-F477 HydrophobicContact CB-CZ 4.1Å; F392-F477 HydrophobicContact CD2-CB 3.79Å; F392-F477 AromaticContact CD2-CD1 3.46Å; F392-F477 HydrophobicContact CD2-CD1 3.46Å; F392-F477 VanDerWaalsContact CD2-CD1 3.46Å; F392-F477 HydrophobicContact CD2-CD2 4.42Å; F392-F477 HydrophobicContact CD2-CE1 4.1Å; F392-F477 AromaticContact CD2-CG 3.65Å; F392-F477 HydrophobicContact CD2-CG 3.65Å; F392-F477 HydrophobicContact CE2-CD1 4.24Å; F392-F477 HydrophobicContact CG-CD1 4.16Å; F392-F477 HydrophobicContact CG-CE1 4.42Å; F392-F477 HydrophobicContact CG-CG 4.31Å; L395-F477 HydrophobicContact CD1-CB 3.63Å; L395-F477 HydrophobicContact CD1-CD2 4.04Å; L395-F477 HydrophobicContact CD1-CG 4.36Å; Q473-F477 HydrophobicContact CB-CE1 4.27Å; Q473-F477 HydrophobicContact CB-CZ 4.13Å; Q473-F477 VanDerWaalsContact O-CD1 3.22Å; Q473-F477 WeakPolarHBondContact O-CD1 3.46Å; Q473-F477 WeakPolarHBondContact O-CG 3.42Å; Q473-F477 PolarHBondContact O-N 3.28Å; I474-F477 WeakPolarHBondContact O-CB 3.42Å; I474-F477 PolarHBondContact O-N 3.39Å; I475-F477 VanDerWaalsContact C-N 3.29Å; I475-F477 PolarHBondContact O-N 3.35Å; F477-T481 WeakPolarHBondContact O-CB 3.28Å; F477-T481 PolarHBondContact O-N 3.11Å; F477-T481 PolarHBondContact O-OG1 3.17Å
478I94.9Very high91.1Very high67 Ų6734 Ų3434%0.34418%0.179SC..Hα-helixtrans-64.7-49.4177-66.3167.2000110.1L395 L398 I474 I475 S476 H480 T481 V482L395-I478 HydrophobicContact CD1-CG1 4.26Å; L395-I478 HydrophobicContact CD2-CG1 4.25Å; L398-I478 HydrophobicContact CD1-CG1 4.42Å; I474-I478 HydrophobicContact CG2-CD1 4.41Å; I474-I478 WeakPolarHBondContact O-CG1 3.48Å; I474-I478 PolarHBondContact O-N 3.5Å; I474-I478 VanDerWaalsContact O-N 3.1Å; I475-I478 PolarHBondContact O-N 3Å; S476-I478 PolarHBondContact O-N 3.36Å; I478-H480 PolarHBondContact O-N 3.1Å; I478-T481 WeakPolarHBondContact O-CB 3.49Å; I478-T481 PolarHBondContact O-N 3.49Å; I478-V482 HydrophobicContact CG2-CG2 4.36Å; I478-V482 VanDerWaalsContact O-CG2 3.29Å; I478-V482 WeakPolarHBondContact O-CG2 3.36Å; I478-V482 PolarHBondContact O-N 3.31Å
479L95.4Very high91.2Very high30 Ų3029.4 Ų29.416%0.15715%0.149CC..Hα-helixtrans-61.6-45.5-179.8-70172000111.6L457 F461 T464 I475 S476 T481 V482 V483L457-L479 HydrophobicContact CD2-CD2 3.81Å; F461-L479 HydrophobicContact CB-CB 3.84Å; F461-L479 HydrophobicContact CD2-CB 4.46Å; T464-L479 HydrophobicContact CG2-CD1 4.08Å; I475-L479 HydrophobicContact CG2-CD1 3.93Å; I475-L479 HydrophobicContact CG2-CG 4.29Å; I475-L479 WeakPolarHBondContact O-CG 3.4Å; I475-L479 PolarHBondContact O-N 3.44Å; S476-L479 PolarHBondContact O-N 3.15Å; L479-T481 VanDerWaalsContact C-N 3.31Å; L479-T481 PolarHBondContact O-N 3.26Å; L479-V482 PolarHBondContact O-N 2.85Å; L479-V483 WeakPolarHBondContact O-CB 3.4Å; L479-V483 WeakPolarHBondContact O-CG2 3.26Å; L479-V483 PolarHBondContact O-N 3.5Å
480H94.7Very high91.2Very high0 Ų026.6 Ų26.60%013%0.134CC..Hα-helixtrans-52.1-51172.9172.2-82.5000111.4L363 Y366 F392 F461 S476 I478 V482 V483 R484L363-H480 WeakPolarHBondContact CD2-CD2 3.21Å; L363-H480 PolarHBondContact O-NE2 3.34Å; Y366-H480 AromaticContact CD1-CD2 3.82Å; F392-H480 AromaticContact CE2-CE1 3.93Å; F392-H480 AromaticContact CE2-CG 3.99Å; F392-H480 AromaticContact CE2-ND1 3.52Å; F392-H480 AromaticContact CZ-CE1 3.59Å; F392-H480 AromaticContact CZ-ND1 3.68Å; F461-H480 HydrophobicContact CD2-CB 3.96Å; F461-H480 HydrophobicContact CE2-CB 3.68Å; F461-H480 HydrophobicContact CZ-CB 4.11Å; F461-H480 AromaticContact CZ-CD2 3.85Å; S476-H480 WeakPolarHBondContact O-CB 3.39Å; S476-H480 PolarHBondContact O-N 3.43Å; I478-H480 PolarHBondContact O-N 3.1Å; H480-V482 PolarHBondContact O-N 3.46Å; H480-V483 PolarHBondContact O-N 3.3Å; H480-R484 WeakPolarHBondContact O-CB 3.43Å; H480-R484 PolarHBondContact O-N 3.14Å
481T93Very high91.4Very high1 Ų124.8 Ų24.81%0.00613%0.125CC..Hα-helixtrans-61.5-46.1-178-59.80000111.6L395 L398 C399 F477 I478 L479 R484 G485L395-T481 WeakPolarHBondContact O-CG2 3.29Å; L398-T481 HydrophobicContact CB-CG2 4.08Å; C399-T481 HydrophobicContact CB-CG2 4.39Å; C399-T481 WeakPolarHBondContact SG-CG2 3.39Å; C399-T481 PolarHBondContact SG-O 3.42Å; F477-T481 WeakPolarHBondContact O-CB 3.28Å; F477-T481 PolarHBondContact O-N 3.11Å; F477-T481 PolarHBondContact O-OG1 3.17Å; I478-T481 WeakPolarHBondContact O-CB 3.49Å; I478-T481 PolarHBondContact O-N 3.49Å; L479-T481 VanDerWaalsContact C-N 3.31Å; L479-T481 PolarHBondContact O-N 3.26Å; T481-R484 PolarHBondContact O-N 2.99Å; T481-G485 PolarHBondContact O-N 3.35Å
482V93.6Very high91.2Very high21 Ų2119.7 Ų19.713%0.12711%0.106CC..Hα-helixtrans-63.5-48.1179.1177.40000111.1T402 L457 I478 L479 H480 R484 G485 F486T402-V482 HydrophobicContact CG2-CG2 3.99Å; L457-V482 HydrophobicContact CD1-CG1 3.71Å; I478-V482 HydrophobicContact CG2-CG2 4.36Å; I478-V482 VanDerWaalsContact O-CG2 3.29Å; I478-V482 WeakPolarHBondContact O-CG2 3.36Å; I478-V482 PolarHBondContact O-N 3.31Å; L479-V482 PolarHBondContact O-N 2.85Å; H480-V482 PolarHBondContact O-N 3.46Å; V482-R484 VanDerWaalsContact C-N 3.29Å; V482-R484 PolarHBondContact O-N 3.15Å; V482-G485 PolarHBondContact O-N 3.41Å; V482-F486 HydrophobicContact CG1-CD1 4.01Å; V482-F486 HydrophobicContact CG1-CD2 3.89Å; V482-F486 HydrophobicContact CG1-CE1 3.73Å; V482-F486 HydrophobicContact CG1-CE2 3.6Å; V482-F486 HydrophobicContact CG1-CG 4.1Å; V482-F486 HydrophobicContact CG1-CZ 3.52Å; V482-F486 WeakPolarHBondContact O-CB 3.48Å; V482-F486 VanDerWaalsContact O-CD1 3.26Å; V482-F486 WeakPolarHBondContact O-CD1 3.39Å; V482-F486 VanDerWaalsContact O-CG 3.3Å; V482-F486 WeakPolarHBondContact O-CG 3.21Å; V482-F486 PolarHBondContact O-N 2.89Å
483V95.1Very high90.8Very high0 Ų018.3 Ų18.30%011%0.105CC..Hα-helixtrans-59.4-41.7-179.1171.30000111.2T359 L363 T454 L457 L458 L479 H480 F486 I487T359-V483 HydrophobicContact CG2-CG1 3.81Å; L363-V483 HydrophobicContact CD2-CG1 4.39Å; T454-V483 HydrophobicContact CG2-CG1 4.28Å; L457-V483 HydrophobicContact CB-CG2 3.55Å; L458-V483 HydrophobicContact CB-CG1 4.14Å; L458-V483 HydrophobicContact CB-CG2 4.32Å; L458-V483 HydrophobicContact CD1-CG1 4.05Å; L479-V483 WeakPolarHBondContact O-CB 3.4Å; L479-V483 WeakPolarHBondContact O-CG2 3.26Å; L479-V483 PolarHBondContact O-N 3.5Å; H480-V483 PolarHBondContact O-N 3.3Å; V483-F486 PolarHBondContact O-N 3.36Å; V483-I487 PolarHBondContact O-N 2.71Å
484R91.3Very high90.7Very high5 Ų518.1 Ų18.12%0.01910%0.104CC..Hα-helixtrans-60.6-46.3178.8-178.2171.6163.4-154.4-20.3112.8L31 A216 L363 H480 T481 V482 F486 H488L31-R484 VanDerWaalsContact CD1-CZ 3.41Å; A216-R484 PolarHBondContact O-NH2 3.02Å; L363-R484 HydrophobicContact CD1-CB 3.86Å; L363-R484 HydrophobicContact CD1-CG 4.23Å; H480-R484 WeakPolarHBondContact O-CB 3.43Å; H480-R484 PolarHBondContact O-N 3.14Å; T481-R484 PolarHBondContact O-N 2.99Å; V482-R484 VanDerWaalsContact C-N 3.29Å; V482-R484 PolarHBondContact O-N 3.15Å; R484-F486 VanDerWaalsContact C-N 3.33Å; R484-H488 PolarHBondContact O-CD2 3.1Å
485G88.6Confident90.4Very high0 Ų015.3 Ų15.30%09%0.09CC..Hα-helixtrans-67.3-36175.700000112.6T481 V482 S489T481-G485 PolarHBondContact O-N 3.35Å; V482-G485 PolarHBondContact O-N 3.41Å; G485-S489 PolarHBondContact O-OG 3.18Å
486F91.2Very high89.7Confident12 Ų1214.1 Ų14.15%0.0539%0.092CC..Hα-helixtrans-73.1-41.1-174.3-78.620000113.2T402 I406 L453 T454 L457 V482 V483 R484 S489 A490T402-F486 VanDerWaalsContact O-CE1 3.31Å; T402-F486 WeakPolarHBondContact O-CE1 3.27Å; I406-F486 HydrophobicContact CB-CD1 3.69Å; I406-F486 HydrophobicContact CB-CD2 4.43Å; I406-F486 HydrophobicContact CB-CE1 3.77Å; I406-F486 HydrophobicContact CB-CG 4.03Å; I406-F486 HydrophobicContact CB-CZ 4.19Å; I406-F486 HydrophobicContact CD1-CD2 4.04Å; I406-F486 HydrophobicContact CD1-CE2 4.26Å; I406-F486 HydrophobicContact CD1-CG 4.29Å; I406-F486 HydrophobicContact CG1-CB 4.4Å; I406-F486 HydrophobicContact CG1-CD1 4.26Å; I406-F486 HydrophobicContact CG1-CD2 4.35Å; I406-F486 HydrophobicContact CG1-CG 4.09Å; I406-F486 HydrophobicContact CG2-CD1 3.7Å; I406-F486 HydrophobicContact CG2-CE1 4.05Å; I406-F486 HydrophobicContact CG2-CG 4.31Å; L453-F486 HydrophobicContact CD2-CD2 4.46Å; L453-F486 HydrophobicContact CD2-CE2 3.86Å; L453-F486 HydrophobicContact CG-CE2 4.29Å; T454-F486 HydrophobicContact CG2-CB 4.05Å; T454-F486 WeakPolarHBondContact OG1-CB 3.37Å; L457-F486 HydrophobicContact CD1-CD2 3.91Å; L457-F486 HydrophobicContact CD1-CE2 3.79Å; V482-F486 HydrophobicContact CG1-CD1 4.01Å; V482-F486 HydrophobicContact CG1-CD2 3.89Å; V482-F486 HydrophobicContact CG1-CE1 3.73Å; V482-F486 HydrophobicContact CG1-CE2 3.6Å; V482-F486 HydrophobicContact CG1-CG 4.1Å; V482-F486 HydrophobicContact CG1-CZ 3.52Å; V482-F486 WeakPolarHBondContact O-CB 3.48Å; V482-F486 VanDerWaalsContact O-CD1 3.26Å; V482-F486 WeakPolarHBondContact O-CD1 3.39Å; V482-F486 VanDerWaalsContact O-CG 3.3Å; V482-F486 WeakPolarHBondContact O-CG 3.21Å; V482-F486 PolarHBondContact O-N 2.89Å; V483-F486 PolarHBondContact O-N 3.36Å; R484-F486 VanDerWaalsContact C-N 3.33Å; F486-S489 PolarHBondContact O-N 3.13Å; F486-A490 VanDerWaalsContact O-CB 3.23Å; F486-A490 WeakPolarHBondContact O-CB 3.42Å; F486-A490 PolarHBondContact O-N 3.19Å
487I90.9Very high89Confident0 Ų014.7 Ų14.70%010%0.097CC..Hα-helixtrans-63.9-45.7-175.2-169.464.4000112.2T355 M356 T359 F451 T454 V483 S489 A490 V491T355-I487 HydrophobicContact CG2-CD1 4.16Å; M356-I487 HydrophobicContact SD-CG1 3.7Å; M356-I487 HydrophobicContact SD-CG2 4.33Å; T359-I487 HydrophobicContact CG2-CB 4.18Å; T359-I487 HydrophobicContact CG2-CG1 4.08Å; T359-I487 HydrophobicContact CG2-CG2 4.17Å; F451-I487 HydrophobicContact CD1-CD1 4.45Å; F451-I487 HydrophobicContact CE1-CD1 3.97Å; T454-I487 HydrophobicContact CG2-CB 4.13Å; T454-I487 HydrophobicContact CG2-CD1 4.18Å; V483-I487 PolarHBondContact O-N 2.71Å; I487-S489 VanDerWaalsContact C-N 3.33Å; I487-S489 PolarHBondContact O-N 3.35Å; I487-A490 PolarHBondContact O-N 3.45Å; I487-V491 WeakPolarHBondContact O-CG2 3.45Å; I487-V491 PolarHBondContact O-N 3.04Å
488H86.1Confident88.5Confident44 Ų4416 Ų1620%0.20411%0.105CC..Hα-helixtrans-64.2-39.5178.8-74.5-73.8000112I212 M356 R484 G492I212-H488 HydrophobicContact CG2-CB 4.17Å; M356-H488 WeakPolarHBondContact CE-CE1 3.13Å; R484-H488 PolarHBondContact O-CD2 3.1Å; H488-G492 PolarHBondContact O-N 3.21Å; H488-G492 VanDerWaalsContact O-N 3.16Å
489S85.3Confident87.9Confident10 Ų1014.1 Ų14.17%0.079%0.094CC..Hα-helixtrans-67.9-44.9177.1-580000112T403 G485 F486 I487 V491 G492 G493T403-S489 WeakPolarHBondContact CG2-OG 3.33Å; G485-S489 PolarHBondContact O-OG 3.18Å; F486-S489 PolarHBondContact O-N 3.13Å; I487-S489 VanDerWaalsContact C-N 3.33Å; I487-S489 PolarHBondContact O-N 3.35Å; S489-V491 PolarHBondContact O-N 3.14Å; S489-G492 PolarHBondContact O-N 2.95Å; S489-G493 PolarHBondContact O-N 3.37Å
490A89.1Confident87Confident0 Ų015.6 Ų15.60%011%0.105CC..Hα-helixtrans-61.5-42.8-179.500000112.3M410 A450 F451 F486 I487 L494M410-A490 VanDerWaalsContact CE-O 3.29Å; M410-A490 WeakPolarHBondContact CE-O 3.28Å; A450-A490 HydrophobicContact CB-CB 4.17Å; F451-A490 HydrophobicContact CD1-CB 4.42Å; F451-A490 HydrophobicContact CD2-CB 4.26Å; F451-A490 HydrophobicContact CE1-CB 4.16Å; F451-A490 HydrophobicContact CE2-CB 3.95Å; F451-A490 WeakPolarHBondContact CE2-O 3.39Å; F451-A490 HydrophobicContact CG-CB 4.47Å; F451-A490 HydrophobicContact CZ-CB 3.92Å; F486-A490 VanDerWaalsContact O-CB 3.23Å; F486-A490 WeakPolarHBondContact O-CB 3.42Å; F486-A490 PolarHBondContact O-N 3.19Å; I487-A490 PolarHBondContact O-N 3.45Å; A490-L494 WeakPolarHBondContact O-CB 3.27Å; A490-L494 PolarHBondContact O-N 3.06Å
491V89Confident85.6Confident4 Ų418.7 Ų18.72%0.02413%0.127CC..Hα-helixtrans-61.6-49.8173.3169.30000110.8F451 I487 S489 G493 L494 Y495F451-V491 HydrophobicContact CE1-CG2 4.26Å; F451-V491 HydrophobicContact CZ-CG2 3.88Å; I487-V491 WeakPolarHBondContact O-CG2 3.45Å; I487-V491 PolarHBondContact O-N 3.04Å; S489-V491 PolarHBondContact O-N 3.14Å; V491-G493 PolarHBondContact O-N 3.45Å; V491-L494 WeakPolarHBondContact O-CB 3.35Å; V491-L494 PolarHBondContact O-N 3.34Å; V491-L494 VanDerWaalsContact O-N 3.11Å; V491-Y495 HydrophobicContact CG1-CD2 3.75Å; V491-Y495 HydrophobicContact CG1-CE1 4.43Å; V491-Y495 HydrophobicContact CG1-CE2 3.35Å; V491-Y495 HydrophobicContact CG1-CG 4.43Å; V491-Y495 PolarHBondContact O-N 3.23Å
492G83.4Confident84.4Confident18 Ų1823.1 Ų23.119%0.18616%0.158CC..Hα-helixtrans-55.8-49.7-178.200000111.9H488 S489 L494 Y495 A496 F504H488-G492 PolarHBondContact O-N 3.21Å; H488-G492 VanDerWaalsContact O-N 3.16Å; S489-G492 PolarHBondContact O-N 2.95Å; G492-L494 VanDerWaalsContact C-N 3.35Å; G492-L494 PolarHBondContact O-N 3.4Å; G492-Y495 PolarHBondContact O-N 2.83Å; G492-A496 PolarHBondContact O-N 3.25Å; G492-F504 WeakPolarHBondContact O-CE2 3.34Å
493G81.3Confident83.5Confident26 Ų2622.7 Ų22.727%0.26815%0.154SC..Hα-helixtrans-73.6-22.2178.400000114.4S489 V491 A497S489-G493 PolarHBondContact O-N 3.37Å; V491-G493 PolarHBondContact O-N 3.45Å; G493-A497 WeakPolarHBondContact O-CB 3.36Å; G493-A497 PolarHBondContact O-N 3.19Å; G493-A497 VanDerWaalsContact O-N 3.14Å
494L87.4Confident82.7Confident0 Ų026.3 Ų26.30%017%0.17CC..Hα-helixtrans-66.2-44.3168.717666000111.2I348 A447 F451 A490 V491 G492 A497 V498 L554 L558I348-L494 HydrophobicContact CG2-CD1 4.22Å; I348-L494 HydrophobicContact CG2-CD2 4Å; I348-L494 HydrophobicContact CG2-CG 4.29Å; A447-L494 HydrophobicContact CB-CB 4.31Å; A447-L494 HydrophobicContact CB-CD1 4.05Å; F451-L494 HydrophobicContact CE2-CB 3.92Å; F451-L494 HydrophobicContact CE2-CD2 3.69Å; F451-L494 HydrophobicContact CE2-CG 4.34Å; F451-L494 HydrophobicContact CZ-CD2 4.07Å; A490-L494 WeakPolarHBondContact O-CB 3.27Å; A490-L494 PolarHBondContact O-N 3.06Å; V491-L494 WeakPolarHBondContact O-CB 3.35Å; V491-L494 PolarHBondContact O-N 3.34Å; V491-L494 VanDerWaalsContact O-N 3.11Å; G492-L494 VanDerWaalsContact C-N 3.35Å; G492-L494 PolarHBondContact O-N 3.4Å; L494-A497 WeakPolarHBondContact O-CB 3.28Å; L494-A497 PolarHBondContact O-N 3.04Å; L494-A497 VanDerWaalsContact O-N 3.07Å; L494-V498 HydrophobicContact CD1-CG2 3.9Å; L494-V498 PolarHBondContact O-N 2.87Å; L494-V498 VanDerWaalsContact O-N 3.08Å; L494-L554 HydrophobicContact CD2-CD1 4.42Å; L494-L554 HydrophobicContact CD2-CD2 4.3Å; L494-L558 HydrophobicContact CD1-CD1 4.31Å; L494-L558 HydrophobicContact CD1-CD2 4.11Å
495Y86.4Confident82Confident1 Ų127.7 Ų27.70%0.00419%0.186CC..Hα-helixtrans-65.9-39.1177.4-66.8-18.7000112.2F349 S352 V491 G492 A497 V498 Y499 L507 Q511F349-Y495 AromaticContact CD2-CE1 3.92Å; F349-Y495 HydrophobicContact CD2-CE1 3.92Å; F349-Y495 AromaticContact CD2-CZ 3.69Å; F349-Y495 WeakPolarHBondContact CD2-OH 3.39Å; F349-Y495 HydrophobicContact CE2-CE2 4.49Å; F349-Y495 AromaticContact CE2-CZ 3.87Å; F349-Y495 WeakPolarHBondContact CE2-OH 3.21Å; S352-Y495 PolarHBondContact OG-OH 3.32Å; S352-Y495 VanDerWaalsContact OG-OH 3.08Å; V491-Y495 HydrophobicContact CG1-CD2 3.75Å; V491-Y495 HydrophobicContact CG1-CE1 4.43Å; V491-Y495 HydrophobicContact CG1-CE2 3.35Å; V491-Y495 HydrophobicContact CG1-CG 4.43Å; V491-Y495 PolarHBondContact O-N 3.23Å; G492-Y495 PolarHBondContact O-N 2.83Å; Y495-A497 PolarHBondContact O-N 3.41Å; Y495-V498 PolarHBondContact O-N 3.45Å; Y495-Y499 AromaticContact CD1-CD2 3.84Å; Y495-Y499 HydrophobicContact CD1-CD2 3.84Å; Y495-Y499 AromaticContact CD1-CE2 3.9Å; Y495-Y499 HydrophobicContact CD1-CE2 3.9Å; Y495-Y499 HydrophobicContact CE1-CE2 4.21Å; Y495-Y499 HydrophobicContact CG-CD2 4.47Å; Y495-Y499 PolarHBondContact O-N 3.12Å; Y495-L507 HydrophobicContact CD2-CB 4.27Å; Y495-L507 HydrophobicContact CE2-CB 4.25Å; Y495-Q511 PolarHBondContact OH-OE1 2.82Å
496A79.2Confident81.7Confident57 Ų5730 Ų3047%0.47120%0.202SC..Hα-helixtrans-67.5-13.3172.500000114.3G492G492-A496 PolarHBondContact O-N 3.25Å
497A79.6Confident81.4Confident12 Ų1229.5 Ų29.510%0.09920%0.2CC..Hα-helixtrans-93.5-35.617800000113.5K443 G493 L494 Y495K443-A497 HydrophobicContact CB-CB 3.6Å; K443-A497 HydrophobicContact CD-CB 4.14Å; K443-A497 HydrophobicContact CG-CB 4.44Å; G493-A497 WeakPolarHBondContact O-CB 3.36Å; G493-A497 PolarHBondContact O-N 3.19Å; G493-A497 VanDerWaalsContact O-N 3.14Å; L494-A497 WeakPolarHBondContact O-CB 3.28Å; L494-A497 PolarHBondContact O-N 3.04Å; L494-A497 VanDerWaalsContact O-N 3.07Å; Y495-A497 PolarHBondContact O-N 3.41Å
498V83.3Confident81.1Confident29 Ų2931.1 Ų31.118%0.17621%0.21CC..Hα-helixtrans-104.9-37.4-168.9178.20000112.2I348 V444 L494 Y495I348-V498 HydrophobicContact CD1-CG1 3.82Å; I348-V498 HydrophobicContact CD1-CG2 4.31Å; V444-V498 HydrophobicContact CG2-CG2 4.48Å; L494-V498 HydrophobicContact CD1-CG2 3.9Å; L494-V498 PolarHBondContact O-N 2.87Å; L494-V498 VanDerWaalsContact O-N 3.08Å; Y495-V498 PolarHBondContact O-N 3.45Å
499Y83.2Confident81.2Confident27 Ų2729 Ų2911%0.10620%0.2CC..SBendtrans-109.4153.7-170.4-64-78000112.1S343 F349 Y495 L507S343-Y499 PolarHBondContact O-OH 3.29Å; F349-Y499 WeakPolarHBondContact CB-OH 3.42Å; F349-Y499 PolarHBondContact N-OH 2.77Å; Y495-Y499 AromaticContact CD1-CD2 3.84Å; Y495-Y499 HydrophobicContact CD1-CD2 3.84Å; Y495-Y499 AromaticContact CD1-CE2 3.9Å; Y495-Y499 HydrophobicContact CD1-CE2 3.9Å; Y495-Y499 HydrophobicContact CE1-CE2 4.21Å; Y495-Y499 HydrophobicContact CG-CD2 4.47Å; Y495-Y499 PolarHBondContact O-N 3.12Å; Y499-L507 HydrophobicContact CD1-CD1 3.79Å; Y499-L507 HydrophobicContact CD2-CD1 3.73Å; Y499-L507 HydrophobicContact CE1-CD1 4.31Å; Y499-L507 HydrophobicContact CE2-CD1 4.27Å; Y499-L507 HydrophobicContact CG-CD1 3.46Å; Y499-L507 VanDerWaalsContact CG-CD1 3.46Å
500P74.8Confident81.4Confident60 Ų6031.1 Ų31.139%0.3921%0.21SC..  trans-63.5149173.926.3-33.9000111.5S502 Q503P500-S502 PolarHBondContact O-N 3.15Å; P500-Q503 HydrophobicContact CG-CB 4.38Å; P500-Q503 HydrophobicContact CG-CG 4.09Å; P500-Q503 PolarHBondContact O-N 3.13Å; P500-Q503 VanDerWaalsContact O-N 3.1Å
501S66.6Low81.6Confident66 Ų6631.3 Ų31.346%0.46221%0.211SC..G310 helixtrans-55.6-33.9-178.262.60000113.2E266 Q503 F504E266-S501 VanDerWaalsContact CD-OG 3.29Å; E266-S501 WeakPolarHBondContact OE1-CB 3.37Å; E266-S501 WeakPolarHBondContact OE2-CB 3.27Å; E266-S501 PolarHBondContact OE2-OG 3.32Å; S501-Q503 VanDerWaalsContact C-N 3.29Å; S501-Q503 PolarHBondContact O-N 3.02Å; S501-F504 VanDerWaalsContact O-CB 3.28Å; S501-F504 WeakPolarHBondContact O-CB 3.47Å; S501-F504 PolarHBondContact O-N 3.36Å
502S67.8Low81.6Confident93 Ų9331.9 Ų31.965%0.6521%0.214SC*.G310 helixtrans-64.3-28.5179.861.80000113.9P500P500-S502 PolarHBondContact O-N 3.15Å
503Q74.6Confident82.1Confident13 Ų1333.6 Ų33.66%0.06122%0.219CC..G310 helixtrans-95-9.1-179.4-63.8-174.5-3.900113E338 S343 P500 S501 G505 S506 L507E338-Q503 PolarHBondContact O-NE2 2.81Å; S343-Q503 PolarHBondContact OG-OE1 3.46Å; P500-Q503 HydrophobicContact CG-CB 4.38Å; P500-Q503 HydrophobicContact CG-CG 4.09Å; P500-Q503 PolarHBondContact O-N 3.13Å; P500-Q503 VanDerWaalsContact O-N 3.1Å; S501-Q503 VanDerWaalsContact C-N 3.29Å; S501-Q503 PolarHBondContact O-N 3.02Å; Q503-G505 PolarHBondContact O-N 3.02Å; Q503-S506 PolarHBondContact O-N 3.45Å; Q503-L507 HydrophobicContact CB-CD1 4.07Å; Q503-L507 HydrophobicContact CB-CG 4.39Å; Q503-L507 WeakPolarHBondContact O-CB 3.14Å; Q503-L507 WeakPolarHBondContact O-CG 3.43Å; Q503-L507 PolarHBondContact O-N 2.94Å
504F78.4Confident82.7Confident76 Ų7634.2 Ų34.233%0.33322%0.222SC..Hα-helixtrans-55.6-48.4-173.3179.1-95.8000113.4G492 S501 T508G492-F504 WeakPolarHBondContact O-CE2 3.34Å; S501-F504 VanDerWaalsContact O-CB 3.28Å; S501-F504 WeakPolarHBondContact O-CB 3.47Å; S501-F504 PolarHBondContact O-N 3.36Å; F504-T508 WeakPolarHBondContact O-CB 3.28Å; F504-T508 PolarHBondContact O-N 2.9Å; F504-T508 PolarHBondContact O-OG1 3.47Å
505G75.9Confident83Confident34 Ų3434.3 Ų34.335%0.35122%0.223SC..Hα-helixtrans-63.9-46.9-179.100000112.2Q503 T508 G509Q503-G505 PolarHBondContact O-N 3.02Å; G505-T508 PolarHBondContact O-N 3.38Å; G505-G509 PolarHBondContact O-N 2.84Å
506S83Confident83.3Confident49 Ų4934.3 Ų34.334%0.34322%0.223SC..Hα-helixtrans-66.4-39.4-179.7-590000112.8Q503 G509 M510Q503-S506 PolarHBondContact O-N 3.45Å; S506-G509 PolarHBondContact O-N 2.96Å; S506-M510 WeakPolarHBondContact O-CB 3.14Å; S506-M510 PolarHBondContact O-N 3.34Å
507L84.6Confident84.1Confident0 Ų035.5 Ų35.50%022%0.224CC..Hα-helixtrans-66.1-44.6175.4-70.8170.8000111.5F340 I344 F349 Y495 Y499 Q503 G509 M510 Q511F340-L507 HydrophobicContact CE2-CD2 4.09Å; F340-L507 HydrophobicContact CE2-CG 4.24Å; I344-L507 HydrophobicContact CG1-CD2 4.04Å; F349-L507 HydrophobicContact CD2-CB 4.5Å; F349-L507 HydrophobicContact CD2-CD2 3.77Å; F349-L507 HydrophobicContact CE2-CB 4.16Å; F349-L507 HydrophobicContact CE2-CD2 3.81Å; Y495-L507 HydrophobicContact CD2-CB 4.27Å; Y495-L507 HydrophobicContact CE2-CB 4.25Å; Y499-L507 HydrophobicContact CD1-CD1 3.79Å; Y499-L507 HydrophobicContact CD2-CD1 3.73Å; Y499-L507 HydrophobicContact CE1-CD1 4.31Å; Y499-L507 HydrophobicContact CE2-CD1 4.27Å; Y499-L507 HydrophobicContact CG-CD1 3.46Å; Y499-L507 VanDerWaalsContact CG-CD1 3.46Å; Q503-L507 HydrophobicContact CB-CD1 4.07Å; Q503-L507 HydrophobicContact CB-CG 4.39Å; Q503-L507 WeakPolarHBondContact O-CB 3.14Å; Q503-L507 WeakPolarHBondContact O-CG 3.43Å; Q503-L507 PolarHBondContact O-N 2.94Å; L507-G509 VanDerWaalsContact C-N 3.33Å; L507-G509 PolarHBondContact O-N 2.66Å; L507-M510 PolarHBondContact O-N 3.12Å; L507-Q511 WeakPolarHBondContact O-CB 3.19Å; L507-Q511 PolarHBondContact O-N 3.37Å
508T85Confident84.8Confident34 Ų3437.9 Ų37.921%0.20923%0.232CC..Hα-helixtrans-62-42.1176.3-56.70000111.3F504 G505 S512F504-T508 WeakPolarHBondContact O-CB 3.28Å; F504-T508 PolarHBondContact O-N 2.9Å; F504-T508 PolarHBondContact O-OG1 3.47Å; G505-T508 PolarHBondContact O-N 3.38Å; T508-S512 WeakPolarHBondContact O-CB 3.49Å; T508-S512 PolarHBondContact O-N 2.86Å; T508-S512 PolarHBondContact O-OG 3.47Å
509G88.1Confident85.3Confident0 Ų036.7 Ų36.70%023%0.225CC..Hα-helixtrans-62.9-45.4174.700000112.6G505 S506 L507 S512 L513G505-G509 PolarHBondContact O-N 2.84Å; S506-G509 PolarHBondContact O-N 2.96Å; L507-G509 VanDerWaalsContact C-N 3.33Å; L507-G509 PolarHBondContact O-N 2.66Å; G509-S512 PolarHBondContact O-N 3.17Å; G509-L513 WeakPolarHBondContact O-CB 3.5Å; G509-L513 PolarHBondContact O-N 3.31Å
510M89.3Confident85.8Confident55 Ų5538.8 Ų38.827%0.27124%0.238SC..Hα-helixtrans-63.3-43.9179-174.861.87100111.5L132 F340 I344 F349 S506 L507 S512 L513 A514L132-M510 HydrophobicContact CD1-CB 4.1Å; L132-M510 HydrophobicContact CD1-CE 3.67Å; L132-M510 HydrophobicContact CD1-SD 4.16Å; F340-M510 HydrophobicContact CE1-CE 4.48Å; I344-M510 HydrophobicContact CD1-CE 3.95Å; I344-M510 HydrophobicContact CD1-CG 4.16Å; I344-M510 HydrophobicContact CG1-CG 4.49Å; F349-M510 HydrophobicContact CE1-CG 4.37Å; F349-M510 HydrophobicContact CZ-CB 4.05Å; F349-M510 HydrophobicContact CZ-CG 3.87Å; S506-M510 WeakPolarHBondContact O-CB 3.14Å; S506-M510 PolarHBondContact O-N 3.34Å; L507-M510 PolarHBondContact O-N 3.12Å; M510-S512 VanDerWaalsContact C-N 3.35Å; M510-L513 PolarHBondContact O-N 3.36Å; M510-A514 WeakPolarHBondContact O-CB 3.35Å; M510-A514 PolarHBondContact O-N 2.86Å
511Q91.8Very high86.7Confident4 Ų439.4 Ų39.42%0.01924%0.238CC..Hα-helixtrans-61.9-44.5175.4-169.3-166.4-90.500111.4F349 A353 M356 Y495 L507 L513 A514 S515F349-Q511 HydrophobicContact CE2-CB 4.25Å; F349-Q511 HydrophobicContact CZ-CB 4.32Å; A353-Q511 HydrophobicContact CB-CG 4.2Å; M356-Q511 HydrophobicContact CB-CG 4.1Å; M356-Q511 HydrophobicContact CG-CG 4.16Å; M356-Q511 VanDerWaalsContact CG-NE2 3.31Å; Y495-Q511 PolarHBondContact OH-OE1 2.82Å; L507-Q511 WeakPolarHBondContact O-CB 3.19Å; L507-Q511 PolarHBondContact O-N 3.37Å; Q511-L513 VanDerWaalsContact C-N 3.32Å; Q511-L513 PolarHBondContact O-N 3.08Å; Q511-A514 PolarHBondContact O-N 3.34Å; Q511-S515 WeakPolarHBondContact O-CB 3.45Å; Q511-S515 PolarHBondContact O-N 3.19Å; Q511-S515 PolarHBondContact O-OG 3.24Å
512S90.7Very high88Confident15 Ų1536.6 Ų36.611%0.10522%0.217CC..Hα-helixtrans-61.7-43.1179.3-57.90000110.9T508 G509 M510 S515 A516T508-S512 WeakPolarHBondContact O-CB 3.49Å; T508-S512 PolarHBondContact O-N 2.86Å; T508-S512 PolarHBondContact O-OG 3.47Å; G509-S512 PolarHBondContact O-N 3.17Å; M510-S512 VanDerWaalsContact C-N 3.35Å; S512-S515 WeakPolarHBondContact CA-OG 3.29Å; S512-S515 PolarHBondContact O-N 3.31Å; S512-S515 PolarHBondContact O-OG 3.29Å; S512-A516 WeakPolarHBondContact O-CB 3.21Å; S512-A516 PolarHBondContact O-N 3.14Å
513L92.9Very high89.2Confident54 Ų5433.2 Ų33.228%0.28319%0.191SC..Hα-helixtrans-61.2-47.8174.3178.662.6000112.1A129 G509 M510 Q511 S515 A516 V517A129-L513 HydrophobicContact CB-CD1 3.82Å; G509-L513 WeakPolarHBondContact O-CB 3.5Å; G509-L513 PolarHBondContact O-N 3.31Å; M510-L513 PolarHBondContact O-N 3.36Å; Q511-L513 VanDerWaalsContact C-N 3.32Å; Q511-L513 PolarHBondContact O-N 3.08Å; L513-S515 VanDerWaalsContact C-N 3.32Å; L513-S515 PolarHBondContact O-N 3.13Å; L513-A516 WeakPolarHBondContact O-CB 3.44Å; L513-A516 PolarHBondContact O-N 2.9Å; L513-V517 HydrophobicContact CD1-CG2 4.45Å; L513-V517 WeakPolarHBondContact O-CG2 3.49Å; L513-V517 PolarHBondContact O-N 3.47Å
514A93.7Very high90Very high40 Ų4035.7 Ų35.733%0.33121%0.209SC..Hα-helixtrans-59-44.4177.100000111.5M510 Q511 A516 V517 F518M510-A514 WeakPolarHBondContact O-CB 3.35Å; M510-A514 PolarHBondContact O-N 2.86Å; Q511-A514 PolarHBondContact O-N 3.34Å; A514-A516 VanDerWaalsContact C-N 3.34Å; A514-A516 PolarHBondContact O-N 2.83Å; A514-V517 PolarHBondContact O-N 2.78Å; A514-F518 WeakPolarHBondContact O-CB 3.49Å; A514-F518 PolarHBondContact O-N 3.48Å
515S93.8Very high90.6Very high2 Ų234 Ų341%0.01420%0.202CC..Hα-helixtrans-66.5-33.7176.872.40000113.1C357 Q511 S512 L513 F518 A519C357-S515 VanDerWaalsContact SG-CA 3.54Å; Q511-S515 WeakPolarHBondContact O-CB 3.45Å; Q511-S515 PolarHBondContact O-N 3.19Å; Q511-S515 PolarHBondContact O-OG 3.24Å; S512-S515 WeakPolarHBondContact CA-OG 3.29Å; S512-S515 PolarHBondContact O-N 3.31Å; S512-S515 PolarHBondContact O-OG 3.29Å; L513-S515 VanDerWaalsContact C-N 3.32Å; L513-S515 PolarHBondContact O-N 3.13Å; S515-F518 PolarHBondContact O-N 3.24Å; S515-A519 WeakPolarHBondContact O-CB 3.14Å; S515-A519 PolarHBondContact O-N 3.24Å
516A93.6Very high91.3Very high1 Ų132.6 Ų32.61%0.00819%0.187CC..Hα-helixtrans-65.9-46.4176.500000111.4F125 S128 A129 S512 L513 A514 F518 A519 L520F125-A516 HydrophobicContact CD2-CB 3.91Å; F125-A516 HydrophobicContact CE2-CB 4.13Å; S128-A516 VanDerWaalsContact CB-CB 3.47Å; A129-A516 HydrophobicContact CB-CB 3.93Å; S512-A516 WeakPolarHBondContact O-CB 3.21Å; S512-A516 PolarHBondContact O-N 3.14Å; L513-A516 WeakPolarHBondContact O-CB 3.44Å; L513-A516 PolarHBondContact O-N 2.9Å; A514-A516 VanDerWaalsContact C-N 3.34Å; A514-A516 PolarHBondContact O-N 2.83Å; A516-F518 VanDerWaalsContact C-N 3.33Å; A516-A519 WeakPolarHBondContact O-CB 3.39Å; A516-A519 PolarHBondContact O-N 3.48Å; A516-L520 PolarHBondContact O-N 3.02Å
517V95.1Very high91.6Very high81 Ų8133.5 Ų33.549%0.49119%0.187SC..Hα-helixtrans-62.8-43.7177.4174.10000110.2F125 L513 A514 A519 L520F125-V517 HydrophobicContact CE2-CG2 4.18Å; L513-V517 HydrophobicContact CD1-CG2 4.45Å; L513-V517 WeakPolarHBondContact O-CG2 3.49Å; L513-V517 PolarHBondContact O-N 3.47Å; A514-V517 PolarHBondContact O-N 2.78Å; V517-A519 VanDerWaalsContact C-N 3.32Å; V517-A519 PolarHBondContact O-N 3.02Å; V517-L520 WeakPolarHBondContact O-CB 3.37Å; V517-L520 PolarHBondContact O-N 3.35Å
518F94.9Very high91.8Very high63 Ų6335.2 Ų35.228%0.27620%0.202SC..Hα-helixtrans-66.2-35.4176.6-163.6-99.9000112.4C357 L361 A514 S515 A516 L520 L521 L547C357-F518 HydrophobicContact CB-CB 3.88Å; C357-F518 HydrophobicContact CB-CD1 3.61Å; C357-F518 HydrophobicContact CB-CD2 4.49Å; C357-F518 HydrophobicContact CB-CE1 4.23Å; C357-F518 HydrophobicContact CB-CG 3.74Å; C357-F518 WeakPolarHBondContact O-CD1 3.37Å; L361-F518 HydrophobicContact CB-CD1 4.04Å; L361-F518 HydrophobicContact CB-CE1 4.18Å; L361-F518 HydrophobicContact CD2-CD1 3.98Å; L361-F518 HydrophobicContact CD2-CE1 3.51Å; L361-F518 HydrophobicContact CD2-CZ 4.33Å; L361-F518 HydrophobicContact CG-CE1 4.47Å; A514-F518 WeakPolarHBondContact O-CB 3.49Å; A514-F518 PolarHBondContact O-N 3.48Å; S515-F518 PolarHBondContact O-N 3.24Å; A516-F518 VanDerWaalsContact C-N 3.33Å; F518-L520 PolarHBondContact O-N 2.99Å; F518-L521 HydrophobicContact CD1-CD1 4.45Å; F518-L521 HydrophobicContact CD2-CD1 3.94Å; F518-L521 HydrophobicContact CE1-CD1 4.26Å; F518-L521 HydrophobicContact CE2-CD1 3.7Å; F518-L521 HydrophobicContact CG-CD1 4.32Å; F518-L521 HydrophobicContact CZ-CD1 3.88Å; F518-L521 VanDerWaalsContact O-CB 3.27Å; F518-L521 WeakPolarHBondContact O-CB 3.33Å; F518-L521 WeakPolarHBondContact O-CG 3.45Å; F518-L521 PolarHBondContact O-N 3.47Å; F518-L521 VanDerWaalsContact O-N 3.1Å; F518-L547 HydrophobicContact CE1-CD2 4.44Å; F518-L547 HydrophobicContact CZ-CD2 4.42Å
519A92.9Very high92Very high4 Ų433.6 Ų33.63%0.03319%0.192CC..Hα-helixtrans-65.4-17.9176.300000113.6L364 S515 A516 V517 L521 Q522L364-A519 HydrophobicContact CD1-CB 3.63Å; S515-A519 WeakPolarHBondContact O-CB 3.14Å; S515-A519 PolarHBondContact O-N 3.24Å; A516-A519 WeakPolarHBondContact O-CB 3.39Å; A516-A519 PolarHBondContact O-N 3.48Å; V517-A519 VanDerWaalsContact C-N 3.32Å; V517-A519 PolarHBondContact O-N 3.02Å; A519-L521 PolarHBondContact O-N 3.44Å; A519-L521 VanDerWaalsContact O-N 3.14Å; A519-Q522 VanDerWaalsContact O-CB 3.23Å; A519-Q522 WeakPolarHBondContact O-CB 3.41Å; A519-Q522 WeakPolarHBondContact O-CG 3.38Å; A519-Q522 PolarHBondContact O-N 3.47Å
520L94.5Very high91.7Very high71 Ų7134.4 Ų34.437%0.37220%0.196SC..THydrogen-bonded Turntrans-60-22171.1-66174.7000112.4T121 F125 A516 V517 F518 Q522 Q523 P524T121-L520 HydrophobicContact CG2-CD2 3.96Å; F125-L520 HydrophobicContact CB-CD2 3.88Å; F125-L520 HydrophobicContact CD2-CD1 4.04Å; F125-L520 HydrophobicContact CD2-CD2 3.73Å; F125-L520 HydrophobicContact CD2-CG 3.85Å; F125-L520 HydrophobicContact CE2-CD1 4.03Å; F125-L520 HydrophobicContact CE2-CG 4.34Å; F125-L520 HydrophobicContact CG-CD2 3.89Å; A516-L520 PolarHBondContact O-N 3.02Å; V517-L520 WeakPolarHBondContact O-CB 3.37Å; V517-L520 PolarHBondContact O-N 3.35Å; F518-L520 PolarHBondContact O-N 2.99Å; L520-Q522 PolarHBondContact O-N 3.39Å; L520-Q522 VanDerWaalsContact O-N 3.15Å; L520-Q523 PolarHBondContact O-N 3.13Å; L520-P524 VanDerWaalsContact O-CD 3.28Å; L520-P524 WeakPolarHBondContact O-CD 3.31Å
521L94.2Very high91.4Very high73 Ų7333.7 Ų33.738%0.38220%0.202SC..THydrogen-bonded Turntrans-61.7-15.7171-65.5173.3000112.7L361 F518 A519 Q523 P524 L525L361-L521 HydrophobicContact CD1-CB 3.96Å; L361-L521 HydrophobicContact CD2-CB 4.21Å; L361-L521 HydrophobicContact CD2-CD1 4.48Å; F518-L521 HydrophobicContact CD1-CD1 4.45Å; F518-L521 HydrophobicContact CD2-CD1 3.94Å; F518-L521 HydrophobicContact CE1-CD1 4.26Å; F518-L521 HydrophobicContact CE2-CD1 3.7Å; F518-L521 HydrophobicContact CG-CD1 4.32Å; F518-L521 HydrophobicContact CZ-CD1 3.88Å; F518-L521 VanDerWaalsContact O-CB 3.27Å; F518-L521 WeakPolarHBondContact O-CB 3.33Å; F518-L521 WeakPolarHBondContact O-CG 3.45Å; F518-L521 PolarHBondContact O-N 3.47Å; F518-L521 VanDerWaalsContact O-N 3.1Å; A519-L521 PolarHBondContact O-N 3.44Å; A519-L521 VanDerWaalsContact O-N 3.14Å; L521-Q523 PolarHBondContact O-N 2.91Å; L521-P524 HydrophobicContact CD2-CG 4.39Å; L521-P524 WeakPolarHBondContact O-CD 3.36Å; L521-P524 WeakPolarHBondContact O-CG 3.3Å; L521-L525 HydrophobicContact CB-CD1 4.15Å; L521-L525 WeakPolarHBondContact O-CD1 3.44Å; L521-L525 PolarHBondContact O-N 3.47Å; L521-L525 VanDerWaalsContact O-N 3.1Å
522Q93.2Very high90.9Very high6 Ų638.8 Ų38.83%0.02824%0.236CC..Hα-helixtrans-59.4-35.9176.477.5-176.5-35.700112.4T121 S124 L361 L364 F365 A519 L520 L525 F526T121-Q522 HydrophobicContact CG2-CG 4.05Å; T121-Q522 WeakPolarHBondContact OG1-CG 3.05Å; T121-Q522 PolarHBondContact OG1-NE2 2.9Å; S124-Q522 PolarHBondContact OG-NE2 3.07Å; L361-Q522 HydrophobicContact CD1-CB 3.94Å; L364-Q522 VanDerWaalsContact CB-OE1 3.26Å; L364-Q522 PolarHBondContact O-OE1 3.18Å; F365-Q522 HydrophobicContact CB-CB 4.41Å; A519-Q522 VanDerWaalsContact O-CB 3.23Å; A519-Q522 WeakPolarHBondContact O-CB 3.41Å; A519-Q522 WeakPolarHBondContact O-CG 3.38Å; A519-Q522 PolarHBondContact O-N 3.47Å; L520-Q522 PolarHBondContact O-N 3.39Å; L520-Q522 VanDerWaalsContact O-N 3.15Å; Q522-L525 PolarHBondContact O-N 3.27Å; Q522-F526 WeakPolarHBondContact O-CB 3.25Å; Q522-F526 PolarHBondContact O-N 3.48Å
523Q92.1Very high90.4Very high22 Ų2240.2 Ų40.210%0.10324%0.242CC..Hα-helixtrans-67.1-51.7-179.5-174.669.512.400112.5E114 L118 T121 L520 L521 L525 F526 L527E114-Q523 PolarHBondContact O-NE2 2.85Å; L118-Q523 HydrophobicContact CD1-CG 3.97Å; T121-Q523 HydrophobicContact CG2-CB 4.29Å; T121-Q523 PolarHBondContact OG1-OE1 2.89Å; L520-Q523 PolarHBondContact O-N 3.13Å; L521-Q523 PolarHBondContact O-N 2.91Å; Q523-L525 VanDerWaalsContact C-N 3.26Å; Q523-L525 PolarHBondContact O-N 3.14Å; Q523-F526 WeakPolarHBondContact O-CB 3.46Å; Q523-F526 PolarHBondContact O-N 3.25Å; Q523-F526 VanDerWaalsContact O-N 3.13Å; Q523-L527 HydrophobicContact CG-CD1 4.33Å; Q523-L527 WeakPolarHBondContact O-CG 3.42Å; Q523-L527 PolarHBondContact O-N 3.43Å
524P92.6Very high89.7Confident66 Ų6645.7 Ų45.743%0.42927%0.266SS..Hα-helixtrans-63.7-31.1174.922.8-32.2000112.6L520 L521 A528L520-P524 VanDerWaalsContact O-CD 3.28Å; L520-P524 WeakPolarHBondContact O-CD 3.31Å; L521-P524 HydrophobicContact CD2-CG 4.39Å; L521-P524 WeakPolarHBondContact O-CD 3.36Å; L521-P524 WeakPolarHBondContact O-CG 3.3Å; P524-A528 WeakPolarHBondContact O-CB 3.34Å; P524-A528 PolarHBondContact O-N 2.78Å
525L91.8Very high88.8Confident39 Ų3944.1 Ų44.120%0.20425%0.254CS..Hα-helixtrans-64.4-41.3171.6-91.480.5000111.8F365 L521 Q522 Q523 A528 M529 V540 L544F365-L525 HydrophobicContact CD2-CB 3.84Å; F365-L525 HydrophobicContact CE2-CB 3.89Å; L521-L525 HydrophobicContact CB-CD1 4.15Å; L521-L525 WeakPolarHBondContact O-CD1 3.44Å; L521-L525 PolarHBondContact O-N 3.47Å; L521-L525 VanDerWaalsContact O-N 3.1Å; Q522-L525 PolarHBondContact O-N 3.27Å; Q523-L525 VanDerWaalsContact C-N 3.26Å; Q523-L525 PolarHBondContact O-N 3.14Å; L525-A528 PolarHBondContact O-N 3.26Å; L525-M529 PolarHBondContact O-N 3.44Å; L525-V540 HydrophobicContact CB-CG1 4.38Å; L525-V540 HydrophobicContact CD2-CG1 3.81Å; L525-V540 HydrophobicContact CG-CG1 4.22Å; L525-L544 HydrophobicContact CD2-CD1 4Å; L525-L544 HydrophobicContact CD2-CD2 3.71Å; L525-L544 HydrophobicContact CD2-CG 3.95Å
526F89.4Confident88.3Confident5 Ų547.5 Ų47.52%0.02227%0.272CS..Hα-helixtrans-65.4-44.6176.2-176-93.8000111.8D113 E114 N117 F365 A369 Q522 Q523 A528 M529 M530D113-F526 HydrophobicContact CB-CZ 4.3Å; E114-F526 HydrophobicContact CG-CE1 4.26Å; N117-F526 HydrophobicContact CB-CD1 4.23Å; N117-F526 HydrophobicContact CB-CE1 4.18Å; N117-F526 HydrophobicContact CB-CZ 4.48Å; N117-F526 WeakPolarHBondContact ND2-CE1 3.32Å; N117-F526 VanDerWaalsContact ND2-CE2 3.33Å; N117-F526 WeakPolarHBondContact ND2-CE2 3.43Å; N117-F526 WeakPolarHBondContact ND2-CZ 3.42Å; F365-F526 HydrophobicContact CE2-CB 4.47Å; A369-F526 HydrophobicContact CB-CD2 4.11Å; A369-F526 HydrophobicContact CB-CE2 4.31Å; Q522-F526 WeakPolarHBondContact O-CB 3.25Å; Q522-F526 PolarHBondContact O-N 3.48Å; Q523-F526 WeakPolarHBondContact O-CB 3.46Å; Q523-F526 PolarHBondContact O-N 3.25Å; Q523-F526 VanDerWaalsContact O-N 3.13Å; F526-A528 VanDerWaalsContact C-N 3.31Å; F526-A528 PolarHBondContact O-N 3.24Å; F526-M529 HydrophobicContact CD2-CE 3.84Å; F526-M529 HydrophobicContact CE2-CE 3.65Å; F526-M529 HydrophobicContact CZ-CE 4.47Å; F526-M529 WeakPolarHBondContact O-CB 3.49Å; F526-M529 PolarHBondContact O-N 3.15Å; F526-M529 VanDerWaalsContact O-N 3.15Å; F526-M530 HydrophobicContact CD1-CG 4.16Å; F526-M530 HydrophobicContact CE1-CG 3.58Å; F526-M530 HydrophobicContact CE2-CG 4.02Å; F526-M530 HydrophobicContact CZ-CG 3.48Å; F526-M530 VanDerWaalsContact CZ-CG 3.48Å; F526-M530 HydrophobicContact CZ-SD 4.18Å; F526-M530 PolarHBondContact O-N 3.37Å
527L88.8Confident87.8Confident68 Ų6848.2 Ų48.236%0.35628%0.276SS..Hα-helixtrans-61.7-38.9174.4-69.9171.8000111.9E114 Q523 M529 G531E114-L527 HydrophobicContact CB-CD2 4.35Å; E114-L527 VanDerWaalsContact CD-CD2 3.49Å; E114-L527 HydrophobicContact CG-CD2 3.79Å; Q523-L527 HydrophobicContact CG-CD1 4.33Å; Q523-L527 WeakPolarHBondContact O-CG 3.42Å; Q523-L527 PolarHBondContact O-N 3.43Å; L527-M529 VanDerWaalsContact C-N 3.34Å; L527-G531 WeakPolarHBondContact O-CA 2.79Å; L527-G531 PolarHBondContact O-N 2.91Å
528A90.2Very high87.5Confident37 Ų3748.4 Ų48.431%0.30627%0.271SS..Hα-helixtrans-63.6-40.1174.200000111.8P524 L525 F526 P532 L533P524-A528 WeakPolarHBondContact O-CB 3.34Å; P524-A528 PolarHBondContact O-N 2.78Å; L525-A528 PolarHBondContact O-N 3.26Å; F526-A528 VanDerWaalsContact C-N 3.31Å; F526-A528 PolarHBondContact O-N 3.24Å; A528-P532 WeakPolarHBondContact O-CD 3.42Å; A528-P532 VanDerWaalsContact O-CG 3.25Å; A528-P532 WeakPolarHBondContact O-CG 2.99Å; A528-L533 WeakPolarHBondContact O-CD1 3.49Å; A528-L533 PolarHBondContact O-N 3.12Å
529M88Confident87.3Confident0 Ų053.1 Ų53.10%029%0.287CS..Hα-helixtrans-65.5-46.8176.7-174.2-171.477.800112.1F365 A369 V373 L525 F526 L527 L533 G535 P537 V540F365-M529 HydrophobicContact CZ-SD 3.89Å; A369-M529 HydrophobicContact CB-CE 3.78Å; A369-M529 HydrophobicContact CB-SD 3.93Å; V373-M529 HydrophobicContact CG2-SD 4.23Å; L525-M529 PolarHBondContact O-N 3.44Å; F526-M529 HydrophobicContact CD2-CE 3.84Å; F526-M529 HydrophobicContact CE2-CE 3.65Å; F526-M529 HydrophobicContact CZ-CE 4.47Å; F526-M529 WeakPolarHBondContact O-CB 3.49Å; F526-M529 PolarHBondContact O-N 3.15Å; F526-M529 VanDerWaalsContact O-N 3.15Å; L527-M529 VanDerWaalsContact C-N 3.34Å; M529-L533 WeakPolarHBondContact O-CB 3.33Å; M529-G535 WeakPolarHBondContact O-CA 3.39Å; M529-G535 PolarHBondContact O-N 2.98Å; M529-P537 HydrophobicContact CG-CB 4.47Å; M529-P537 HydrophobicContact SD-CB 3.99Å; M529-V540 HydrophobicContact CB-CG2 4.32Å
530M82.6Confident87.2Confident17 Ų1753.8 Ų53.88%0.08429%0.291CS..Hα-helixtrans-80.3-27.4-175-67.3-57.9-71.300114K110 F526K110-M530 HydrophobicContact CB-CE 4.23Å; K110-M530 HydrophobicContact CD-CE 4.09Å; K110-M530 HydrophobicContact CG-CE 3.8Å; F526-M530 HydrophobicContact CD1-CG 4.16Å; F526-M530 HydrophobicContact CE1-CG 3.58Å; F526-M530 HydrophobicContact CE2-CG 4.02Å; F526-M530 HydrophobicContact CZ-CG 3.48Å; F526-M530 VanDerWaalsContact CZ-CG 3.48Å; F526-M530 HydrophobicContact CZ-SD 4.18Å; F526-M530 PolarHBondContact O-N 3.37Å
531G82.6Confident87.1Confident39 Ų3950.8 Ų50.840%0.40228%0.275SS..THydrogen-bonded Turntrans-86.4-97.117900000112.8L527 L533 E534L527-G531 WeakPolarHBondContact O-CA 2.79Å; L527-G531 PolarHBondContact O-N 2.91Å; G531-L533 PolarHBondContact O-N 3.49Å; G531-E534 PolarHBondContact O-N 3.42Å; G531-E534 VanDerWaalsContact O-N 3.09Å
532P81.4Confident87.1Confident112 Ų11249.8 Ų49.873%0.72727%0.269SS*.THydrogen-bonded Turntrans-65.7-20.1-170.726.3-36.2000115.1A528A528-P532 WeakPolarHBondContact O-CD 3.42Å; A528-P532 VanDerWaalsContact O-CG 3.25Å; A528-P532 WeakPolarHBondContact O-CG 2.99Å
533L81.1Confident87.2Confident45 Ų4551.5 Ų51.524%0.23629%0.288CS..THydrogen-bonded Turntrans-95.14.1178.5-77.7149.3000112.9A528 M529 G531 G535 D536 W539 V540A528-L533 WeakPolarHBondContact O-CD1 3.49Å; A528-L533 PolarHBondContact O-N 3.12Å; M529-L533 WeakPolarHBondContact O-CB 3.33Å; G531-L533 PolarHBondContact O-N 3.49Å; L533-G535 PolarHBondContact O-N 3.19Å; L533-D536 PolarHBondContact O-N 3.05Å; L533-W539 HydrophobicContact CD2-CB 3.87Å; L533-W539 HydrophobicContact CD2-CG 4.05Å; L533-V540 HydrophobicContact CD1-CG2 3.7Å
534E76.6Confident87.2Confident169 Ų16950.7 Ų50.779%0.7929%0.285SS*.THydrogen-bonded Turntrans54.416.6176.7-61.5-176.4172.300115.1G531G531-E534 PolarHBondContact O-N 3.42Å; G531-E534 VanDerWaalsContact O-N 3.09Å
535G74.7Confident87.4Confident7 Ų749 Ų497%0.07227%0.272CS..THydrogen-bonded Turntrans105.1-3.8-176.500000115.1M529 L533 P537M529-G535 WeakPolarHBondContact O-CA 3.39Å; M529-G535 PolarHBondContact O-N 2.98Å; L533-G535 PolarHBondContact O-N 3.19Å; G535-P537 VanDerWaalsContact O-CD 3.27Å; G535-P537 WeakPolarHBondContact O-CD 2.99Å
536D83.4Confident87.5Confident73 Ų7351.5 Ų51.539%0.3929%0.289SS..  trans-77.2115.3176.9-177.610.3000111.8L533 F538L533-D536 PolarHBondContact O-N 3.05Å; D536-F538 VanDerWaalsContact C-N 3.29Å; D536-F538 PolarHBondContact O-N 3.01Å; D536-F538 WeakPolarHBondContact OD1-CB 3.23Å; D536-F538 PolarHBondContact OD1-N 2.86Å
537P84.6Confident87.8Confident16 Ų1653.7 Ų53.710%0.10430%0.3CS..  trans-80.2-5.1-179.536.1-39.4000113.8V373 M529 G535 W539 V540 N541V373-P537 HydrophobicContact CG1-CG 4.1Å; V373-P537 HydrophobicContact CG2-CB 3.76Å; V373-P537 HydrophobicContact CG2-CG 3.89Å; M529-P537 HydrophobicContact CG-CB 4.47Å; M529-P537 HydrophobicContact SD-CB 3.99Å; G535-P537 VanDerWaalsContact O-CD 3.27Å; G535-P537 WeakPolarHBondContact O-CD 2.99Å; P537-W539 PolarHBondContact O-N 3.37Å; P537-V540 PolarHBondContact O-N 3.49Å; P537-N541 WeakPolarHBondContact O-CB 3.16Å; P537-N541 PolarHBondContact O-N 3.32Å; P537-N541 PolarHBondContact O-ND2 2.91Å
538F88.9Confident88Confident84 Ų8450.4 Ų50.437%0.36828%0.283SS..Hα-helixtrans-55.6-53.5-169.8-178.1-103.1000113.6L466 D536 V540 N541 I542L466-F538 HydrophobicContact CD2-CD2 4.04Å; L466-F538 HydrophobicContact CD2-CE2 4.14Å; D536-F538 VanDerWaalsContact C-N 3.29Å; D536-F538 PolarHBondContact O-N 3.01Å; D536-F538 WeakPolarHBondContact OD1-CB 3.23Å; D536-F538 PolarHBondContact OD1-N 2.86Å; F538-V540 PolarHBondContact O-N 3.17Å; F538-N541 PolarHBondContact O-N 2.85Å; F538-I542 HydrophobicContact CD1-CD1 3.86Å; F538-I542 HydrophobicContact CE1-CD1 3.32Å; F538-I542 HydrophobicContact CE1-CG1 4.4Å; F538-I542 HydrophobicContact CE2-CD1 4.29Å; F538-I542 HydrophobicContact CZ-CD1 3.58Å; F538-I542 HydrophobicContact CZ-CG1 4.47Å; F538-I542 WeakPolarHBondContact O-CG1 3.33Å; F538-I542 PolarHBondContact O-N 3.32Å
539W89.9Confident88.2Confident163 Ų16353 Ų5362%0.61729%0.292SS*.Hα-helixtrans-68.3-37.4-176.7-72.3103.2000113.4L533 P537 N541 I542 G543L533-W539 HydrophobicContact CD2-CB 3.87Å; L533-W539 HydrophobicContact CD2-CG 4.05Å; P537-W539 PolarHBondContact O-N 3.37Å; W539-N541 VanDerWaalsContact C-N 3.33Å; W539-I542 HydrophobicContact CE3-CD1 4.3Å; W539-I542 HydrophobicContact CZ3-CD1 4.47Å; W539-I542 PolarHBondContact O-N 3.2Å; W539-G543 PolarHBondContact O-N 3.41Å
540V91.8Very high88.5Confident18 Ų1856.5 Ų56.511%0.10931%0.31CS..Hα-helixtrans-64.8-41.8175.1-177.80000110F365 L525 M529 L533 P537 F538 I542 G543 L544F365-V540 HydrophobicContact CE1-CG1 3.8Å; F365-V540 HydrophobicContact CE2-CG1 4.12Å; F365-V540 HydrophobicContact CZ-CB 4.29Å; F365-V540 HydrophobicContact CZ-CG1 3.53Å; L525-V540 HydrophobicContact CB-CG1 4.38Å; L525-V540 HydrophobicContact CD2-CG1 3.81Å; L525-V540 HydrophobicContact CG-CG1 4.22Å; M529-V540 HydrophobicContact CB-CG2 4.32Å; L533-V540 HydrophobicContact CD1-CG2 3.7Å; P537-V540 PolarHBondContact O-N 3.49Å; F538-V540 PolarHBondContact O-N 3.17Å; V540-I542 PolarHBondContact O-N 2.95Å; V540-G543 PolarHBondContact O-N 3.43Å; V540-L544 HydrophobicContact CG1-CD1 4.13Å; V540-L544 WeakPolarHBondContact O-CG 3.21Å; V540-L544 PolarHBondContact O-N 3.12Å
541N92.3Very high88.9Confident8 Ų855.8 Ų55.84%0.04331%0.306CS..Hα-helixtrans-64.9-36176.3-80-37000113.1L466 P537 F538 W539 L545L466-N541 HydrophobicContact CD2-CB 3.71Å; P537-N541 WeakPolarHBondContact O-CB 3.16Å; P537-N541 PolarHBondContact O-N 3.32Å; P537-N541 PolarHBondContact O-ND2 2.91Å; F538-N541 PolarHBondContact O-N 2.85Å; W539-N541 VanDerWaalsContact C-N 3.33Å; N541-L545 VanDerWaalsContact O-CB 3.25Å; N541-L545 WeakPolarHBondContact O-CB 3.48Å; N541-L545 PolarHBondContact O-N 3.45Å
542I94.2Very high89.5Confident51 Ų5156.4 Ų56.426%0.26230%0.298SS..Hα-helixtrans-62.4-49.2171.8-71.2177.6000110.4L466 F538 W539 V540 L544 L545 V546L466-I542 HydrophobicContact CD1-CG1 4.36Å; L466-I542 HydrophobicContact CD2-CG1 3.6Å; F538-I542 HydrophobicContact CD1-CD1 3.86Å; F538-I542 HydrophobicContact CE1-CD1 3.32Å; F538-I542 HydrophobicContact CE1-CG1 4.4Å; F538-I542 HydrophobicContact CE2-CD1 4.29Å; F538-I542 HydrophobicContact CZ-CD1 3.58Å; F538-I542 HydrophobicContact CZ-CG1 4.47Å; F538-I542 WeakPolarHBondContact O-CG1 3.33Å; F538-I542 PolarHBondContact O-N 3.32Å; W539-I542 HydrophobicContact CE3-CD1 4.3Å; W539-I542 HydrophobicContact CZ3-CD1 4.47Å; W539-I542 PolarHBondContact O-N 3.2Å; V540-I542 PolarHBondContact O-N 2.95Å; I542-L544 VanDerWaalsContact C-N 3.34Å; I542-L544 PolarHBondContact O-N 2.88Å; I542-L545 WeakPolarHBondContact O-CB 3.22Å; I542-L545 PolarHBondContact O-N 3.42Å; I542-L545 VanDerWaalsContact O-N 3.12Å; I542-V546 HydrophobicContact CG2-CG2 4.49Å; I542-V546 WeakPolarHBondContact O-CG2 3.47Å; I542-V546 PolarHBondContact O-N 3.27Å
543G93.8Very high90.1Very high42 Ų4254.7 Ų54.743%0.43328%0.283SS..Hα-helixtrans-57.7-46.8178.700000112.1W539 V540 L545 V546 L547W539-G543 PolarHBondContact O-N 3.41Å; V540-G543 PolarHBondContact O-N 3.43Å; G543-L545 VanDerWaalsContact C-N 3.33Å; G543-L545 PolarHBondContact O-N 2.94Å; G543-V546 PolarHBondContact O-N 3.05Å; G543-L547 WeakPolarHBondContact O-CB 3.36Å; G543-L547 PolarHBondContact O-N 2.92Å
544L93.8Very high90.7Very high6 Ų652.6 Ų52.63%0.03127%0.272CS..Hα-helixtrans-65.5-32.9175.9-71.6174.3000112.9L361 R362 F365 L525 V540 I542 S548L361-L544 HydrophobicContact CD2-CD2 4.21Å; L361-L544 HydrophobicContact CG-CD2 4.34Å; R362-L544 HydrophobicContact CG-CB 4.32Å; R362-L544 HydrophobicContact CG-CD1 4.35Å; F365-L544 HydrophobicContact CB-CD1 4.48Å; F365-L544 HydrophobicContact CD1-CD1 3.45Å; F365-L544 VanDerWaalsContact CD1-CD1 3.45Å; F365-L544 HydrophobicContact CE1-CD1 3.9Å; F365-L544 HydrophobicContact CG-CD1 4.08Å; L525-L544 HydrophobicContact CD2-CD1 4Å; L525-L544 HydrophobicContact CD2-CD2 3.71Å; L525-L544 HydrophobicContact CD2-CG 3.95Å; V540-L544 HydrophobicContact CG1-CD1 4.13Å; V540-L544 WeakPolarHBondContact O-CG 3.21Å; V540-L544 PolarHBondContact O-N 3.12Å; I542-L544 VanDerWaalsContact C-N 3.34Å; I542-L544 PolarHBondContact O-N 2.88Å; L544-S548 WeakPolarHBondContact O-CB 3.45Å; L544-S548 PolarHBondContact O-N 3.48Å; L544-S548 PolarHBondContact O-OG 3.09Å
545L94.9Very high91.5Very high29 Ų2944.7 Ų44.715%0.15224%0.235CC..Hα-helixtrans-66.9-47.7174.8179.362.1000111.7V459 V463 L466 N541 I542 G543 L547 S548 L549V459-L545 HydrophobicContact CG1-CD1 4.25Å; V463-L545 HydrophobicContact CG2-CD2 4.32Å; L466-L545 HydrophobicContact CD1-CD2 3.64Å; N541-L545 VanDerWaalsContact O-CB 3.25Å; N541-L545 WeakPolarHBondContact O-CB 3.48Å; N541-L545 PolarHBondContact O-N 3.45Å; I542-L545 WeakPolarHBondContact O-CB 3.22Å; I542-L545 PolarHBondContact O-N 3.42Å; I542-L545 VanDerWaalsContact O-N 3.12Å; G543-L545 VanDerWaalsContact C-N 3.33Å; G543-L545 PolarHBondContact O-N 2.94Å; L545-L547 VanDerWaalsContact C-N 3.3Å; L545-L547 PolarHBondContact O-N 3.27Å; L545-S548 WeakPolarHBondContact O-CB 3.41Å; L545-S548 PolarHBondContact O-N 3.34Å; L545-S548 VanDerWaalsContact O-N 3.14Å; L545-L549 PolarHBondContact O-N 3.16Å
546V95.2Very high92.4Very high92 Ų9249.5 Ų49.556%0.55826%0.259SS*.Hα-helixtrans-60.2-44.1175.9173.20000110.2I542 G543 S548 L549I542-V546 HydrophobicContact CG2-CG2 4.49Å; I542-V546 WeakPolarHBondContact O-CG2 3.47Å; I542-V546 PolarHBondContact O-N 3.27Å; G543-V546 PolarHBondContact O-N 3.05Å; V546-S548 VanDerWaalsContact C-N 3.28Å; V546-S548 PolarHBondContact O-N 2.98Å; V546-L549 WeakPolarHBondContact O-CB 3.28Å; V546-L549 PolarHBondContact O-N 3.47Å; V546-L549 VanDerWaalsContact O-N 3.13Å
547L94.4Very high92.9Very high51 Ų5148.9 Ų48.927%0.26725%0.251SS..Hα-helixtrans-61-39.1176.7-167.369.6000111.6I358 F518 G543 L545 L549 L550I358-L547 HydrophobicContact CB-CD2 4.49Å; I358-L547 HydrophobicContact CB-CG 4.41Å; I358-L547 HydrophobicContact CD1-CD1 4.24Å; I358-L547 HydrophobicContact CD1-CG 3.99Å; I358-L547 HydrophobicContact CG1-CD1 4.39Å; I358-L547 HydrophobicContact CG1-CD2 4.02Å; I358-L547 HydrophobicContact CG1-CG 3.84Å; I358-L547 HydrophobicContact CG2-CB 4.28Å; I358-L547 HydrophobicContact CG2-CD2 4.05Å; I358-L547 HydrophobicContact CG2-CG 3.79Å; F518-L547 HydrophobicContact CE1-CD2 4.44Å; F518-L547 HydrophobicContact CZ-CD2 4.42Å; G543-L547 WeakPolarHBondContact O-CB 3.36Å; G543-L547 PolarHBondContact O-N 2.92Å; L545-L547 VanDerWaalsContact C-N 3.3Å; L545-L547 PolarHBondContact O-N 3.27Å; L547-L549 PolarHBondContact O-N 3Å; L547-L550 HydrophobicContact CD1-CD1 3.78Å; L547-L550 WeakPolarHBondContact O-CB 3.43Å; L547-L550 PolarHBondContact O-N 2.71Å
548S94.6Very high93.1Very high0 Ų048.1 Ų48.10%025%0.246CC..Hα-helixtrans-60.8-25.2177.5-600000113.5R362 L544 L545 V546 L550 G551R362-S548 PolarHBondContact NH1-OG 3.05Å; L544-S548 WeakPolarHBondContact O-CB 3.45Å; L544-S548 PolarHBondContact O-N 3.48Å; L544-S548 PolarHBondContact O-OG 3.09Å; L545-S548 WeakPolarHBondContact O-CB 3.41Å; L545-S548 PolarHBondContact O-N 3.34Å; L545-S548 VanDerWaalsContact O-N 3.14Å; V546-S548 VanDerWaalsContact C-N 3.28Å; V546-S548 PolarHBondContact O-N 2.98Å; S548-L550 PolarHBondContact O-N 2.97Å; S548-G551 PolarHBondContact O-N 3.4Å; S548-G551 VanDerWaalsContact O-N 3.1Å
549L94.6Very high93.3Very high92 Ų9248.1 Ų48.148%0.48225%0.249SC..Hα-helixtrans-67.2-24.5175.9-62175.2000112.6V459 L545 V546 L547 G551 F552V459-L549 HydrophobicContact CG2-CD2 3.85Å; L545-L549 PolarHBondContact O-N 3.16Å; V546-L549 WeakPolarHBondContact O-CB 3.28Å; V546-L549 PolarHBondContact O-N 3.47Å; V546-L549 VanDerWaalsContact O-N 3.13Å; L547-L549 PolarHBondContact O-N 3Å; L549-G551 PolarHBondContact O-N 2.82Å; L549-F552 HydrophobicContact CD2-CE2 4.36Å; L549-F552 WeakPolarHBondContact O-CD2 3.48Å; L549-F552 PolarHBondContact O-N 2.77Å
550L94.1Very high93.4Very high73 Ų7346.9 Ų46.938%0.38224%0.244SC..G310 helixtrans-64.6-20.5173.3-60.7178.7000112.3I358 L547 S548 F552 L553I358-L550 HydrophobicContact CD1-CB 3.86Å; I358-L550 HydrophobicContact CD1-CD1 4.25Å; L547-L550 HydrophobicContact CD1-CD1 3.78Å; L547-L550 WeakPolarHBondContact O-CB 3.43Å; L547-L550 PolarHBondContact O-N 2.71Å; S548-L550 PolarHBondContact O-N 2.97Å; L550-F552 PolarHBondContact O-N 3.18Å; L550-F552 VanDerWaalsContact O-N 3.15Å; L550-L553 HydrophobicContact CB-CD1 4.32Å; L550-L553 HydrophobicContact CD2-CD1 4.17Å; L550-L553 VanDerWaalsContact O-CB 3.29Å; L550-L553 WeakPolarHBondContact O-CB 3.35Å; L550-L553 VanDerWaalsContact O-CG 3.25Å; L550-L553 WeakPolarHBondContact O-CG 3.27Å; L550-L553 PolarHBondContact O-N 2.86Å
551G91.1Very high93.2Very high1 Ų148.1 Ų48.11%0.0125%0.248CC..G310 helixtrans-60.7-20.2174.100000113.9N455 S548 L549 L553 P555N455-G551 PolarHBondContact ND2-O 2.8Å; S548-G551 PolarHBondContact O-N 3.4Å; S548-G551 VanDerWaalsContact O-N 3.1Å; L549-G551 PolarHBondContact O-N 2.82Å; G551-L553 VanDerWaalsContact C-N 3.29Å; G551-L553 PolarHBondContact O-N 3.42Å; G551-P555 WeakPolarHBondContact O-CD 3.12Å
552F94.5Very high93Very high52 Ų5252.1 Ų52.123%0.22826%0.262CS..G310 helixtrans-75.2-13.7174.8-72.5-83.9000113.9N455 L456 V459 L549 L550 L554 P555 L556N455-F552 HydrophobicContact CB-CD1 4.28Å; N455-F552 HydrophobicContact CB-CD2 4.34Å; N455-F552 HydrophobicContact CB-CE1 3.85Å; N455-F552 HydrophobicContact CB-CE2 3.91Å; N455-F552 HydrophobicContact CB-CZ 3.64Å; L456-F552 HydrophobicContact CD2-CE1 4.29Å; L456-F552 HydrophobicContact CD2-CZ 4.04Å; L456-F552 HydrophobicContact CG-CE1 4.37Å; L456-F552 HydrophobicContact CG-CZ 4.31Å; V459-F552 HydrophobicContact CG2-CE2 3.83Å; V459-F552 HydrophobicContact CG2-CZ 4.38Å; L549-F552 HydrophobicContact CD2-CE2 4.36Å; L549-F552 WeakPolarHBondContact O-CD2 3.48Å; L549-F552 PolarHBondContact O-N 2.77Å; L550-F552 PolarHBondContact O-N 3.18Å; L550-F552 VanDerWaalsContact O-N 3.15Å; F552-L554 VanDerWaalsContact C-N 3.28Å; F552-L554 PolarHBondContact O-N 3.02Å; F552-P555 WeakPolarHBondContact O-CD 3.47Å; F552-L556 VanDerWaalsContact O-CG 3.26Å; F552-L556 WeakPolarHBondContact O-CG 3.26Å; F552-L556 PolarHBondContact O-N 2.87Å; F552-L556 VanDerWaalsContact O-N 3.08Å
553L94.5Very high92.7Very high77 Ų7756 Ų5640%0.40327%0.274SS..Hα-helixtrans-61-37.4176.5-65.6174.9000112L351 L354 L550 G551 L556 Y557L351-L553 HydrophobicContact CD2-CB 3.83Å; L354-L553 HydrophobicContact CD2-CD1 4.42Å; L550-L553 HydrophobicContact CB-CD1 4.32Å; L550-L553 HydrophobicContact CD2-CD1 4.17Å; L550-L553 VanDerWaalsContact O-CB 3.29Å; L550-L553 WeakPolarHBondContact O-CB 3.35Å; L550-L553 VanDerWaalsContact O-CG 3.25Å; L550-L553 WeakPolarHBondContact O-CG 3.27Å; L550-L553 PolarHBondContact O-N 2.86Å; G551-L553 VanDerWaalsContact C-N 3.29Å; G551-L553 PolarHBondContact O-N 3.42Å; L553-L556 PolarHBondContact O-N 3.1Å; L553-Y557 WeakPolarHBondContact O-CB 3.37Å; L553-Y557 PolarHBondContact O-N 3.45Å
554L92.9Very high92.4Very high0 Ų055.8 Ų55.80%026%0.264CS..Hα-helixtrans-64.4-54.9177174.672.7000112L351 F451 L494 F552 L556 Y557 L558L351-L554 HydrophobicContact CB-CB 3.97Å; L351-L554 HydrophobicContact CB-CD1 3.74Å; L351-L554 HydrophobicContact CB-CG 4.47Å; F451-L554 HydrophobicContact CD1-CD2 3.58Å; F451-L554 HydrophobicContact CD2-CD2 3.91Å; F451-L554 HydrophobicContact CE1-CD2 3.53Å; F451-L554 HydrophobicContact CE2-CD2 3.89Å; F451-L554 HydrophobicContact CG-CD2 3.77Å; F451-L554 HydrophobicContact CZ-CD2 3.7Å; L494-L554 HydrophobicContact CD2-CD1 4.42Å; L494-L554 HydrophobicContact CD2-CD2 4.3Å; F552-L554 VanDerWaalsContact C-N 3.28Å; F552-L554 PolarHBondContact O-N 3.02Å; L554-L556 VanDerWaalsContact C-N 3.29Å; L554-L556 PolarHBondContact O-N 2.97Å; L554-Y557 PolarHBondContact O-N 3.1Å; L554-L558 HydrophobicContact CD1-CD1 4.31Å; L554-L558 HydrophobicContact CD1-CG 4.21Å; L554-L558 HydrophobicContact CG-CD1 4.12Å; L554-L558 HydrophobicContact CG-CG 4.39Å; L554-L558 WeakPolarHBondContact O-CG 3.48Å; L554-L558 PolarHBondContact O-N 3.28Å
555P93.5Very high91.9Very high4 Ų456.4 Ų56.43%0.02627%0.267CS..Hα-helixtrans-50.3-44.5171.4-31.834.5000114.5L448 F451 I452 G551 F552 Y557 L558 I559L448-P555 HydrophobicContact CD1-CB 3.74Å; L448-P555 VanDerWaalsContact CD1-O 3.23Å; L448-P555 WeakPolarHBondContact CD1-O 3.31Å; F451-P555 HydrophobicContact CB-CG 3.98Å; I452-P555 HydrophobicContact CD1-CB 4.43Å; I452-P555 HydrophobicContact CG1-CB 3.73Å; I452-P555 HydrophobicContact CG1-CG 4.09Å; G551-P555 WeakPolarHBondContact O-CD 3.12Å; F552-P555 WeakPolarHBondContact O-CD 3.47Å; P555-Y557 VanDerWaalsContact C-N 3.35Å; P555-Y557 PolarHBondContact O-N 3.04Å; P555-L558 PolarHBondContact O-N 2.78Å; P555-I559 WeakPolarHBondContact O-CG1 3.36Å; P555-I559 PolarHBondContact O-N 3.1Å
556L93.6Very high91.4Very high108 Ų10857.3 Ų57.357%0.56527%0.27SS*.Hα-helixtrans-61.8-44.1178.8-70.1171.3000111.4F552 L553 L554 I559 W560F552-L556 VanDerWaalsContact O-CG 3.26Å; F552-L556 WeakPolarHBondContact O-CG 3.26Å; F552-L556 PolarHBondContact O-N 2.87Å; F552-L556 VanDerWaalsContact O-N 3.08Å; L553-L556 PolarHBondContact O-N 3.1Å; L554-L556 VanDerWaalsContact C-N 3.29Å; L554-L556 PolarHBondContact O-N 2.97Å; L556-I559 PolarHBondContact O-N 3.07Å; L556-W560 PolarHBondContact O-N 3.43Å
557Y93.2Very high90.9Very high59 Ų5958.6 Ų58.623%0.23127%0.265CS..Hα-helixtrans-65.3-40.5175.1-175-94.2000112.3P347 I348 L351 L553 L554 P555 I559 W560 Y561P347-Y557 HydrophobicContact CB-CE1 4.18Å; P347-Y557 HydrophobicContact CB-CE2 4.11Å; P347-Y557 HydrophobicContact CG-CE1 4.01Å; P347-Y557 HydrophobicContact CG-CE2 4.23Å; P347-Y557 WeakPolarHBondContact CG-OH 3.49Å; I348-Y557 HydrophobicContact CD1-CE1 4.35Å; I348-Y557 HydrophobicContact CG1-CD1 4.04Å; I348-Y557 HydrophobicContact CG1-CE1 3.55Å; L351-Y557 VanDerWaalsContact CD1-CB 3.47Å; L351-Y557 HydrophobicContact CD1-CD1 4.16Å; L351-Y557 HydrophobicContact CD1-CD2 4.2Å; L351-Y557 HydrophobicContact CD1-CG 3.67Å; L553-Y557 WeakPolarHBondContact O-CB 3.37Å; L553-Y557 PolarHBondContact O-N 3.45Å; L554-Y557 PolarHBondContact O-N 3.1Å; P555-Y557 VanDerWaalsContact C-N 3.35Å; P555-Y557 PolarHBondContact O-N 3.04Å; Y557-I559 VanDerWaalsContact C-N 3.29Å; Y557-I559 PolarHBondContact O-N 3.38Å; Y557-W560 HydrophobicContact CD2-CE3 4.24Å; Y557-W560 AromaticContact CE2-CE3 3.7Å; Y557-W560 HydrophobicContact CE2-CE3 3.7Å; Y557-W560 AromaticContact CE2-CZ3 3.8Å; Y557-W560 HydrophobicContact CE2-CZ3 3.8Å; Y557-W560 AromaticContact CZ-CE3 3.96Å; Y557-W560 AromaticContact CZ-CZ3 3.86Å; Y557-W560 WeakPolarHBondContact O-CB 3.04Å; Y557-W560 PolarHBondContact O-N 3.41Å; Y557-W560 VanDerWaalsContact O-N 3.15Å; Y557-Y561 WeakPolarHBondContact O-CB 3.33Å; Y557-Y561 PolarHBondContact O-N 3.33Å
558L90.6Very high90.5Very high0 Ų060.4 Ų60.40%027%0.272CS..Hα-helixtrans-64.6-31.6177-72.2178.1000112.4I348 V444 L448 L494 L554 P555 R562I348-L558 HydrophobicContact CG2-CD2 4.48Å; V444-L558 HydrophobicContact CG1-CD2 4.38Å; L448-L558 HydrophobicContact CB-CB 4.39Å; L448-L558 HydrophobicContact CB-CD1 4.44Å; L448-L558 HydrophobicContact CD1-CB 4.02Å; L494-L558 HydrophobicContact CD1-CD1 4.31Å; L494-L558 HydrophobicContact CD1-CD2 4.11Å; L554-L558 HydrophobicContact CD1-CD1 4.31Å; L554-L558 HydrophobicContact CD1-CG 4.21Å; L554-L558 HydrophobicContact CG-CD1 4.12Å; L554-L558 HydrophobicContact CG-CG 4.39Å; L554-L558 WeakPolarHBondContact O-CG 3.48Å; L554-L558 PolarHBondContact O-N 3.28Å; P555-L558 PolarHBondContact O-N 2.78Å; L558-R562 WeakPolarHBondContact O-CB 3.31Å; L558-R562 PolarHBondContact O-N 3.15Å
559I91.9Very high89.8Confident85 Ų8563.3 Ų63.344%0.43629%0.287SS..Hα-helixtrans-63.4-46.7171.5-69.4163.5000110.3L448 P555 L556 Y557 R562 W563L448-I559 HydrophobicContact CD1-CD1 4.43Å; L448-I559 HydrophobicContact CD1-CG1 3.93Å; L448-I559 HydrophobicContact CD2-CG1 3.6Å; L448-I559 HydrophobicContact CG-CG1 4.42Å; P555-I559 WeakPolarHBondContact O-CG1 3.36Å; P555-I559 PolarHBondContact O-N 3.1Å; L556-I559 PolarHBondContact O-N 3.07Å; Y557-I559 VanDerWaalsContact C-N 3.29Å; Y557-I559 PolarHBondContact O-N 3.38Å; I559-R562 PolarHBondContact O-N 2.97Å; I559-W563 PolarHBondContact O-N 2.95Å
560W91.4Very high89.3Confident136 Ų13664.8 Ų64.852%0.51529%0.292SS..Hα-helixtrans-64.1-48177.2178.182.1000111.8L556 Y557 R562 W563 T564L556-W560 PolarHBondContact O-N 3.43Å; Y557-W560 HydrophobicContact CD2-CE3 4.24Å; Y557-W560 AromaticContact CE2-CE3 3.7Å; Y557-W560 HydrophobicContact CE2-CE3 3.7Å; Y557-W560 AromaticContact CE2-CZ3 3.8Å; Y557-W560 HydrophobicContact CE2-CZ3 3.8Å; Y557-W560 AromaticContact CZ-CE3 3.96Å; Y557-W560 AromaticContact CZ-CZ3 3.86Å; Y557-W560 WeakPolarHBondContact O-CB 3.04Å; Y557-W560 PolarHBondContact O-N 3.41Å; Y557-W560 VanDerWaalsContact O-N 3.15Å; W560-R562 VanDerWaalsContact C-N 3.31Å; W560-R562 PolarHBondContact O-N 3.1Å; W560-W563 WeakPolarHBondContact O-CB 3.27Å; W560-W563 PolarHBondContact O-N 3.14Å; W560-T564 PolarHBondContact O-N 3.23Å; W560-T564 PolarHBondContact O-OG1 3.09Å; W560-T564 VanDerWaalsContact O-OG1 3.13Å
561Y88.7Confident88.8Confident45 Ų4566.2 Ų66.218%0.17630%0.297CS..Hα-helixtrans-58.7-42.9177.3-179.7-110.6000112I348 V444 Y557 W563 T564 L565I348-Y561 HydrophobicContact CD1-CD1 4.11Å; I348-Y561 HydrophobicContact CD1-CD2 4.32Å; I348-Y561 HydrophobicContact CD1-CE1 4.01Å; I348-Y561 HydrophobicContact CD1-CE2 4.24Å; I348-Y561 HydrophobicContact CD1-CG 4.26Å; V444-Y561 HydrophobicContact CG1-CD1 4.15Å; V444-Y561 HydrophobicContact CG2-CE1 4.21Å; Y557-Y561 WeakPolarHBondContact O-CB 3.33Å; Y557-Y561 PolarHBondContact O-N 3.33Å; Y561-W563 PolarHBondContact O-N 3.29Å; Y561-T564 PolarHBondContact O-N 3.4Å; Y561-L565 HydrophobicContact CD1-CD1 3.87Å; Y561-L565 HydrophobicContact CE1-CD1 3.37Å; Y561-L565 HydrophobicContact CE1-CG 4.19Å; Y561-L565 HydrophobicContact CE2-CD1 4.47Å; Y561-L565 HydrophobicContact CE2-CG 4.45Å; Y561-L565 PolarHBondContact O-N 2.95Å
562R88Confident88.3Confident92 Ų9272.9 Ų72.935%0.34733%0.325SS..Hα-helixtrans-58.8-46.8173.2175.3179.1-178.5-137.8-4.6111V444 T445 L558 I559 W560 T564 L565 H566V444-R562 HydrophobicContact CG1-CB 4.43Å; T445-R562 WeakPolarHBondContact OG1-CD 3.47Å; T445-R562 PolarHBondContact OG1-NE 3.21Å; L558-R562 WeakPolarHBondContact O-CB 3.31Å; L558-R562 PolarHBondContact O-N 3.15Å; I559-R562 PolarHBondContact O-N 2.97Å; W560-R562 VanDerWaalsContact C-N 3.31Å; W560-R562 PolarHBondContact O-N 3.1Å; R562-T564 VanDerWaalsContact C-N 3.35Å; R562-T564 PolarHBondContact O-N 2.96Å; R562-L565 PolarHBondContact O-N 2.54Å; R562-H566 WeakPolarHBondContact CG-CE1 3.47Å; R562-H566 WeakPolarHBondContact CG-NE2 3.21Å; R562-H566 PolarHBondContact NE-NE2 3.37Å; R562-H566 VanDerWaalsContact NE-NE2 3.16Å; R562-H566 PolarHBondContact O-CD2 2.93Å; R562-H566 PolarHBondContact O-CE1 3Å; R562-H566 PolarHBondContact O-N 2.89Å; R562-H566 VanDerWaalsContact O-N 3.12Å; R562-H566 PolarHBondContact O-ND1 2.97Å; R562-H566 PolarHBondContact O-NE2 3.15Å
563W87.3Confident87.6Confident133 Ų13372.7 Ų72.750%0.50433%0.333SS..Hα-helixtrans-61.6-42.4177.8178.975.9000112.2I559 W560 Y561 H566 R567I559-W563 PolarHBondContact O-N 2.95Å; W560-W563 WeakPolarHBondContact O-CB 3.27Å; W560-W563 PolarHBondContact O-N 3.14Å; Y561-W563 PolarHBondContact O-N 3.29Å; W563-H566 PolarHBondContact O-N 3.06Å; W563-R567 WeakPolarHBondContact O-CG 3.41Å; W563-R567 PolarHBondContact O-N 2.96Å; W563-R567 VanDerWaalsContact O-N 3.14Å
564T87Confident87Confident37 Ų3774.6 Ų74.623%0.22734%0.34CS..Hα-helixtrans-60.4-48176.1-54.90000111.9W560 Y561 R562 H566 R567 E568W560-T564 PolarHBondContact O-N 3.23Å; W560-T564 PolarHBondContact O-OG1 3.09Å; W560-T564 VanDerWaalsContact O-OG1 3.13Å; Y561-T564 PolarHBondContact O-N 3.4Å; R562-T564 VanDerWaalsContact C-N 3.35Å; R562-T564 PolarHBondContact O-N 2.96Å; T564-H566 VanDerWaalsContact C-N 3.28Å; T564-H566 PolarHBondContact O-N 3.5Å; T564-R567 WeakPolarHBondContact O-CB 3.11Å; T564-R567 PolarHBondContact O-N 2.99Å; T564-R567 VanDerWaalsContact O-N 3.1Å; T564-E568 PolarHBondContact O-N 3.3Å
565L83.8Confident86.5Confident18 Ų1879.3 Ų79.39%0.09437%0.365CS..Hα-helixtrans-57.8-39.2176.3-79171.6000112.6I441 Y561 R562 R567 E568 L569I441-L565 HydrophobicContact CG1-CB 4.36Å; Y561-L565 HydrophobicContact CD1-CD1 3.87Å; Y561-L565 HydrophobicContact CE1-CD1 3.37Å; Y561-L565 HydrophobicContact CE1-CG 4.19Å; Y561-L565 HydrophobicContact CE2-CD1 4.47Å; Y561-L565 HydrophobicContact CE2-CG 4.45Å; Y561-L565 PolarHBondContact O-N 2.95Å; R562-L565 PolarHBondContact O-N 2.54Å; L565-R567 VanDerWaalsContact C-N 3.31Å; L565-R567 PolarHBondContact O-N 3.11Å; L565-E568 PolarHBondContact O-N 2.97Å; L565-L569 WeakPolarHBondContact O-CG 3.41Å; L565-L569 PolarHBondContact O-N 3.4Å
566H83.7Confident85.6Confident48 Ų4881.5 Ų81.522%0.22238%0.384CS..Hα-helixtrans-65.8-37.9178.6-59.5-5.2000111.7I441 R562 W563 T564 Q570I441-H566 WeakPolarHBondContact CD1-ND1 3.43Å; I441-H566 WeakPolarHBondContact CG2-CE1 3.48Å; R562-H566 WeakPolarHBondContact CG-CE1 3.47Å; R562-H566 WeakPolarHBondContact CG-NE2 3.21Å; R562-H566 PolarHBondContact NE-NE2 3.37Å; R562-H566 VanDerWaalsContact NE-NE2 3.16Å; R562-H566 PolarHBondContact O-CD2 2.93Å; R562-H566 PolarHBondContact O-CE1 3Å; R562-H566 PolarHBondContact O-N 2.89Å; R562-H566 VanDerWaalsContact O-N 3.12Å; R562-H566 PolarHBondContact O-ND1 2.97Å; R562-H566 PolarHBondContact O-NE2 3.15Å; W563-H566 PolarHBondContact O-N 3.06Å; T564-H566 VanDerWaalsContact C-N 3.28Å; T564-H566 PolarHBondContact O-N 3.5Å; H566-Q570 WeakPolarHBondContact O-CB 3.32Å; H566-Q570 VanDerWaalsContact O-CG 3.26Å; H566-Q570 WeakPolarHBondContact O-CG 3.32Å; H566-Q570 PolarHBondContact O-N 3.37Å
567R85.4Confident85Confident119 Ų11983.1 Ų83.145%0.44939%0.386SS..Hα-helixtrans-67.5-43.3177.1-68.2-177.279.6-173.92.3111.3W563 T564 L565 L569 Q570 Q571W563-R567 WeakPolarHBondContact O-CG 3.41Å; W563-R567 PolarHBondContact O-N 2.96Å; W563-R567 VanDerWaalsContact O-N 3.14Å; T564-R567 WeakPolarHBondContact O-CB 3.11Å; T564-R567 PolarHBondContact O-N 2.99Å; T564-R567 VanDerWaalsContact O-N 3.1Å; L565-R567 VanDerWaalsContact C-N 3.31Å; L565-R567 PolarHBondContact O-N 3.11Å; R567-L569 VanDerWaalsContact C-N 3.34Å; R567-L569 PolarHBondContact O-N 3.42Å; R567-Q570 PolarHBondContact O-N 3.02Å; R567-Q571 WeakPolarHBondContact O-CG 3.39Å; R567-Q571 PolarHBondContact O-N 3.11Å
568E85.4Confident84.1Confident89 Ų8984.7 Ų84.742%0.41640%0.398SS..Hα-helixtrans-61.6-41.4176.7-71.4177.3-174.500112T564 L565 Q571 K572T564-E568 PolarHBondContact O-N 3.3Å; L565-E568 PolarHBondContact O-N 2.97Å; E568-Q571 PolarHBondContact O-N 3.39Å; E568-K572 WeakPolarHBondContact O-CG 3.38Å; E568-K572 PolarHBondContact O-N 3.43Å
569L81.7Confident83.1Confident61 Ų6190.4 Ų90.432%0.31942%0.42SS..Hα-helixtrans-68.2-37.1175.3-73.7178.8000112.8D438 I441 L565 R567 Q571 K572 A573D438-L569 HydrophobicContact CB-CD1 3.95Å; D438-L569 WeakPolarHBondContact OD2-CD1 3.47Å; I441-L569 HydrophobicContact CD1-CD1 3.18Å; I441-L569 HydrophobicContact CD1-CG 4.43Å; I441-L569 HydrophobicContact CG1-CD1 4.27Å; L565-L569 WeakPolarHBondContact O-CG 3.41Å; L565-L569 PolarHBondContact O-N 3.4Å; R567-L569 VanDerWaalsContact C-N 3.34Å; R567-L569 PolarHBondContact O-N 3.42Å; L569-Q571 VanDerWaalsContact C-N 3.34Å; L569-K572 PolarHBondContact O-N 3.41Å; L569-A573 VanDerWaalsContact O-CB 3.31Å; L569-A573 WeakPolarHBondContact O-CB 3.43Å; L569-A573 PolarHBondContact O-N 3.34Å
570Q82.6Confident82.1Confident123 Ų12389.8 Ų89.858%0.57542%0.417SS*.Hα-helixtrans-62.6-44.2173.5-77.4173.9-13.900110.9H566 R567 A573 E574H566-Q570 WeakPolarHBondContact O-CB 3.32Å; H566-Q570 VanDerWaalsContact O-CG 3.26Å; H566-Q570 WeakPolarHBondContact O-CG 3.32Å; H566-Q570 PolarHBondContact O-N 3.37Å; R567-Q570 PolarHBondContact O-N 3.02Å; Q570-A573 PolarHBondContact O-N 3.38Å; Q570-E574 WeakPolarHBondContact O-CB 3.34Å; Q570-E574 WeakPolarHBondContact O-CG 3.32Å; Q570-E574 PolarHBondContact O-N 3.37Å
571Q84.1Confident81.1Confident104 Ų10492 Ų9249%0.48643%0.43SS..Hα-helixtrans-60.4-50.1174.7-74.7174.8-23.900111.4R567 E568 L569 A573 E574 D575R567-Q571 WeakPolarHBondContact O-CG 3.39Å; R567-Q571 PolarHBondContact O-N 3.11Å; E568-Q571 PolarHBondContact O-N 3.39Å; L569-Q571 VanDerWaalsContact C-N 3.34Å; Q571-A573 VanDerWaalsContact C-N 3.26Å; Q571-A573 PolarHBondContact O-N 2.9Å; Q571-E574 CarbonylContact O-C 3.56Å; Q571-E574 WeakPolarHBondContact O-CA 3.47Å; Q571-E574 PolarHBondContact O-N 3.11Å; Q571-D575 WeakPolarHBondContact O-CB 3.44Å; Q571-D575 VanDerWaalsContact O-CG 3.25Å; Q571-D575 PolarHBondContact O-N 2.9Å
572K81.1Confident80.2Confident141 Ų14196 Ų9661%0.61345%0.454SS*.Hα-helixtrans-57.9-38.2175.8-73.7-179.3-179.7-176.20112.8E568 L569 A576E568-K572 WeakPolarHBondContact O-CG 3.38Å; E568-K572 PolarHBondContact O-N 3.43Å; L569-K572 PolarHBondContact O-N 3.41Å; K572-A576 VanDerWaalsContact O-CB 3.23Å; K572-A576 WeakPolarHBondContact O-CB 3.39Å; K572-A576 PolarHBondContact O-N 2.93Å
573A80.1Confident79.1Confident48 Ų4895.2 Ų95.240%0.39746%0.456SS..Hα-helixtrans-71.2-32.9176.700000112.5L569 Q570 Q571 K577L569-A573 VanDerWaalsContact O-CB 3.31Å; L569-A573 WeakPolarHBondContact O-CB 3.43Å; L569-A573 PolarHBondContact O-N 3.34Å; Q570-A573 PolarHBondContact O-N 3.38Å; Q571-A573 VanDerWaalsContact C-N 3.26Å; Q571-A573 PolarHBondContact O-N 2.9Å; A573-K577 WeakPolarHBondContact O-CD 3.15Å; A573-K577 WeakPolarHBondContact O-CG 3.4Å; A573-K577 PolarHBondContact O-N 3.13Å
574E81.9Confident77.4Confident116 Ų11692.3 Ų92.354%0.54247%0.468SS..Hα-helixtrans-71.3-46.2172.6-74.5-178.7174.200111.4Q570 Q571 A576 K577 I578Q570-E574 WeakPolarHBondContact O-CB 3.34Å; Q570-E574 WeakPolarHBondContact O-CG 3.32Å; Q570-E574 PolarHBondContact O-N 3.37Å; Q571-E574 CarbonylContact O-C 3.56Å; Q571-E574 WeakPolarHBondContact O-CA 3.47Å; Q571-E574 PolarHBondContact O-N 3.11Å; E574-A576 VanDerWaalsContact C-N 3.33Å; E574-A576 PolarHBondContact O-N 2.04Å; E574-K577 WeakPolarHBondContact O-CB 3.46Å; E574-K577 PolarHBondContact O-N 3.03Å; E574-K577 VanDerWaalsContact O-N 3.09Å; E574-I578 VanDerWaalsContact O-CG1 3.31Å; E574-I578 WeakPolarHBondContact O-CG1 3.46Å; E574-I578 PolarHBondContact O-N 3.18Å
575D80.8Confident75.9Confident99 Ų9994.1 Ų94.153%0.52948%0.479SS..Hα-helixtrans-59.2-43.5175.2-66.6-22.1000111.1Q571 K577 I578 Y579Q571-D575 WeakPolarHBondContact O-CB 3.44Å; Q571-D575 VanDerWaalsContact O-CG 3.25Å; Q571-D575 PolarHBondContact O-N 2.9Å; D575-K577 VanDerWaalsContact C-N 3.34Å; D575-K577 PolarHBondContact O-N 3.07Å; D575-I578 PolarHBondContact O-N 3.46Å; D575-Y579 WeakPolarHBondContact O-CB 3.03Å; D575-Y579 PolarHBondContact O-N 3.16Å
576A76.3Confident74.2Confident50 Ų50102.3 Ų102.341%0.41352%0.516SS..Hα-helixtrans-61.9-40.2174.500000112.2K572 E574 Y579 I580K572-A576 VanDerWaalsContact O-CB 3.23Å; K572-A576 WeakPolarHBondContact O-CB 3.39Å; K572-A576 PolarHBondContact O-N 2.93Å; E574-A576 VanDerWaalsContact C-N 3.33Å; E574-A576 PolarHBondContact O-N 2.04Å; A576-Y579 PolarHBondContact O-N 2.97Å; A576-I580 WeakPolarHBondContact O-CD1 3.06Å; A576-I580 VanDerWaalsContact O-CG1 3.25Å; A576-I580 WeakPolarHBondContact O-CG1 3.49Å; A576-I580 PolarHBondContact O-N 3.16Å
577K79.4Confident72.6Confident142 Ų142105 Ų10562%0.61754%0.536SS*.Hα-helixtrans-66.1-39.3174.9-74.7166-179.3172.70111.9A573 E574 D575 K581A573-K577 WeakPolarHBondContact O-CD 3.15Å; A573-K577 WeakPolarHBondContact O-CG 3.4Å; A573-K577 PolarHBondContact O-N 3.13Å; E574-K577 WeakPolarHBondContact O-CB 3.46Å; E574-K577 PolarHBondContact O-N 3.03Å; E574-K577 VanDerWaalsContact O-N 3.09Å; D575-K577 VanDerWaalsContact C-N 3.34Å; D575-K577 PolarHBondContact O-N 3.07Å; K577-K581 WeakPolarHBondContact O-CB 3.34Å; K577-K581 PolarHBondContact O-N 3.39Å
578I75.9Confident70.6Confident93 Ų93103.9 Ų103.948%0.47754%0.544SS..Hα-helixtrans-64.3-45.5176.4-68.1164.9000109.5E574 D575 K581 I582E574-I578 VanDerWaalsContact O-CG1 3.31Å; E574-I578 WeakPolarHBondContact O-CG1 3.46Å; E574-I578 PolarHBondContact O-N 3.18Å; D575-I578 PolarHBondContact O-N 3.46Å; I578-K581 PolarHBondContact O-N 3.2Å; I578-K581 VanDerWaalsContact O-N 3.17Å; I578-I582 HydrophobicContact CG2-CD1 3.64Å; I578-I582 HydrophobicContact CG2-CG1 4.42Å; I578-I582 VanDerWaalsContact O-CG1 3.3Å; I578-I582 WeakPolarHBondContact O-CG1 3.25Å; I578-I582 PolarHBondContact O-N 3.36Å
579Y68.8Low68.4Low120 Ų120106.3 Ų106.347%0.47156%0.555SS.*Hα-helixtrans-60.1-47.4178.3-165.1-92.9000112.2D575 A576 K581 I582 N583D575-Y579 WeakPolarHBondContact O-CB 3.03Å; D575-Y579 PolarHBondContact O-N 3.16Å; A576-Y579 PolarHBondContact O-N 2.97Å; Y579-K581 VanDerWaalsContact C-N 3.28Å; Y579-K581 PolarHBondContact O-N 2.91Å; Y579-I582 PolarHBondContact O-N 3.09Å; Y579-I582 VanDerWaalsContact O-N 3.15Å; Y579-N583 PolarHBondContact O-N 3.42Å
580I70.4Confident66.3Low71 Ų71107.7 Ų107.736%0.36458%0.576SS.*Hα-helixtrans-59.7-40175.3-68.3165.5000111.1A576 I582 G584A576-I580 WeakPolarHBondContact O-CD1 3.06Å; A576-I580 VanDerWaalsContact O-CG1 3.25Å; A576-I580 WeakPolarHBondContact O-CG1 3.49Å; A576-I580 PolarHBondContact O-N 3.16Å; I580-I582 VanDerWaalsContact C-N 3.31Å; I580-I582 PolarHBondContact O-N 3.19Å; I580-G584 PolarHBondContact O-N 3.42Å
581K72.1Confident64Low184 Ų184111.3 Ų111.380%0.859%0.59SS**Hα-helixtrans-68.7-29179.2-166.6175.1-178-177.30112.9K577 I578 Y579K577-K581 WeakPolarHBondContact O-CB 3.34Å; K577-K581 PolarHBondContact O-N 3.39Å; I578-K581 PolarHBondContact O-N 3.2Å; I578-K581 VanDerWaalsContact O-N 3.17Å; Y579-K581 VanDerWaalsContact C-N 3.28Å; Y579-K581 PolarHBondContact O-N 2.91Å
582I68.4Low61.6Low129 Ų129114.3 Ų114.366%0.66262%0.615SS**Hα-helixtrans-81.7-40.5178.9-68.1167.4000111.5I578 Y579 I580 G584I578-I582 HydrophobicContact CG2-CD1 3.64Å; I578-I582 HydrophobicContact CG2-CG1 4.42Å; I578-I582 VanDerWaalsContact O-CG1 3.3Å; I578-I582 WeakPolarHBondContact O-CG1 3.25Å; I578-I582 PolarHBondContact O-N 3.36Å; Y579-I582 PolarHBondContact O-N 3.09Å; Y579-I582 VanDerWaalsContact O-N 3.15Å; I580-I582 VanDerWaalsContact C-N 3.31Å; I580-I582 PolarHBondContact O-N 3.19Å; I582-G584 PolarHBondContact O-N 2.89Å
583N65.3Low60.6Low74 Ų74113 Ų11340%0.39662%0.615SS.*Hα-helixtrans-83.6-5.2-176.1-101.210.7000115Y579 T585Y579-N583 PolarHBondContact O-N 3.42Å; N583-T585 PolarHBondContact O-N 2.63Å; N583-T585 PolarHBondContact O-OG1 3.33Å
584G52.1Low59.6Low73 Ų73116.4 Ų116.475%0.75363%0.626SS**  trans60.411.5173.800000115.3I580 I582I580-G584 PolarHBondContact O-N 3.42Å; I582-G584 PolarHBondContact O-N 2.89Å
585T54.8Low58.3Low74 Ų74116.4 Ų116.445%0.45463%0.631SS.*  trans-121.2130.5-176.927.70000109.1N583 V587N583-T585 PolarHBondContact O-N 2.63Å; N583-T585 PolarHBondContact O-OG1 3.33Å; T585-V587 PolarHBondContact O-N 3.29Å; T585-V587 VanDerWaalsContact O-N 3.12Å
586E49.3Very low57Low190 Ų190117.4 Ų117.489%0.88864%0.637SS**SBendtrans-73.52.7-175.8-64.9-172157.400113.8
587V49.8Very low55.8Low105 Ų105121.6 Ų121.664%0.63665%0.651SS**SBendtrans-106.3119.7-176.9-169.20000108.8T585 E589T585-V587 PolarHBondContact O-N 3.29Å; T585-V587 VanDerWaalsContact O-N 3.12Å; V587-E589 PolarHBondContact O-N 3.23Å
588P41.9Very low54.3Low96 Ų96120.3 Ų120.362%0.62365%0.653SS**  trans-69.5100.4171.328.3-29.9000107.5A590P588-A590 PolarHBondContact O-N 3.18Å
589E39.5Very low52.7Low139 Ų139122.2 Ų122.265%0.6567%0.666SS**PPolyproline II helixtrans-62.6123.6165.8-72.4-171.9164.100107.8V587V587-E589 PolarHBondContact O-N 3.23Å
590A38.8Very low51.5Low90 Ų90122.4 Ų122.474%0.74468%0.681SS**PPolyproline II helixtrans-61136.8-178.700000109.8P588 V592P588-A590 PolarHBondContact O-N 3.18Å; A590-V592 PolarHBondContact O-N 2.85Å
591F34Very low49.9Very low200 Ų200126.7 Ų126.788%0.87771%0.707SS**PPolyproline II helixtrans-49121.7169.9-91.9-96.5000110.4
592V32.7Very low47.9Very low166 Ų166121.5 Ų121.5100%1.00670%0.699SS**  trans-72.20158.41780000108A590A590-V592 PolarHBondContact O-N 2.85Å

Retrieved 592 of 592 residues in 168.2 ms (Link to these results)

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