A0A060XJ30_ONCMY Loading...

Solute carrier family 5 member 8, like

AlphaFold DB , UniProt , Accession A0A060XJ30, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110494699, Length 613 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
1M49.8Very low74.7Confident178 Ų17860.6 Ų60.688%0.87739%0.385SS*.  01350-81.4161.9172.900108T3 P8M1-T3 PolarHBondContact O-N 3.41Å; M1-P8 WeakPolarHBondContact CE-O 3.49Å
2T63.7Low75.6Confident91 Ų9156.9 Ų56.956%0.55836%0.359SS*.  trans-76.6104.4171.134.70000108T5T2-T5 WeakPolarHBondContact CB-OG1 3.34Å; T2-T5 PolarHBondContact O-N 3.46Å; T2-T5 PolarHBondContact O-OG1 3.27Å; T2-T5 PolarHBondContact OG1-OG1 3.13Å
3T79.1Confident76.6Confident52 Ų5255.4 Ų55.432%0.31935%0.351SS..THydrogen-bonded Turntrans-57.2140.1178.451.40000110.5M1 I212 D331M1-T3 PolarHBondContact O-N 3.41Å; T3-I212 HydrophobicContact CG2-CD1 4.25Å; T3-D331 WeakPolarHBondContact CA-OD1 3.32Å
4G78Confident77.6Confident11 Ų1159.4 Ų59.411%0.11337%0.374CS..THydrogen-bonded Turntrans77.914.4176.200000115.8D331G4-D331 PolarHBondContact N-OD2 3.29Å
5T79.4Confident78.5Confident35 Ų3566.3 Ų66.322%0.21539%0.39CS..SBendtrans-108.25-178.560.50000115.1T2 C310 N483T2-T5 WeakPolarHBondContact CB-OG1 3.34Å; T2-T5 PolarHBondContact O-N 3.46Å; T2-T5 PolarHBondContact O-OG1 3.27Å; T2-T5 PolarHBondContact OG1-OG1 3.13Å; T5-C310 VanDerWaalsContact C-SG 3.59Å; T5-N483 PolarHBondContact O-N 3.4Å
6G73.6Confident79.3Confident16 Ų1662.3 Ų62.317%0.16537%0.367CS..  trans76171.2-174.900000113D317G6-D317 VanDerWaalsContact CA-OD2 3.24Å; G6-D317 WeakPolarHBondContact CA-OD2 3.44Å
7G78Confident79.8Confident12 Ų1263.8 Ų63.812%0.12437%0.366CS..SBendtrans100.4-173.3177.600000115.8V9 D317 Y327G7-V9 PolarHBondContact O-N 2.91Å; G7-D317 VanDerWaalsContact CA-OD1 3.32Å; G7-D317 WeakPolarHBondContact CA-OD1 3.3Å; G7-D317 VanDerWaalsContact N-CG 3.28Å; G7-D317 PolarHBondContact N-OD1 2.92Å; G7-D317 PolarHBondContact N-OD2 2.96Å; G7-Y327 PolarHBondContact N-OH 3.36Å; G7-Y327 PolarHBondContact O-OH 2.88Å
8P76.6Confident80.5Confident110 Ų11064.7 Ų64.771%0.71437%0.372SS*.PPolyproline II helixtrans-66.7127.1-173.825.3-33000112.1M1M1-P8 WeakPolarHBondContact CE-O 3.49Å
9V80.3Confident81Confident35 Ų3563.8 Ų63.821%0.21237%0.368CS..PPolyproline II helixtrans-91.9157.8172.7-67.90000111.2G7 Y327 M330 D331G7-V9 PolarHBondContact O-N 2.91Å; V9-Y327 HydrophobicContact CB-CE2 4.29Å; V9-Y327 HydrophobicContact CG1-CD2 3.91Å; V9-Y327 HydrophobicContact CG1-CE1 4.35Å; V9-Y327 HydrophobicContact CG1-CE2 3.41Å; V9-Y327 VanDerWaalsContact CG1-CE2 3.41Å; V9-Y327 HydrophobicContact CG2-CD2 3.85Å; V9-Y327 HydrophobicContact CG2-CE2 3.93Å; V9-M330 HydrophobicContact CB-CB 3.95Å; V9-M330 HydrophobicContact CG2-CB 3.87Å; V9-D331 HydrophobicContact CG1-CB 3.9Å
10A80.7Confident81.4Confident38 Ų3861.9 Ų61.931%0.31436%0.355SS..PPolyproline II helixtrans-61.1151.6174.800000111.3M330 A334A10-M330 WeakPolarHBondContact O-CE 3.46Å; A10-A334 HydrophobicContact CB-CB 3.72Å
11S82.9Confident81.7Confident89 Ų8962.3 Ų62.362%0.62236%0.358SS*.PPolyproline II helixtrans-90.1169.3172.459.40000111.5S13 M330S11-S13 PolarHBondContact O-N 3.13Å; S11-M330 VanDerWaalsContact C-CE 3.49Å
12F85.3Confident83.6Confident16 Ų1655.8 Ų55.87%0.0734%0.337CS..PPolyproline II helixtrans-55130.3178.9-101.9168000113.5D16 Y17 L156 I159 T160 M330 P340 V344F12-D16 HydrophobicContact CB-CB 4.35Å; F12-D16 HydrophobicContact CD2-CB 3.19Å; F12-D16 HydrophobicContact CE2-CB 3.42Å; F12-D16 VanDerWaalsContact CE2-CB 3.42Å; F12-D16 HydrophobicContact CG-CB 3.84Å; F12-D16 HydrophobicContact CZ-CB 4.2Å; F12-Y17 HydrophobicContact CB-CD2 4.17Å; F12-Y17 HydrophobicContact CB-CE2 3.55Å; F12-Y17 HydrophobicContact CD1-CD1 4.41Å; F12-Y17 AromaticContact CD1-CE1 3.99Å; F12-Y17 HydrophobicContact CD1-CE1 3.99Å; F12-Y17 HydrophobicContact CD1-CE2 4.3Å; F12-Y17 AromaticContact CD1-CZ 3.93Å; F12-Y17 HydrophobicContact CG-CE2 4.37Å; F12-L156 HydrophobicContact CD1-CD1 4.19Å; F12-L156 HydrophobicContact CE1-CD1 3.49Å; F12-L156 VanDerWaalsContact CE1-CD1 3.49Å; F12-L156 HydrophobicContact CZ-CD1 4.42Å; F12-I159 HydrophobicContact CD1-CD1 4.37Å; F12-I159 HydrophobicContact CD1-CG1 4.42Å; F12-I159 HydrophobicContact CE1-CD1 3.78Å; F12-I159 HydrophobicContact CE1-CG1 4.26Å; F12-I159 HydrophobicContact CE2-CD1 3.95Å; F12-I159 HydrophobicContact CZ-CD1 3.6Å; F12-I159 HydrophobicContact CZ-CG1 4.45Å; F12-I159 PolarHBondContact N-O 3.14Å; F12-T160 HydrophobicContact CB-CG2 4.27Å; F12-T160 HydrophobicContact CD1-CG2 3.22Å; F12-T160 HydrophobicContact CE1-CG2 3.86Å; F12-T160 HydrophobicContact CG-CG2 4.05Å; F12-M330 HydrophobicContact CD2-CE 4.42Å; F12-M330 HydrophobicContact CD2-SD 4.34Å; F12-P340 HydrophobicContact CD2-CB 4.26Å; F12-P340 HydrophobicContact CE2-CB 3.88Å; F12-V344 HydrophobicContact CE1-CG2 4.43Å; F12-V344 HydrophobicContact CE2-CG2 4.18Å; F12-V344 HydrophobicContact CZ-CB 3.87Å; F12-V344 HydrophobicContact CZ-CG1 4.22Å; F12-V344 HydrophobicContact CZ-CG2 3.56Å
13S88.3Confident84.6Confident37 Ų3752.3 Ų52.326%0.25932%0.316SS..PPolyproline II helixtrans-79.6163.2170.176.30000111.3S11 W15 D16 Y17S11-S13 PolarHBondContact O-N 3.13Å; S13-W15 PolarHBondContact O-N 3.24Å; S13-D16 WeakPolarHBondContact CA-OD2 3.46Å; S13-D16 VanDerWaalsContact CB-OD2 3.29Å; S13-D16 WeakPolarHBondContact CB-OD2 3.39Å; S13-D16 PolarHBondContact N-OD2 3.35Å; S13-D16 WeakPolarHBondContact O-CB 3.36Å; S13-D16 PolarHBondContact O-N 2.89Å; S13-D16 VanDerWaalsContact OG-CG 3.24Å; S13-D16 PolarHBondContact OG-N 3.24Å; S13-D16 PolarHBondContact OG-OD2 2.66Å; S13-Y17 WeakPolarHBondContact O-CD2 3.32Å; S13-Y17 PolarHBondContact O-N 3.32Å
14V90.1Very high84.8Confident112 Ų11251 Ų5168%0.67931%0.307SS*.Hα-helixtrans-56-39.5176.1178.80000111.6D16 Y17 V18V14-D16 VanDerWaalsContact C-N 3.28Å; V14-D16 PolarHBondContact O-N 3.47Å; V14-Y17 PolarHBondContact O-N 3.35Å; V14-V18 WeakPolarHBondContact O-CG2 3.33Å; V14-V18 PolarHBondContact O-N 2.9Å
15W91.3Very high85.1Confident162 Ų16256 Ų5661%0.61433%0.331SS*.Hα-helixtrans-66.6-30.5178.6-69.3112.1000112.8S13 V18 V19 P337S13-W15 PolarHBondContact O-N 3.24Å; W15-V18 HydrophobicContact CE3-CB 4.45Å; W15-V18 HydrophobicContact CE3-CG1 4.45Å; W15-V18 PolarHBondContact O-N 3.43Å; W15-V19 WeakPolarHBondContact O-CG2 3.47Å; W15-V19 PolarHBondContact O-N 2.76Å; W15-P337 HydrophobicContact CB-CB 3.74Å; W15-P337 HydrophobicContact CG-CB 4Å
16D91Very high85.3Confident2 Ų255.6 Ų55.61%0.01133%0.334CS..Hα-helixtrans-66.4-42.8174.9-60.6-51.4000111.5F12 S13 V14 V18 V19 F20 G338 P340 G341F12-D16 HydrophobicContact CB-CB 4.35Å; F12-D16 HydrophobicContact CD2-CB 3.19Å; F12-D16 HydrophobicContact CE2-CB 3.42Å; F12-D16 VanDerWaalsContact CE2-CB 3.42Å; F12-D16 HydrophobicContact CG-CB 3.84Å; F12-D16 HydrophobicContact CZ-CB 4.2Å; S13-D16 WeakPolarHBondContact CA-OD2 3.46Å; S13-D16 VanDerWaalsContact CB-OD2 3.29Å; S13-D16 WeakPolarHBondContact CB-OD2 3.39Å; S13-D16 PolarHBondContact N-OD2 3.35Å; S13-D16 WeakPolarHBondContact O-CB 3.36Å; S13-D16 PolarHBondContact O-N 2.89Å; S13-D16 VanDerWaalsContact OG-CG 3.24Å; S13-D16 PolarHBondContact OG-N 3.24Å; S13-D16 PolarHBondContact OG-OD2 2.66Å; V14-D16 VanDerWaalsContact C-N 3.28Å; V14-D16 PolarHBondContact O-N 3.47Å; D16-V18 VanDerWaalsContact C-N 3.35Å; D16-V19 PolarHBondContact O-N 3.31Å; D16-F20 WeakPolarHBondContact O-CB 3.16Å; D16-F20 PolarHBondContact O-N 3.02Å; D16-G338 WeakPolarHBondContact OD1-CA 3.27Å; D16-G338 PolarHBondContact OD1-N 2.9Å; D16-P340 VanDerWaalsContact OD1-CD 3.27Å; D16-P340 WeakPolarHBondContact OD1-CD 3.42Å; D16-G341 WeakPolarHBondContact O-CA 3.37Å; D16-G341 PolarHBondContact OD1-N 3.25Å; D16-G341 VanDerWaalsContact OD1-N 3.1Å
17Y88.9Confident85.6Confident89 Ų8955 Ų5535%0.34933%0.327SS..Hα-helixtrans-61.9-42.2172.5-72.4-74.6000111.9F12 S13 V14 F20 V21 T160F12-Y17 HydrophobicContact CB-CD2 4.17Å; F12-Y17 HydrophobicContact CB-CE2 3.55Å; F12-Y17 HydrophobicContact CD1-CD1 4.41Å; F12-Y17 AromaticContact CD1-CE1 3.99Å; F12-Y17 HydrophobicContact CD1-CE1 3.99Å; F12-Y17 HydrophobicContact CD1-CE2 4.3Å; F12-Y17 AromaticContact CD1-CZ 3.93Å; F12-Y17 HydrophobicContact CG-CE2 4.37Å; S13-Y17 WeakPolarHBondContact O-CD2 3.32Å; S13-Y17 PolarHBondContact O-N 3.32Å; V14-Y17 PolarHBondContact O-N 3.35Å; Y17-F20 PolarHBondContact O-N 2.82Å; Y17-V21 VanDerWaalsContact O-CB 3.27Å; Y17-V21 WeakPolarHBondContact O-CB 3.37Å; Y17-V21 VanDerWaalsContact O-CG2 3.25Å; Y17-V21 WeakPolarHBondContact O-CG2 3.39Å; Y17-V21 PolarHBondContact O-N 3.42Å; Y17-T160 HydrophobicContact CE1-CG2 4.33Å; Y17-T160 WeakPolarHBondContact OH-CG2 3.49Å
18V91.4Very high85.6Confident80 Ų8056.1 Ų56.149%0.48534%0.336SS..Hα-helixtrans-61.9-47.5178.6171.20000111.3V14 W15 D16 G22V14-V18 WeakPolarHBondContact O-CG2 3.33Å; V14-V18 PolarHBondContact O-N 2.9Å; W15-V18 HydrophobicContact CE3-CB 4.45Å; W15-V18 HydrophobicContact CE3-CG1 4.45Å; W15-V18 PolarHBondContact O-N 3.43Å; D16-V18 VanDerWaalsContact C-N 3.35Å; V18-G22 WeakPolarHBondContact O-CA 3.31Å; V18-G22 PolarHBondContact O-N 2.74Å
19V91.2Very high85.8Confident48 Ų4852.6 Ų52.629%0.29132%0.319SS..Hα-helixtrans-64.5-48.1177.4172.10000110.3W15 D16 G22 T23 L342W15-V19 WeakPolarHBondContact O-CG2 3.47Å; W15-V19 PolarHBondContact O-N 2.76Å; D16-V19 PolarHBondContact O-N 3.31Å; V19-G22 PolarHBondContact O-N 3.1Å; V19-T23 WeakPolarHBondContact O-CB 3.43Å; V19-T23 PolarHBondContact O-N 2.99Å; V19-T23 PolarHBondContact O-OG1 3.33Å; V19-L342 HydrophobicContact CG1-CB 4.11Å
20F88.8Confident85.8Confident24 Ų2453.8 Ų53.811%0.10532%0.324CS..Hα-helixtrans-57.7-55.8-180172.3-115.8000112.4D16 Y17 G22 T23 V24 L156 V344 A345 Y348D16-F20 WeakPolarHBondContact O-CB 3.16Å; D16-F20 PolarHBondContact O-N 3.02Å; Y17-F20 PolarHBondContact O-N 2.82Å; F20-G22 VanDerWaalsContact C-N 3.34Å; F20-G22 PolarHBondContact O-N 2.97Å; F20-T23 PolarHBondContact O-N 3.42Å; F20-V24 HydrophobicContact CD2-CG2 4.39Å; F20-V24 HydrophobicContact CE2-CG2 3.99Å; F20-V24 HydrophobicContact CZ-CG2 4.25Å; F20-V24 WeakPolarHBondContact O-CG2 3.32Å; F20-V24 PolarHBondContact O-N 3.36Å; F20-L156 HydrophobicContact CE1-CD2 4.5Å; F20-V344 HydrophobicContact CD2-CB 4.35Å; F20-V344 HydrophobicContact CD2-CG1 3.93Å; F20-V344 HydrophobicContact CE2-CG1 3.85Å; F20-V344 HydrophobicContact CZ-CG1 4.48Å; F20-A345 HydrophobicContact CD2-CB 4.14Å; F20-Y348 HydrophobicContact CE2-CD1 4.24Å; F20-Y348 AromaticContact CE2-CD2 3.61Å; F20-Y348 HydrophobicContact CE2-CD2 3.61Å; F20-Y348 HydrophobicContact CE2-CE2 4.18Å; F20-Y348 AromaticContact CE2-CG 3.67Å; F20-Y348 HydrophobicContact CE2-CG 3.67Å; F20-Y348 HydrophobicContact CZ-CD1 4.1Å; F20-Y348 AromaticContact CZ-CD2 3.89Å; F20-Y348 HydrophobicContact CZ-CD2 3.89Å; F20-Y348 HydrophobicContact CZ-CE1 4.19Å; F20-Y348 HydrophobicContact CZ-CE2 4.02Å; F20-Y348 AromaticContact CZ-CG 3.95Å; F20-Y348 HydrophobicContact CZ-CG 3.95Å
21V87.4Confident85.6Confident71 Ų7152 Ų5243%0.4331%0.31SS..Hα-helixtrans-64.2-41.3179.7174.40000110.4Y17 T23 V24 L25Y17-V21 VanDerWaalsContact O-CB 3.27Å; Y17-V21 WeakPolarHBondContact O-CB 3.37Å; Y17-V21 VanDerWaalsContact O-CG2 3.25Å; Y17-V21 WeakPolarHBondContact O-CG2 3.39Å; Y17-V21 PolarHBondContact O-N 3.42Å; V21-T23 VanDerWaalsContact C-N 3.33Å; V21-T23 PolarHBondContact O-N 3.38Å; V21-V24 PolarHBondContact O-N 2.83Å; V21-L25 HydrophobicContact CG1-CD1 3.75Å; V21-L25 HydrophobicContact CG1-CG 4.09Å; V21-L25 WeakPolarHBondContact O-CB 3.4Å; V21-L25 VanDerWaalsContact O-CG 3.28Å; V21-L25 WeakPolarHBondContact O-CG 3.09Å; V21-L25 PolarHBondContact O-N 3.46Å
22G88.6Confident85.4Confident41 Ų4151.7 Ų51.742%0.42330%0.3SS..Hα-helixtrans-59.5-41.4176.800000112.7V18 V19 F20 G26V18-G22 WeakPolarHBondContact O-CA 3.31Å; V18-G22 PolarHBondContact O-N 2.74Å; V19-G22 PolarHBondContact O-N 3.1Å; F20-G22 VanDerWaalsContact C-N 3.34Å; F20-G22 PolarHBondContact O-N 2.97Å; G22-G26 PolarHBondContact O-N 2.91Å
23T86.2Confident85.2Confident19 Ų1957 Ų5712%0.11732%0.324CS..Hα-helixtrans-67.5-44.3176.5-61.70000112.2V19 F20 V21 G26 A27 F193 I197 A345V19-T23 WeakPolarHBondContact O-CB 3.43Å; V19-T23 PolarHBondContact O-N 2.99Å; V19-T23 PolarHBondContact O-OG1 3.33Å; F20-T23 PolarHBondContact O-N 3.42Å; V21-T23 VanDerWaalsContact C-N 3.33Å; V21-T23 PolarHBondContact O-N 3.38Å; T23-G26 PolarHBondContact O-N 2.93Å; T23-A27 PolarHBondContact O-N 3.42Å; T23-F193 HydrophobicContact CG2-CE1 4.31Å; T23-I197 HydrophobicContact CG2-CD1 3.31Å; T23-I197 HydrophobicContact CG2-CG1 4.24Å; T23-I197 HydrophobicContact CG2-CG2 4.26Å; T23-A345 HydrophobicContact CG2-CB 3.75Å
24V82.1Confident84.6Confident23 Ų2357.1 Ų57.114%0.13932%0.32CS..Hα-helixtrans-62.7-45.2177173.30000110.8F20 V21 G26 A27 A28 V174 L352F20-V24 HydrophobicContact CD2-CG2 4.39Å; F20-V24 HydrophobicContact CE2-CG2 3.99Å; F20-V24 HydrophobicContact CZ-CG2 4.25Å; F20-V24 WeakPolarHBondContact O-CG2 3.32Å; F20-V24 PolarHBondContact O-N 3.36Å; V21-V24 PolarHBondContact O-N 2.83Å; V24-G26 VanDerWaalsContact C-N 3.34Å; V24-G26 PolarHBondContact O-N 3.41Å; V24-A27 PolarHBondContact O-N 3.04Å; V24-A28 WeakPolarHBondContact O-CB 3.3Å; V24-A28 PolarHBondContact O-N 3.4Å; V24-V174 HydrophobicContact CG1-CG1 3.93Å; V24-L352 HydrophobicContact CG1-CD1 4.5Å
25L84.3Confident83.7Confident116 Ų11652.6 Ų52.661%0.60730%0.295SS*.Hα-helixtrans-65.8-35.6175.5-70.2178.9000112.3V21 A28 G29V21-L25 HydrophobicContact CG1-CD1 3.75Å; V21-L25 HydrophobicContact CG1-CG 4.09Å; V21-L25 WeakPolarHBondContact O-CB 3.4Å; V21-L25 VanDerWaalsContact O-CG 3.28Å; V21-L25 WeakPolarHBondContact O-CG 3.09Å; V21-L25 PolarHBondContact O-N 3.46Å; L25-A28 PolarHBondContact O-N 3.42Å; L25-G29 PolarHBondContact O-N 3.29Å
26G83.4Confident83Confident28 Ų2849.7 Ų49.729%0.28929%0.29SS..Hα-helixtrans-61.9-47174.200000111.9G22 T23 V24 G29 I30G22-G26 PolarHBondContact O-N 2.91Å; T23-G26 PolarHBondContact O-N 2.93Å; V24-G26 VanDerWaalsContact C-N 3.34Å; V24-G26 PolarHBondContact O-N 3.41Å; G26-G29 PolarHBondContact O-N 2.64Å; G26-I30 WeakPolarHBondContact O-CG1 3.42Å; G26-I30 PolarHBondContact O-N 2.89Å
27A80Confident82.1Confident2 Ų257.9 Ų57.92%0.01732%0.321CS..Hα-helixtrans-61.2-46174.300000111.6T23 V24 G29 I30 G31 T190 F193 Q194T23-A27 PolarHBondContact O-N 3.42Å; V24-A27 PolarHBondContact O-N 3.04Å; A27-G29 VanDerWaalsContact C-N 3.32Å; A27-G29 PolarHBondContact O-N 3.26Å; A27-I30 PolarHBondContact O-N 2.86Å; A27-G31 PolarHBondContact O-N 2.93Å; A27-G31 VanDerWaalsContact O-N 3.07Å; A27-T190 VanDerWaalsContact O-CG2 3.24Å; A27-T190 WeakPolarHBondContact O-CG2 3.4Å; A27-F193 HydrophobicContact CB-CD1 4.07Å; A27-F193 HydrophobicContact CB-CE1 4.18Å; A27-Q194 HydrophobicContact CB-CG 4.5Å
28A77.8Confident80.9Confident37 Ų3755 Ų5531%0.30632%0.318SS..Hα-helixtrans-61.1-40.1175.900000112.3V24 L25 G31 L32V24-A28 WeakPolarHBondContact O-CB 3.3Å; V24-A28 PolarHBondContact O-N 3.4Å; L25-A28 PolarHBondContact O-N 3.42Å; A28-G31 PolarHBondContact O-N 2.87Å; A28-L32 WeakPolarHBondContact O-CB 3.35Å; A28-L32 PolarHBondContact O-N 2.83Å
29G80.8Confident79.4Confident36 Ų3659.1 Ų59.137%0.37133%0.325SS..Hα-helixtrans-64.6-42.6177.500000113L25 G26 A27 L32 F33L25-G29 PolarHBondContact O-N 3.29Å; G26-G29 PolarHBondContact O-N 2.64Å; A27-G29 VanDerWaalsContact C-N 3.32Å; A27-G29 PolarHBondContact O-N 3.26Å; G29-L32 PolarHBondContact O-N 3Å; G29-F33 VanDerWaalsContact O-CB 3.26Å; G29-F33 WeakPolarHBondContact O-CB 3.39Å; G29-F33 PolarHBondContact O-N 3.37Å
30I81.6Confident77.6Confident59 Ų5966.1 Ų66.130%0.30335%0.351SS..Hα-helixtrans-61-46.8174.1-67.8164.7000110.2G26 A27 F33 Q34 W189 T190 F193G26-I30 WeakPolarHBondContact O-CG1 3.42Å; G26-I30 PolarHBondContact O-N 2.89Å; A27-I30 PolarHBondContact O-N 2.86Å; I30-F33 PolarHBondContact O-N 2.85Å; I30-Q34 WeakPolarHBondContact O-CB 3.35Å; I30-Q34 PolarHBondContact O-N 3.04Å; I30-W189 HydrophobicContact CG2-CB 4.37Å; I30-T190 HydrophobicContact CB-CG2 4.2Å; I30-T190 HydrophobicContact CG2-CG2 4.05Å; I30-F193 HydrophobicContact CD1-CB 3.97Å; I30-F193 HydrophobicContact CD1-CD1 3.93Å; I30-F193 HydrophobicContact CD1-CD2 3.96Å; I30-F193 HydrophobicContact CD1-CE1 4.38Å; I30-F193 HydrophobicContact CD1-CE2 4.42Å; I30-F193 HydrophobicContact CD1-CG 3.69Å
31G76.5Confident75.9Confident2 Ų270.4 Ų70.42%0.02138%0.375CS..Hα-helixtrans-61-46.8177.700000112.4A27 A28 Q34 A35A27-G31 PolarHBondContact O-N 2.93Å; A27-G31 VanDerWaalsContact O-N 3.07Å; A28-G31 PolarHBondContact O-N 2.87Å; G31-Q34 PolarHBondContact O-N 3.47Å; G31-A35 WeakPolarHBondContact O-CB 3.19Å; G31-A35 PolarHBondContact O-N 2.92Å
32L78.4Confident74.4Confident81 Ų8171.5 Ų71.542%0.42438%0.382SS..Hα-helixtrans-64-44.4178.3-178.361.7000112.1A28 G29 Q34 A35 I36 L181A28-L32 WeakPolarHBondContact O-CB 3.35Å; A28-L32 PolarHBondContact O-N 2.83Å; G29-L32 PolarHBondContact O-N 3Å; L32-Q34 VanDerWaalsContact C-N 3.31Å; L32-Q34 PolarHBondContact O-N 3.47Å; L32-A35 PolarHBondContact O-N 2.73Å; L32-I36 HydrophobicContact CD1-CD1 4Å; L32-I36 HydrophobicContact CD1-CG1 4.21Å; L32-I36 HydrophobicContact CG-CD1 3.85Å; L32-I36 HydrophobicContact CG-CG1 4.46Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.49Å; L32-I36 PolarHBondContact O-N 2.92Å; L32-L181 HydrophobicContact CD1-CD1 4.38Å
33F81.1Confident73.3Confident129 Ų12972 Ų7257%0.56638%0.379SS*.Hα-helixtrans-58.3-45.7176174.1-100.6000111.2G29 I30 I36 R37G29-F33 VanDerWaalsContact O-CB 3.26Å; G29-F33 WeakPolarHBondContact O-CB 3.39Å; G29-F33 PolarHBondContact O-N 3.37Å; I30-F33 PolarHBondContact O-N 2.85Å; F33-I36 PolarHBondContact O-N 3.09Å; F33-R37 WeakPolarHBondContact O-CB 3.4Å; F33-R37 PolarHBondContact O-N 3.19Å
34Q76.4Confident72.2Confident39 Ų3971.8 Ų71.818%0.18238%0.378CS..Hα-helixtrans-68.5-35.9179.8-16755.669.700112.1I30 G31 L32 G38 A186I30-Q34 WeakPolarHBondContact O-CB 3.35Å; I30-Q34 PolarHBondContact O-N 3.04Å; G31-Q34 PolarHBondContact O-N 3.47Å; L32-Q34 VanDerWaalsContact C-N 3.31Å; L32-Q34 PolarHBondContact O-N 3.47Å; Q34-G38 PolarHBondContact O-N 3.05Å; Q34-A186 HydrophobicContact CB-CB 4.14Å; Q34-A186 HydrophobicContact CG-CB 4.33Å
35A71.3Confident71.3Confident17 Ų1774.9 Ų74.914%0.1439%0.394CS..Hα-helixtrans-65.5-44.617400000112.3G31 L32 G38 R39 L181G31-A35 WeakPolarHBondContact O-CB 3.19Å; G31-A35 PolarHBondContact O-N 2.92Å; L32-A35 PolarHBondContact O-N 2.73Å; A35-G38 PolarHBondContact O-N 3.45Å; A35-R39 PolarHBondContact O-N 3.41Å; A35-L181 WeakPolarHBondContact CB-O 3.13Å
36I75.3Confident70.5Confident101 Ų10170.9 Ų70.952%0.51837%0.372SS..Hα-helixtrans-63.8-43.1176.9-67.6167.2000110.5L32 F33 G38 R39L32-I36 HydrophobicContact CD1-CD1 4Å; L32-I36 HydrophobicContact CD1-CG1 4.21Å; L32-I36 HydrophobicContact CG-CD1 3.85Å; L32-I36 HydrophobicContact CG-CG1 4.46Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.49Å; L32-I36 PolarHBondContact O-N 2.92Å; F33-I36 PolarHBondContact O-N 3.09Å; I36-G38 VanDerWaalsContact C-N 3.29Å; I36-G38 PolarHBondContact O-N 3.49Å; I36-R39 PolarHBondContact O-N 2.85Å
37R72.7Confident69.6Low174 Ų17471.5 Ų71.566%0.65737%0.367SS*.Hα-helixtrans-65.8-33.2176.9-169.7175.7178.5-179.31.2112.4F33F33-R37 WeakPolarHBondContact O-CB 3.4Å; F33-R37 PolarHBondContact O-N 3.19Å
38G63.7Low68.7Low27 Ų2771.4 Ų71.428%0.27837%0.366SS..Hα-helixtrans-77.7-19.2178.900000115.2Q34 A35 I36 K40 N41Q34-G38 PolarHBondContact O-N 3.05Å; A35-G38 PolarHBondContact O-N 3.45Å; I36-G38 VanDerWaalsContact C-N 3.29Å; I36-G38 PolarHBondContact O-N 3.49Å; G38-K40 PolarHBondContact O-N 3.44Å; G38-N41 PolarHBondContact O-N 2.94Å
39R60.1Low68.1Low168 Ų16869.8 Ų69.863%0.63435%0.352SS*.THydrogen-bonded Turntrans-60.6-3.2-178.2-94-177.7178.6177.90.8116.1A35 I36 N41A35-R39 PolarHBondContact O-N 3.41Å; I36-R39 PolarHBondContact O-N 2.85Å; R39-N41 PolarHBondContact O-N 3.01Å
40K53.8Low67.2Low194 Ų19468 Ų6884%0.84334%0.335SS*.THydrogen-bonded Turntrans-68.8-20175.6-70.7-172.7176.6-174.90113.2G38G38-K40 PolarHBondContact O-N 3.44Å
41N52.3Low66.4Low115 Ų11566.3 Ų66.362%0.61533%0.332SS*.  trans-131101.7176.4-71.1-15.3000110.6G38 R39 S43 E46G38-N41 PolarHBondContact O-N 2.94Å; R39-N41 PolarHBondContact O-N 3.01Å; N41-S43 PolarHBondContact O-N 3.39Å; N41-E46 HydrophobicContact CB-CG 4.47Å
42T56.3Low66.1Low94 Ų9468 Ų6858%0.57734%0.337SS*.  trans-94.561.9-179.447.10000112.2
43S65.3Low66.1Low52 Ų5268.8 Ų68.836%0.36434%0.339SS..  trans-106.2151.9170.769.60000111.1N41 D45 E46 F47N41-S43 PolarHBondContact O-N 3.39Å; S43-D45 PolarHBondContact O-N 3.45Å; S43-E46 PolarHBondContact O-N 3.45Å; S43-E46 VanDerWaalsContact O-N 3.14Å; S43-E46 PolarHBondContact OG-N 2.99Å; S43-F47 PolarHBondContact O-N 3.42Å; S43-F47 VanDerWaalsContact O-N 3.16Å
44S63.5Low66Low13 Ų1363.4 Ų63.49%0.09132%0.315CS..Hα-helixtrans-57.9-36.4177.3-169.30000112.3E46 F47 L48 R372S44-E46 VanDerWaalsContact C-N 3.34Å; S44-F47 PolarHBondContact O-N 3.36Å; S44-L48 WeakPolarHBondContact O-CB 3.21Å; S44-L48 WeakPolarHBondContact O-CG 3.49Å; S44-L48 PolarHBondContact O-N 3.02Å; S44-R372 PolarHBondContact OG-NH2 3.4Å
45D62.9Low66.5Low88 Ų8864.7 Ų64.747%0.47133%0.326SS..Hα-helixtrans-67.1-34.5177.9-72.82.8000112.4S43 L49 G50 G51S43-D45 PolarHBondContact O-N 3.45Å; D45-L49 CarbonylContact O-C 3.52Å; D45-L49 VanDerWaalsContact O-CA 3.32Å; D45-L49 WeakPolarHBondContact O-CA 3.36Å; D45-L49 VanDerWaalsContact O-CB 3.29Å; D45-L49 WeakPolarHBondContact O-CB 3.5Å; D45-L49 PolarHBondContact O-N 3.46Å; D45-G50 PolarHBondContact O-N 3.44Å; D45-G51 PolarHBondContact O-N 3.36Å
46E67.9Low67.4Low33 Ų3364 Ų6415%0.15432%0.32CS..Hα-helixtrans-69.1-40174.4-176.865.6-174.600110.8N41 S43 S44 G50 G51 K185N41-E46 HydrophobicContact CB-CG 4.47Å; S43-E46 PolarHBondContact O-N 3.45Å; S43-E46 VanDerWaalsContact O-N 3.14Å; S43-E46 PolarHBondContact OG-N 2.99Å; S44-E46 VanDerWaalsContact C-N 3.34Å; E46-G50 VanDerWaalsContact O-CA 3.27Å; E46-G50 WeakPolarHBondContact O-CA 3.5Å; E46-G50 PolarHBondContact O-N 2.85Å; E46-G50 VanDerWaalsContact O-N 3.12Å; E46-G51 WeakPolarHBondContact OE2-CA 3.45Å; E46-G51 PolarHBondContact OE2-N 2.97Å; E46-K185 IonicContact OE1-NZ 2.67Å; E46-K185 PolarHBondContact OE1-NZ 3.47Å; E46-K185 IonicContact OE2-NZ 2.72Å; E46-K185 PolarHBondContact OE2-NZ 3.31Å
47F63.3Low68.1Low41 Ų4162.9 Ų62.918%0.1832%0.318CS..Hα-helixtrans-68.9-48.5178.5-173.2-94.9000112.3S43 S44 L184 N387S43-F47 PolarHBondContact O-N 3.42Å; S43-F47 VanDerWaalsContact O-N 3.16Å; S44-F47 PolarHBondContact O-N 3.36Å; F47-L184 PolarHBondContact O-N 2.94Å; F47-N387 HydrophobicContact CE1-CB 4.14Å
48L61.3Low68.9Low0 Ų055.3 Ų55.30%029%0.291CS..Hα-helixtrans-84.8-35.9-174.1-63178.4000113.2S44 L184 Q267 A364S44-L48 WeakPolarHBondContact O-CB 3.21Å; S44-L48 WeakPolarHBondContact O-CG 3.49Å; S44-L48 PolarHBondContact O-N 3.02Å; L48-L184 WeakPolarHBondContact O-CD2 3.22Å; L48-Q267 PolarHBondContact O-NE2 3.43Å; L48-A364 HydrophobicContact CD1-CB 4.47Å; L48-A364 HydrophobicContact CD2-CB 3.91Å
49L65.3Low70.1Confident2 Ų254 Ų541%0.0128%0.278CS..Hα-helixtrans-117.50.7-172-60.6173.2000113.6D45 G51 R52 T115 Q267 I270 S271D45-L49 CarbonylContact O-C 3.52Å; D45-L49 VanDerWaalsContact O-CA 3.32Å; D45-L49 WeakPolarHBondContact O-CA 3.36Å; D45-L49 VanDerWaalsContact O-CB 3.29Å; D45-L49 WeakPolarHBondContact O-CB 3.5Å; D45-L49 PolarHBondContact O-N 3.46Å; L49-G51 PolarHBondContact O-N 2.96Å; L49-G51 VanDerWaalsContact O-N 3.17Å; L49-R52 HydrophobicContact CB-CG 4.23Å; L49-R52 PolarHBondContact O-N 3.46Å; L49-R52 VanDerWaalsContact O-N 3.11Å; L49-T115 HydrophobicContact CD1-CG2 4.22Å; L49-T115 HydrophobicContact CD2-CG2 4.26Å; L49-T115 HydrophobicContact CG-CG2 4.41Å; L49-Q267 HydrophobicContact CD2-CG 4.11Å; L49-I270 HydrophobicContact CD2-CD1 4.14Å; L49-I270 HydrophobicContact CD2-CG1 4.29Å; L49-S271 VanDerWaalsContact O-CB 3.3Å; L49-S271 WeakPolarHBondContact O-CB 3.37Å
50G62.3Low71.7Confident0 Ų046.1 Ų46.10%025%0.248CC..G310 helixtrans57.131.1-175.600000112.6D45 E46 R52 Q53 K185D45-G50 PolarHBondContact O-N 3.44Å; E46-G50 VanDerWaalsContact O-CA 3.27Å; E46-G50 WeakPolarHBondContact O-CA 3.5Å; E46-G50 PolarHBondContact O-N 2.85Å; E46-G50 VanDerWaalsContact O-N 3.12Å; G50-R52 PolarHBondContact O-N 3.45Å; G50-Q53 PolarHBondContact O-N 3.02Å; G50-K185 WeakPolarHBondContact O-CE 3.45Å; G50-K185 PolarHBondContact O-NZ 3.2Å
51G64.4Low73.4Confident23 Ų2339.6 Ų39.624%0.23722%0.222CC..G310 helixtrans6217-179.600000114.3D45 E46 L49 Q53D45-G51 PolarHBondContact O-N 3.36Å; E46-G51 WeakPolarHBondContact OE2-CA 3.45Å; E46-G51 PolarHBondContact OE2-N 2.97Å; L49-G51 PolarHBondContact O-N 2.96Å; L49-G51 VanDerWaalsContact O-N 3.17Å; G51-Q53 VanDerWaalsContact C-N 3.26Å; G51-Q53 WeakPolarHBondContact O-CG 3.29Å; G51-Q53 PolarHBondContact O-N 3.47Å
52R70Confident75.2Confident38 Ų3834.1 Ų34.114%0.14319%0.193CC..G310 helixtrans56.335.8179-67.6167.2159.5-175.116.6113.9L49 G50 G113 S271 K273 N592L49-R52 HydrophobicContact CB-CG 4.23Å; L49-R52 PolarHBondContact O-N 3.46Å; L49-R52 VanDerWaalsContact O-N 3.11Å; G50-R52 PolarHBondContact O-N 3.45Å; R52-G113 PolarHBondContact NH2-O 3.1Å; R52-S271 CarbonylContact C-O 3.6Å; R52-S271 WeakPolarHBondContact CA-O 3.3Å; R52-K273 WeakPolarHBondContact O-CA 3.37Å; R52-N592 VanDerWaalsContact CD-ND2 3.33Å; R52-N592 WeakPolarHBondContact CD-ND2 3.27Å; R52-N592 PolarHBondContact NH1-OD1 3.49Å
53Q77.9Confident76.8Confident97 Ų9729.7 Ų29.745%0.45317%0.165SC..  trans-111.912.6-174.9-76.8177.220.200114.8G50 G51 S271 K273 F595G50-Q53 PolarHBondContact O-N 3.02Å; G51-Q53 VanDerWaalsContact C-N 3.26Å; G51-Q53 WeakPolarHBondContact O-CG 3.29Å; G51-Q53 PolarHBondContact O-N 3.47Å; Q53-S271 PolarHBondContact N-O 3.44Å; Q53-K273 WeakPolarHBondContact O-CE 3.35Å; Q53-F595 HydrophobicContact CG-CE2 4.43Å; Q53-F595 HydrophobicContact CG-CZ 4.17Å
54M80.2Confident78Confident15 Ų1527.3 Ų27.37%0.07415%0.149CC..BIsolated β-bridgetrans-81150.7-173.9-57.5-58-102.800112.5V59 K185 I188 S271 C272 K273M54-V59 HydrophobicContact CB-CG2 3.47Å; M54-V59 VanDerWaalsContact CB-CG2 3.47Å; M54-V59 HydrophobicContact CG-CG2 4.31Å; M54-K185 HydrophobicContact CE-CG 4.2Å; M54-K185 HydrophobicContact SD-CG 4.11Å; M54-I188 HydrophobicContact CE-CB 3.66Å; M54-I188 HydrophobicContact CE-CD1 3.37Å; M54-I188 HydrophobicContact CE-CG1 4.07Å; M54-I188 HydrophobicContact CE-CG2 3.58Å; M54-I188 HydrophobicContact CG-CD1 4.14Å; M54-S271 WeakPolarHBondContact CG-OG 3.5Å; M54-S271 PolarHBondContact N-O 2.89Å; M54-C272 VanDerWaalsContact O-CA 3.32Å; M54-C272 WeakPolarHBondContact O-CA 3.36Å; M54-K273 PolarHBondContact O-N 2.91Å
55T87.4Confident79.1Confident67 Ų6726.8 Ų26.841%0.41115%0.145SC..  trans-98162.6174.354.60000110.6V57 P58 V59T55-V57 PolarHBondContact O-N 3.32Å; T55-P58 WeakPolarHBondContact O-CD 3.44Å; T55-P58 VanDerWaalsContact OG1-CD 3.25Å; T55-P58 WeakPolarHBondContact OG1-CD 3.25Å; T55-V59 WeakPolarHBondContact O-CG2 3.43Å; T55-V59 PolarHBondContact O-N 2.88Å
56A89.8Confident79.8Confident1 Ų122.7 Ų22.71%0.00812%0.123CC..Hα-helixtrans-59.8-41.8-171.400000114.2V59 A60 Q277 L280 S281A56-V59 PolarHBondContact O-N 3.03Å; A56-A60 VanDerWaalsContact O-CB 3.23Å; A56-A60 WeakPolarHBondContact O-CB 3.37Å; A56-A60 PolarHBondContact O-N 2.97Å; A56-Q277 WeakPolarHBondContact CB-O 3.43Å; A56-Q277 VanDerWaalsContact CB-OE1 3.26Å; A56-L280 HydrophobicContact CB-CB 3.86Å; A56-L280 HydrophobicContact CB-CD2 3.74Å; A56-L280 HydrophobicContact CB-CG 3.74Å; A56-S281 WeakPolarHBondContact O-CB 3.14Å
57V90.1Very high80Confident78 Ų7821.6 Ų21.647%0.47312%0.118SC..Hα-helixtrans-69.7-51.3-170.8171.50000113T55 V59 A60 M61T55-V57 PolarHBondContact O-N 3.32Å; V57-V59 VanDerWaalsContact C-N 3.28Å; V57-V59 PolarHBondContact O-N 2.89Å; V57-A60 PolarHBondContact O-N 3.13Å; V57-M61 HydrophobicContact CG1-CE 3.65Å; V57-M61 PolarHBondContact O-N 3.44Å
58P88.4Confident80.5Confident16 Ų1619.8 Ų19.810%0.10411%0.11CC..Hα-helixtrans-58.7-40.3174.3-24.334.4000112.4T55 M61 S62 I188T55-P58 WeakPolarHBondContact O-CD 3.44Å; T55-P58 VanDerWaalsContact OG1-CD 3.25Å; T55-P58 WeakPolarHBondContact OG1-CD 3.25Å; P58-M61 PolarHBondContact O-N 3.45Å; P58-S62 WeakPolarHBondContact O-CB 3.46Å; P58-S62 PolarHBondContact O-N 2.87Å; P58-I188 HydrophobicContact CB-CG2 3.93Å
59V90.2Very high81.6Confident0 Ų019.8 Ų19.80%011%0.11CC..Hα-helixtrans-64.7-43.5177.6173.90000111M54 T55 A56 V57 S62 L63 R268M54-V59 HydrophobicContact CB-CG2 3.47Å; M54-V59 VanDerWaalsContact CB-CG2 3.47Å; M54-V59 HydrophobicContact CG-CG2 4.31Å; T55-V59 WeakPolarHBondContact O-CG2 3.43Å; T55-V59 PolarHBondContact O-N 2.88Å; A56-V59 PolarHBondContact O-N 3.03Å; V57-V59 VanDerWaalsContact C-N 3.28Å; V57-V59 PolarHBondContact O-N 2.89Å; V59-S62 VanDerWaalsContact O-CB 3.22Å; V59-S62 WeakPolarHBondContact O-CB 3.42Å; V59-S62 PolarHBondContact O-N 3.35Å; V59-L63 HydrophobicContact CG1-CD1 3.96Å; V59-L63 HydrophobicContact CG1-CG 4.23Å; V59-L63 WeakPolarHBondContact O-CB 3.42Å; V59-L63 VanDerWaalsContact O-CG 3.25Å; V59-L63 WeakPolarHBondContact O-CG 3.31Å; V59-L63 PolarHBondContact O-N 2.99Å; V59-R268 HydrophobicContact CG1-CB 4.22Å; V59-R268 WeakPolarHBondContact CG1-O 3.45Å
60A92.3Very high82.5Confident1 Ų119.7 Ų19.71%0.00811%0.11CC..Hα-helixtrans-60.6-48.3177.100000112.4A56 V57 S62 L63 T64 S281 V284 N285A56-A60 VanDerWaalsContact O-CB 3.23Å; A56-A60 WeakPolarHBondContact O-CB 3.37Å; A56-A60 PolarHBondContact O-N 2.97Å; V57-A60 PolarHBondContact O-N 3.13Å; A60-S62 VanDerWaalsContact C-N 3.26Å; A60-S62 PolarHBondContact O-N 2.86Å; A60-L63 WeakPolarHBondContact O-CB 3.25Å; A60-L63 PolarHBondContact O-N 3.29Å; A60-T64 PolarHBondContact O-N 2.87Å; A60-T64 PolarHBondContact O-OG1 3.25Å; A60-T64 VanDerWaalsContact O-OG1 3.05Å; A60-S281 WeakPolarHBondContact CB-O 3.37Å; A60-V284 HydrophobicContact CB-CB 3.61Å; A60-V284 HydrophobicContact CB-CG1 3.53Å; A60-N285 HydrophobicContact CB-CB 4.34Å
61M89.9Confident83.8Confident58 Ų5820 Ų2029%0.28611%0.111SC..Hα-helixtrans-60.3-40176.5-72.6-173.7-70.300111.4V57 P58 T64 A65 V192V57-M61 HydrophobicContact CG1-CE 3.65Å; V57-M61 PolarHBondContact O-N 3.44Å; P58-M61 PolarHBondContact O-N 3.45Å; M61-T64 PolarHBondContact O-N 3.09Å; M61-A65 WeakPolarHBondContact O-CB 3.32Å; M61-A65 PolarHBondContact O-N 3.29Å; M61-V192 HydrophobicContact CB-CG2 3.94Å; M61-V192 HydrophobicContact CE-CB 4.27Å; M61-V192 HydrophobicContact CE-CG1 3.59Å; M61-V192 HydrophobicContact CE-CG2 3.66Å; M61-V192 HydrophobicContact SD-CG1 3.85Å; M61-V192 HydrophobicContact SD-CG2 4.36Å
62S89.9Confident85.1Confident0 Ų019.5 Ų19.50%010%0.103CC..Hα-helixtrans-61.1-48.2172.5-115.50000114P58 V59 A60 T64 A65 S66 I188 D191 R268P58-S62 WeakPolarHBondContact O-CB 3.46Å; P58-S62 PolarHBondContact O-N 2.87Å; V59-S62 VanDerWaalsContact O-CB 3.22Å; V59-S62 WeakPolarHBondContact O-CB 3.42Å; V59-S62 PolarHBondContact O-N 3.35Å; A60-S62 VanDerWaalsContact C-N 3.26Å; A60-S62 PolarHBondContact O-N 2.86Å; S62-T64 PolarHBondContact O-N 2.96Å; S62-A65 PolarHBondContact O-N 3.35Å; S62-S66 VanDerWaalsContact O-CB 3.24Å; S62-S66 WeakPolarHBondContact O-CB 3.33Å; S62-S66 PolarHBondContact O-N 3.42Å; S62-S66 PolarHBondContact O-OG 3.15Å; S62-I188 WeakPolarHBondContact OG-CA 3.35Å; S62-I188 WeakPolarHBondContact OG-CG1 3.48Å; S62-D191 WeakPolarHBondContact OG-CB 3.43Å; S62-D191 PolarHBondContact OG-OD2 2.81Å; S62-R268 PolarHBondContact OG-NH1 3.38Å
63L90.9Very high86.1Confident0 Ų017.7 Ų17.70%010%0.097CC..Hα-helixtrans-58.6-38.5177.4-75169.5000110.4V59 A60 Y259 Q265 R268 L282 N285V59-L63 HydrophobicContact CG1-CD1 3.96Å; V59-L63 HydrophobicContact CG1-CG 4.23Å; V59-L63 WeakPolarHBondContact O-CB 3.42Å; V59-L63 VanDerWaalsContact O-CG 3.25Å; V59-L63 WeakPolarHBondContact O-CG 3.31Å; V59-L63 PolarHBondContact O-N 2.99Å; A60-L63 WeakPolarHBondContact O-CB 3.25Å; A60-L63 PolarHBondContact O-N 3.29Å; L63-Y259 HydrophobicContact CB-CE1 4.23Å; L63-Y259 HydrophobicContact CD2-CE1 4.26Å; L63-Y259 PolarHBondContact O-OH 3.26Å; L63-Q265 HydrophobicContact CD2-CB 4.29Å; L63-R268 HydrophobicContact CD2-CB 3.76Å; L63-R268 HydrophobicContact CD2-CG 4.43Å; L63-R268 HydrophobicContact CG-CB 4.27Å; L63-L282 HydrophobicContact CD1-CD2 4.15Å; L63-N285 VanDerWaalsContact C-OD1 3.23Å; L63-N285 HydrophobicContact CB-CB 4.12Å; L63-N285 WeakPolarHBondContact CB-OD1 3.14Å; L63-N285 HydrophobicContact CD1-CB 4.28Å
64T90.5Very high86.7Confident3 Ų313.1 Ų13.12%0.0188%0.076CC..Hα-helixtrans-70.4-51.8177.1-56.40000110.9A60 M61 S62 S66 F67 M68 M195 N285 G288 L289A60-T64 PolarHBondContact O-N 2.87Å; A60-T64 PolarHBondContact O-OG1 3.25Å; A60-T64 VanDerWaalsContact O-OG1 3.05Å; M61-T64 PolarHBondContact O-N 3.09Å; S62-T64 PolarHBondContact O-N 2.96Å; T64-S66 VanDerWaalsContact C-N 3.33Å; T64-S66 PolarHBondContact O-N 3.46Å; T64-F67 PolarHBondContact O-N 2.92Å; T64-M68 HydrophobicContact CG2-CG 4.05Å; T64-M68 WeakPolarHBondContact O-CB 3.41Å; T64-M68 WeakPolarHBondContact O-CG 3.19Å; T64-M68 PolarHBondContact O-N 3.46Å; T64-M195 HydrophobicContact CG2-CE 3.52Å; T64-M195 HydrophobicContact CG2-SD 3.75Å; T64-N285 VanDerWaalsContact CA-OD1 3.27Å; T64-N285 WeakPolarHBondContact CA-OD1 3.25Å; T64-N285 PolarHBondContact N-OD1 3.08Å; T64-N285 PolarHBondContact OG1-O 3.07Å; T64-N285 PolarHBondContact OG1-OD1 3.11Å; T64-G288 VanDerWaalsContact CG2-C 3.48Å; T64-L289 HydrophobicContact CG2-CD2 4.24Å
65A85.7Confident87.3Confident1 Ų112.5 Ų12.51%0.0087%0.073CC..Hα-helixtrans-62.3-38.4-17800000113M61 S62 F67 D191 M195M61-A65 WeakPolarHBondContact O-CB 3.32Å; M61-A65 PolarHBondContact O-N 3.29Å; S62-A65 PolarHBondContact O-N 3.35Å; A65-F67 PolarHBondContact O-N 2.6Å; A65-D191 HydrophobicContact CB-CB 3.95Å; A65-M195 HydrophobicContact CB-CB 4.19Å; A65-M195 HydrophobicContact CB-SD 4.08Å
66S77.6Confident87.6Confident2 Ų29.5 Ų9.51%0.0145%0.054CC..THydrogen-bonded Turntrans-66.3-22-178.3-59.80000113.5S62 T64 R268 S353 T354 S357S62-S66 VanDerWaalsContact O-CB 3.24Å; S62-S66 WeakPolarHBondContact O-CB 3.33Å; S62-S66 PolarHBondContact O-N 3.42Å; S62-S66 PolarHBondContact O-OG 3.15Å; T64-S66 VanDerWaalsContact C-N 3.33Å; T64-S66 PolarHBondContact O-N 3.46Å; S66-R268 PolarHBondContact OG-NE 2.96Å; S66-R268 VanDerWaalsContact OG-NE 3.14Å; S66-R268 PolarHBondContact OG-NH2 3.22Å; S66-S353 WeakPolarHBondContact CA-OG 3.44Å; S66-S353 PolarHBondContact N-OG 3.34Å; S66-T354 WeakPolarHBondContact O-CB 3.22Å; S66-T354 WeakPolarHBondContact O-CG2 3.32Å; S66-T354 PolarHBondContact O-OG1 3.11Å; S66-S357 PolarHBondContact OG-OG 3.49Å
67F71.5Confident87.9Confident11 Ų119.5 Ų9.55%0.0485%0.054CC..THydrogen-bonded Turntrans-112.9-26.7-178.7-148.3-83000113.2T64 A65 S69 W255 I258 F419T64-F67 PolarHBondContact O-N 2.92Å; A65-F67 PolarHBondContact O-N 2.6Å; F67-S69 PolarHBondContact O-N 3.45Å; F67-W255 HydrophobicContact CD1-CE3 4.38Å; F67-W255 AromaticContact CD1-CH2 3.39Å; F67-W255 HydrophobicContact CD1-CH2 3.39Å; F67-W255 AromaticContact CD1-CZ3 3.17Å; F67-W255 HydrophobicContact CD1-CZ3 3.17Å; F67-W255 HydrophobicContact CE1-CE3 4.2Å; F67-W255 AromaticContact CE1-CH2 3.3Å; F67-W255 HydrophobicContact CE1-CH2 3.3Å; F67-W255 HydrophobicContact CE1-CZ2 4.4Å; F67-W255 AromaticContact CE1-CZ3 3.18Å; F67-W255 HydrophobicContact CE1-CZ3 3.18Å; F67-W255 HydrophobicContact CG-CZ3 4.03Å; F67-W255 HydrophobicContact CZ-CH2 4.46Å; F67-W255 HydrophobicContact CZ-CZ3 4.09Å; F67-I258 HydrophobicContact CD2-CG2 3.52Å; F67-I258 HydrophobicContact CE1-CD1 3.96Å; F67-I258 HydrophobicContact CE1-CG2 4.29Å; F67-I258 HydrophobicContact CE2-CB 4.24Å; F67-I258 HydrophobicContact CE2-CD1 4.13Å; F67-I258 HydrophobicContact CE2-CG1 4.07Å; F67-I258 HydrophobicContact CE2-CG2 3.16Å; F67-I258 HydrophobicContact CG-CG2 4.24Å; F67-I258 HydrophobicContact CZ-CB 4.33Å; F67-I258 HydrophobicContact CZ-CD1 3.4Å; F67-I258 HydrophobicContact CZ-CG1 3.84Å; F67-I258 HydrophobicContact CZ-CG2 3.59Å; F67-F419 HydrophobicContact CE2-CE1 4.38Å; F67-F419 AromaticContact CE2-CE2 3.81Å; F67-F419 HydrophobicContact CE2-CE2 3.81Å; F67-F419 AromaticContact CE2-CZ 3.67Å; F67-F419 HydrophobicContact CE2-CZ 3.67Å; F67-F419 HydrophobicContact CZ-CD2 4.03Å; F67-F419 AromaticContact CZ-CE2 3.53Å; F67-F419 HydrophobicContact CZ-CE2 3.53Å; F67-F419 AromaticContact CZ-CZ 3.88Å; F67-F419 HydrophobicContact CZ-CZ 3.88Å
68M75.2Confident88Confident2 Ų26 Ų61%0.013%0.033CC..SBendtrans-76.446.4168.9-62.2-51.5-108.800111.8T64 T72 M198 L289 T292 V293T64-M68 HydrophobicContact CG2-CG 4.05Å; T64-M68 WeakPolarHBondContact O-CB 3.41Å; T64-M68 WeakPolarHBondContact O-CG 3.19Å; T64-M68 PolarHBondContact O-N 3.46Å; M68-T72 HydrophobicContact CB-CG2 4.39Å; M68-T72 HydrophobicContact CE-CG2 3.66Å; M68-T72 HydrophobicContact SD-CG2 3.69Å; M68-M198 HydrophobicContact CB-CE 3.74Å; M68-M198 HydrophobicContact CB-SD 4.03Å; M68-L289 HydrophobicContact CG-CD2 3.78Å; M68-L289 HydrophobicContact SD-CD2 3.75Å; M68-T292 HydrophobicContact CB-CG2 4.02Å; M68-T292 VanDerWaalsContact CE-CB 3.41Å; M68-T292 HydrophobicContact CE-CG2 3.56Å; M68-T292 HydrophobicContact CG-CG2 3.88Å; M68-T292 HydrophobicContact SD-CG2 4.48Å; M68-V293 HydrophobicContact CE-CB 4.03Å
69S84.6Confident88.3Confident1 Ų15.5 Ų5.51%0.0073%0.029CC..  trans-52.7176.8-175.971.50000114.1F67 I71 T72 V73 T354F67-S69 PolarHBondContact O-N 3.45Å; S69-I71 PolarHBondContact O-N 2.73Å; S69-I71 WeakPolarHBondContact OG-CB 3.42Å; S69-I71 PolarHBondContact OG-N 2.95Å; S69-T72 WeakPolarHBondContact O-CB 3.5Å; S69-T72 PolarHBondContact O-N 2.8Å; S69-V73 PolarHBondContact O-N 3.38Å; S69-T354 WeakPolarHBondContact CA-OG1 3.36Å; S69-T354 WeakPolarHBondContact CB-OG1 3.47Å
70G84.6Confident88.5Confident0 Ų05.6 Ų5.60%03%0.03CC..Hα-helixtrans-53.1-27.6170.700000113.5T72 V73 I74 A347 T351G70-T72 VanDerWaalsContact C-N 3.35Å; G70-T72 PolarHBondContact O-N 3.19Å; G70-V73 PolarHBondContact O-N 2.92Å; G70-I74 WeakPolarHBondContact O-CB 3.5Å; G70-I74 PolarHBondContact O-N 2.73Å; G70-A347 WeakPolarHBondContact CA-O 3.23Å; G70-T351 WeakPolarHBondContact CA-OG1 3.42Å; G70-T351 PolarHBondContact N-OG1 3.48Å
71I89.5Confident88.7Confident5 Ų55.7 Ų5.73%0.0263%0.03CC..Hα-helixtrans-62.5-40.9173.4-55.5178.3000110.9S69 G75 Y144 M147 V148 A151 I411 L412 A415S69-I71 PolarHBondContact O-N 2.73Å; S69-I71 WeakPolarHBondContact OG-CB 3.42Å; S69-I71 PolarHBondContact OG-N 2.95Å; I71-G75 VanDerWaalsContact O-CA 3.22Å; I71-G75 WeakPolarHBondContact O-CA 3.28Å; I71-G75 PolarHBondContact O-N 3.01Å; I71-Y144 HydrophobicContact CD1-CE2 4.06Å; I71-M147 HydrophobicContact CD1-CB 4.03Å; I71-V148 HydrophobicContact CD1-CB 4.31Å; I71-V148 HydrophobicContact CD1-CG2 3.49Å; I71-V148 VanDerWaalsContact CD1-CG2 3.49Å; I71-V148 HydrophobicContact CG1-CG2 4.1Å; I71-A151 HydrophobicContact CG1-CB 3.93Å; I71-I411 HydrophobicContact CD1-CG2 3.98Å; I71-I411 HydrophobicContact CG1-CG2 3.99Å; I71-I411 HydrophobicContact CG2-CG2 4.2Å; I71-L412 HydrophobicContact CG2-CB 3.97Å; I71-L412 HydrophobicContact CG2-CD1 3.84Å; I71-A415 HydrophobicContact CD1-CB 3.94Å
72T90.5Very high88.8Confident13 Ų135.9 Ų5.98%0.083%0.028CC..Hα-helixtrans-68.3-43.4177-61.10000110.9M68 S69 G70 I74 T76 P77M68-T72 HydrophobicContact CB-CG2 4.39Å; M68-T72 HydrophobicContact CE-CG2 3.66Å; M68-T72 HydrophobicContact SD-CG2 3.69Å; S69-T72 WeakPolarHBondContact O-CB 3.5Å; S69-T72 PolarHBondContact O-N 2.8Å; G70-T72 VanDerWaalsContact C-N 3.35Å; G70-T72 PolarHBondContact O-N 3.19Å; T72-I74 VanDerWaalsContact C-N 3.26Å; T72-I74 PolarHBondContact O-N 3.12Å; T72-T76 VanDerWaalsContact O-CB 3.27Å; T72-T76 WeakPolarHBondContact O-CB 3.19Å; T72-T76 PolarHBondContact O-N 3.4Å; T72-T76 PolarHBondContact O-OG1 3.41Å; T72-P77 WeakPolarHBondContact O-CD 3.46Å
73V90.8Very high88.9Confident1 Ų17.5 Ų7.51%0.0064%0.035CC..Hα-helixtrans-58-41.2-179.2178.60000111.5S69 G70 P77 M198 F202 L325 F343 A347S69-V73 PolarHBondContact O-N 3.38Å; G70-V73 PolarHBondContact O-N 2.92Å; V73-P77 WeakPolarHBondContact O-CD 3.43Å; V73-P77 WeakPolarHBondContact O-CG 3.22Å; V73-M198 HydrophobicContact CG2-CG 3.65Å; V73-M198 HydrophobicContact CG2-SD 3.58Å; V73-M198 VanDerWaalsContact CG2-SD 3.58Å; V73-F202 HydrophobicContact CB-CZ 4.27Å; V73-F202 HydrophobicContact CG1-CE1 4.34Å; V73-F202 HydrophobicContact CG1-CZ 4.3Å; V73-F202 HydrophobicContact CG2-CE2 4.45Å; V73-F202 HydrophobicContact CG2-CZ 4.15Å; V73-L325 WeakPolarHBondContact O-CD2 3.08Å; V73-F343 HydrophobicContact CG1-CE2 4.17Å; V73-F343 HydrophobicContact CG1-CZ 4.2Å; V73-A347 HydrophobicContact CB-CB 4.46Å; V73-A347 HydrophobicContact CG1-CB 4.09Å
74I91.6Very high89Confident1 Ų17.7 Ų7.71%0.0054%0.037CC..Hα-helixtrans-95.3-47.4-174.7-67.5163.8000111.9G70 T72 P77 A78 A151 A155 D322 A347G70-I74 WeakPolarHBondContact O-CB 3.5Å; G70-I74 PolarHBondContact O-N 2.73Å; T72-I74 VanDerWaalsContact C-N 3.26Å; T72-I74 PolarHBondContact O-N 3.12Å; I74-P77 WeakPolarHBondContact O-CD 3.34Å; I74-A78 PolarHBondContact O-N 3.04Å; I74-A151 HydrophobicContact CD1-CB 4.47Å; I74-A151 WeakPolarHBondContact CD1-O 3.22Å; I74-A155 HydrophobicContact CD1-CB 3.62Å; I74-A155 HydrophobicContact CG1-CB 4.47Å; I74-D322 HydrophobicContact CG2-CB 3.9Å; I74-D322 WeakPolarHBondContact CG2-O 3.43Å; I74-A347 HydrophobicContact CD1-CB 4.13Å; I74-A347 HydrophobicContact CG1-CB 4.43Å
75G92.3Very high89.3Confident1 Ų17.8 Ų7.81%0.014%0.038CC..Hα-helixtrans-77-38-171.300000113.9I71 A78 E79I71-G75 VanDerWaalsContact O-CA 3.22Å; I71-G75 WeakPolarHBondContact O-CA 3.28Å; I71-G75 PolarHBondContact O-N 3.01Å; G75-A78 PolarHBondContact O-N 3.03Å; G75-E79 WeakPolarHBondContact O-CB 3.26Å; G75-E79 PolarHBondContact O-N 3.4Å
76T93.9Very high89.7Confident5 Ų58.3 Ų8.33%0.0314%0.042CC..Hα-helixtrans-65.5-43.2-178.6-54.20000112.4T72 A78 E79 A80 F87 V293 A296 V297T72-T76 VanDerWaalsContact O-CB 3.27Å; T72-T76 WeakPolarHBondContact O-CB 3.19Å; T72-T76 PolarHBondContact O-N 3.4Å; T72-T76 PolarHBondContact O-OG1 3.41Å; T76-A78 VanDerWaalsContact C-N 3.33Å; T76-A78 PolarHBondContact O-N 3.49Å; T76-E79 PolarHBondContact O-N 2.91Å; T76-A80 PolarHBondContact O-N 3.46Å; T76-F87 HydrophobicContact CG2-CD2 3.95Å; T76-V293 HydrophobicContact CG2-CG2 4.26Å; T76-A296 HydrophobicContact CG2-CB 3.75Å; T76-V297 HydrophobicContact CG2-CG2 4Å
77P95.6Very high90.4Very high0 Ų08.6 Ų8.60%04%0.043CC..Hα-helixtrans-63.5-37.4173.5-26.239.3000112.8T72 V73 I74 A80 Y81 F202 A296 G300 L325T72-P77 WeakPolarHBondContact O-CD 3.46Å; V73-P77 WeakPolarHBondContact O-CD 3.43Å; V73-P77 WeakPolarHBondContact O-CG 3.22Å; I74-P77 WeakPolarHBondContact O-CD 3.34Å; P77-A80 PolarHBondContact O-N 3.32Å; P77-Y81 WeakPolarHBondContact O-CB 3.37Å; P77-Y81 PolarHBondContact O-N 2.92Å; P77-F202 HydrophobicContact CG-CE1 4.08Å; P77-A296 HydrophobicContact CG-CB 4.18Å; P77-A296 WeakPolarHBondContact CG-O 3.31Å; P77-G300 VanDerWaalsContact O-CA 3.22Å; P77-G300 WeakPolarHBondContact O-CA 3.37Å; P77-L325 HydrophobicContact CB-CD1 4.14Å; P77-L325 HydrophobicContact CB-CD2 3.85Å; P77-L325 HydrophobicContact CB-CG 4.44Å; P77-L325 HydrophobicContact CG-CD2 3.62Å
78A93.8Very high91.6Very high4 Ų412.6 Ų12.63%0.0336%0.058CC..Hα-helixtrans-64.2-40.8174.500000112I74 G75 T76 Y81 R82 L321I74-A78 PolarHBondContact O-N 3.04Å; G75-A78 PolarHBondContact O-N 3.03Å; T76-A78 VanDerWaalsContact C-N 3.33Å; T76-A78 PolarHBondContact O-N 3.49Å; A78-Y81 WeakPolarHBondContact O-CB 3.33Å; A78-Y81 PolarHBondContact O-N 3Å; A78-R82 PolarHBondContact O-N 3.01Å; A78-R82 VanDerWaalsContact O-N 3.11Å; A78-L321 WeakPolarHBondContact CB-O 3.39Å
79E92.9Very high92.5Very high6 Ų612.7 Ų12.73%0.0286%0.058CC..Hα-helixtrans-62.7-45.1174.6-162.973.3-171.400110.8G75 T76 Y81 R82 F83 F87 R241 H242 L412G75-E79 WeakPolarHBondContact O-CB 3.26Å; G75-E79 PolarHBondContact O-N 3.4Å; T76-E79 PolarHBondContact O-N 2.91Å; E79-Y81 VanDerWaalsContact C-N 3.31Å; E79-Y81 PolarHBondContact O-N 3.42Å; E79-R82 PolarHBondContact O-N 3.12Å; E79-F83 VanDerWaalsContact CD-CD2 3.4Å; E79-F83 HydrophobicContact CG-CD2 4.12Å; E79-F83 PolarHBondContact O-N 3.2Å; E79-F83 WeakPolarHBondContact OE1-CD2 3.38Å; E79-F87 HydrophobicContact CG-CD1 4.2Å; E79-F87 HydrophobicContact CG-CE1 3.85Å; E79-F87 HydrophobicContact CG-CE2 4.37Å; E79-F87 HydrophobicContact CG-CZ 3.91Å; E79-R241 IonicContact OE1-CZ 2.69Å; E79-R241 IonicContact OE1-NE 2.65Å; E79-R241 PolarHBondContact OE1-NE 2.8Å; E79-R241 IonicContact OE1-NH2 3.68Å; E79-R241 PolarHBondContact OE1-NH2 2.84Å; E79-R241 IonicContact OE2-NH2 2.72Å; E79-R241 PolarHBondContact OE2-NH2 2.84Å; E79-H242 IonicContact OE1-CE1 2.74Å; E79-H242 PolarHBondContact OE1-CE1 2.69Å; E79-H242 IonicContact OE1-NE2 3.66Å; E79-H242 PolarHBondContact OE1-NE2 3.05Å; E79-L412 HydrophobicContact CB-CD2 4.12Å
80A95.5Very high93Very high2 Ų212.8 Ų12.82%0.0176%0.059CC..Hα-helixtrans-64.6-34.1178.100000113.3T76 P77 G84 V297T76-A80 PolarHBondContact O-N 3.46Å; P77-A80 PolarHBondContact O-N 3.32Å; A80-G84 WeakPolarHBondContact CA-O 3.42Å; A80-G84 WeakPolarHBondContact O-CA 3.32Å; A80-G84 PolarHBondContact O-N 2.98Å; A80-G84 VanDerWaalsContact O-N 3.08Å; A80-V297 HydrophobicContact CB-CB 4.45Å; A80-V297 HydrophobicContact CB-CG1 4.17Å
81Y95.1Very high93.5Very high3 Ų313.4 Ų13.41%0.0127%0.065CC..Hα-helixtrans-64.8-45.2174.1176.6-92.8000112.6P77 A78 E79 R228 M303 Y304 D311 L324 I477P77-Y81 WeakPolarHBondContact O-CB 3.37Å; P77-Y81 PolarHBondContact O-N 2.92Å; A78-Y81 WeakPolarHBondContact O-CB 3.33Å; A78-Y81 PolarHBondContact O-N 3Å; E79-Y81 VanDerWaalsContact C-N 3.31Å; E79-Y81 PolarHBondContact O-N 3.42Å; Y81-R228 PolarHBondContact O-NH2 3.45Å; Y81-M303 HydrophobicContact CD1-CE 4.46Å; Y81-M303 HydrophobicContact CD2-CB 4.13Å; Y81-M303 HydrophobicContact CD2-CE 3.87Å; Y81-M303 HydrophobicContact CD2-CG 3.84Å; Y81-M303 HydrophobicContact CE2-CG 4.26Å; Y81-M303 HydrophobicContact CG-CE 3.66Å; Y81-Y304 HydrophobicContact CE2-CD2 4.27Å; Y81-D311 WeakPolarHBondContact CE1-OD1 3.49Å; Y81-D311 PolarHBondContact OH-OD1 2.78Å; Y81-L324 HydrophobicContact CD1-CD1 3.78Å; Y81-L324 HydrophobicContact CE1-CD1 4.05Å; Y81-L324 HydrophobicContact CG-CD1 4.47Å; Y81-I477 HydrophobicContact CE1-CG2 4.29Å
82R92.8Very high93.9Very high63 Ų6316.7 Ų16.724%0.2388%0.082CC..Hα-helixtrans-86.2-37.8-172.5-175.257.6171.3164.5-4.6113.9A78 E79 L321 P474 L475 I477A78-R82 PolarHBondContact O-N 3.01Å; A78-R82 VanDerWaalsContact O-N 3.11Å; E79-R82 PolarHBondContact O-N 3.12Å; R82-L321 HydrophobicContact CB-CD2 4.32Å; R82-L321 HydrophobicContact CG-CD2 4.36Å; R82-P474 VanDerWaalsContact CZ-CB 3.46Å; R82-L475 PolarHBondContact O-N 3.39Å; R82-I477 VanDerWaalsContact NH1-CD1 3.27Å
83F92.3Very high94.2Very high34 Ų3416.1 Ų16.115%0.1498%0.078CC..Hα-helixtrans-120.7-5.7-171.5-57.2-75.2000113.6E79 T472 P474E79-F83 VanDerWaalsContact CD-CD2 3.4Å; E79-F83 HydrophobicContact CG-CD2 4.12Å; E79-F83 PolarHBondContact O-N 3.2Å; E79-F83 WeakPolarHBondContact OE1-CD2 3.38Å; F83-T472 WeakPolarHBondContact CD1-O 3.34Å; F83-T472 WeakPolarHBondContact CE1-O 3.31Å; F83-P474 HydrophobicContact CD1-CB 4.41Å; F83-P474 HydrophobicContact CE1-CB 3.96Å
84G93.8Very high94.4Very high3 Ų316.3 Ų16.33%0.0318%0.079CC..  trans89.9-174177.900000114.1A80 A86A80-G84 WeakPolarHBondContact CA-O 3.42Å; A80-G84 WeakPolarHBondContact O-CA 3.32Å; A80-G84 PolarHBondContact O-N 2.98Å; A80-G84 VanDerWaalsContact O-N 3.08Å; G84-A86 PolarHBondContact O-N 3.47Å
85A95.3Very high94.7Very high5 Ų517.8 Ų17.84%0.0419%0.091CC..G310 helixtrans-79.214.2-165.600000115.2F87 W88 R228 L231 V297 L301A85-F87 PolarHBondContact O-N 3.29Å; A85-F87 VanDerWaalsContact O-N 3.08Å; A85-W88 WeakPolarHBondContact O-CB 3.13Å; A85-W88 PolarHBondContact O-N 2.97Å; A85-R228 WeakPolarHBondContact CB-O 3.45Å; A85-R228 PolarHBondContact N-O 2.74Å; A85-L231 HydrophobicContact CB-CD2 3.53Å; A85-L231 HydrophobicContact CB-CG 4.41Å; A85-L231 WeakPolarHBondContact O-CD2 3.47Å; A85-V297 HydrophobicContact CB-CG1 3.69Å; A85-L301 HydrophobicContact CB-CD2 4.47Å
86A93.8Very high94.9Very high12 Ų1220.6 Ų20.610%0.09911%0.106CC..G310 helixtrans-53.7-35.7-172.800000113.2G84 W88 I89 H242 I247G84-A86 PolarHBondContact O-N 3.47Å; A86-W88 PolarHBondContact O-N 2.88Å; A86-W88 VanDerWaalsContact O-N 3.08Å; A86-I89 VanDerWaalsContact O-CB 3.31Å; A86-I89 WeakPolarHBondContact O-CB 3.49Å; A86-I89 PolarHBondContact O-N 3.32Å; A86-H242 HydrophobicContact CB-CB 3.95Å; A86-I247 VanDerWaalsContact C-CD1 3.48Å; A86-I247 HydrophobicContact CB-CD1 3.66Å; A86-I247 WeakPolarHBondContact O-CD1 3.36Å
87F93.6Very high95Very high8 Ų820.4 Ų20.44%0.03510%0.104CC..G310 helixtrans-58.2-22.2177-91.238.4000114.3T76 E79 A85 I89 F90 H242 V293 V297 L412 L416 Y521T76-F87 HydrophobicContact CG2-CD2 3.95Å; E79-F87 HydrophobicContact CG-CD1 4.2Å; E79-F87 HydrophobicContact CG-CE1 3.85Å; E79-F87 HydrophobicContact CG-CE2 4.37Å; E79-F87 HydrophobicContact CG-CZ 3.91Å; A85-F87 PolarHBondContact O-N 3.29Å; A85-F87 VanDerWaalsContact O-N 3.08Å; F87-I89 PolarHBondContact O-N 3.31Å; F87-F90 HydrophobicContact CB-CD2 4.12Å; F87-F90 HydrophobicContact CB-CE2 4.39Å; F87-F90 HydrophobicContact CD1-CD2 4.35Å; F87-F90 AromaticContact CD1-CE2 3.79Å; F87-F90 HydrophobicContact CD1-CE2 3.79Å; F87-F90 HydrophobicContact CD2-CD2 4.05Å; F87-F90 AromaticContact CD2-CE2 3.75Å; F87-F90 HydrophobicContact CD2-CE2 3.75Å; F87-F90 AromaticContact CE1-CE2 3.88Å; F87-F90 HydrophobicContact CE1-CE2 3.88Å; F87-F90 AromaticContact CE2-CE2 3.86Å; F87-F90 HydrophobicContact CE2-CE2 3.86Å; F87-F90 AromaticContact CG-CD2 3.94Å; F87-F90 HydrophobicContact CG-CD2 3.94Å; F87-F90 AromaticContact CG-CE2 3.72Å; F87-F90 HydrophobicContact CG-CE2 3.72Å; F87-F90 AromaticContact CZ-CE2 3.94Å; F87-F90 HydrophobicContact CZ-CE2 3.94Å; F87-F90 VanDerWaalsContact O-CB 3.31Å; F87-F90 WeakPolarHBondContact O-CB 3.24Å; F87-F90 WeakPolarHBondContact O-CD2 3.34Å; F87-F90 PolarHBondContact O-N 3Å; F87-H242 AromaticContact CE1-CE1 3.61Å; F87-H242 AromaticContact CE1-NE2 3.46Å; F87-H242 WeakPolarHBondContact CE1-NE2 3.08Å; F87-V293 HydrophobicContact CB-CG2 4.44Å; F87-V297 HydrophobicContact CB-CG2 4.01Å; F87-L412 HydrophobicContact CD2-CD2 4.45Å; F87-L412 HydrophobicContact CE2-CD2 3.47Å; F87-L412 VanDerWaalsContact CE2-CD2 3.47Å; F87-L412 HydrophobicContact CE2-CG 4.29Å; F87-L412 HydrophobicContact CZ-CD2 3.91Å; F87-L416 HydrophobicContact CZ-CD1 4.41Å; F87-Y521 WeakPolarHBondContact CZ-OH 3.42Å
88W95.7Very high95Very high95 Ų9520.4 Ų20.436%0.3610%0.104SC..G310 helixtrans-60.2-27.9174.6-171.277.4000112.4A85 A86 F90 G91 L231 W290 S294A85-W88 WeakPolarHBondContact O-CB 3.13Å; A85-W88 PolarHBondContact O-N 2.97Å; A86-W88 PolarHBondContact O-N 2.88Å; A86-W88 VanDerWaalsContact O-N 3.08Å; W88-F90 PolarHBondContact O-N 2.97Å; W88-G91 PolarHBondContact O-N 3.31Å; W88-L231 HydrophobicContact CB-CD2 4.05Å; W88-L231 HydrophobicContact CE3-CD1 4.25Å; W88-L231 HydrophobicContact CE3-CD2 4.24Å; W88-W290 AromaticContact CE2-NE1 3.92Å; W88-W290 HydrophobicContact CH2-CZ2 4.25Å; W88-W290 AromaticContact CZ2-CZ2 3.74Å; W88-W290 HydrophobicContact CZ2-CZ2 3.74Å; W88-W290 AromaticContact NE1-NE1 3.8Å; W88-S294 PolarHBondContact NE1-OG 3Å; W88-S294 VanDerWaalsContact NE1-OG 3.14Å
89I95.6Very high95.2Very high4 Ų424.6 Ų24.62%0.02113%0.125CC..G310 helixtrans-65.5-18.9176.3-64.3175.8000112.3A86 F87 G91 I92 L231 F232 F244 I247 V248A86-I89 VanDerWaalsContact O-CB 3.31Å; A86-I89 WeakPolarHBondContact O-CB 3.49Å; A86-I89 PolarHBondContact O-N 3.32Å; F87-I89 PolarHBondContact O-N 3.31Å; I89-G91 PolarHBondContact O-N 3.21Å; I89-I92 HydrophobicContact CG2-CD1 4.34Å; I89-I92 PolarHBondContact O-N 3.23Å; I89-L231 HydrophobicContact CD1-CB 4.46Å; I89-L231 WeakPolarHBondContact CD1-O 3.45Å; I89-F232 HydrophobicContact CD1-CD1 3.97Å; I89-F232 HydrophobicContact CD1-CE1 4.17Å; I89-F232 HydrophobicContact CG1-CE1 4.41Å; I89-F244 HydrophobicContact CD1-CD2 4.41Å; I89-F244 HydrophobicContact CG2-CD2 4.34Å; I89-I247 HydrophobicContact CB-CG2 3.94Å; I89-I247 HydrophobicContact CG2-CB 4.3Å; I89-I247 HydrophobicContact CG2-CG2 3.85Å; I89-V248 HydrophobicContact CG2-CG2 3.63Å
90F94.9Very high95.3Very high3 Ų326.8 Ų26.81%0.01314%0.137CC..Hα-helixtrans-55.9-18.6172.5-80.2-56.8000113.1F87 W88 I92 S93 Y94 I247 M254 W255 L522F87-F90 HydrophobicContact CB-CD2 4.12Å; F87-F90 HydrophobicContact CB-CE2 4.39Å; F87-F90 HydrophobicContact CD1-CD2 4.35Å; F87-F90 AromaticContact CD1-CE2 3.79Å; F87-F90 HydrophobicContact CD1-CE2 3.79Å; F87-F90 HydrophobicContact CD2-CD2 4.05Å; F87-F90 AromaticContact CD2-CE2 3.75Å; F87-F90 HydrophobicContact CD2-CE2 3.75Å; F87-F90 AromaticContact CE1-CE2 3.88Å; F87-F90 HydrophobicContact CE1-CE2 3.88Å; F87-F90 AromaticContact CE2-CE2 3.86Å; F87-F90 HydrophobicContact CE2-CE2 3.86Å; F87-F90 AromaticContact CG-CD2 3.94Å; F87-F90 HydrophobicContact CG-CD2 3.94Å; F87-F90 AromaticContact CG-CE2 3.72Å; F87-F90 HydrophobicContact CG-CE2 3.72Å; F87-F90 AromaticContact CZ-CE2 3.94Å; F87-F90 HydrophobicContact CZ-CE2 3.94Å; F87-F90 VanDerWaalsContact O-CB 3.31Å; F87-F90 WeakPolarHBondContact O-CB 3.24Å; F87-F90 WeakPolarHBondContact O-CD2 3.34Å; F87-F90 PolarHBondContact O-N 3Å; W88-F90 PolarHBondContact O-N 2.97Å; F90-I92 PolarHBondContact O-N 3.33Å; F90-S93 CarbonylContact O-C 3.34Å; F90-S93 WeakPolarHBondContact O-CA 3.42Å; F90-S93 WeakPolarHBondContact O-CB 3.33Å; F90-S93 PolarHBondContact O-N 3.08Å; F90-Y94 HydrophobicContact CB-CD2 4.36Å; F90-Y94 HydrophobicContact CB-CE1 4.36Å; F90-Y94 HydrophobicContact CB-CE2 3.81Å; F90-Y94 WeakPolarHBondContact O-CB 3.29Å; F90-Y94 WeakPolarHBondContact O-CD2 3.19Å; F90-Y94 PolarHBondContact O-N 2.69Å; F90-I247 HydrophobicContact CD1-CG2 3.63Å; F90-I247 HydrophobicContact CD2-CG2 4.37Å; F90-I247 HydrophobicContact CE1-CG2 3.81Å; F90-I247 HydrophobicContact CG-CG2 3.92Å; F90-I247 HydrophobicContact CZ-CG2 4.25Å; F90-M254 HydrophobicContact CE1-CE 4.34Å; F90-M254 HydrophobicContact CZ-CE 4.44Å; F90-W255 AromaticContact CD1-CD1 3.75Å; F90-W255 AromaticContact CD1-NE1 3.24Å; F90-W255 AromaticContact CE1-CD1 3.93Å; F90-W255 AromaticContact CE1-NE1 3.34Å; F90-W255 VanDerWaalsContact CE1-NE1 3.34Å; F90-W255 AromaticContact CG-NE1 3.91Å; F90-L522 HydrophobicContact CE1-CD1 4.41Å; F90-L522 HydrophobicContact CE1-CD2 4.35Å; F90-L522 HydrophobicContact CZ-CD1 3.95Å; F90-L522 HydrophobicContact CZ-CD2 3.88Å
91G95.3Very high95.3Very high13 Ų1326.7 Ų26.713%0.13414%0.136CC..Hα-helixtrans-50.2-40.8168.700000113.6W88 I89 A95W88-G91 PolarHBondContact O-N 3.31Å; I89-G91 PolarHBondContact O-N 3.21Å; G91-A95 PolarHBondContact O-N 2.96Å
92I96.6Very high95.3Very high75 Ų7526.6 Ų26.639%0.38514%0.135SC..Hα-helixtrans-69-43.8175.4-57.4177.5000110I89 F90 Y94 A95 I96 F244 V248I89-I92 HydrophobicContact CG2-CD1 4.34Å; I89-I92 PolarHBondContact O-N 3.23Å; F90-I92 PolarHBondContact O-N 3.33Å; I92-Y94 VanDerWaalsContact C-N 3.32Å; I92-Y94 PolarHBondContact O-N 3.47Å; I92-A95 WeakPolarHBondContact O-CB 3.44Å; I92-A95 PolarHBondContact O-N 3.19Å; I92-A95 VanDerWaalsContact O-N 3.15Å; I92-I96 HydrophobicContact CG2-CD1 4.1Å; I92-I96 PolarHBondContact O-N 3.31Å; I92-F244 HydrophobicContact CD1-CE2 4.13Å; I92-V248 HydrophobicContact CB-CG2 4.34Å; I92-V248 HydrophobicContact CD1-CG2 4.42Å; I92-V248 HydrophobicContact CG2-CG1 4.13Å; I92-V248 HydrophobicContact CG2-CG2 4.26Å
93S96.6Very high95.4Very high0 Ų025.3 Ų25.30%013%0.132CC..Hα-helixtrans-62.9-38.9-179.8-42.80000112.2F90 I96 M97 I247 S252F90-S93 CarbonylContact O-C 3.34Å; F90-S93 WeakPolarHBondContact O-CA 3.42Å; F90-S93 WeakPolarHBondContact O-CB 3.33Å; F90-S93 PolarHBondContact O-N 3.08Å; S93-I96 PolarHBondContact O-N 3Å; S93-M97 VanDerWaalsContact O-CB 3.27Å; S93-M97 WeakPolarHBondContact O-CB 3.5Å; S93-M97 PolarHBondContact O-N 3.08Å; S93-I247 PolarHBondContact OG-O 3.02Å; S93-S252 WeakPolarHBondContact CA-OG 3.17Å
94Y95.9Very high95.4Very high6 Ų625 Ų252%0.02413%0.131CC..Hα-helixtrans-62.8-41.2173.3-62.6-37000111.8F90 I92 M97 S98 W255 L289 V293F90-Y94 HydrophobicContact CB-CD2 4.36Å; F90-Y94 HydrophobicContact CB-CE1 4.36Å; F90-Y94 HydrophobicContact CB-CE2 3.81Å; F90-Y94 WeakPolarHBondContact O-CB 3.29Å; F90-Y94 WeakPolarHBondContact O-CD2 3.19Å; F90-Y94 PolarHBondContact O-N 2.69Å; I92-Y94 VanDerWaalsContact C-N 3.32Å; I92-Y94 PolarHBondContact O-N 3.47Å; Y94-M97 PolarHBondContact O-N 3.42Å; Y94-S98 WeakPolarHBondContact O-CB 3.21Å; Y94-S98 PolarHBondContact O-N 3.4Å; Y94-S98 PolarHBondContact O-OG 3.44Å; Y94-W255 HydrophobicContact CD1-CD2 4.1Å; Y94-W255 HydrophobicContact CD1-CE3 4.46Å; Y94-W255 HydrophobicContact CD1-CG 4.18Å; Y94-W255 AromaticContact CE1-CD2 3.58Å; Y94-W255 HydrophobicContact CE1-CD2 3.58Å; Y94-W255 AromaticContact CE1-CE2 3.38Å; Y94-W255 AromaticContact CE1-CE3 3.92Å; Y94-W255 HydrophobicContact CE1-CE3 3.92Å; Y94-W255 HydrophobicContact CE1-CG 4.07Å; Y94-W255 AromaticContact CE1-CH2 3.9Å; Y94-W255 HydrophobicContact CE1-CH2 3.9Å; Y94-W255 AromaticContact CE1-CZ2 3.59Å; Y94-W255 HydrophobicContact CE1-CZ2 3.59Å; Y94-W255 HydrophobicContact CE1-CZ3 4.04Å; Y94-W255 AromaticContact CE1-NE1 3.7Å; Y94-W255 AromaticContact CZ-CZ2 3.98Å; Y94-W255 WeakPolarHBondContact OH-CZ2 3.45Å; Y94-L289 HydrophobicContact CD1-CB 4.4Å; Y94-L289 HydrophobicContact CD1-CD1 3.72Å; Y94-L289 HydrophobicContact CD2-CB 3.76Å; Y94-L289 HydrophobicContact CD2-CD1 4.5Å; Y94-L289 HydrophobicContact CE1-CB 4.36Å; Y94-L289 HydrophobicContact CE1-CD1 3.92Å; Y94-L289 HydrophobicContact CE2-CB 3.77Å; Y94-L289 HydrophobicContact CG-CB 4.12Å; Y94-L289 HydrophobicContact CG-CD1 4.04Å; Y94-V293 HydrophobicContact CE2-CB 4.45Å; Y94-V293 HydrophobicContact CE2-CG1 4.08Å
95A97.3Very high95.5Very high31 Ų3124.9 Ų24.926%0.25613%0.13SC..Hα-helixtrans-62.5-47.6176.500000112G91 I92 M97 S98 I99 M286G91-A95 PolarHBondContact O-N 2.96Å; I92-A95 WeakPolarHBondContact O-CB 3.44Å; I92-A95 PolarHBondContact O-N 3.19Å; I92-A95 VanDerWaalsContact O-N 3.15Å; A95-M97 PolarHBondContact O-N 3.32Å; A95-S98 PolarHBondContact O-N 3.47Å; A95-I99 WeakPolarHBondContact O-CG1 3.37Å; A95-I99 PolarHBondContact O-N 3.35Å; A95-M286 VanDerWaalsContact CA-SD 3.55Å; A95-M286 HydrophobicContact CB-SD 3.8Å
96I97.5Very high95.5Very high61 Ų6124.6 Ų24.631%0.31313%0.128SC..Hα-helixtrans-60.9-46.3176.9-66.4167.2000110.5I92 S93 I99 I100 V248 S252I92-I96 HydrophobicContact CG2-CD1 4.1Å; I92-I96 PolarHBondContact O-N 3.31Å; S93-I96 PolarHBondContact O-N 3Å; I96-I99 PolarHBondContact O-N 3.27Å; I96-I100 HydrophobicContact CG2-CD1 3.69Å; I96-I100 HydrophobicContact CG2-CG1 4.42Å; I96-I100 WeakPolarHBondContact O-CB 3.26Å; I96-I100 VanDerWaalsContact O-CG1 3.32Å; I96-I100 WeakPolarHBondContact O-CG1 3.31Å; I96-I100 PolarHBondContact O-N 3.16Å; I96-V248 HydrophobicContact CD1-CG1 4.09Å; I96-S252 WeakPolarHBondContact CB-OG 3.24Å; I96-S252 WeakPolarHBondContact CD1-OG 3.3Å
97M95.4Very high95.4Very high0 Ų024.4 Ų24.40%013%0.126CC..Hα-helixtrans-60.9-44.6178166.2-96.1125.800112.6S93 Y94 A95 I100 T101 W255 Y259 L282S93-M97 VanDerWaalsContact O-CB 3.27Å; S93-M97 WeakPolarHBondContact O-CB 3.5Å; S93-M97 PolarHBondContact O-N 3.08Å; Y94-M97 PolarHBondContact O-N 3.42Å; A95-M97 PolarHBondContact O-N 3.32Å; M97-I100 PolarHBondContact O-N 2.87Å; M97-T101 HydrophobicContact CE-CG2 4.26Å; M97-T101 WeakPolarHBondContact CE-OG1 3.43Å; M97-T101 WeakPolarHBondContact O-CB 3.4Å; M97-T101 PolarHBondContact O-N 2.65Å; M97-T101 PolarHBondContact O-OG1 2.89Å; M97-W255 HydrophobicContact CB-CB 3.89Å; M97-W255 VanDerWaalsContact CG-C 3.4Å; M97-W255 HydrophobicContact CG-CB 3.83Å; M97-W255 WeakPolarHBondContact CG-O 3.4Å; M97-Y259 HydrophobicContact CE-CD1 3.64Å; M97-Y259 HydrophobicContact CE-CD2 3.81Å; M97-Y259 HydrophobicContact CE-CG 3.21Å; M97-Y259 HydrophobicContact CG-CD2 4.27Å; M97-Y259 HydrophobicContact CG-CG 4.47Å; M97-Y259 HydrophobicContact SD-CD1 4.3Å; M97-Y259 HydrophobicContact SD-CD2 3.51Å; M97-Y259 VanDerWaalsContact SD-CD2 3.51Å; M97-Y259 HydrophobicContact SD-CE2 4.15Å; M97-Y259 HydrophobicContact SD-CG 3.62Å; M97-L282 HydrophobicContact CE-CD2 4.2Å
98S95.9Very high95.3Very high0 Ų024 Ų240%012%0.124CC..Hα-helixtrans-61.3-43.5177.5-78.60000112Y94 A95 A102 L282Y94-S98 WeakPolarHBondContact O-CB 3.21Å; Y94-S98 PolarHBondContact O-N 3.4Å; Y94-S98 PolarHBondContact O-OG 3.44Å; A95-S98 PolarHBondContact O-N 3.47Å; S98-A102 WeakPolarHBondContact O-CB 3.49Å; S98-A102 PolarHBondContact O-N 2.85Å; S98-L282 PolarHBondContact OG-O 3.07Å; S98-L282 VanDerWaalsContact OG-O 3.11Å
99I96.4Very high95.2Very high93 Ų9319.6 Ų19.648%0.47711%0.108SC..Hα-helixtrans-63.6-51.1176.3-66.6165.5000110.6A95 I96 T101 A102 E103 Y283A95-I99 WeakPolarHBondContact O-CG1 3.37Å; A95-I99 PolarHBondContact O-N 3.35Å; I96-I99 PolarHBondContact O-N 3.27Å; I99-T101 VanDerWaalsContact C-N 3.32Å; I99-T101 PolarHBondContact O-N 2.93Å; I99-A102 PolarHBondContact O-N 3.28Å; I99-E103 HydrophobicContact CG2-CG 4.39Å; I99-E103 WeakPolarHBondContact O-CB 3.45Å; I99-E103 WeakPolarHBondContact O-CG 3.44Å; I99-E103 PolarHBondContact O-N 3.09Å; I99-Y283 HydrophobicContact CG1-CE1 4.29Å
100I95.9Very high94.8Very high52 Ų5221.2 Ų21.227%0.26711%0.114SC..Hα-helixtrans-57.1-48.2179.8-72.1172000110.4I96 M97 I104 F105 A256I96-I100 HydrophobicContact CG2-CD1 3.69Å; I96-I100 HydrophobicContact CG2-CG1 4.42Å; I96-I100 WeakPolarHBondContact O-CB 3.26Å; I96-I100 VanDerWaalsContact O-CG1 3.32Å; I96-I100 WeakPolarHBondContact O-CG1 3.31Å; I96-I100 PolarHBondContact O-N 3.16Å; M97-I100 PolarHBondContact O-N 2.87Å; I100-I104 HydrophobicContact CG2-CD1 4.31Å; I100-I104 WeakPolarHBondContact O-CB 3.29Å; I100-I104 WeakPolarHBondContact O-CG1 3.23Å; I100-I104 PolarHBondContact O-N 2.72Å; I100-F105 HydrophobicContact CG2-CD2 4.17Å; I100-F105 HydrophobicContact CG2-CE2 3.88Å; I100-A256 HydrophobicContact CG2-CB 4.38Å
101T96.2Very high94.6Very high0 Ų024.3 Ų24.30%013%0.125CC..Iπ-helixtrans-68.1-50.5-176.3-53.60000110.8M97 I99 E103 F105 V106 S260 Y269 L282M97-T101 HydrophobicContact CE-CG2 4.26Å; M97-T101 WeakPolarHBondContact CE-OG1 3.43Å; M97-T101 WeakPolarHBondContact O-CB 3.4Å; M97-T101 PolarHBondContact O-N 2.65Å; M97-T101 PolarHBondContact O-OG1 2.89Å; I99-T101 VanDerWaalsContact C-N 3.32Å; I99-T101 PolarHBondContact O-N 2.93Å; T101-E103 PolarHBondContact O-N 3.42Å; T101-F105 PolarHBondContact O-N 3.16Å; T101-F105 VanDerWaalsContact O-N 3.15Å; T101-V106 HydrophobicContact CG2-CG2 4.32Å; T101-V106 WeakPolarHBondContact O-CG2 3.43Å; T101-V106 PolarHBondContact O-N 3.38Å; T101-S260 PolarHBondContact OG1-OG 3.19Å; T101-Y269 HydrophobicContact CG2-CE1 4.2Å; T101-L282 HydrophobicContact CG2-CD1 3.68Å; T101-L282 HydrophobicContact CG2-CD2 4.2Å
102A95.4Very high94.2Very high0 Ų025.5 Ų25.50%013%0.128CC..Iπ-helixtrans-66.5-36.2-175.200000113.1S98 I99 P107 K279 L282 Y283S98-A102 WeakPolarHBondContact O-CB 3.49Å; S98-A102 PolarHBondContact O-N 2.85Å; I99-A102 PolarHBondContact O-N 3.28Å; A102-P107 WeakPolarHBondContact O-CD 3.47Å; A102-K279 HydrophobicContact CB-CB 4.28Å; A102-K279 HydrophobicContact CB-CG 4.19Å; A102-K279 WeakPolarHBondContact O-CE 3.48Å; A102-K279 WeakPolarHBondContact O-CG 3.2Å; A102-L282 HydrophobicContact CB-CB 4.38Å; A102-L282 HydrophobicContact CB-CD1 3.86Å; A102-Y283 HydrophobicContact CB-CE2 4.07Å
103E93.6Very high93.6Very high37 Ų3723.5 Ų23.517%0.17313%0.127CC..Iπ-helixtrans-95.8-23.2-174.6-55.4-53.3147.400113.6I99 T101 P107 K279 Y283I99-E103 HydrophobicContact CG2-CG 4.39Å; I99-E103 WeakPolarHBondContact O-CB 3.45Å; I99-E103 WeakPolarHBondContact O-CG 3.44Å; I99-E103 PolarHBondContact O-N 3.09Å; T101-E103 PolarHBondContact O-N 3.42Å; E103-P107 WeakPolarHBondContact O-CG 3.11Å; E103-K279 IonicContact OE1-NZ 3.18Å; E103-K279 IonicContact OE2-NZ 3.37Å; E103-K279 PolarHBondContact OE2-NZ 2.94Å; E103-Y283 PolarHBondContact OE1-OH 2.94Å
104I93.8Very high92.9Very high26 Ų2623.8 Ų23.813%0.13313%0.128CC..Iπ-helixtrans-107.9-56.1-176.2-52.3-179.9000111.3I100 F435 V557 L562I100-I104 HydrophobicContact CG2-CD1 4.31Å; I100-I104 WeakPolarHBondContact O-CB 3.29Å; I100-I104 WeakPolarHBondContact O-CG1 3.23Å; I100-I104 PolarHBondContact O-N 2.72Å; I104-F435 HydrophobicContact CD1-CZ 4.18Å; I104-F435 HydrophobicContact CG2-CE2 4.19Å; I104-F435 HydrophobicContact CG2-CZ 3.67Å; I104-V557 HydrophobicContact CG2-CG1 4.45Å; I104-V557 HydrophobicContact CG2-CG2 3.68Å; I104-L562 HydrophobicContact CD1-CD2 4.33Å; I104-L562 HydrophobicContact CG1-CD2 4.03Å
105F95.1Very high92.1Very high1 Ų124.4 Ų24.40%0.00413%0.132CC..Iπ-helixtrans-81.6-45.3-170.7-73.2-99.8000112.7I100 T101 L108 F109 S260 I261 L427 L431 M434I100-F105 HydrophobicContact CG2-CD2 4.17Å; I100-F105 HydrophobicContact CG2-CE2 3.88Å; T101-F105 PolarHBondContact O-N 3.16Å; T101-F105 VanDerWaalsContact O-N 3.15Å; F105-L108 PolarHBondContact O-N 3.34Å; F105-F109 HydrophobicContact CB-CE2 4.14Å; F105-F109 HydrophobicContact CD1-CE2 4.21Å; F105-F109 AromaticContact CD1-CZ 3.93Å; F105-F109 HydrophobicContact CD1-CZ 3.93Å; F105-F109 WeakPolarHBondContact O-CD2 3.36Å; F105-F109 WeakPolarHBondContact O-CG 3.35Å; F105-F109 PolarHBondContact O-N 3.06Å; F105-S260 WeakPolarHBondContact CD1-O 3.41Å; F105-S260 VanDerWaalsContact CD2-OG 3.26Å; F105-S260 WeakPolarHBondContact CD2-OG 3.36Å; F105-S260 VanDerWaalsContact CG-CB 3.48Å; F105-I261 HydrophobicContact CD1-CG2 4.18Å; F105-I261 HydrophobicContact CE1-CG2 3.65Å; F105-I261 HydrophobicContact CZ-CG2 4.5Å; F105-L427 HydrophobicContact CE1-CD1 4.44Å; F105-L427 HydrophobicContact CZ-CD1 3.84Å; F105-L431 HydrophobicContact CE2-CD2 4.35Å; F105-L431 HydrophobicContact CZ-CD2 3.95Å; F105-M434 HydrophobicContact CD1-CE 3.38Å; F105-M434 HydrophobicContact CD1-SD 3.94Å; F105-M434 HydrophobicContact CE1-CE 3.38Å; F105-M434 HydrophobicContact CE1-SD 3.68Å; F105-M434 HydrophobicContact CG-CE 4.35Å; F105-M434 HydrophobicContact CZ-CE 4.34Å; F105-M434 HydrophobicContact CZ-SD 4.06Å
106V94.1Very high91.6Very high0 Ų023 Ų230%012%0.12CC..Hα-helixtrans-59.2-49-177.9-179.90000112.2T101 L108 F109 Y110 Y269 L275 A278 L282T101-V106 HydrophobicContact CG2-CG2 4.32Å; T101-V106 WeakPolarHBondContact O-CG2 3.43Å; T101-V106 PolarHBondContact O-N 3.38Å; V106-L108 VanDerWaalsContact C-N 3.28Å; V106-L108 PolarHBondContact O-N 2.89Å; V106-F109 PolarHBondContact O-N 3.45Å; V106-Y110 HydrophobicContact CG1-CD2 3.57Å; V106-Y110 HydrophobicContact CG1-CE2 3.78Å; V106-Y110 WeakPolarHBondContact O-CB 3.26Å; V106-Y110 WeakPolarHBondContact O-CD2 3.39Å; V106-Y110 PolarHBondContact O-N 3.36Å; V106-Y269 HydrophobicContact CG1-CD2 4.4Å; V106-Y269 HydrophobicContact CG2-CD2 3.83Å; V106-Y269 HydrophobicContact CG2-CE2 3.68Å; V106-Y269 HydrophobicContact CG2-CG 4.41Å; V106-L275 HydrophobicContact CB-CD1 4.42Å; V106-L275 HydrophobicContact CG1-CD1 3.51Å; V106-A278 HydrophobicContact CG1-CB 3.77Å; V106-L282 HydrophobicContact CG2-CD1 3.47Å; V106-L282 VanDerWaalsContact CG2-CD1 3.47Å
107P92.5Very high91.3Very high8 Ų820 Ų205%0.05211%0.105CC..Hα-helixtrans-62.1-36.8-178.7-23.636.8000112.5A102 E103 R111 L275 D561A102-P107 WeakPolarHBondContact O-CD 3.47Å; E103-P107 WeakPolarHBondContact O-CG 3.11Å; P107-R111 WeakPolarHBondContact O-CB 3.46Å; P107-R111 PolarHBondContact O-N 3.32Å; P107-L275 HydrophobicContact CB-CD2 4.48Å; P107-L275 HydrophobicContact CG-CD1 4.37Å; P107-D561 HydrophobicContact CB-CB 4.34Å
108L91.9Very high91.2Very high0 Ų020.1 Ų20.10%011%0.106CC..Hα-helixtrans-64.2-50.8177-17868.5000111.1F105 V106 Y110 R111 L112 Y120 M434 D554F105-L108 PolarHBondContact O-N 3.34Å; V106-L108 VanDerWaalsContact C-N 3.28Å; V106-L108 PolarHBondContact O-N 2.89Å; L108-Y110 PolarHBondContact O-N 3.19Å; L108-R111 PolarHBondContact O-N 2.8Å; L108-L112 HydrophobicContact CD1-CD1 4.08Å; L108-L112 HydrophobicContact CG-CD1 4.04Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3Å; L108-Y120 HydrophobicContact CD2-CD2 4.34Å; L108-Y120 HydrophobicContact CD2-CE2 3.9Å; L108-M434 HydrophobicContact CD2-CE 3.4Å; L108-M434 VanDerWaalsContact CD2-CE 3.4Å; L108-M434 HydrophobicContact CD2-CG 3.66Å; L108-M434 HydrophobicContact CD2-SD 3.72Å; L108-D554 VanDerWaalsContact CD1-O 3.26Å; L108-D554 WeakPolarHBondContact CD1-O 3.5Å
109F92.3Very high90.9Very high2 Ų221.9 Ų21.91%0.00911%0.114CC..Hα-helixtrans-66.6-37.6-178.9-62.1-24.7000112.9F105 V106 R111 L112 G113 I114 T117 S260 V266 Y269 I270 Y430 M434F105-F109 HydrophobicContact CB-CE2 4.14Å; F105-F109 HydrophobicContact CD1-CE2 4.21Å; F105-F109 AromaticContact CD1-CZ 3.93Å; F105-F109 HydrophobicContact CD1-CZ 3.93Å; F105-F109 WeakPolarHBondContact O-CD2 3.36Å; F105-F109 WeakPolarHBondContact O-CG 3.35Å; F105-F109 PolarHBondContact O-N 3.06Å; V106-F109 PolarHBondContact O-N 3.45Å; F109-R111 VanDerWaalsContact C-N 3.32Å; F109-R111 PolarHBondContact O-N 3.28Å; F109-L112 PolarHBondContact O-N 3.21Å; F109-G113 PolarHBondContact O-N 3.08Å; F109-I114 HydrophobicContact CB-CD1 4.17Å; F109-I114 HydrophobicContact CB-CG1 4.21Å; F109-I114 HydrophobicContact CD1-CD1 3.4Å; F109-I114 HydrophobicContact CD1-CG1 4.34Å; F109-I114 HydrophobicContact CE1-CD1 3.92Å; F109-I114 HydrophobicContact CG-CD1 3.89Å; F109-I114 HydrophobicContact CG-CG1 4.45Å; F109-T117 HydrophobicContact CE2-CG2 4.08Å; F109-T117 HydrophobicContact CZ-CG2 4.16Å; F109-S260 VanDerWaalsContact CE2-O 3.23Å; F109-S260 WeakPolarHBondContact CE2-O 3.11Å; F109-V266 HydrophobicContact CD2-CG1 3.68Å; F109-V266 HydrophobicContact CE2-CG1 3.92Å; F109-V266 HydrophobicContact CE2-CG2 4.11Å; F109-Y269 HydrophobicContact CD2-CE2 4.41Å; F109-I270 HydrophobicContact CB-CG2 4.46Å; F109-Y430 HydrophobicContact CZ-CE1 4.42Å; F109-M434 HydrophobicContact CE1-CE 4Å; F109-M434 HydrophobicContact CZ-CE 4.17Å
110Y88.9Confident90.8Very high38 Ų3817.4 Ų17.415%0.1499%0.091CC..Hα-helixtrans-62.2-39.9173.8-97.3-96.7000112.3V106 L108 G113 Y269 I270 C272 L275 A278V106-Y110 HydrophobicContact CG1-CD2 3.57Å; V106-Y110 HydrophobicContact CG1-CE2 3.78Å; V106-Y110 WeakPolarHBondContact O-CB 3.26Å; V106-Y110 WeakPolarHBondContact O-CD2 3.39Å; V106-Y110 PolarHBondContact O-N 3.36Å; L108-Y110 PolarHBondContact O-N 3.19Å; Y110-G113 PolarHBondContact O-N 2.99Å; Y110-Y269 PolarHBondContact OH-O 3.34Å; Y110-I270 HydrophobicContact CD2-CG2 4.46Å; Y110-I270 HydrophobicContact CE2-CB 4.39Å; Y110-I270 HydrophobicContact CE2-CG2 4.19Å; Y110-C272 WeakPolarHBondContact OH-CB 3.37Å; Y110-C272 PolarHBondContact OH-O 2.99Å; Y110-L275 HydrophobicContact CD1-CB 4.37Å; Y110-L275 HydrophobicContact CD2-CD1 4.02Å; Y110-L275 HydrophobicContact CG-CD1 4.03Å; Y110-A278 HydrophobicContact CD2-CB 4.46Å; Y110-A278 HydrophobicContact CE2-CB 3.45Å; Y110-A278 VanDerWaalsContact CE2-CB 3.45Å; Y110-A278 WeakPolarHBondContact OH-CB 3.37Å
111R89.9Confident90.7Very high68 Ų6815 Ų1526%0.2578%0.078SC..Hα-helixtrans-66.5-40.5177.8-172.3-174.4-53.9152.93.8112.2P107 L108 F109 G113 D554 D561P107-R111 WeakPolarHBondContact O-CB 3.46Å; P107-R111 PolarHBondContact O-N 3.32Å; L108-R111 PolarHBondContact O-N 2.8Å; F109-R111 VanDerWaalsContact C-N 3.32Å; F109-R111 PolarHBondContact O-N 3.28Å; R111-G113 VanDerWaalsContact C-N 3.31Å; R111-D554 VanDerWaalsContact CD-OD1 3.32Å; R111-D554 WeakPolarHBondContact CD-OD1 3.37Å; R111-D561 IonicContact CZ-OD2 3.16Å; R111-D561 IonicContact NH1-OD2 3.74Å; R111-D561 IonicContact NH2-OD1 3.26Å; R111-D561 PolarHBondContact NH2-OD1 3.44Å; R111-D561 IonicContact NH2-OD2 2.66Å; R111-D561 PolarHBondContact NH2-OD2 2.85Å
112L87.7Confident90.6Very high37 Ų3718.1 Ų18.119%0.1949%0.093CC..Hα-helixtrans-78.9-16.2-178.6-63173.1000112.9L108 F109 I114 Y120 M123 D554 L555L108-L112 HydrophobicContact CD1-CD1 4.08Å; L108-L112 HydrophobicContact CG-CD1 4.04Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3Å; F109-L112 PolarHBondContact O-N 3.21Å; L112-I114 HydrophobicContact CB-CG2 3.82Å; L112-I114 PolarHBondContact O-N 3.06Å; L112-Y120 HydrophobicContact CD1-CD2 3.59Å; L112-Y120 HydrophobicContact CD1-CE2 4.24Å; L112-M123 HydrophobicContact CB-CE 4.23Å; L112-M123 HydrophobicContact CD1-CE 4.01Å; L112-M123 HydrophobicContact CD2-CE 4.37Å; L112-M123 HydrophobicContact CG-CE 4.45Å; L112-D554 HydrophobicContact CD2-CB 4.44Å; L112-L555 HydrophobicContact CD1-CD2 4.34Å; L112-L555 HydrophobicContact CD2-CD2 4.02Å
113G83.6Confident90.4Very high34 Ų3422.2 Ų22.235%0.35111%0.113SC..THydrogen-bonded Turntrans68.113.417700000114.7R52 F109 Y110 R111R52-G113 PolarHBondContact NH2-O 3.1Å; F109-G113 PolarHBondContact O-N 3.08Å; Y110-G113 PolarHBondContact O-N 2.99Å; R111-G113 VanDerWaalsContact C-N 3.31Å
114I82.4Confident90.4Very high5 Ų520.6 Ų20.63%0.02611%0.106CC..  trans-63.4150.2-172.261.1179.4000112.8F109 L112 E119 M123F109-I114 HydrophobicContact CB-CD1 4.17Å; F109-I114 HydrophobicContact CB-CG1 4.21Å; F109-I114 HydrophobicContact CD1-CD1 3.4Å; F109-I114 HydrophobicContact CD1-CG1 4.34Å; F109-I114 HydrophobicContact CE1-CD1 3.92Å; F109-I114 HydrophobicContact CG-CD1 3.89Å; F109-I114 HydrophobicContact CG-CG1 4.45Å; L112-I114 HydrophobicContact CB-CG2 3.82Å; L112-I114 PolarHBondContact O-N 3.06Å; I114-E119 WeakPolarHBondContact CA-OE2 3.24Å; I114-E119 HydrophobicContact CB-CB 4.26Å; I114-E119 WeakPolarHBondContact CB-OE2 3.47Å; I114-E119 HydrophobicContact CG2-CB 3.89Å; I114-M123 HydrophobicContact CG2-CE 3.47Å; I114-M123 VanDerWaalsContact CG2-CE 3.47Å
115T77.5Confident90.4Very high19 Ų1920.2 Ų20.212%0.11710%0.103CC..SBendtrans-99.3-47.5172.7-63.50000110.1L49 E119 Q263 E368L49-T115 HydrophobicContact CD1-CG2 4.22Å; L49-T115 HydrophobicContact CD2-CG2 4.26Å; L49-T115 HydrophobicContact CG-CG2 4.41Å; T115-E119 PolarHBondContact N-OE1 3.12Å; T115-E119 PolarHBondContact N-OE2 3.47Å; T115-Q263 PolarHBondContact O-NE2 3.39Å; T115-E368 HydrophobicContact CG2-CG 4.1Å
116S87.3Confident90.3Very high1 Ų122.9 Ų22.91%0.00712%0.118CC..SBendtrans-95131.8170.4174.90000110.7Y118 E119 D369S116-Y118 PolarHBondContact O-N 3.49Å; S116-Y118 VanDerWaalsContact O-N 3.17Å; S116-Y118 WeakPolarHBondContact OG-CD2 3.42Å; S116-Y118 PolarHBondContact OG-N 2.86Å; S116-E119 WeakPolarHBondContact CB-OE1 3.4Å; S116-E119 PolarHBondContact N-OE1 3.32Å; S116-E119 VanDerWaalsContact O-CB 3.3Å; S116-E119 WeakPolarHBondContact O-CB 3.43Å; S116-E119 PolarHBondContact O-N 3.36Å; S116-E119 VanDerWaalsContact O-N 3.1Å; S116-D369 WeakPolarHBondContact CB-OD1 3.4Å; S116-D369 PolarHBondContact OG-OD1 2.8Å; S116-D369 PolarHBondContact OG-OD2 2.92Å; S116-D369 VanDerWaalsContact OG-OD2 3.07Å
117T90.7Very high90.3Very high0 Ų028.1 Ų28.10%014%0.14CC..Hα-helixtrans-55.4-32.1171.8500000111.9F109 E119 Y120 Q263 V266 Y430F109-T117 HydrophobicContact CE2-CG2 4.08Å; F109-T117 HydrophobicContact CZ-CG2 4.16Å; T117-E119 VanDerWaalsContact C-N 3.26Å; T117-E119 PolarHBondContact O-N 3.26Å; T117-Y120 WeakPolarHBondContact O-CB 3.27Å; T117-Y120 PolarHBondContact O-N 3.47Å; T117-Y120 VanDerWaalsContact O-N 3.12Å; T117-Q263 PolarHBondContact OG1-OE1 3.33Å; T117-V266 HydrophobicContact CG2-CB 3.57Å; T117-V266 HydrophobicContact CG2-CG1 3.5Å; T117-V266 HydrophobicContact CG2-CG2 3.42Å; T117-V266 VanDerWaalsContact CG2-CG2 3.42Å; T117-Y430 VanDerWaalsContact CB-OH 3.28Å; T117-Y430 WeakPolarHBondContact CB-OH 3.48Å; T117-Y430 PolarHBondContact O-OH 3.38Å; T117-Y430 PolarHBondContact OG1-OH 2.91Å
118Y93.3Very high90.4Very high1 Ų132.1 Ų32.10%0.00416%0.161CC..Hα-helixtrans-72.9-15.7-177.9-52.9-72.8000113.4S116 Y120 L121 E122 R130 G133 T134 Y137 V365 Y430S116-Y118 PolarHBondContact O-N 3.49Å; S116-Y118 VanDerWaalsContact O-N 3.17Å; S116-Y118 WeakPolarHBondContact OG-CD2 3.42Å; S116-Y118 PolarHBondContact OG-N 2.86Å; Y118-Y120 PolarHBondContact O-N 3.24Å; Y118-L121 HydrophobicContact CD1-CD1 3.87Å; Y118-L121 WeakPolarHBondContact O-CB 3.49Å; Y118-L121 PolarHBondContact O-N 3.04Å; Y118-L121 VanDerWaalsContact O-N 3.08Å; Y118-E122 PolarHBondContact O-N 2.72Å; Y118-R130 WeakPolarHBondContact O-CG 3.19Å; Y118-G133 WeakPolarHBondContact CE1-O 3.2Å; Y118-T134 WeakPolarHBondContact CB-OG1 3.43Å; Y118-T134 HydrophobicContact CD2-CG2 4.3Å; Y118-T134 WeakPolarHBondContact CD2-OG1 3.32Å; Y118-Y137 HydrophobicContact CE2-CD1 4.07Å; Y118-Y137 AromaticContact CE2-CG 3.92Å; Y118-Y137 HydrophobicContact CE2-CG 3.92Å; Y118-Y137 AromaticContact CZ-CG 3.79Å; Y118-Y137 WeakPolarHBondContact OH-CB 3.41Å; Y118-Y137 WeakPolarHBondContact OH-CD2 3.35Å; Y118-V365 HydrophobicContact CD2-CG1 4.15Å; Y118-V365 HydrophobicContact CE2-CG1 4.03Å; Y118-Y430 WeakPolarHBondContact CD1-OH 3.23Å; Y118-Y430 PolarHBondContact N-OH 3.17Å
119E90.6Very high90.6Very high37 Ų3732.1 Ų32.117%0.17316%0.161CC..Hα-helixtrans-58.2-37.3167.9-71.8163.6-142.200111I114 T115 S116 T117 L121 E122 M123I114-E119 WeakPolarHBondContact CA-OE2 3.24Å; I114-E119 HydrophobicContact CB-CB 4.26Å; I114-E119 WeakPolarHBondContact CB-OE2 3.47Å; I114-E119 HydrophobicContact CG2-CB 3.89Å; T115-E119 PolarHBondContact N-OE1 3.12Å; T115-E119 PolarHBondContact N-OE2 3.47Å; S116-E119 WeakPolarHBondContact CB-OE1 3.4Å; S116-E119 PolarHBondContact N-OE1 3.32Å; S116-E119 VanDerWaalsContact O-CB 3.3Å; S116-E119 WeakPolarHBondContact O-CB 3.43Å; S116-E119 PolarHBondContact O-N 3.36Å; S116-E119 VanDerWaalsContact O-N 3.1Å; T117-E119 VanDerWaalsContact C-N 3.26Å; T117-E119 PolarHBondContact O-N 3.26Å; E119-L121 VanDerWaalsContact C-N 3.27Å; E119-L121 PolarHBondContact O-N 2.74Å; E119-E122 PolarHBondContact O-N 3.33Å; E119-M123 HydrophobicContact CB-CE 4.45Å; E119-M123 WeakPolarHBondContact O-CG 3.47Å; E119-M123 PolarHBondContact O-N 3.12Å
120Y94.1Very high90.7Very high0 Ų033.2 Ų33.20%017%0.165CC..Hα-helixtrans-57.1-42.6174.2171.9-102.7000111.9L108 L112 T117 Y118 E122 M123 R124 Y430 G433 M434 L555L108-Y120 HydrophobicContact CD2-CD2 4.34Å; L108-Y120 HydrophobicContact CD2-CE2 3.9Å; L112-Y120 HydrophobicContact CD1-CD2 3.59Å; L112-Y120 HydrophobicContact CD1-CE2 4.24Å; T117-Y120 WeakPolarHBondContact O-CB 3.27Å; T117-Y120 PolarHBondContact O-N 3.47Å; T117-Y120 VanDerWaalsContact O-N 3.12Å; Y118-Y120 PolarHBondContact O-N 3.24Å; Y120-E122 VanDerWaalsContact C-N 3.33Å; Y120-E122 PolarHBondContact O-N 3.06Å; Y120-M123 PolarHBondContact O-N 3.06Å; Y120-R124 HydrophobicContact CE1-CB 4.37Å; Y120-R124 HydrophobicContact CE2-CB 4.4Å; Y120-R124 VanDerWaalsContact O-CB 3.23Å; Y120-R124 WeakPolarHBondContact O-CB 3.26Å; Y120-R124 PolarHBondContact O-N 3.44Å; Y120-Y430 AromaticContact CD1-CD1 3.44Å; Y120-Y430 HydrophobicContact CD1-CD1 3.44Å; Y120-Y430 VanDerWaalsContact CD1-CD1 3.44Å; Y120-Y430 AromaticContact CD1-CE1 3.52Å; Y120-Y430 HydrophobicContact CD1-CE1 3.52Å; Y120-Y430 AromaticContact CE1-CD1 3.81Å; Y120-Y430 HydrophobicContact CE1-CD1 3.81Å; Y120-Y430 HydrophobicContact CE1-CE1 4.35Å; Y120-Y430 HydrophobicContact CG-CD1 4.48Å; Y120-Y430 HydrophobicContact CG-CE1 4.29Å; Y120-G433 PolarHBondContact OH-O 3.41Å; Y120-M434 HydrophobicContact CE1-CE 4.17Å; Y120-M434 HydrophobicContact CE1-CG 4.06Å; Y120-M434 VanDerWaalsContact OH-CA 3.28Å; Y120-M434 WeakPolarHBondContact OH-CA 3.31Å; Y120-M434 VanDerWaalsContact OH-CG 3.22Å; Y120-M434 WeakPolarHBondContact OH-CG 3.32Å; Y120-M434 PolarHBondContact OH-N 2.89Å; Y120-M434 VanDerWaalsContact OH-N 3.09Å; Y120-L555 HydrophobicContact CD2-CD2 4.32Å; Y120-L555 HydrophobicContact CE2-CD2 4.27Å; Y120-L555 WeakPolarHBondContact CE2-O 3.15Å; Y120-L555 PolarHBondContact OH-O 3.45Å; Y120-L555 VanDerWaalsContact OH-O 3.07Å
121L94.7Very high91Very high0 Ų033.6 Ų33.60%017%0.171CC..Hα-helixtrans-67-34.2-179.4-60.6-177.8000112.3Y118 E119 F125 N126 I129 L429 Y430Y118-L121 HydrophobicContact CD1-CD1 3.87Å; Y118-L121 WeakPolarHBondContact O-CB 3.49Å; Y118-L121 PolarHBondContact O-N 3.04Å; Y118-L121 VanDerWaalsContact O-N 3.08Å; E119-L121 VanDerWaalsContact C-N 3.27Å; E119-L121 PolarHBondContact O-N 2.74Å; L121-F125 WeakPolarHBondContact O-CA 3.16Å; L121-F125 WeakPolarHBondContact O-CB 3.34Å; L121-F125 PolarHBondContact O-N 2.83Å; L121-N126 PolarHBondContact O-N 3.36Å; L121-I129 HydrophobicContact CB-CG2 4.09Å; L121-I129 HydrophobicContact CD1-CG2 4.22Å; L121-L429 HydrophobicContact CD1-CD2 3.9Å; L121-L429 HydrophobicContact CD2-CD2 3.97Å; L121-L429 HydrophobicContact CD2-CG 4.02Å; L121-Y430 HydrophobicContact CD1-CE2 4.04Å; L121-Y430 HydrophobicContact CD2-CD1 4.05Å; L121-Y430 HydrophobicContact CD2-CD2 4.26Å; L121-Y430 HydrophobicContact CD2-CE1 3.92Å; L121-Y430 HydrophobicContact CD2-CE2 4.12Å; L121-Y430 HydrophobicContact CD2-CG 4.22Å; L121-Y430 HydrophobicContact CG-CE1 4.11Å; L121-Y430 HydrophobicContact CG-CE2 4.23Å
122E93.6Very high91.3Very high66 Ų6632.6 Ų32.631%0.30817%0.17SC..Hα-helixtrans-68.7-46.8173.4178167.3-160.300111.6Y118 E119 Y120 R124 N126 K127 R130Y118-E122 PolarHBondContact O-N 2.72Å; E119-E122 PolarHBondContact O-N 3.33Å; Y120-E122 VanDerWaalsContact C-N 3.33Å; Y120-E122 PolarHBondContact O-N 3.06Å; E122-R124 PolarHBondContact O-N 3.08Å; E122-N126 PolarHBondContact O-N 3.39Å; E122-K127 HydrophobicContact CG-CB 4.46Å; E122-R130 HydrophobicContact CB-CB 3.86Å; E122-R130 HydrophobicContact CB-CG 4.37Å; E122-R130 WeakPolarHBondContact OE2-CD 3.2Å; E122-R130 IonicContact OE2-CZ 2.91Å; E122-R130 IonicContact OE2-NE 3.22Å; E122-R130 IonicContact OE2-NH1 3.21Å; E122-R130 PolarHBondContact OE2-NH1 2.94Å
123M91.3Very high91.7Very high86 Ų8630.9 Ų30.942%0.42416%0.161SC..Hα-helixtrans-61.4-35.7177.5-67.6-174-73.500112L112 I114 E119 Y120 L555L112-M123 HydrophobicContact CB-CE 4.23Å; L112-M123 HydrophobicContact CD1-CE 4.01Å; L112-M123 HydrophobicContact CD2-CE 4.37Å; L112-M123 HydrophobicContact CG-CE 4.45Å; I114-M123 HydrophobicContact CG2-CE 3.47Å; I114-M123 VanDerWaalsContact CG2-CE 3.47Å; E119-M123 HydrophobicContact CB-CE 4.45Å; E119-M123 WeakPolarHBondContact O-CG 3.47Å; E119-M123 PolarHBondContact O-N 3.12Å; Y120-M123 PolarHBondContact O-N 3.06Å; M123-L555 HydrophobicContact CB-CD2 3.68Å; M123-L555 HydrophobicContact SD-CD2 4.46Å
124R93.2Very high92.2Very high4 Ų429.2 Ų29.22%0.01514%0.144CC..Hα-helixtrans-83.4-36.4-178179.656.7-173.584.2-4.4113.6Y120 E122 G433 W436 A439Y120-R124 HydrophobicContact CE1-CB 4.37Å; Y120-R124 HydrophobicContact CE2-CB 4.4Å; Y120-R124 VanDerWaalsContact O-CB 3.23Å; Y120-R124 WeakPolarHBondContact O-CB 3.26Å; Y120-R124 PolarHBondContact O-N 3.44Å; E122-R124 PolarHBondContact O-N 3.08Å; R124-G433 PolarHBondContact NE-O 2.82Å; R124-W436 PolarHBondContact NH2-O 2.95Å; R124-A439 VanDerWaalsContact CZ-O 3.26Å; R124-A439 PolarHBondContact NH1-O 2.89Å; R124-A439 PolarHBondContact NH2-O 3.38Å
125F93.1Very high92.9Very high18 Ų1831.8 Ų31.88%0.07916%0.16CC..THydrogen-bonded Turntrans-125.1-82.4-173-62-71.8000112.1L121 I129 L429 A439 S441L121-F125 WeakPolarHBondContact O-CA 3.16Å; L121-F125 WeakPolarHBondContact O-CB 3.34Å; L121-F125 PolarHBondContact O-N 2.83Å; F125-I129 HydrophobicContact CB-CB 4.4Å; F125-I129 HydrophobicContact CB-CD1 3.64Å; F125-I129 HydrophobicContact CB-CG1 4.42Å; F125-I129 HydrophobicContact CD1-CD1 4.43Å; F125-I129 HydrophobicContact CD2-CD1 4.24Å; F125-I129 HydrophobicContact CD2-CG2 4.42Å; F125-I129 HydrophobicContact CG-CD1 3.88Å; F125-L429 HydrophobicContact CD2-CD1 4.13Å; F125-L429 HydrophobicContact CE2-CD1 3.56Å; F125-L429 HydrophobicContact CE2-CG 4.18Å; F125-L429 HydrophobicContact CZ-CD1 3.96Å; F125-A439 HydrophobicContact CE1-CB 4.35Å; F125-S441 VanDerWaalsContact C-OG 3.25Å; F125-S441 WeakPolarHBondContact CA-OG 3Å; F125-S441 PolarHBondContact O-OG 3.4Å
126N93.6Very high93.8Very high57 Ų5731.6 Ų31.631%0.30516%0.158SC..  trans-169.5171176.761.128.8000111.1L121 E122 L128 I129 R130 S441L121-N126 PolarHBondContact O-N 3.36Å; E122-N126 PolarHBondContact O-N 3.39Å; N126-L128 VanDerWaalsContact C-N 3.28Å; N126-L128 PolarHBondContact O-N 3.41Å; N126-L128 WeakPolarHBondContact OD1-CB 3.38Å; N126-L128 PolarHBondContact OD1-N 3.39Å; N126-I129 PolarHBondContact O-N 2.86Å; N126-I129 WeakPolarHBondContact OD1-CG1 3.49Å; N126-I129 PolarHBondContact OD1-N 3.49Å; N126-R130 PolarHBondContact O-N 3.07Å; N126-S441 WeakPolarHBondContact ND2-CB 3.33Å
127K93.3Very high94.2Very high109 Ų10931.6 Ų31.647%0.47416%0.158SC..Hα-helixtrans-59.7-32.9178.4-170.2173.2-177.3178.70114E122 R130 V131E122-K127 HydrophobicContact CG-CB 4.46Å; K127-R130 PolarHBondContact O-N 2.89Å; K127-V131 WeakPolarHBondContact O-CG2 3.48Å; K127-V131 PolarHBondContact O-N 3.32Å
128L94.9Very high94.4Very high93 Ų9333 Ų3349%0.48717%0.165SC..Hα-helixtrans-62.9-45.3179.5177.562.4000111.2N126 R130 V131 I132 L445N126-L128 VanDerWaalsContact C-N 3.28Å; N126-L128 PolarHBondContact O-N 3.41Å; N126-L128 WeakPolarHBondContact OD1-CB 3.38Å; N126-L128 PolarHBondContact OD1-N 3.39Å; L128-R130 VanDerWaalsContact C-N 3.34Å; L128-V131 PolarHBondContact O-N 3.06Å; L128-I132 HydrophobicContact CD1-CD1 3.9Å; L128-I132 HydrophobicContact CD1-CG1 4.3Å; L128-I132 HydrophobicContact CG-CD1 3.95Å; L128-I132 WeakPolarHBondContact O-CG1 3.25Å; L128-I132 PolarHBondContact O-N 3.07Å; L128-L445 HydrophobicContact CD2-CD2 3.79Å
129I95.9Very high94.5Very high0 Ų037.3 Ų37.30%019%0.188CC..Hα-helixtrans-65.4-38.8177.7-68-171.1000111.2L121 F125 N126 I132 G133 L429 S441 L445L121-I129 HydrophobicContact CB-CG2 4.09Å; L121-I129 HydrophobicContact CD1-CG2 4.22Å; F125-I129 HydrophobicContact CB-CB 4.4Å; F125-I129 HydrophobicContact CB-CD1 3.64Å; F125-I129 HydrophobicContact CB-CG1 4.42Å; F125-I129 HydrophobicContact CD1-CD1 4.43Å; F125-I129 HydrophobicContact CD2-CD1 4.24Å; F125-I129 HydrophobicContact CD2-CG2 4.42Å; F125-I129 HydrophobicContact CG-CD1 3.88Å; N126-I129 PolarHBondContact O-N 2.86Å; N126-I129 WeakPolarHBondContact OD1-CG1 3.49Å; N126-I129 PolarHBondContact OD1-N 3.49Å; I129-I132 PolarHBondContact O-N 3.42Å; I129-G133 PolarHBondContact O-N 3.18Å; I129-L429 HydrophobicContact CG2-CD1 4.4Å; I129-L429 HydrophobicContact CG2-CD2 3.44Å; I129-L429 VanDerWaalsContact CG2-CD2 3.44Å; I129-L429 HydrophobicContact CG2-CG 4.42Å; I129-S441 WeakPolarHBondContact CD1-O 3.49Å; I129-L445 HydrophobicContact CD1-CB 4.02Å; I129-L445 HydrophobicContact CG1-CB 4.15Å; I129-L445 HydrophobicContact CG1-CD1 4.36Å
130R94.9Very high94.7Very high24 Ų2435.7 Ų35.79%0.09118%0.18CC..Hα-helixtrans-55.7-54.1172.1173.2175.9-175.4176.93.3110.8Y118 E122 N126 K127 L128 I132 G133 T134 E368 D369Y118-R130 WeakPolarHBondContact O-CG 3.19Å; E122-R130 HydrophobicContact CB-CB 3.86Å; E122-R130 HydrophobicContact CB-CG 4.37Å; E122-R130 WeakPolarHBondContact OE2-CD 3.2Å; E122-R130 IonicContact OE2-CZ 2.91Å; E122-R130 IonicContact OE2-NE 3.22Å; E122-R130 IonicContact OE2-NH1 3.21Å; E122-R130 PolarHBondContact OE2-NH1 2.94Å; N126-R130 PolarHBondContact O-N 3.07Å; K127-R130 PolarHBondContact O-N 2.89Å; L128-R130 VanDerWaalsContact C-N 3.34Å; R130-I132 PolarHBondContact O-N 3.29Å; R130-G133 PolarHBondContact O-N 3.49Å; R130-T134 PolarHBondContact O-N 2.91Å; R130-T134 PolarHBondContact O-OG1 3.4Å; R130-E368 PolarHBondContact NH2-O 3.47Å; R130-E368 VanDerWaalsContact NH2-O 3.1Å; R130-D369 IonicContact CZ-OD1 2.73Å; R130-D369 IonicContact NE-OD1 2.92Å; R130-D369 PolarHBondContact NE-OD1 3.01Å; R130-D369 IonicContact NH2-OD1 3.24Å; R130-D369 PolarHBondContact NH2-OD1 3.17Å
131V95Very high94.7Very high46 Ų4635.9 Ų35.928%0.27918%0.181SC..Hα-helixtrans-58.4-47.7-178.71690000111.9K127 L128 G133 T134 T135 F370K127-V131 WeakPolarHBondContact O-CG2 3.48Å; K127-V131 PolarHBondContact O-N 3.32Å; L128-V131 PolarHBondContact O-N 3.06Å; V131-G133 PolarHBondContact O-N 3.21Å; V131-T134 PolarHBondContact O-N 2.85Å; V131-T135 WeakPolarHBondContact O-CB 3.48Å; V131-T135 PolarHBondContact O-N 2.92Å; V131-T135 PolarHBondContact O-OG1 3.48Å; V131-T135 VanDerWaalsContact O-OG1 3.04Å; V131-F370 HydrophobicContact CG1-CE1 3.8Å; V131-F370 HydrophobicContact CG1-CZ 4.19Å; V131-F370 HydrophobicContact CG2-CE1 4.43Å
132I96.6Very high94.6Very high48 Ų4836 Ų3625%0.24618%0.182CC..Hα-helixtrans-62.8-45.1178.7-67.1170000110.6L128 I129 R130 T134 T135 M136 L445 L448L128-I132 HydrophobicContact CD1-CD1 3.9Å; L128-I132 HydrophobicContact CD1-CG1 4.3Å; L128-I132 HydrophobicContact CG-CD1 3.95Å; L128-I132 WeakPolarHBondContact O-CG1 3.25Å; L128-I132 PolarHBondContact O-N 3.07Å; I129-I132 PolarHBondContact O-N 3.42Å; R130-I132 PolarHBondContact O-N 3.29Å; I132-T134 PolarHBondContact O-N 3.48Å; I132-T135 PolarHBondContact O-N 3.41Å; I132-M136 HydrophobicContact CG2-CG 4.43Å; I132-M136 HydrophobicContact CG2-SD 4.07Å; I132-M136 VanDerWaalsContact O-CG 3.31Å; I132-M136 WeakPolarHBondContact O-CG 3.48Å; I132-M136 PolarHBondContact O-N 2.89Å; I132-L445 HydrophobicContact CD1-CD1 3.47Å; I132-L445 VanDerWaalsContact CD1-CD1 3.47Å; I132-L448 HydrophobicContact CG2-CD2 3.78Å
133G95.9Very high94.6Very high0 Ų034.8 Ų34.80%018%0.178CC..Hα-helixtrans-59.8-45.5178.200000112.5Y118 I129 R130 V131 M136 Y137Y118-G133 WeakPolarHBondContact CE1-O 3.2Å; I129-G133 PolarHBondContact O-N 3.18Å; R130-G133 PolarHBondContact O-N 3.49Å; V131-G133 PolarHBondContact O-N 3.21Å; G133-M136 PolarHBondContact O-N 3.39Å; G133-Y137 PolarHBondContact O-N 3.04Å; G133-Y137 VanDerWaalsContact O-N 3.07Å
134T95.5Very high94.7Very high0 Ų031.2 Ų31.20%016%0.16CC..Hα-helixtrans-64.3-43.4176.2-520000111.6Y118 R130 V131 I132 M136 Y137 I138 V365 D369 F370Y118-T134 WeakPolarHBondContact CB-OG1 3.43Å; Y118-T134 HydrophobicContact CD2-CG2 4.3Å; Y118-T134 WeakPolarHBondContact CD2-OG1 3.32Å; R130-T134 PolarHBondContact O-N 2.91Å; R130-T134 PolarHBondContact O-OG1 3.4Å; V131-T134 PolarHBondContact O-N 2.85Å; I132-T134 PolarHBondContact O-N 3.48Å; T134-M136 PolarHBondContact O-N 3.36Å; T134-Y137 WeakPolarHBondContact O-CB 3.49Å; T134-Y137 PolarHBondContact O-N 3.37Å; T134-I138 HydrophobicContact CG2-CD1 4.04Å; T134-I138 HydrophobicContact CG2-CG1 4.42Å; T134-I138 WeakPolarHBondContact O-CG1 3.49Å; T134-I138 PolarHBondContact O-N 2.85Å; T134-V365 HydrophobicContact CG2-CB 3.75Å; T134-V365 HydrophobicContact CG2-CG2 3.86Å; T134-D369 WeakPolarHBondContact CB-OD2 3.33Å; T134-D369 HydrophobicContact CG2-CB 3.95Å; T134-D369 WeakPolarHBondContact CG2-OD2 3.49Å; T134-D369 PolarHBondContact OG1-OD2 3.49Å; T134-F370 HydrophobicContact CG2-CD2 4.4Å; T134-F370 HydrophobicContact CG2-CE2 3.63Å; T134-F370 HydrophobicContact CG2-CZ 4.41Å
135T95.9Very high94.6Very high58 Ų5831 Ų3136%0.35616%0.159SC..Hα-helixtrans-62-43.2177.2-62.20000111.8V131 I132 Y137 I138 I139V131-T135 WeakPolarHBondContact O-CB 3.48Å; V131-T135 PolarHBondContact O-N 2.92Å; V131-T135 PolarHBondContact O-OG1 3.48Å; V131-T135 VanDerWaalsContact O-OG1 3.04Å; I132-T135 PolarHBondContact O-N 3.41Å; T135-Y137 VanDerWaalsContact C-N 3.3Å; T135-Y137 PolarHBondContact O-N 3.26Å; T135-I138 PolarHBondContact O-N 3.24Å; T135-I139 HydrophobicContact CG2-CD1 3.94Å; T135-I139 WeakPolarHBondContact O-CG1 3.48Å; T135-I139 PolarHBondContact O-N 3.21Å
136M96.1Very high94.5Very high16 Ų1630.2 Ų30.28%0.07916%0.155CC..Hα-helixtrans-58.2-43.7175.1-73.7176.266.300111.5I132 G133 T134 I139 Q140 I422 L426 L448 L452I132-M136 HydrophobicContact CG2-CG 4.43Å; I132-M136 HydrophobicContact CG2-SD 4.07Å; I132-M136 VanDerWaalsContact O-CG 3.31Å; I132-M136 WeakPolarHBondContact O-CG 3.48Å; I132-M136 PolarHBondContact O-N 2.89Å; G133-M136 PolarHBondContact O-N 3.39Å; T134-M136 PolarHBondContact O-N 3.36Å; M136-I139 PolarHBondContact O-N 3.42Å; M136-Q140 VanDerWaalsContact O-CB 3.31Å; M136-Q140 WeakPolarHBondContact O-CB 3.31Å; M136-Q140 PolarHBondContact O-N 2.85Å; M136-I422 HydrophobicContact CB-CG2 3.96Å; M136-I422 HydrophobicContact CE-CG2 3.82Å; M136-L426 HydrophobicContact CB-CD1 4.13Å; M136-L426 HydrophobicContact CB-CD2 4.49Å; M136-L426 HydrophobicContact CE-CD1 4.37Å; M136-L426 HydrophobicContact CE-CD2 4.18Å; M136-L426 HydrophobicContact CE-CG 3.9Å; M136-L426 HydrophobicContact SD-CD2 4.02Å; M136-L426 HydrophobicContact SD-CG 4.4Å; M136-L448 HydrophobicContact CE-CD1 4.07Å; M136-L448 HydrophobicContact SD-CD1 3.95Å; M136-L448 HydrophobicContact SD-CD2 3.95Å; M136-L448 HydrophobicContact SD-CG 4.09Å; M136-L452 HydrophobicContact CE-CB 4.38Å; M136-L452 HydrophobicContact CE-CD1 3.73Å; M136-L452 HydrophobicContact CE-CD2 3.8Å; M136-L452 HydrophobicContact CE-CG 4.18Å; M136-L452 HydrophobicContact CG-CD2 4.46Å; M136-L452 HydrophobicContact SD-CD2 4.08Å
137Y95.6Very high94.4Very high1 Ų127.7 Ų27.70%0.00414%0.142CC..Hα-helixtrans-64.2-42.5176.1170.2-97.5000113.4Y118 G133 T134 T135 I139 Q140 T141 Q263 A361 L362 V365Y118-Y137 HydrophobicContact CE2-CD1 4.07Å; Y118-Y137 AromaticContact CE2-CG 3.92Å; Y118-Y137 HydrophobicContact CE2-CG 3.92Å; Y118-Y137 AromaticContact CZ-CG 3.79Å; Y118-Y137 WeakPolarHBondContact OH-CB 3.41Å; Y118-Y137 WeakPolarHBondContact OH-CD2 3.35Å; G133-Y137 PolarHBondContact O-N 3.04Å; G133-Y137 VanDerWaalsContact O-N 3.07Å; T134-Y137 WeakPolarHBondContact O-CB 3.49Å; T134-Y137 PolarHBondContact O-N 3.37Å; T135-Y137 VanDerWaalsContact C-N 3.3Å; T135-Y137 PolarHBondContact O-N 3.26Å; Y137-I139 VanDerWaalsContact C-N 3.35Å; Y137-I139 PolarHBondContact O-N 2.91Å; Y137-Q140 PolarHBondContact O-N 3.5Å; Y137-T141 WeakPolarHBondContact CD2-OG1 3.12Å; Y137-T141 WeakPolarHBondContact CE2-OG1 3.04Å; Y137-T141 VanDerWaalsContact CZ-OG1 3.25Å; Y137-T141 WeakPolarHBondContact O-CB 3.41Å; Y137-T141 PolarHBondContact O-N 2.87Å; Y137-T141 PolarHBondContact O-OG1 3.06Å; Y137-Q263 HydrophobicContact CE1-CB 3.95Å; Y137-Q263 HydrophobicContact CE2-CB 3.99Å; Y137-A361 WeakPolarHBondContact OH-CB 3.23Å; Y137-L362 HydrophobicContact CE1-CD2 4.34Å; Y137-V365 HydrophobicContact CD1-CG1 4.16Å; Y137-V365 HydrophobicContact CD1-CG2 3.96Å; Y137-V365 HydrophobicContact CE1-CG1 3.98Å; Y137-V365 HydrophobicContact CE1-CG2 3.95Å
138I95.9Very high94.3Very high28 Ų2822.5 Ų22.514%0.14412%0.119CC..Hα-helixtrans-59.6-48.4177.4-72.2169.4000110.1T134 T135 T141 A142 L362 V365 F370 F394T134-I138 HydrophobicContact CG2-CD1 4.04Å; T134-I138 HydrophobicContact CG2-CG1 4.42Å; T134-I138 WeakPolarHBondContact O-CG1 3.49Å; T134-I138 PolarHBondContact O-N 2.85Å; T135-I138 PolarHBondContact O-N 3.24Å; I138-T141 PolarHBondContact O-N 3.45Å; I138-A142 VanDerWaalsContact O-CB 3.31Å; I138-A142 WeakPolarHBondContact O-CB 3.41Å; I138-A142 PolarHBondContact O-N 2.86Å; I138-L362 HydrophobicContact CB-CD2 4.03Å; I138-L362 HydrophobicContact CG1-CD2 3.87Å; I138-L362 HydrophobicContact CG2-CD2 4.03Å; I138-V365 HydrophobicContact CD1-CG2 4.22Å; I138-V365 HydrophobicContact CG1-CG2 3.96Å; I138-F370 HydrophobicContact CD1-CE2 3.92Å; I138-F394 HydrophobicContact CG2-CE1 3.93Å; I138-F394 HydrophobicContact CG2-CZ 4.45Å
139I95Very high94.1Very high93 Ų9318.1 Ų18.148%0.47710%0.096SC..Hα-helixtrans-62-49.8179.5-67.4168.3000110.6T135 M136 Y137 T141 A142 L143T135-I139 HydrophobicContact CG2-CD1 3.94Å; T135-I139 WeakPolarHBondContact O-CG1 3.48Å; T135-I139 PolarHBondContact O-N 3.21Å; M136-I139 PolarHBondContact O-N 3.42Å; Y137-I139 VanDerWaalsContact C-N 3.35Å; Y137-I139 PolarHBondContact O-N 2.91Å; I139-T141 PolarHBondContact O-N 3.29Å; I139-A142 PolarHBondContact O-N 3.07Å; I139-L143 HydrophobicContact CG2-CD1 3.95Å; I139-L143 WeakPolarHBondContact O-CG 3.36Å; I139-L143 PolarHBondContact O-N 2.97Å
140Q94.6Very high93.8Very high3 Ų319.2 Ų19.21%0.01410%0.101CC..Hα-helixtrans-57.9-48.2178.6175.7177.26100112.1M136 Y137 L143 Y144 I418 F419 I422 S423M136-Q140 VanDerWaalsContact O-CB 3.31Å; M136-Q140 WeakPolarHBondContact O-CB 3.31Å; M136-Q140 PolarHBondContact O-N 2.85Å; Y137-Q140 PolarHBondContact O-N 3.5Å; Q140-L143 PolarHBondContact O-N 2.65Å; Q140-Y144 WeakPolarHBondContact O-CB 3.41Å; Q140-Y144 PolarHBondContact O-N 2.67Å; Q140-I418 HydrophobicContact CG-CG2 4.07Å; Q140-I418 PolarHBondContact NE2-O 2.87Å; Q140-I418 VanDerWaalsContact NE2-O 3.11Å; Q140-F419 PolarHBondContact NE2-O 3.3Å; Q140-I422 HydrophobicContact CB-CB 4.2Å; Q140-I422 HydrophobicContact CB-CD1 3.86Å; Q140-I422 HydrophobicContact CB-CG2 3.96Å; Q140-I422 HydrophobicContact CG-CB 4.35Å; Q140-I422 HydrophobicContact CG-CD1 4.39Å; Q140-S423 VanDerWaalsContact NE2-N 3.2Å; Q140-S423 PolarHBondContact NE2-OG 3.3Å; Q140-S423 PolarHBondContact OE1-OG 3.45Å
141T93.9Very high93.5Very high3 Ų318.2 Ų18.22%0.01810%0.097CC..Hα-helixtrans-68.8-39-175.1-58.60000111.1Y137 I138 I139 Y144 T145 L362Y137-T141 WeakPolarHBondContact CD2-OG1 3.12Å; Y137-T141 WeakPolarHBondContact CE2-OG1 3.04Å; Y137-T141 VanDerWaalsContact CZ-OG1 3.25Å; Y137-T141 WeakPolarHBondContact O-CB 3.41Å; Y137-T141 PolarHBondContact O-N 2.87Å; Y137-T141 PolarHBondContact O-OG1 3.06Å; I138-T141 PolarHBondContact O-N 3.45Å; I139-T141 PolarHBondContact O-N 3.29Å; T141-Y144 PolarHBondContact O-N 3.46Å; T141-T145 VanDerWaalsContact O-CB 3.28Å; T141-T145 WeakPolarHBondContact O-CB 3.37Å; T141-T145 PolarHBondContact O-N 3.39Å; T141-T145 PolarHBondContact O-OG1 3.38Å; T141-L362 HydrophobicContact CG2-CD1 4.04Å; T141-L362 HydrophobicContact CG2-CD2 4.14Å; T141-L362 HydrophobicContact CG2-CG 3.9Å
142A93.7Very high93Very high4 Ų416.1 Ų16.13%0.0338%0.084CC..Hα-helixtrans-63-44.8174.500000112.1I138 I139 T145 G146 L397 M401I138-A142 VanDerWaalsContact O-CB 3.31Å; I138-A142 WeakPolarHBondContact O-CB 3.41Å; I138-A142 PolarHBondContact O-N 2.86Å; I139-A142 PolarHBondContact O-N 3.07Å; A142-T145 PolarHBondContact O-N 3.22Å; A142-G146 PolarHBondContact O-N 3.33Å; A142-L397 HydrophobicContact CB-CD2 3.99Å; A142-L397 HydrophobicContact CB-CG 4.41Å; A142-M401 HydrophobicContact CB-CG 4.27Å; A142-M401 WeakPolarHBondContact O-CB 3.44Å
143L93Very high92.6Very high39 Ų3913.8 Ų13.820%0.2047%0.073CC..Hα-helixtrans-58.9-50174-78.8164.9000111.5I139 Q140 T145 G146 M147 M401 I418I139-L143 HydrophobicContact CG2-CD1 3.95Å; I139-L143 WeakPolarHBondContact O-CG 3.36Å; I139-L143 PolarHBondContact O-N 2.97Å; Q140-L143 PolarHBondContact O-N 2.65Å; L143-T145 PolarHBondContact O-N 2.85Å; L143-G146 PolarHBondContact O-N 3.22Å; L143-M147 PolarHBondContact O-N 3.42Å; L143-M401 HydrophobicContact CD2-CE 3.15Å; L143-M401 HydrophobicContact CG-CE 3.75Å; L143-I418 HydrophobicContact CB-CD1 4.3Å; L143-I418 HydrophobicContact CB-CG2 4.35Å
144Y92.9Very high92.1Very high12 Ų1214.4 Ų14.45%0.0478%0.076CC..Hα-helixtrans-60-47.3178.9172.7-114.5000112.2I71 Q140 T141 G146 M147 V148 T354 A415 F419I71-Y144 HydrophobicContact CD1-CE2 4.06Å; Q140-Y144 WeakPolarHBondContact O-CB 3.41Å; Q140-Y144 PolarHBondContact O-N 2.67Å; T141-Y144 PolarHBondContact O-N 3.46Å; Y144-G146 VanDerWaalsContact C-N 3.27Å; Y144-G146 PolarHBondContact O-N 2.9Å; Y144-M147 HydrophobicContact CD2-CE 4.35Å; Y144-M147 WeakPolarHBondContact O-CB 3.45Å; Y144-M147 PolarHBondContact O-N 2.96Å; Y144-M147 VanDerWaalsContact O-N 3.14Å; Y144-V148 HydrophobicContact CD1-CG2 4.26Å; Y144-V148 HydrophobicContact CD2-CG2 4Å; Y144-V148 HydrophobicContact CE1-CG2 3.84Å; Y144-V148 HydrophobicContact CE2-CG2 3.53Å; Y144-V148 HydrophobicContact CG-CG2 4.34Å; Y144-V148 VanDerWaalsContact CZ-CG2 3.45Å; Y144-V148 VanDerWaalsContact O-CG2 3.28Å; Y144-V148 WeakPolarHBondContact O-CG2 3.49Å; Y144-V148 PolarHBondContact O-N 3.12Å; Y144-T354 HydrophobicContact CD1-CG2 4.43Å; Y144-T354 HydrophobicContact CE1-CG2 3.43Å; Y144-T354 VanDerWaalsContact CE1-CG2 3.43Å; Y144-A415 HydrophobicContact CD2-CB 4.16Å; Y144-A415 HydrophobicContact CE2-CB 4.23Å; Y144-F419 HydrophobicContact CD1-CE2 4.1Å; Y144-F419 AromaticContact CD1-CZ 3.81Å; Y144-F419 HydrophobicContact CD1-CZ 3.81Å; Y144-F419 HydrophobicContact CD2-CD2 4.37Å; Y144-F419 AromaticContact CD2-CE2 3.46Å; Y144-F419 HydrophobicContact CD2-CE2 3.46Å; Y144-F419 VanDerWaalsContact CD2-CE2 3.46Å; Y144-F419 HydrophobicContact CD2-CZ 4.01Å; Y144-F419 HydrophobicContact CE1-CE2 4.19Å; Y144-F419 HydrophobicContact CE1-CZ 4.02Å; Y144-F419 AromaticContact CE2-CE2 3.58Å; Y144-F419 HydrophobicContact CE2-CE2 3.58Å; Y144-F419 HydrophobicContact CE2-CZ 4.24Å; Y144-F419 AromaticContact CG-CE2 3.74Å; Y144-F419 HydrophobicContact CG-CE2 3.74Å; Y144-F419 AromaticContact CG-CZ 3.78Å; Y144-F419 HydrophobicContact CG-CZ 3.78Å; Y144-F419 AromaticContact CZ-CE2 3.94Å
145T91.8Very high91.6Very high0 Ų014.5 Ų14.50%08%0.077CC..Hα-helixtrans-64.5-34.7-179-58.30000111.5T141 A142 L143 V148 I149 V355 S358 C398T141-T145 VanDerWaalsContact O-CB 3.28Å; T141-T145 WeakPolarHBondContact O-CB 3.37Å; T141-T145 PolarHBondContact O-N 3.39Å; T141-T145 PolarHBondContact O-OG1 3.38Å; A142-T145 PolarHBondContact O-N 3.22Å; L143-T145 PolarHBondContact O-N 2.85Å; T145-V148 PolarHBondContact O-N 3.32Å; T145-I149 HydrophobicContact CG2-CD1 4.28Å; T145-I149 WeakPolarHBondContact O-CG1 3.35Å; T145-I149 PolarHBondContact O-N 3.45Å; T145-V355 HydrophobicContact CG2-CB 4.12Å; T145-V355 HydrophobicContact CG2-CG1 3.95Å; T145-V355 HydrophobicContact CG2-CG2 3.8Å; T145-S358 WeakPolarHBondContact OG1-CB 3.24Å; T145-S358 PolarHBondContact OG1-OG 2.79Å; T145-C398 HydrophobicContact CG2-CB 3.75Å; T145-C398 VanDerWaalsContact CG2-SG 3.57Å
146G91.6Very high91.1Very high0 Ų012.3 Ų12.30%06%0.063CC..Hα-helixtrans-58.9-47.4171.300000113.1A142 L143 Y144 V148 I149 Y150 C398 A402A142-G146 PolarHBondContact O-N 3.33Å; L143-G146 PolarHBondContact O-N 3.22Å; Y144-G146 VanDerWaalsContact C-N 3.27Å; Y144-G146 PolarHBondContact O-N 2.9Å; G146-V148 VanDerWaalsContact C-N 3.29Å; G146-V148 PolarHBondContact O-N 3.45Å; G146-I149 PolarHBondContact O-N 2.62Å; G146-Y150 WeakPolarHBondContact O-CB 3.39Å; G146-Y150 PolarHBondContact O-N 3.39Å; G146-C398 VanDerWaalsContact CA-O 3.29Å; G146-C398 WeakPolarHBondContact CA-O 3.34Å; G146-A402 VanDerWaalsContact O-CB 3.26Å; G146-A402 WeakPolarHBondContact O-CB 3.36Å
147M90.6Very high90.6Very high4 Ų413.2 Ų13.22%0.027%0.068CC..Hα-helixtrans-61.9-37.9174.8-71.2179.4-68.200112.4I71 L143 Y144 Y150 A151 A405 M408 I411 A414 A415 I418I71-M147 HydrophobicContact CD1-CB 4.03Å; L143-M147 PolarHBondContact O-N 3.42Å; Y144-M147 HydrophobicContact CD2-CE 4.35Å; Y144-M147 WeakPolarHBondContact O-CB 3.45Å; Y144-M147 PolarHBondContact O-N 2.96Å; Y144-M147 VanDerWaalsContact O-N 3.14Å; M147-Y150 PolarHBondContact O-N 3.25Å; M147-A151 PolarHBondContact O-N 3.36Å; M147-A405 HydrophobicContact CB-CB 4.17Å; M147-A405 HydrophobicContact CG-CB 3.55Å; M147-M408 HydrophobicContact CG-SD 4.34Å; M147-M408 HydrophobicContact SD-CE 4.49Å; M147-M408 HydrophobicContact SD-SD 3.86Å; M147-I411 HydrophobicContact CB-CG2 4.1Å; M147-A414 HydrophobicContact SD-CB 3.84Å; M147-A415 HydrophobicContact CE-CB 3.94Å; M147-A415 HydrophobicContact SD-CB 4.17Å; M147-I418 HydrophobicContact CE-CB 4.41Å; M147-I418 HydrophobicContact CE-CD1 3.34Å; M147-I418 HydrophobicContact CE-CG1 4.41Å; M147-I418 HydrophobicContact SD-CD1 3.85Å
148V91.3Very high90Very high0 Ų015.4 Ų15.40%08%0.078CC..Hα-helixtrans-66.7-37.2179175.30000111.4I71 Y144 T145 G146 P152 T351 T354 V355I71-V148 HydrophobicContact CD1-CB 4.31Å; I71-V148 HydrophobicContact CD1-CG2 3.49Å; I71-V148 VanDerWaalsContact CD1-CG2 3.49Å; I71-V148 HydrophobicContact CG1-CG2 4.1Å; Y144-V148 HydrophobicContact CD1-CG2 4.26Å; Y144-V148 HydrophobicContact CD2-CG2 4Å; Y144-V148 HydrophobicContact CE1-CG2 3.84Å; Y144-V148 HydrophobicContact CE2-CG2 3.53Å; Y144-V148 HydrophobicContact CG-CG2 4.34Å; Y144-V148 VanDerWaalsContact CZ-CG2 3.45Å; Y144-V148 VanDerWaalsContact O-CG2 3.28Å; Y144-V148 WeakPolarHBondContact O-CG2 3.49Å; Y144-V148 PolarHBondContact O-N 3.12Å; T145-V148 PolarHBondContact O-N 3.32Å; G146-V148 VanDerWaalsContact C-N 3.29Å; G146-V148 PolarHBondContact O-N 3.45Å; V148-P152 WeakPolarHBondContact O-CD 3.34Å; V148-T351 HydrophobicContact CG1-CG2 3.84Å; V148-T351 WeakPolarHBondContact O-CG2 3.01Å; V148-T351 PolarHBondContact O-OG1 3.1Å; V148-T354 HydrophobicContact CB-CG2 4.34Å; V148-T354 HydrophobicContact CG1-CG2 3.84Å; V148-T354 HydrophobicContact CG2-CG2 3.87Å; V148-V355 HydrophobicContact CG1-CG2 4.25Å
149I90.4Very high89.3Confident2 Ų214.5 Ų14.51%0.017%0.074CC..Hα-helixtrans-67.9-38.1173.1-66.1167.3000111T145 G146 P152 L168 T171 V355 C398T145-I149 HydrophobicContact CG2-CD1 4.28Å; T145-I149 WeakPolarHBondContact O-CG1 3.35Å; T145-I149 PolarHBondContact O-N 3.45Å; G146-I149 PolarHBondContact O-N 2.62Å; I149-P152 WeakPolarHBondContact O-CD 3.49Å; I149-L168 HydrophobicContact CG2-CD2 4.23Å; I149-L168 HydrophobicContact CG2-CG 4.18Å; I149-T171 HydrophobicContact CG2-CG2 4.28Å; I149-V355 HydrophobicContact CD1-CG1 4.48Å; I149-V355 HydrophobicContact CD1-CG2 4.21Å; I149-V355 HydrophobicContact CG1-CG2 3.6Å; I149-C398 HydrophobicContact CD1-CB 3.94Å
150Y89.3Confident88.8Confident23 Ų2311.3 Ų11.39%0.096%0.058CC..Hα-helixtrans-67.1-43.6-177.3-179.6-108.4000113.5G146 M147 A153 L154 L164 L168 A405 S406 I411G146-Y150 WeakPolarHBondContact O-CB 3.39Å; G146-Y150 PolarHBondContact O-N 3.39Å; M147-Y150 PolarHBondContact O-N 3.25Å; Y150-A153 WeakPolarHBondContact O-CB 3.28Å; Y150-A153 PolarHBondContact O-N 3.17Å; Y150-A153 VanDerWaalsContact O-N 3.16Å; Y150-L154 HydrophobicContact CE1-CB 4.5Å; Y150-L154 HydrophobicContact CE1-CD2 4.15Å; Y150-L154 PolarHBondContact O-N 2.75Å; Y150-L164 HydrophobicContact CE2-CD1 4.43Å; Y150-L164 HydrophobicContact CE2-CD2 3.9Å; Y150-L168 HydrophobicContact CD2-CD1 4.3Å; Y150-A405 HydrophobicContact CD1-CB 4.18Å; Y150-A405 HydrophobicContact CG-CB 4.07Å; Y150-S406 VanDerWaalsContact CZ-CA 3.5Å; Y150-I411 HydrophobicContact CD1-CD1 3.58Å; Y150-I411 HydrophobicContact CD1-CG1 4.1Å; Y150-I411 HydrophobicContact CE1-CD1 3.71Å; Y150-I411 HydrophobicContact CE1-CG1 4.2Å
151A87.9Confident88.1Confident3 Ų314.3 Ų14.33%0.0259%0.09CC..Hα-helixtrans-54.5-54.7-174.300000115.2I71 I74 M147 A153 L154 A155 I411I71-A151 HydrophobicContact CG1-CB 3.93Å; I74-A151 HydrophobicContact CD1-CB 4.47Å; I74-A151 WeakPolarHBondContact CD1-O 3.22Å; M147-A151 PolarHBondContact O-N 3.36Å; A151-A153 VanDerWaalsContact C-N 3.31Å; A151-A153 PolarHBondContact O-N 3.09Å; A151-L154 WeakPolarHBondContact O-CB 3.25Å; A151-L154 PolarHBondContact O-N 3.09Å; A151-A155 PolarHBondContact O-N 3.18Å; A151-I411 HydrophobicContact CB-CD1 4.07Å; A151-I411 HydrophobicContact CB-CG2 4.33Å
152P85.9Confident87.7Confident1 Ų118 Ų181%0.00611%0.109CC..Hα-helixtrans-73.4-24.1178.735.7-42.1000112.6V148 I149 L154 A155 L156 A347 Y348 T351V148-P152 WeakPolarHBondContact O-CD 3.34Å; I149-P152 WeakPolarHBondContact O-CD 3.49Å; P152-L154 VanDerWaalsContact C-N 3.35Å; P152-A155 PolarHBondContact O-N 2.81Å; P152-L156 WeakPolarHBondContact O-CB 3.3Å; P152-L156 PolarHBondContact O-N 3.29Å; P152-A347 HydrophobicContact CB-CB 4.25Å; P152-Y348 HydrophobicContact CB-CD2 3.7Å; P152-Y348 HydrophobicContact CB-CE2 3.67Å; P152-Y348 HydrophobicContact CB-CG 4.29Å; P152-Y348 HydrophobicContact CG-CE2 4.37Å; P152-T351 HydrophobicContact CG-CG2 3.83Å; P152-T351 VanDerWaalsContact CG-OG1 3.28Å; P152-T351 WeakPolarHBondContact CG-OG1 3.43Å
153A88.1Confident87.4Confident0 Ų022.2 Ų22.20%013%0.131CC..Hα-helixtrans-65.9-41173.700000110.7Y150 A151 L156 N157 L164 V167 L168Y150-A153 WeakPolarHBondContact O-CB 3.28Å; Y150-A153 PolarHBondContact O-N 3.17Å; Y150-A153 VanDerWaalsContact O-N 3.16Å; A151-A153 VanDerWaalsContact C-N 3.31Å; A151-A153 PolarHBondContact O-N 3.09Å; A153-L156 PolarHBondContact O-N 3.23Å; A153-N157 VanDerWaalsContact O-CB 3.31Å; A153-N157 WeakPolarHBondContact O-CB 3.09Å; A153-N157 PolarHBondContact O-N 3.15Å; A153-L164 HydrophobicContact CB-CD1 4.17Å; A153-V167 HydrophobicContact CB-CG1 3.74Å; A153-L168 HydrophobicContact CB-CB 4.48Å
154L84.9Confident86.9Confident12 Ų1221.7 Ų21.76%0.06313%0.128CC..Hα-helixtrans-62-42.8172.4-175.466.2000111.6Y150 A151 P152 N157 Q158 D322 Q323 I411Y150-L154 HydrophobicContact CE1-CB 4.5Å; Y150-L154 HydrophobicContact CE1-CD2 4.15Å; Y150-L154 PolarHBondContact O-N 2.75Å; A151-L154 WeakPolarHBondContact O-CB 3.25Å; A151-L154 PolarHBondContact O-N 3.09Å; P152-L154 VanDerWaalsContact C-N 3.35Å; L154-N157 PolarHBondContact O-N 2.9Å; L154-Q158 PolarHBondContact O-N 2.72Å; L154-D322 HydrophobicContact CD2-CB 4.18Å; L154-Q323 HydrophobicContact CD1-CG 4.31Å; L154-Q323 HydrophobicContact CD2-CG 4.16Å; L154-Q323 HydrophobicContact CG-CG 3.94Å; L154-I411 HydrophobicContact CD2-CD1 4.09Å
155A84.9Confident86.5Confident2 Ų226.9 Ų26.92%0.01715%0.148CC..Hα-helixtrans-62.6-44.6175.300000112.7I74 A151 P152 Q158 I159 P326I74-A155 HydrophobicContact CD1-CB 3.62Å; I74-A155 HydrophobicContact CG1-CB 4.47Å; A151-A155 PolarHBondContact O-N 3.18Å; P152-A155 PolarHBondContact O-N 2.81Å; A155-Q158 PolarHBondContact O-N 3.37Å; A155-I159 WeakPolarHBondContact O-CG1 3.46Å; A155-I159 PolarHBondContact O-N 3.49Å; A155-P326 HydrophobicContact CB-CB 4.04Å; A155-P326 HydrophobicContact CB-CG 3.37Å
156L85.6Confident86.2Confident12 Ų1228.8 Ų28.86%0.06317%0.168CC..Hα-helixtrans-66.7-40.4178.7-174.965.9000111.4F12 F20 P152 A153 Q158 I159 T160 V167 V344 Y348F12-L156 HydrophobicContact CD1-CD1 4.19Å; F12-L156 HydrophobicContact CE1-CD1 3.49Å; F12-L156 VanDerWaalsContact CE1-CD1 3.49Å; F12-L156 HydrophobicContact CZ-CD1 4.42Å; F20-L156 HydrophobicContact CE1-CD2 4.5Å; P152-L156 WeakPolarHBondContact O-CB 3.3Å; P152-L156 PolarHBondContact O-N 3.29Å; A153-L156 PolarHBondContact O-N 3.23Å; L156-Q158 VanDerWaalsContact C-N 3.34Å; L156-Q158 PolarHBondContact O-N 2.83Å; L156-I159 HydrophobicContact CD1-CD1 4.27Å; L156-I159 HydrophobicContact CD1-CG1 4.43Å; L156-I159 WeakPolarHBondContact O-CG1 3.23Å; L156-I159 PolarHBondContact O-N 2.97Å; L156-T160 HydrophobicContact CD1-CG2 3.6Å; L156-T160 HydrophobicContact CG-CG2 4.16Å; L156-T160 WeakPolarHBondContact O-CB 3.16Å; L156-T160 WeakPolarHBondContact O-CG2 3.36Å; L156-T160 PolarHBondContact O-N 2.91Å; L156-T160 PolarHBondContact O-OG1 3.45Å; L156-V167 HydrophobicContact CB-CG1 4.24Å; L156-V167 HydrophobicContact CD2-CG1 3.69Å; L156-V167 HydrophobicContact CD2-CG2 4.08Å; L156-V167 HydrophobicContact CG-CG1 4.37Å; L156-V344 HydrophobicContact CD1-CG1 3.97Å; L156-Y348 HydrophobicContact CB-CE2 4.15Å; L156-Y348 HydrophobicContact CD2-CE2 4.25Å
157N86.3Confident85.9Confident35 Ų3529.2 Ų29.219%0.18717%0.17CC..Hα-helixtrans-56.8-46.1173.5165.3-103.1000111.3A153 L154 I159 G161 L162 L164A153-N157 VanDerWaalsContact O-CB 3.31Å; A153-N157 WeakPolarHBondContact O-CB 3.09Å; A153-N157 PolarHBondContact O-N 3.15Å; L154-N157 PolarHBondContact O-N 2.9Å; N157-I159 VanDerWaalsContact C-N 3.32Å; N157-I159 PolarHBondContact O-N 2.98Å; N157-G161 WeakPolarHBondContact O-CA 3Å; N157-G161 PolarHBondContact O-N 3.4Å; N157-L162 PolarHBondContact ND2-O 3.08Å; N157-L164 HydrophobicContact CB-CD1 4.02Å
158Q81.9Confident85.6Confident48 Ų4829.2 Ų29.222%0.22417%0.17CC..Hα-helixtrans-60.3-37.7-178.9-177.761.819.400113.7L154 A155 L156 Q323L154-Q158 PolarHBondContact O-N 2.72Å; A155-Q158 PolarHBondContact O-N 3.37Å; L156-Q158 VanDerWaalsContact C-N 3.34Å; L156-Q158 PolarHBondContact O-N 2.83Å; Q158-Q323 HydrophobicContact CB-CG 4.23Å; Q158-Q323 HydrophobicContact CG-CB 4.12Å; Q158-Q323 HydrophobicContact CG-CG 4.31Å; Q158-Q323 VanDerWaalsContact OE1-CD 3.31Å
159I82.4Confident85.3Confident9 Ų932.9 Ų32.95%0.04619%0.192CC..Hα-helixtrans-96.2-18.5-172.766.5-173.3000113.8F12 A155 L156 N157 P326 M330 V344F12-I159 HydrophobicContact CD1-CD1 4.37Å; F12-I159 HydrophobicContact CD1-CG1 4.42Å; F12-I159 HydrophobicContact CE1-CD1 3.78Å; F12-I159 HydrophobicContact CE1-CG1 4.26Å; F12-I159 HydrophobicContact CE2-CD1 3.95Å; F12-I159 HydrophobicContact CZ-CD1 3.6Å; F12-I159 HydrophobicContact CZ-CG1 4.45Å; F12-I159 PolarHBondContact N-O 3.14Å; A155-I159 WeakPolarHBondContact O-CG1 3.46Å; A155-I159 PolarHBondContact O-N 3.49Å; L156-I159 HydrophobicContact CD1-CD1 4.27Å; L156-I159 HydrophobicContact CD1-CG1 4.43Å; L156-I159 WeakPolarHBondContact O-CG1 3.23Å; L156-I159 PolarHBondContact O-N 2.97Å; N157-I159 VanDerWaalsContact C-N 3.32Å; N157-I159 PolarHBondContact O-N 2.98Å; I159-P326 HydrophobicContact CG2-CB 3.85Å; I159-M330 HydrophobicContact CB-CG 3.75Å; I159-M330 HydrophobicContact CB-SD 4.16Å; I159-M330 HydrophobicContact CG2-CG 3.45Å; I159-M330 VanDerWaalsContact CG2-CG 3.45Å; I159-M330 HydrophobicContact CG2-SD 4.29Å; I159-V344 HydrophobicContact CD1-CB 4.4Å; I159-V344 HydrophobicContact CD1-CG1 4.44Å; I159-V344 HydrophobicContact CD1-CG2 3.19Å
160T84.1Confident84.9Confident26 Ų2635.4 Ų35.416%0.1621%0.214CC..Hα-helixtrans-107.3-25.2178.960.60000113.9F12 Y17 L156 L162F12-T160 HydrophobicContact CB-CG2 4.27Å; F12-T160 HydrophobicContact CD1-CG2 3.22Å; F12-T160 HydrophobicContact CE1-CG2 3.86Å; F12-T160 HydrophobicContact CG-CG2 4.05Å; Y17-T160 HydrophobicContact CE1-CG2 4.33Å; Y17-T160 WeakPolarHBondContact OH-CG2 3.49Å; L156-T160 HydrophobicContact CD1-CG2 3.6Å; L156-T160 HydrophobicContact CG-CG2 4.16Å; L156-T160 WeakPolarHBondContact O-CB 3.16Å; L156-T160 WeakPolarHBondContact O-CG2 3.36Å; L156-T160 PolarHBondContact O-N 2.91Å; L156-T160 PolarHBondContact O-OG1 3.45Å; T160-L162 HydrophobicContact CG2-CD1 4.34Å; T160-L162 PolarHBondContact O-N 3.33Å; T160-L162 WeakPolarHBondContact OG1-CB 3.41Å; T160-L162 VanDerWaalsContact OG1-CG 3.29Å; T160-L162 WeakPolarHBondContact OG1-CG 3.39Å; T160-L162 PolarHBondContact OG1-N 3.36Å; T160-L162 VanDerWaalsContact OG1-N 3.13Å
161G80.3Confident84.4Confident65 Ų6534.7 Ų34.767%0.6721%0.212SC*.  trans70.410-167.600000114.2N157N157-G161 WeakPolarHBondContact O-CA 3Å; N157-G161 PolarHBondContact O-N 3.4Å
162L84.7Confident84Confident82 Ų8234.6 Ų34.643%0.42921%0.211SC..  trans-66.7147.6176.3-70.8173000111.3N157 T160 L164 V167N157-L162 PolarHBondContact ND2-O 3.08Å; T160-L162 HydrophobicContact CG2-CD1 4.34Å; T160-L162 PolarHBondContact O-N 3.33Å; T160-L162 WeakPolarHBondContact OG1-CB 3.41Å; T160-L162 VanDerWaalsContact OG1-CG 3.29Å; T160-L162 WeakPolarHBondContact OG1-CG 3.39Å; T160-L162 PolarHBondContact OG1-N 3.36Å; T160-L162 VanDerWaalsContact OG1-N 3.13Å; L162-L164 PolarHBondContact O-N 3.04Å; L162-V167 HydrophobicContact CB-CG2 3.71Å; L162-V167 HydrophobicContact CD1-CG2 4.16Å
163D86.9Confident83.7Confident91 Ų9137.6 Ų37.649%0.48723%0.229SC..  trans-56127.8175.2176.867.9000111.7W165 G166 V167D163-W165 VanDerWaalsContact C-N 3.32Å; D163-W165 PolarHBondContact O-N 3.37Å; D163-W165 WeakPolarHBondContact OD2-CB 3.04Å; D163-W165 PolarHBondContact OD2-N 3.47Å; D163-G166 PolarHBondContact O-N 2.8Å; D163-G166 PolarHBondContact OD2-N 3.43Å; D163-V167 WeakPolarHBondContact O-CG2 3.25Å; D163-V167 PolarHBondContact O-N 3.45Å
164L83Confident83.2Confident28 Ų2840.5 Ų40.515%0.14725%0.247CC..Hα-helixtrans-61-40.3-174.4-178.861.9000111.8Y150 A153 N157 L162 V167 L168Y150-L164 HydrophobicContact CE2-CD1 4.43Å; Y150-L164 HydrophobicContact CE2-CD2 3.9Å; A153-L164 HydrophobicContact CB-CD1 4.17Å; N157-L164 HydrophobicContact CB-CD1 4.02Å; L162-L164 PolarHBondContact O-N 3.04Å; L164-V167 PolarHBondContact O-N 3.36Å; L164-L168 VanDerWaalsContact O-CB 3.23Å; L164-L168 WeakPolarHBondContact O-CB 3.24Å; L164-L168 PolarHBondContact O-N 3.49Å
165W85.4Confident82.8Confident121 Ų12140 Ų4046%0.45824%0.244SC..Hα-helixtrans-69.1-41.1179.5-66.4103.7000111.7D163 V167 L168 V169 A403D163-W165 VanDerWaalsContact C-N 3.32Å; D163-W165 PolarHBondContact O-N 3.37Å; D163-W165 WeakPolarHBondContact OD2-CB 3.04Å; D163-W165 PolarHBondContact OD2-N 3.47Å; W165-V167 PolarHBondContact O-N 2.84Å; W165-L168 HydrophobicContact CE3-CD1 4.5Å; W165-L168 PolarHBondContact O-N 3Å; W165-V169 WeakPolarHBondContact O-CG2 3.47Å; W165-V169 PolarHBondContact O-N 2.92Å; W165-A403 HydrophobicContact CH2-CB 3.52Å; W165-A403 HydrophobicContact CZ3-CB 3.82Å
166G84.9Confident82.5Confident41 Ų4140.7 Ų40.742%0.42325%0.248SC..Hα-helixtrans-57.5-47.2172.600000112.3D163 A170D163-G166 PolarHBondContact O-N 2.8Å; D163-G166 PolarHBondContact OD2-N 3.43Å; G166-A170 WeakPolarHBondContact O-CB 3.27Å; G166-A170 PolarHBondContact O-N 3.41Å
167V84.6Confident82Confident9 Ų944.5 Ų44.56%0.05527%0.267CS..Hα-helixtrans-63-43.3176.7170.70000111.6A153 L156 L162 D163 L164 W165 A170 T171 Y348A153-V167 HydrophobicContact CB-CG1 3.74Å; L156-V167 HydrophobicContact CB-CG1 4.24Å; L156-V167 HydrophobicContact CD2-CG1 3.69Å; L156-V167 HydrophobicContact CD2-CG2 4.08Å; L156-V167 HydrophobicContact CG-CG1 4.37Å; L162-V167 HydrophobicContact CB-CG2 3.71Å; L162-V167 HydrophobicContact CD1-CG2 4.16Å; D163-V167 WeakPolarHBondContact O-CG2 3.25Å; D163-V167 PolarHBondContact O-N 3.45Å; L164-V167 PolarHBondContact O-N 3.36Å; W165-V167 PolarHBondContact O-N 2.84Å; V167-A170 PolarHBondContact O-N 3.48Å; V167-T171 WeakPolarHBondContact O-CB 3.33Å; V167-T171 PolarHBondContact O-N 2.82Å; V167-T171 PolarHBondContact O-OG1 3.46Å; V167-Y348 WeakPolarHBondContact CG1-OH 3.39Å
168L84.3Confident81.2Confident3 Ų343.6 Ų43.62%0.01626%0.261CS..Hα-helixtrans-64.5-46.6-178.2-165.3163.3000111.1I149 Y150 A153 L164 W165 T171 G172 I399 A402I149-L168 HydrophobicContact CG2-CD2 4.23Å; I149-L168 HydrophobicContact CG2-CG 4.18Å; Y150-L168 HydrophobicContact CD2-CD1 4.3Å; A153-L168 HydrophobicContact CB-CB 4.48Å; L164-L168 VanDerWaalsContact O-CB 3.23Å; L164-L168 WeakPolarHBondContact O-CB 3.24Å; L164-L168 PolarHBondContact O-N 3.49Å; W165-L168 HydrophobicContact CE3-CD1 4.5Å; W165-L168 PolarHBondContact O-N 3Å; L168-T171 PolarHBondContact O-N 3.41Å; L168-G172 PolarHBondContact O-N 2.82Å; L168-I399 HydrophobicContact CD2-CB 4.43Å; L168-I399 HydrophobicContact CD2-CG2 3.67Å; L168-A402 HydrophobicContact CD1-CB 3.71Å; L168-A402 HydrophobicContact CD2-CB 3.91Å; L168-A402 HydrophobicContact CG-CB 4.08Å
169V84.8Confident80.6Confident77 Ų7741.7 Ų41.747%0.46725%0.253SS..Hα-helixtrans-62.7-45.8175.7172.40000110.9W165 T171 G172 V173W165-V169 WeakPolarHBondContact O-CG2 3.47Å; W165-V169 PolarHBondContact O-N 2.92Å; V169-T171 VanDerWaalsContact C-N 3.35Å; V169-T171 PolarHBondContact O-N 2.87Å; V169-G172 PolarHBondContact O-N 3.01Å; V169-V173 HydrophobicContact CG1-CG2 4.38Å; V169-V173 WeakPolarHBondContact O-CG2 3.34Å; V169-V173 PolarHBondContact O-N 3.03Å
170A82.2Confident79.9Confident55 Ų5542.3 Ų42.346%0.45526%0.257SS..Hα-helixtrans-59.9-45.4178.200000111.8G166 V167 G172 V173 V174G166-A170 WeakPolarHBondContact O-CB 3.27Å; G166-A170 PolarHBondContact O-N 3.41Å; V167-A170 PolarHBondContact O-N 3.48Å; A170-G172 PolarHBondContact O-N 2.96Å; A170-V173 PolarHBondContact O-N 3.15Å; A170-V174 WeakPolarHBondContact O-CG2 3.2Å; A170-V174 PolarHBondContact O-N 3.47Å
171T78.6Confident79Confident8 Ų844.8 Ų44.85%0.04927%0.269CS..Hα-helixtrans-59.5-47.5176.3-55.30000110.7I149 V167 L168 V169 V173 V174 C175 Y348I149-T171 HydrophobicContact CG2-CG2 4.28Å; V167-T171 WeakPolarHBondContact O-CB 3.33Å; V167-T171 PolarHBondContact O-N 2.82Å; V167-T171 PolarHBondContact O-OG1 3.46Å; L168-T171 PolarHBondContact O-N 3.41Å; V169-T171 VanDerWaalsContact C-N 3.35Å; V169-T171 PolarHBondContact O-N 2.87Å; T171-V173 PolarHBondContact O-N 2.95Å; T171-V174 PolarHBondContact O-N 3.37Å; T171-C175 PolarHBondContact O-N 3.37Å; T171-C175 PolarHBondContact O-SG 3.36Å; T171-Y348 HydrophobicContact CG2-CD1 4.15Å; T171-Y348 HydrophobicContact CG2-CE1 3.48Å; T171-Y348 VanDerWaalsContact CG2-CE1 3.48Å; T171-Y348 VanDerWaalsContact OG1-CE1 3.23Å; T171-Y348 WeakPolarHBondContact OG1-CE1 3.31Å; T171-Y348 PolarHBondContact OG1-OH 3.36Å
172G79.2Confident78.1Confident1 Ų141.8 Ų41.81%0.0124%0.239CC..Hα-helixtrans-60.5-42.7177.700000113.5L168 V169 A170 C175 I176L168-G172 PolarHBondContact O-N 2.82Å; V169-G172 PolarHBondContact O-N 3.01Å; A170-G172 PolarHBondContact O-N 2.96Å; G172-C175 WeakPolarHBondContact O-CB 3.43Å; G172-C175 PolarHBondContact O-N 3.31Å; G172-I176 VanDerWaalsContact O-CG1 3.25Å; G172-I176 WeakPolarHBondContact O-CG1 3.47Å; G172-I176 PolarHBondContact O-N 3.31Å
173V80.8Confident77.4Confident64 Ų6438.7 Ų38.739%0.38823%0.226SC..Hα-helixtrans-63-45.2176.51700000111.3V169 A170 T171 C175 I176 I177V169-V173 HydrophobicContact CG1-CG2 4.38Å; V169-V173 WeakPolarHBondContact O-CG2 3.34Å; V169-V173 PolarHBondContact O-N 3.03Å; A170-V173 PolarHBondContact O-N 3.15Å; T171-V173 PolarHBondContact O-N 2.95Å; V173-C175 VanDerWaalsContact C-N 3.33Å; V173-C175 PolarHBondContact O-N 3.2Å; V173-I176 PolarHBondContact O-N 3.15Å; V173-I177 HydrophobicContact CG1-CD1 3.84Å; V173-I177 HydrophobicContact CG1-CG1 4.47Å; V173-I177 WeakPolarHBondContact O-CG1 3.46Å; V173-I177 PolarHBondContact O-N 3.45Å
174V78.4Confident76.8Confident61 Ų6134.5 Ų34.537%0.3720%0.204SC..Hα-helixtrans-59.8-45.3175.8172.50000110.5V24 A170 T171 I176 I177 Y178 L352V24-V174 HydrophobicContact CG1-CG1 3.93Å; A170-V174 WeakPolarHBondContact O-CG2 3.2Å; A170-V174 PolarHBondContact O-N 3.47Å; T171-V174 PolarHBondContact O-N 3.37Å; V174-I176 PolarHBondContact O-N 2.96Å; V174-I177 PolarHBondContact O-N 2.95Å; V174-Y178 WeakPolarHBondContact O-CB 3.32Å; V174-Y178 PolarHBondContact O-N 2.99Å; V174-L352 HydrophobicContact CG1-CD2 4.28Å
175C74.9Confident76.4Confident2 Ų235.2 Ų35.21%0.01421%0.206CC..Hα-helixtrans-58.5-46.3174.8-69.30000111.9T171 G172 V173 Y178 C179 L352 V355T171-C175 PolarHBondContact O-N 3.37Å; T171-C175 PolarHBondContact O-SG 3.36Å; G172-C175 WeakPolarHBondContact O-CB 3.43Å; G172-C175 PolarHBondContact O-N 3.31Å; V173-C175 VanDerWaalsContact C-N 3.33Å; V173-C175 PolarHBondContact O-N 3.2Å; C175-Y178 WeakPolarHBondContact O-CB 3.5Å; C175-Y178 PolarHBondContact O-N 3.47Å; C175-C179 WeakPolarHBondContact O-CB 3.39Å; C175-C179 PolarHBondContact O-N 3.07Å; C175-C179 PolarHBondContact O-SG 3.06Å; C175-L352 WeakPolarHBondContact SG-CD2 3.32Å; C175-V355 HydrophobicContact CB-CG1 3.75Å
176I79.1Confident76Confident16 Ų1629.6 Ų29.68%0.08219%0.185CC..Hα-helixtrans-62.4-48.6-179.1-71.5163.2000111.2G172 V173 V174 Y178 C179 T180 V392 F396 I399G172-I176 VanDerWaalsContact O-CG1 3.25Å; G172-I176 WeakPolarHBondContact O-CG1 3.47Å; G172-I176 PolarHBondContact O-N 3.31Å; V173-I176 PolarHBondContact O-N 3.15Å; V174-I176 PolarHBondContact O-N 2.96Å; I176-Y178 PolarHBondContact O-N 3.38Å; I176-C179 PolarHBondContact O-N 2.89Å; I176-T180 HydrophobicContact CG2-CG2 4.16Å; I176-T180 WeakPolarHBondContact O-CB 3.41Å; I176-T180 VanDerWaalsContact O-CG2 3.23Å; I176-T180 WeakPolarHBondContact O-CG2 3.35Å; I176-T180 PolarHBondContact O-N 2.85Å; I176-T180 PolarHBondContact O-OG1 3.47Å; I176-V392 HydrophobicContact CG2-CB 4.42Å; I176-V392 HydrophobicContact CG2-CG2 3.94Å; I176-F396 HydrophobicContact CD1-CD2 4.46Å; I176-F396 HydrophobicContact CD1-CG 4.46Å; I176-I399 HydrophobicContact CD1-CD1 3.9Å
177I75.4Confident75.7Confident92 Ų9227.7 Ų27.747%0.47217%0.165SC..Hα-helixtrans-58.3-43.2177.4-67.4169.1000109.6V173 V174 T180 L181V173-I177 HydrophobicContact CG1-CD1 3.84Å; V173-I177 HydrophobicContact CG1-CG1 4.47Å; V173-I177 WeakPolarHBondContact O-CG1 3.46Å; V173-I177 PolarHBondContact O-N 3.45Å; V174-I177 PolarHBondContact O-N 2.95Å; I177-T180 WeakPolarHBondContact CA-OG1 3.09Å; I177-T180 PolarHBondContact O-OG1 3.07Å; I177-L181 HydrophobicContact CG2-CD1 3.88Å; I177-L181 VanDerWaalsContact O-CG 3.29Å; I177-L181 WeakPolarHBondContact O-CG 3.35Å; I177-L181 PolarHBondContact O-N 2.79Å
178Y68.8Low75.6Confident17 Ų1727.3 Ų27.37%0.06716%0.163CC..Hα-helixtrans-62.8-45.8178.9-176.8-103000112.7V174 C175 I176 G182 T190V174-Y178 WeakPolarHBondContact O-CB 3.32Å; V174-Y178 PolarHBondContact O-N 2.99Å; C175-Y178 WeakPolarHBondContact O-CB 3.5Å; C175-Y178 PolarHBondContact O-N 3.47Å; I176-Y178 PolarHBondContact O-N 3.38Å; Y178-G182 PolarHBondContact O-N 2.68Å; Y178-T190 HydrophobicContact CE2-CG2 3.92Å; Y178-T190 WeakPolarHBondContact OH-CB 3.47Å; Y178-T190 WeakPolarHBondContact OH-CG2 3.32Å; Y178-T190 PolarHBondContact OH-OG1 3.28Å
179C69.6Low75.5Confident8 Ų832.9 Ų32.95%0.05418%0.183CC..Hα-helixtrans-73.8-29.7-178-61.40000113.5C175 I176 S356 I359C175-C179 WeakPolarHBondContact O-CB 3.39Å; C175-C179 PolarHBondContact O-N 3.07Å; C175-C179 PolarHBondContact O-SG 3.06Å; I176-C179 PolarHBondContact O-N 2.89Å; C179-S356 WeakPolarHBondContact SG-CA 3.32Å; C179-S356 VanDerWaalsContact SG-CB 3.54Å; C179-I359 HydrophobicContact CB-CB 4.47Å; C179-I359 HydrophobicContact CB-CD1 4.39Å; C179-I359 HydrophobicContact CB-CG2 4.1Å
180T68.6Low75.4Confident22 Ų2229.2 Ų29.214%0.13516%0.161CC..Hα-helixtrans-75.4-27.6179.449.20000112.2I176 I177 V392I176-T180 HydrophobicContact CG2-CG2 4.16Å; I176-T180 WeakPolarHBondContact O-CB 3.41Å; I176-T180 VanDerWaalsContact O-CG2 3.23Å; I176-T180 WeakPolarHBondContact O-CG2 3.35Å; I176-T180 PolarHBondContact O-N 2.85Å; I176-T180 PolarHBondContact O-OG1 3.47Å; I177-T180 WeakPolarHBondContact CA-OG1 3.09Å; I177-T180 PolarHBondContact O-OG1 3.07Å; T180-V392 HydrophobicContact CG2-CG2 3.57Å
181L63.6Low75.6Confident77 Ų7726.6 Ų26.640%0.40314%0.14SC..Hα-helixtrans-91.7-24.9-178.5-64.4173.8000113.5L32 A35 I177L32-L181 HydrophobicContact CD1-CD1 4.38Å; A35-L181 WeakPolarHBondContact CB-O 3.13Å; I177-L181 HydrophobicContact CG2-CD1 3.88Å; I177-L181 VanDerWaalsContact O-CG 3.29Å; I177-L181 WeakPolarHBondContact O-CG 3.35Å; I177-L181 PolarHBondContact O-N 2.79Å
182G62.5Low76Confident3 Ų327.2 Ų27.23%0.03114%0.144CC..  trans-106.2126.2-174.600000114.8Y178Y178-G182 PolarHBondContact O-N 2.68Å
183G69.7Low76.3Confident16 Ų1630.6 Ų30.617%0.16516%0.158CC..  trans-80.4176.5163.200000112.3K185 A186 V187G183-K185 PolarHBondContact O-N 2.66Å; G183-A186 WeakPolarHBondContact O-CB 3.48Å; G183-A186 PolarHBondContact O-N 2.89Å; G183-V187 PolarHBondContact O-N 3Å
184L74.9Confident76.6Confident4 Ų427.7 Ų27.72%0.02114%0.14CC..Hα-helixtrans-50.6-37.7-173.5-174.571.6000113.8F47 L48 V187 I188 Q267F47-L184 PolarHBondContact O-N 2.94Å; L48-L184 WeakPolarHBondContact O-CD2 3.22Å; L184-V187 PolarHBondContact O-N 3.24Å; L184-I188 HydrophobicContact CD1-CD1 4.41Å; L184-I188 HydrophobicContact CD2-CD1 4.31Å; L184-I188 HydrophobicContact CG-CD1 3.93Å; L184-I188 WeakPolarHBondContact O-CG1 3.42Å; L184-I188 PolarHBondContact O-N 3.43Å; L184-Q267 HydrophobicContact CD2-CG 4.47Å
185K74.5Confident77Confident43 Ų4325.3 Ų25.319%0.18713%0.125CC..Hα-helixtrans-61.7-43.1175.8-78-178.8178.7157.20113.3E46 G50 M54 G183 I188 W189E46-K185 IonicContact OE1-NZ 2.67Å; E46-K185 PolarHBondContact OE1-NZ 3.47Å; E46-K185 IonicContact OE2-NZ 2.72Å; E46-K185 PolarHBondContact OE2-NZ 3.31Å; G50-K185 WeakPolarHBondContact O-CE 3.45Å; G50-K185 PolarHBondContact O-NZ 3.2Å; M54-K185 HydrophobicContact CE-CG 4.2Å; M54-K185 HydrophobicContact SD-CG 4.11Å; G183-K185 PolarHBondContact O-N 2.66Å; K185-I188 PolarHBondContact O-N 3.48Å; K185-W189 VanDerWaalsContact O-CD1 3.3Å; K185-W189 PolarHBondContact O-N 3.49Å
186A77.4Confident77.7Confident2 Ų229.6 Ų29.62%0.01715%0.151CC..Hα-helixtrans-65.5-44.9179.200000110Q34 G183 I188 W189 T190Q34-A186 HydrophobicContact CB-CB 4.14Å; Q34-A186 HydrophobicContact CG-CB 4.33Å; G183-A186 WeakPolarHBondContact O-CB 3.48Å; G183-A186 PolarHBondContact O-N 2.89Å; A186-I188 VanDerWaalsContact C-N 3.31Å; A186-I188 PolarHBondContact O-N 3.03Å; A186-W189 PolarHBondContact O-N 3.25Å; A186-T190 PolarHBondContact O-N 2.96Å; A186-T190 VanDerWaalsContact O-N 3.09Å; A186-T190 PolarHBondContact O-OG1 2.86Å
187V77.6Confident78.3Confident2 Ų229.5 Ų29.51%0.01215%0.15CC..Hα-helixtrans-55.7-46.4174.8178.20000110.8G183 L184 W189 T190 D191G183-V187 PolarHBondContact O-N 3Å; L184-V187 PolarHBondContact O-N 3.24Å; V187-W189 PolarHBondContact O-N 3.41Å; V187-T190 PolarHBondContact O-N 2.96Å; V187-T190 PolarHBondContact O-OG1 3.32Å; V187-D191 PolarHBondContact O-N 3.16Å
188I82.7Confident78.9Confident0 Ų025.2 Ų25.20%013%0.128CC..Hα-helixtrans-62-44.1-178.7-70.3163.7000112.4M54 P58 S62 L184 K185 A186 D191 V192 R268M54-I188 HydrophobicContact CE-CB 3.66Å; M54-I188 HydrophobicContact CE-CD1 3.37Å; M54-I188 HydrophobicContact CE-CG1 4.07Å; M54-I188 HydrophobicContact CE-CG2 3.58Å; M54-I188 HydrophobicContact CG-CD1 4.14Å; P58-I188 HydrophobicContact CB-CG2 3.93Å; S62-I188 WeakPolarHBondContact OG-CA 3.35Å; S62-I188 WeakPolarHBondContact OG-CG1 3.48Å; L184-I188 HydrophobicContact CD1-CD1 4.41Å; L184-I188 HydrophobicContact CD2-CD1 4.31Å; L184-I188 HydrophobicContact CG-CD1 3.93Å; L184-I188 WeakPolarHBondContact O-CG1 3.42Å; L184-I188 PolarHBondContact O-N 3.43Å; K185-I188 PolarHBondContact O-N 3.48Å; A186-I188 VanDerWaalsContact C-N 3.31Å; A186-I188 PolarHBondContact O-N 3.03Å; I188-D191 WeakPolarHBondContact O-CB 3.45Å; I188-D191 PolarHBondContact O-N 3.4Å; I188-V192 WeakPolarHBondContact O-CG2 3.45Å; I188-V192 PolarHBondContact O-N 3.42Å; I188-R268 VanDerWaalsContact CG1-NH1 3.3Å
189W81.9Confident80Confident120 Ų12026.7 Ų26.746%0.45514%0.137SC..Hα-helixtrans-70.4-33.3-178.8-80.8105.6000113.7I30 K185 A186 V187 D191 V192 F193I30-W189 HydrophobicContact CG2-CB 4.37Å; K185-W189 VanDerWaalsContact O-CD1 3.3Å; K185-W189 PolarHBondContact O-N 3.49Å; A186-W189 PolarHBondContact O-N 3.25Å; V187-W189 PolarHBondContact O-N 3.41Å; W189-D191 VanDerWaalsContact C-N 3.34Å; W189-V192 PolarHBondContact O-N 3.47Å; W189-F193 PolarHBondContact O-N 3.31Å
190T83Confident81.1Confident0 Ų028.2 Ų28.20%015%0.151CC..Hα-helixtrans-69.4-36173.355.90000112.2A27 I30 Y178 A186 V187 V192 F193 Q194A27-T190 VanDerWaalsContact O-CG2 3.24Å; A27-T190 WeakPolarHBondContact O-CG2 3.4Å; I30-T190 HydrophobicContact CB-CG2 4.2Å; I30-T190 HydrophobicContact CG2-CG2 4.05Å; Y178-T190 HydrophobicContact CE2-CG2 3.92Å; Y178-T190 WeakPolarHBondContact OH-CB 3.47Å; Y178-T190 WeakPolarHBondContact OH-CG2 3.32Å; Y178-T190 PolarHBondContact OH-OG1 3.28Å; A186-T190 PolarHBondContact O-N 2.96Å; A186-T190 VanDerWaalsContact O-N 3.09Å; A186-T190 PolarHBondContact O-OG1 2.86Å; V187-T190 PolarHBondContact O-N 2.96Å; V187-T190 PolarHBondContact O-OG1 3.32Å; T190-V192 VanDerWaalsContact C-N 3.26Å; T190-V192 PolarHBondContact O-N 2.89Å; T190-F193 WeakPolarHBondContact O-CB 3.45Å; T190-F193 PolarHBondContact O-N 3.01Å; T190-Q194 WeakPolarHBondContact O-CB 3.42Å; T190-Q194 VanDerWaalsContact O-CG 3.22Å; T190-Q194 WeakPolarHBondContact O-CG 3.38Å; T190-Q194 PolarHBondContact O-N 3.49Å
191D86Confident82.2Confident0 Ų027.2 Ų27.20%015%0.145CC..Hα-helixtrans-60.7-39.7176.8-66.1-17.5000111.3S62 A65 V187 I188 W189 F193 Q194 M195 R268 S353S62-D191 WeakPolarHBondContact OG-CB 3.43Å; S62-D191 PolarHBondContact OG-OD2 2.81Å; A65-D191 HydrophobicContact CB-CB 3.95Å; V187-D191 PolarHBondContact O-N 3.16Å; I188-D191 WeakPolarHBondContact O-CB 3.45Å; I188-D191 PolarHBondContact O-N 3.4Å; W189-D191 VanDerWaalsContact C-N 3.34Å; D191-F193 VanDerWaalsContact C-N 3.34Å; D191-F193 PolarHBondContact O-N 2.77Å; D191-Q194 PolarHBondContact O-N 3.36Å; D191-M195 WeakPolarHBondContact O-CB 3.31Å; D191-M195 PolarHBondContact O-N 3.43Å; D191-R268 IonicContact OD2-CZ 2.85Å; D191-R268 VanDerWaalsContact OD2-CZ 3.24Å; D191-R268 IonicContact OD2-NH1 2.9Å; D191-R268 PolarHBondContact OD2-NH1 2.69Å; D191-R268 VanDerWaalsContact OD2-NH1 3.1Å; D191-R268 IonicContact OD2-NH2 3.54Å; D191-R268 PolarHBondContact OD2-NH2 3.1Å; D191-S353 WeakPolarHBondContact OD1-CA 3.21Å; D191-S353 VanDerWaalsContact OD1-CB 3.23Å; D191-S353 WeakPolarHBondContact OD1-CB 3.39Å; D191-S353 PolarHBondContact OD1-OG 3.5Å
192V86.6Confident83.6Confident22 Ų2223.7 Ų23.713%0.13313%0.126CC..Hα-helixtrans-59-47.2176174.10000111M61 I188 W189 T190 M195 V196M61-V192 HydrophobicContact CB-CG2 3.94Å; M61-V192 HydrophobicContact CE-CB 4.27Å; M61-V192 HydrophobicContact CE-CG1 3.59Å; M61-V192 HydrophobicContact CE-CG2 3.66Å; M61-V192 HydrophobicContact SD-CG1 3.85Å; M61-V192 HydrophobicContact SD-CG2 4.36Å; I188-V192 WeakPolarHBondContact O-CG2 3.45Å; I188-V192 PolarHBondContact O-N 3.42Å; W189-V192 PolarHBondContact O-N 3.47Å; T190-V192 VanDerWaalsContact C-N 3.26Å; T190-V192 PolarHBondContact O-N 2.89Å; V192-M195 PolarHBondContact O-N 3.31Å; V192-V196 PolarHBondContact O-N 2.9Å
193F86.6Confident85.1Confident71 Ų7127.2 Ų27.231%0.31115%0.147SC..Hα-helixtrans-63-45.3177.2175.6-109.5000111.6T23 A27 I30 W189 T190 D191 M195 V196 I197T23-F193 HydrophobicContact CG2-CE1 4.31Å; A27-F193 HydrophobicContact CB-CD1 4.07Å; A27-F193 HydrophobicContact CB-CE1 4.18Å; I30-F193 HydrophobicContact CD1-CB 3.97Å; I30-F193 HydrophobicContact CD1-CD1 3.93Å; I30-F193 HydrophobicContact CD1-CD2 3.96Å; I30-F193 HydrophobicContact CD1-CE1 4.38Å; I30-F193 HydrophobicContact CD1-CE2 4.42Å; I30-F193 HydrophobicContact CD1-CG 3.69Å; W189-F193 PolarHBondContact O-N 3.31Å; T190-F193 WeakPolarHBondContact O-CB 3.45Å; T190-F193 PolarHBondContact O-N 3.01Å; D191-F193 VanDerWaalsContact C-N 3.34Å; D191-F193 PolarHBondContact O-N 2.77Å; F193-M195 VanDerWaalsContact C-N 3.33Å; F193-M195 PolarHBondContact O-N 3.37Å; F193-V196 PolarHBondContact O-N 2.8Å; F193-I197 HydrophobicContact CD1-CD1 3.59Å; F193-I197 HydrophobicContact CD2-CD1 4.39Å; F193-I197 HydrophobicContact CE1-CD1 3.26Å; F193-I197 HydrophobicContact CE1-CG1 4.49Å; F193-I197 HydrophobicContact CE2-CD1 4.1Å; F193-I197 HydrophobicContact CG-CD1 4.16Å; F193-I197 HydrophobicContact CZ-CD1 3.55Å; F193-I197 HydrophobicContact CZ-CG1 4.42Å; F193-I197 WeakPolarHBondContact O-CG1 3.42Å; F193-I197 PolarHBondContact O-N 2.9Å
194Q87Confident86.2Confident3 Ų327.7 Ų27.71%0.01415%0.149CC..Hα-helixtrans-63.2-36.9179.4-75.9173.3-20.400112.7A27 T190 D191 V196 I197 M198 S349 L352 S353A27-Q194 HydrophobicContact CB-CG 4.5Å; T190-Q194 WeakPolarHBondContact O-CB 3.42Å; T190-Q194 VanDerWaalsContact O-CG 3.22Å; T190-Q194 WeakPolarHBondContact O-CG 3.38Å; T190-Q194 PolarHBondContact O-N 3.49Å; D191-Q194 PolarHBondContact O-N 3.36Å; Q194-V196 PolarHBondContact O-N 2.85Å; Q194-I197 PolarHBondContact O-N 3.24Å; Q194-M198 WeakPolarHBondContact O-CB 3.39Å; Q194-M198 PolarHBondContact O-N 3.07Å; Q194-S349 VanDerWaalsContact CD-O 3.27Å; Q194-S349 PolarHBondContact OE1-O 3.5Å; Q194-L352 VanDerWaalsContact NE2-CB 3.31Å; Q194-S353 VanDerWaalsContact OE1-CB 3.27Å
195M87Confident87.2Confident12 Ų1227.5 Ų27.56%0.05915%0.148CC..Hα-helixtrans-59.7-45.1175.3-171.967.2-155.200111.7T64 A65 D191 V192 F193 I197 M198 L199 T292T64-M195 HydrophobicContact CG2-CE 3.52Å; T64-M195 HydrophobicContact CG2-SD 3.75Å; A65-M195 HydrophobicContact CB-CB 4.19Å; A65-M195 HydrophobicContact CB-SD 4.08Å; D191-M195 WeakPolarHBondContact O-CB 3.31Å; D191-M195 PolarHBondContact O-N 3.43Å; V192-M195 PolarHBondContact O-N 3.31Å; F193-M195 VanDerWaalsContact C-N 3.33Å; F193-M195 PolarHBondContact O-N 3.37Å; M195-I197 VanDerWaalsContact C-N 3.34Å; M195-I197 PolarHBondContact O-N 3.1Å; M195-M198 HydrophobicContact CE-CE 3.48Å; M195-M198 VanDerWaalsContact CE-CE 3.48Å; M195-M198 PolarHBondContact O-N 3.11Å; M195-M198 HydrophobicContact SD-CE 3.32Å; M195-M198 WeakPolarHBondContact SD-CE 3.08Å; M195-L199 HydrophobicContact CE-CD1 4.01Å; M195-L199 HydrophobicContact CE-CD2 3.86Å; M195-L199 HydrophobicContact CE-CG 3.89Å; M195-L199 HydrophobicContact CG-CD1 4.48Å; M195-L199 WeakPolarHBondContact O-CG 3.37Å; M195-L199 PolarHBondContact O-N 2.74Å; M195-T292 HydrophobicContact CE-CG2 4.42Å; M195-T292 WeakPolarHBondContact CE-OG1 3.33Å
196V90Very high88.2Confident92 Ų9226.4 Ų26.456%0.55814%0.144SC*.Hα-helixtrans-63.1-43.4179.7174.10000110.7V192 F193 Q194 M198 L199 A200V192-V196 PolarHBondContact O-N 2.9Å; F193-V196 PolarHBondContact O-N 2.8Å; Q194-V196 PolarHBondContact O-N 2.85Å; V196-M198 VanDerWaalsContact C-N 3.33Å; V196-M198 PolarHBondContact O-N 3.12Å; V196-L199 PolarHBondContact O-N 2.66Å; V196-A200 WeakPolarHBondContact O-CB 3.49Å; V196-A200 PolarHBondContact O-N 2.84Å
197I89.9Confident89Confident13 Ų1328.9 Ų28.97%0.06717%0.165CC..Hα-helixtrans-62.3-43.8177.9-64158000110.5T23 F193 Q194 M195 L199 A200 G201 L342 A345 A346T23-I197 HydrophobicContact CG2-CD1 3.31Å; T23-I197 HydrophobicContact CG2-CG1 4.24Å; T23-I197 HydrophobicContact CG2-CG2 4.26Å; F193-I197 HydrophobicContact CD1-CD1 3.59Å; F193-I197 HydrophobicContact CD2-CD1 4.39Å; F193-I197 HydrophobicContact CE1-CD1 3.26Å; F193-I197 HydrophobicContact CE1-CG1 4.49Å; F193-I197 HydrophobicContact CE2-CD1 4.1Å; F193-I197 HydrophobicContact CG-CD1 4.16Å; F193-I197 HydrophobicContact CZ-CD1 3.55Å; F193-I197 HydrophobicContact CZ-CG1 4.42Å; F193-I197 WeakPolarHBondContact O-CG1 3.42Å; F193-I197 PolarHBondContact O-N 2.9Å; Q194-I197 PolarHBondContact O-N 3.24Å; M195-I197 VanDerWaalsContact C-N 3.34Å; M195-I197 PolarHBondContact O-N 3.1Å; I197-L199 PolarHBondContact O-N 3.04Å; I197-A200 PolarHBondContact O-N 3.1Å; I197-G201 PolarHBondContact O-N 2.87Å; I197-L342 HydrophobicContact CG2-CD1 4.02Å; I197-A345 HydrophobicContact CG2-CB 4.38Å; I197-A346 HydrophobicContact CG2-CB 4.11Å
198M89.6Confident89.8Confident2 Ų231.5 Ų31.51%0.0118%0.175CC..Hα-helixtrans-59.1-48.1177.9-176.1179.358.700112.5M68 V73 Q194 M195 V196 A200 G201 F202 T292 A346M68-M198 HydrophobicContact CB-CE 3.74Å; M68-M198 HydrophobicContact CB-SD 4.03Å; V73-M198 HydrophobicContact CG2-CG 3.65Å; V73-M198 HydrophobicContact CG2-SD 3.58Å; V73-M198 VanDerWaalsContact CG2-SD 3.58Å; Q194-M198 WeakPolarHBondContact O-CB 3.39Å; Q194-M198 PolarHBondContact O-N 3.07Å; M195-M198 HydrophobicContact CE-CE 3.48Å; M195-M198 VanDerWaalsContact CE-CE 3.48Å; M195-M198 PolarHBondContact O-N 3.11Å; M195-M198 HydrophobicContact SD-CE 3.32Å; M195-M198 WeakPolarHBondContact SD-CE 3.08Å; V196-M198 VanDerWaalsContact C-N 3.33Å; V196-M198 PolarHBondContact O-N 3.12Å; M198-A200 VanDerWaalsContact C-N 3.33Å; M198-A200 PolarHBondContact O-N 3.49Å; M198-G201 PolarHBondContact O-N 3.47Å; M198-F202 HydrophobicContact CG-CD2 4.43Å; M198-F202 HydrophobicContact CG-CE2 3.98Å; M198-F202 WeakPolarHBondContact O-CD2 3.44Å; M198-F202 PolarHBondContact O-N 3.26Å; M198-T292 HydrophobicContact CE-CG2 3.7Å; M198-T292 HydrophobicContact SD-CG2 4.3Å; M198-A346 HydrophobicContact CB-CB 4.49Å
199L91.4Very high90.4Very high48 Ų4831.5 Ų31.525%0.25118%0.175SC..Hα-helixtrans-61.9-41.4177-65.5174.5000111.7M195 V196 I197 G201 F202 V203 V291 L295M195-L199 HydrophobicContact CE-CD1 4.01Å; M195-L199 HydrophobicContact CE-CD2 3.86Å; M195-L199 HydrophobicContact CE-CG 3.89Å; M195-L199 HydrophobicContact CG-CD1 4.48Å; M195-L199 WeakPolarHBondContact O-CG 3.37Å; M195-L199 PolarHBondContact O-N 2.74Å; V196-L199 PolarHBondContact O-N 2.66Å; I197-L199 PolarHBondContact O-N 3.04Å; L199-G201 VanDerWaalsContact C-N 3.31Å; L199-G201 PolarHBondContact O-N 3.09Å; L199-F202 PolarHBondContact O-N 2.91Å; L199-V203 WeakPolarHBondContact O-CG2 3.48Å; L199-V203 PolarHBondContact O-N 3.33Å; L199-V203 VanDerWaalsContact O-N 3.1Å; L199-V291 HydrophobicContact CD2-CG1 4.28Å; L199-L295 HydrophobicContact CD2-CD1 3.65Å
200A92.2Very high91Very high41 Ų4126.4 Ų26.434%0.33916%0.158SC..Hα-helixtrans-61.6-39176.600000112.2V196 I197 M198 V203 A204V196-A200 WeakPolarHBondContact O-CB 3.49Å; V196-A200 PolarHBondContact O-N 2.84Å; I197-A200 PolarHBondContact O-N 3.1Å; M198-A200 VanDerWaalsContact C-N 3.33Å; M198-A200 PolarHBondContact O-N 3.49Å; A200-V203 PolarHBondContact O-N 3.2Å; A200-A204 WeakPolarHBondContact O-CB 3.42Å; A200-A204 PolarHBondContact O-N 2.86Å
201G91.8Very high91.6Very high1 Ų131.3 Ų31.31%0.0119%0.187CC..Hα-helixtrans-59.1-47.8176.400000112.9I197 M198 L199 A204 V205I197-G201 PolarHBondContact O-N 2.87Å; M198-G201 PolarHBondContact O-N 3.47Å; L199-G201 VanDerWaalsContact C-N 3.31Å; L199-G201 PolarHBondContact O-N 3.09Å; G201-A204 PolarHBondContact O-N 3.4Å; G201-V205 PolarHBondContact O-N 3.17Å
202F93.1Very high92Very high2 Ų233.3 Ų33.31%0.00920%0.198CC..Hα-helixtrans-63.2-45.3175.8-70-58.5000112.4V73 P77 M198 L199 A204 V205 I206 T292 L295 A296 S299V73-F202 HydrophobicContact CB-CZ 4.27Å; V73-F202 HydrophobicContact CG1-CE1 4.34Å; V73-F202 HydrophobicContact CG1-CZ 4.3Å; V73-F202 HydrophobicContact CG2-CE2 4.45Å; V73-F202 HydrophobicContact CG2-CZ 4.15Å; P77-F202 HydrophobicContact CG-CE1 4.08Å; M198-F202 HydrophobicContact CG-CD2 4.43Å; M198-F202 HydrophobicContact CG-CE2 3.98Å; M198-F202 WeakPolarHBondContact O-CD2 3.44Å; M198-F202 PolarHBondContact O-N 3.26Å; L199-F202 PolarHBondContact O-N 2.91Å; F202-A204 VanDerWaalsContact C-N 3.27Å; F202-A204 PolarHBondContact O-N 3.21Å; F202-V205 PolarHBondContact O-N 2.98Å; F202-I206 VanDerWaalsContact O-CG1 3.25Å; F202-I206 WeakPolarHBondContact O-CG1 3.33Å; F202-I206 PolarHBondContact O-N 2.98Å; F202-T292 HydrophobicContact CE2-CG2 3.92Å; F202-L295 HydrophobicContact CB-CB 3.86Å; F202-L295 HydrophobicContact CB-CD1 4.46Å; F202-L295 HydrophobicContact CD2-CB 4.11Å; F202-L295 HydrophobicContact CG-CB 4.08Å; F202-A296 HydrophobicContact CD1-CB 4.48Å; F202-A296 HydrophobicContact CE1-CB 3.69Å; F202-A296 HydrophobicContact CE2-CB 4.3Å; F202-A296 HydrophobicContact CZ-CB 3.55Å; F202-S299 WeakPolarHBondContact CD1-OG 3.34Å
203V94.5Very high92.3Very high77 Ų7734.3 Ų34.347%0.46720%0.201SC..Hα-helixtrans-59.7-40179.4171.50000111L199 A200 I206 A207 L295L199-V203 WeakPolarHBondContact O-CG2 3.48Å; L199-V203 PolarHBondContact O-N 3.33Å; L199-V203 VanDerWaalsContact O-N 3.1Å; A200-V203 PolarHBondContact O-N 3.2Å; V203-I206 PolarHBondContact O-N 3.31Å; V203-A207 WeakPolarHBondContact O-CB 3.41Å; V203-A207 PolarHBondContact O-N 2.83Å; V203-L295 HydrophobicContact CG2-CD1 4.48Å; V203-L295 HydrophobicContact CG2-CD2 4.36Å
204A93.4Very high92.6Very high26 Ų2634.4 Ų34.422%0.21522%0.222CC..Hα-helixtrans-61.6-45.9177.300000112.4A200 G201 F202 R208 V339A200-A204 WeakPolarHBondContact O-CB 3.42Å; A200-A204 PolarHBondContact O-N 2.86Å; G201-A204 PolarHBondContact O-N 3.4Å; F202-A204 VanDerWaalsContact C-N 3.27Å; F202-A204 PolarHBondContact O-N 3.21Å; A204-R208 WeakPolarHBondContact O-CB 3.21Å; A204-R208 PolarHBondContact O-N 2.99Å; A204-V339 HydrophobicContact CB-CG1 4.06Å
205V94.2Very high93Very high0 Ų035.5 Ų35.50%023%0.234CC..Hα-helixtrans-61.8-46.8177.1173.20000110.9G201 F202 G209 L325 L328 V329 I332 L333 F343G201-V205 PolarHBondContact O-N 3.17Å; F202-V205 PolarHBondContact O-N 2.98Å; V205-G209 PolarHBondContact O-N 3.34Å; V205-L325 HydrophobicContact CG1-CD1 4.38Å; V205-L328 HydrophobicContact CG1-CD2 3.97Å; V205-V329 HydrophobicContact CG2-CG2 3.76Å; V205-I332 HydrophobicContact CG1-CD1 4.35Å; V205-L333 HydrophobicContact CG2-CD1 4.22Å; V205-F343 HydrophobicContact CG2-CD2 3.93Å; V205-F343 HydrophobicContact CG2-CE2 4.26Å
206I96Very high93.4Very high20 Ų2039.2 Ų39.210%0.10325%0.253CS..Hα-helixtrans-64.7-48.9-178.6-66.6168.6000111.1F202 V203 R208 G209 A210 L216 L295 F298 S299F202-I206 VanDerWaalsContact O-CG1 3.25Å; F202-I206 WeakPolarHBondContact O-CG1 3.33Å; F202-I206 PolarHBondContact O-N 2.98Å; V203-I206 PolarHBondContact O-N 3.31Å; I206-R208 VanDerWaalsContact C-N 3.33Å; I206-R208 PolarHBondContact O-N 3.04Å; I206-G209 PolarHBondContact O-N 2.76Å; I206-A210 WeakPolarHBondContact O-CB 3.35Å; I206-A210 PolarHBondContact O-N 2.95Å; I206-L216 HydrophobicContact CG2-CD2 4.04Å; I206-L295 HydrophobicContact CD1-CD2 3.92Å; I206-F298 HydrophobicContact CB-CD1 4.29Å; I206-F298 HydrophobicContact CD1-CB 4.1Å; I206-F298 HydrophobicContact CD1-CD1 3.83Å; I206-F298 HydrophobicContact CD1-CG 4.42Å; I206-F298 HydrophobicContact CG1-CD1 3.83Å; I206-F298 HydrophobicContact CG2-CD1 3.52Å; I206-F298 HydrophobicContact CG2-CE1 3.55Å; I206-S299 WeakPolarHBondContact CG1-OG 3.41Å
207A95.1Very high93.7Very high54 Ų5437.1 Ų37.145%0.44625%0.25SS..Hα-helixtrans-60.7-44.5-179.100000111V203 A210 V211V203-A207 WeakPolarHBondContact O-CB 3.41Å; V203-A207 PolarHBondContact O-N 2.83Å; A207-A210 PolarHBondContact O-N 3.25Å; A207-V211 WeakPolarHBondContact O-CG2 3.17Å; A207-V211 PolarHBondContact O-N 2.94Å
208R94.4Very high94Very high58 Ų5840.2 Ų40.222%0.21926%0.264CS..Hα-helixtrans-67.8-43.4178.1178.960.7-179.5158.23.3112.2A204 I206 A210 V211 I212 I332 L333 Y336A204-R208 WeakPolarHBondContact O-CB 3.21Å; A204-R208 PolarHBondContact O-N 2.99Å; I206-R208 VanDerWaalsContact C-N 3.33Å; I206-R208 PolarHBondContact O-N 3.04Å; R208-A210 VanDerWaalsContact C-N 3.29Å; R208-A210 PolarHBondContact O-N 2.77Å; R208-V211 PolarHBondContact O-N 3.21Å; R208-V211 VanDerWaalsContact O-N 3.16Å; R208-I212 HydrophobicContact CG-CD1 4.05Å; R208-I212 WeakPolarHBondContact O-CG1 3.48Å; R208-I212 PolarHBondContact O-N 3.41Å; R208-I332 HydrophobicContact CB-CD1 4.03Å; R208-I332 HydrophobicContact CG-CB 4.06Å; R208-I332 HydrophobicContact CG-CD1 3.85Å; R208-I332 HydrophobicContact CG-CG1 4.27Å; R208-I332 WeakPolarHBondContact CG-O 3.32Å; R208-I332 PolarHBondContact NE-O 3.16Å; R208-L333 HydrophobicContact CB-CD2 3.66Å; R208-L333 HydrophobicContact CB-CG 4.3Å; R208-L333 HydrophobicContact CG-CD2 3.66Å; R208-L333 HydrophobicContact CG-CG 4.12Å; R208-Y336 PolarHBondContact NH1-OH 3.29Å
209G94.7Very high94.3Very high0 Ų040.2 Ų40.20%026%0.263CS..Hα-helixtrans-61-38.3176.600000112.7V205 I206 V211 I212 Q213V205-G209 PolarHBondContact O-N 3.34Å; I206-G209 PolarHBondContact O-N 2.76Å; G209-V211 PolarHBondContact O-N 3.22Å; G209-I212 PolarHBondContact O-N 3.24Å; G209-Q213 PolarHBondContact O-N 3.08Å
210A95.6Very high94.5Very high13 Ų1344.3 Ų44.311%0.10728%0.276CS..Hα-helixtrans-61.3-41.6173.800000112.2I206 A207 R208 G214 G215 L216 I219I206-A210 WeakPolarHBondContact O-CB 3.35Å; I206-A210 PolarHBondContact O-N 2.95Å; A207-A210 PolarHBondContact O-N 3.25Å; R208-A210 VanDerWaalsContact C-N 3.29Å; R208-A210 PolarHBondContact O-N 2.77Å; A210-G214 PolarHBondContact O-N 3.03Å; A210-G214 VanDerWaalsContact O-N 3.15Å; A210-G215 WeakPolarHBondContact O-CA 3.47Å; A210-G215 PolarHBondContact O-N 3.08Å; A210-L216 HydrophobicContact CB-CD2 3.6Å; A210-L216 HydrophobicContact CB-CG 3.97Å; A210-I219 HydrophobicContact CB-CD1 4.31Å
211V95.1Very high94.8Very high102 Ų10246.5 Ų46.562%0.61828%0.282SS*.Hα-helixtrans-63.3-42.3175.9172.60000111.3A207 R208 G209 G214A207-V211 WeakPolarHBondContact O-CG2 3.17Å; A207-V211 PolarHBondContact O-N 2.94Å; R208-V211 PolarHBondContact O-N 3.21Å; R208-V211 VanDerWaalsContact O-N 3.16Å; G209-V211 PolarHBondContact O-N 3.22Å; V211-G214 PolarHBondContact O-N 3.13Å
212I93Very high95Very high43 Ų4346.7 Ų46.722%0.22128%0.282CS..Hα-helixtrans-67.4-41.8-178.8-67.9170.2000111.7T3 R208 G209 G214 I332T3-I212 HydrophobicContact CG2-CD1 4.25Å; R208-I212 HydrophobicContact CG-CD1 4.05Å; R208-I212 WeakPolarHBondContact O-CG1 3.48Å; R208-I212 PolarHBondContact O-N 3.41Å; G209-I212 PolarHBondContact O-N 3.24Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 3.34Å; I212-I332 HydrophobicContact CD1-CB 3.53Å; I212-I332 HydrophobicContact CD1-CG2 3.41Å; I212-I332 VanDerWaalsContact CD1-CG2 3.41Å
213Q93.9Very high95.1Very high43 Ų4346.6 Ų46.620%0.20128%0.282CS..Hα-helixtrans-82-5.1-178.9-69.6-61.9-35.600113.9G209 K218 I219 S305 I306G209-Q213 PolarHBondContact O-N 3.08Å; Q213-K218 HydrophobicContact CB-CG 4.46Å; Q213-K218 WeakPolarHBondContact O-CB 3.03Å; Q213-K218 WeakPolarHBondContact O-CG 3.11Å; Q213-I219 HydrophobicContact CB-CD1 4.47Å; Q213-I219 HydrophobicContact CB-CG1 3.89Å; Q213-I219 HydrophobicContact CG-CG1 4Å; Q213-S305 WeakPolarHBondContact CG-OG 3.49Å; Q213-S305 PolarHBondContact OE1-OG 3.17Å; Q213-I306 HydrophobicContact CG-CG1 4.02Å
214G92.9Very high95.2Very high72 Ų7250.5 Ų50.574%0.74229%0.29SS*.THydrogen-bonded Turntrans81.720.3-177.700000114.4A210 V211 I212A210-G214 PolarHBondContact O-N 3.03Å; A210-G214 VanDerWaalsContact O-N 3.15Å; V211-G214 PolarHBondContact O-N 3.13Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 3.34Å
215G94.4Very high95.3Very high26 Ų2656.6 Ų56.627%0.26831%0.314SS..SBendtrans134.7162.717100000114A210 G217 K218A210-G215 WeakPolarHBondContact O-CA 3.47Å; A210-G215 PolarHBondContact O-N 3.08Å; G215-G217 VanDerWaalsContact C-N 3.26Å; G215-G217 PolarHBondContact O-N 3.01Å; G215-K218 PolarHBondContact O-N 3.18Å
216L95.6Very high95.2Very high90 Ų9057.1 Ų57.147%0.47132%0.319SS..Hα-helixtrans-63.8-32.1175.8-65172.7000112.4I206 A210 K218 I219 W220 F298I206-L216 HydrophobicContact CG2-CD2 4.04Å; A210-L216 HydrophobicContact CB-CD2 3.6Å; A210-L216 HydrophobicContact CB-CG 3.97Å; L216-K218 VanDerWaalsContact C-N 3.31Å; L216-K218 PolarHBondContact O-N 3.31Å; L216-I219 PolarHBondContact O-N 3.29Å; L216-W220 PolarHBondContact O-N 3.18Å; L216-F298 HydrophobicContact CD2-CE1 3.54Å; L216-F298 HydrophobicContact CD2-CZ 3.74Å
217G96.4Very high95.1Very high48 Ų4857 Ų5750%0.49532%0.322SS..Hα-helixtrans-61.5-39.1176.800000112.4G215 W220 D221G215-G217 VanDerWaalsContact C-N 3.26Å; G215-G217 PolarHBondContact O-N 3.01Å; G217-W220 WeakPolarHBondContact O-CB 3.47Å; G217-W220 PolarHBondContact O-N 2.73Å; G217-D221 VanDerWaalsContact O-CG 3.31Å; G217-D221 PolarHBondContact O-N 2.64Å
218K96Very high95.1Very high79 Ų7954.4 Ų54.434%0.34330%0.301SS..Hα-helixtrans-67-40.1178.3-174.954.5175.4153.60112.4Q213 G215 L216 W220 D221 D222Q213-K218 HydrophobicContact CB-CG 4.46Å; Q213-K218 WeakPolarHBondContact O-CB 3.03Å; Q213-K218 WeakPolarHBondContact O-CG 3.11Å; G215-K218 PolarHBondContact O-N 3.18Å; L216-K218 VanDerWaalsContact C-N 3.31Å; L216-K218 PolarHBondContact O-N 3.31Å; K218-W220 VanDerWaalsContact C-N 3.29Å; K218-W220 PolarHBondContact O-N 3.11Å; K218-D221 PolarHBondContact O-N 3Å; K218-D222 VanDerWaalsContact CE-OD1 3.29Å; K218-D222 WeakPolarHBondContact CE-OD1 3.13Å; K218-D222 IonicContact NZ-OD1 2.67Å; K218-D222 PolarHBondContact NZ-OD1 3.45Å; K218-D222 WeakPolarHBondContact O-CB 3.4Å; K218-D222 VanDerWaalsContact O-CG 3.28Å; K218-D222 PolarHBondContact O-N 3.33Å
219I96.9Very high95.1Very high1 Ų152.7 Ų52.71%0.00530%0.296CS..Hα-helixtrans-59.3-45.7173.5-65.8168.5000110A210 Q213 L216 D222 C223 T302A210-I219 HydrophobicContact CB-CD1 4.31Å; Q213-I219 HydrophobicContact CB-CD1 4.47Å; Q213-I219 HydrophobicContact CB-CG1 3.89Å; Q213-I219 HydrophobicContact CG-CG1 4Å; L216-I219 PolarHBondContact O-N 3.29Å; I219-D222 PolarHBondContact O-N 3.19Å; I219-C223 WeakPolarHBondContact O-CB 3.47Å; I219-C223 PolarHBondContact O-N 2.88Å; I219-C223 PolarHBondContact O-SG 3.29Å; I219-T302 HydrophobicContact CD1-CG2 3.96Å
220W96.3Very high94.9Very high134 Ų13458.5 Ų58.551%0.50833%0.327SS..Hα-helixtrans-60.6-48.7178.3-169.1-91.8000112.1L216 G217 K218 D222 C223 Y224 L229 F298L216-W220 PolarHBondContact O-N 3.18Å; G217-W220 WeakPolarHBondContact O-CB 3.47Å; G217-W220 PolarHBondContact O-N 2.73Å; K218-W220 VanDerWaalsContact C-N 3.29Å; K218-W220 PolarHBondContact O-N 3.11Å; W220-D222 PolarHBondContact O-N 3.48Å; W220-C223 PolarHBondContact O-N 3.01Å; W220-Y224 WeakPolarHBondContact O-CB 3.36Å; W220-Y224 PolarHBondContact O-N 3.18Å; W220-L229 HydrophobicContact CD2-CD1 3.64Å; W220-L229 VanDerWaalsContact CE2-CD1 3.41Å; W220-L229 HydrophobicContact CE3-CD1 4.13Å; W220-L229 HydrophobicContact CE3-CD2 4.39Å; W220-L229 HydrophobicContact CG-CD1 4.02Å; W220-L229 HydrophobicContact CH2-CD1 4.23Å; W220-L229 HydrophobicContact CH2-CD2 4.33Å; W220-L229 HydrophobicContact CZ2-CD1 3.75Å; W220-L229 HydrophobicContact CZ3-CD1 4.4Å; W220-L229 HydrophobicContact CZ3-CD2 4.2Å; W220-F298 HydrophobicContact CE3-CE2 4.38Å
221D97Very high94.4Very high87 Ų8759.6 Ų59.647%0.46533%0.331SS..Hα-helixtrans-62.2-44.6179.4-69.6-20000112.3G217 K218 C223 Y224 Q225G217-D221 VanDerWaalsContact O-CG 3.31Å; G217-D221 PolarHBondContact O-N 2.64Å; K218-D221 PolarHBondContact O-N 3Å; D221-C223 VanDerWaalsContact C-N 3.31Å; D221-C223 PolarHBondContact O-N 3.14Å; D221-Y224 WeakPolarHBondContact O-CB 3.45Å; D221-Y224 PolarHBondContact O-N 2.88Å; D221-Q225 WeakPolarHBondContact O-CG 3.46Å; D221-Q225 PolarHBondContact O-N 3.3Å
222D96.1Very high94.1Very high5 Ų560.2 Ų60.23%0.02733%0.326CS..Hα-helixtrans-61.2-42.7176.8-74-14.9000110.7K218 I219 W220 Q225 G226 Y304 S305 K308K218-D222 VanDerWaalsContact CE-OD1 3.29Å; K218-D222 WeakPolarHBondContact CE-OD1 3.13Å; K218-D222 IonicContact NZ-OD1 2.67Å; K218-D222 PolarHBondContact NZ-OD1 3.45Å; K218-D222 WeakPolarHBondContact O-CB 3.4Å; K218-D222 VanDerWaalsContact O-CG 3.28Å; K218-D222 PolarHBondContact O-N 3.33Å; I219-D222 PolarHBondContact O-N 3.19Å; W220-D222 PolarHBondContact O-N 3.48Å; D222-Q225 PolarHBondContact O-N 3.46Å; D222-G226 PolarHBondContact O-N 2.93Å; D222-Y304 WeakPolarHBondContact O-CE1 3.29Å; D222-S305 PolarHBondContact OD2-OG 2.79Å; D222-K308 HydrophobicContact CB-CD 4.33Å; D222-K308 IonicContact OD1-NZ 2.79Å; D222-K308 PolarHBondContact OD1-NZ 3.24Å; D222-K308 IonicContact OD2-NZ 3.46Å; D222-K308 PolarHBondContact OD2-NZ 2.75Å
223C96.3Very high94Very high1 Ų160.9 Ų60.91%0.00733%0.329CS..Hα-helixtrans-68-36.3177.5-67.70000112.8I219 W220 D221 G226 G227 R228 L229 L301I219-C223 WeakPolarHBondContact O-CB 3.47Å; I219-C223 PolarHBondContact O-N 2.88Å; I219-C223 PolarHBondContact O-SG 3.29Å; W220-C223 PolarHBondContact O-N 3.01Å; D221-C223 VanDerWaalsContact C-N 3.31Å; D221-C223 PolarHBondContact O-N 3.14Å; C223-G226 PolarHBondContact O-N 3.22Å; C223-G227 PolarHBondContact O-N 3.29Å; C223-G227 VanDerWaalsContact O-N 3.17Å; C223-R228 HydrophobicContact CB-CB 4.24Å; C223-R228 PolarHBondContact O-N 3.46Å; C223-L229 HydrophobicContact CB-CD1 4.25Å; C223-L229 HydrophobicContact CB-CD2 4.02Å; C223-L229 HydrophobicContact CB-CG 3.87Å; C223-L301 HydrophobicContact CB-CD2 4.19Å; C223-L301 PolarHBondContact SG-O 3.44Å
224Y96Very high94Very high158 Ų15864.4 Ų64.462%0.6234%0.344SS*.Hα-helixtrans-61.9-50.9174.3-176.8-102.4000110.5W220 D221 G226 G227 L229W220-Y224 WeakPolarHBondContact O-CB 3.36Å; W220-Y224 PolarHBondContact O-N 3.18Å; D221-Y224 WeakPolarHBondContact O-CB 3.45Å; D221-Y224 PolarHBondContact O-N 2.88Å; Y224-G226 VanDerWaalsContact C-N 3.27Å; Y224-G226 PolarHBondContact O-N 3.04Å; Y224-G227 PolarHBondContact O-N 3.08Å; Y224-L229 HydrophobicContact CD2-CD1 4.46Å
225Q95.3Very high94Very high155 Ų15563.5 Ų63.572%0.72432%0.323SS*.Hα-helixtrans-63.4-34.3177.2-68.6176.57.400112.4D221 D222 G227D221-Q225 WeakPolarHBondContact O-CG 3.46Å; D221-Q225 PolarHBondContact O-N 3.3Å; D222-Q225 PolarHBondContact O-N 3.46Å; Q225-G227 PolarHBondContact O-N 3.29Å
226G92.9Very high93.9Very high10 Ų1066.9 Ų66.910%0.10334%0.34CS..THydrogen-bonded Turntrans-74.4-4.1174.200000115.2D222 C223 Y224 R228 Y304D222-G226 PolarHBondContact O-N 2.93Å; C223-G226 PolarHBondContact O-N 3.22Å; Y224-G226 VanDerWaalsContact C-N 3.27Å; Y224-G226 PolarHBondContact O-N 3.04Å; G226-R228 VanDerWaalsContact O-CD 3.3Å; G226-R228 WeakPolarHBondContact O-CD 3.48Å; G226-R228 PolarHBondContact O-N 3.44Å; G226-R228 PolarHBondContact O-NH1 2.97Å; G226-Y304 VanDerWaalsContact CA-OH 3.23Å; G226-Y304 WeakPolarHBondContact CA-OH 3.26Å
227G94.1Very high93.8Very high17 Ų1764.3 Ų64.318%0.17533%0.327CS..THydrogen-bonded Turntrans72.77.8-177.800000115.2C223 Y224 Q225 L229 N230C223-G227 PolarHBondContact O-N 3.29Å; C223-G227 VanDerWaalsContact O-N 3.17Å; Y224-G227 PolarHBondContact O-N 3.08Å; Q225-G227 PolarHBondContact O-N 3.29Å; G227-L229 VanDerWaalsContact C-N 3.26Å; G227-L229 PolarHBondContact O-N 2.76Å; G227-N230 WeakPolarHBondContact O-CB 2.9Å; G227-N230 PolarHBondContact O-N 3.04Å; G227-N230 PolarHBondContact O-ND2 3.39Å
228R95.1Very high93.6Very high1 Ų164.8 Ų64.80%0.00432%0.321CS..THydrogen-bonded Turntrans-71.9-20-178.4-82.172.8178.1150.81.9113.2Y81 A85 C223 G226 N230 L301 Y304 L475 P476Y81-R228 PolarHBondContact O-NH2 3.45Å; A85-R228 WeakPolarHBondContact CB-O 3.45Å; A85-R228 PolarHBondContact N-O 2.74Å; C223-R228 HydrophobicContact CB-CB 4.24Å; C223-R228 PolarHBondContact O-N 3.46Å; G226-R228 VanDerWaalsContact O-CD 3.3Å; G226-R228 WeakPolarHBondContact O-CD 3.48Å; G226-R228 PolarHBondContact O-N 3.44Å; G226-R228 PolarHBondContact O-NH1 2.97Å; R228-N230 VanDerWaalsContact C-N 3.34Å; R228-L301 HydrophobicContact CB-CD2 3.68Å; R228-L301 HydrophobicContact CG-CD2 4.31Å; R228-Y304 HydrophobicContact CG-CD1 4.23Å; R228-Y304 HydrophobicContact CG-CG 4.32Å; R228-Y304 VanDerWaalsContact CZ-CD2 3.44Å; R228-L475 HydrophobicContact CB-CD1 4.37Å; R228-L475 HydrophobicContact CG-CD1 3.78Å; R228-P476 VanDerWaalsContact CZ-O 3.29Å; R228-P476 PolarHBondContact NH1-O 2.98Å; R228-P476 PolarHBondContact NH2-O 3.26Å
229L94.4Very high93.5Very high22 Ų2262.7 Ų62.712%0.11531%0.313CS..THydrogen-bonded Turntrans-90.33.4-180-58.2-174.9000113.5W220 C223 Y224 G227 L231 L301W220-L229 HydrophobicContact CD2-CD1 3.64Å; W220-L229 VanDerWaalsContact CE2-CD1 3.41Å; W220-L229 HydrophobicContact CE3-CD1 4.13Å; W220-L229 HydrophobicContact CE3-CD2 4.39Å; W220-L229 HydrophobicContact CG-CD1 4.02Å; W220-L229 HydrophobicContact CH2-CD1 4.23Å; W220-L229 HydrophobicContact CH2-CD2 4.33Å; W220-L229 HydrophobicContact CZ2-CD1 3.75Å; W220-L229 HydrophobicContact CZ3-CD1 4.4Å; W220-L229 HydrophobicContact CZ3-CD2 4.2Å; C223-L229 HydrophobicContact CB-CD1 4.25Å; C223-L229 HydrophobicContact CB-CD2 4.02Å; C223-L229 HydrophobicContact CB-CG 3.87Å; Y224-L229 HydrophobicContact CD2-CD1 4.46Å; G227-L229 VanDerWaalsContact C-N 3.26Å; G227-L229 PolarHBondContact O-N 2.76Å; L229-L231 PolarHBondContact O-N 3.45Å; L229-L301 HydrophobicContact CD2-CD1 3.69Å; L229-L301 HydrophobicContact CD2-CD2 4.23Å
230N89.9Confident93.2Very high121 Ų12164.7 Ų64.765%0.64732%0.322SS*.  trans-73.876.6173.6-68-26.3000109.7G227 R228G227-N230 WeakPolarHBondContact O-CB 2.9Å; G227-N230 PolarHBondContact O-N 3.04Å; G227-N230 PolarHBondContact O-ND2 3.39Å; R228-N230 VanDerWaalsContact C-N 3.34Å
231L85.1Confident92.9Very high36 Ų3659.1 Ų59.119%0.18830%0.301CS..  trans-67.2-44.5-174.9-71.3160.1000112.1A85 W88 I89 L229 D233A85-L231 HydrophobicContact CB-CD2 3.53Å; A85-L231 HydrophobicContact CB-CG 4.41Å; A85-L231 WeakPolarHBondContact O-CD2 3.47Å; W88-L231 HydrophobicContact CB-CD2 4.05Å; W88-L231 HydrophobicContact CE3-CD1 4.25Å; W88-L231 HydrophobicContact CE3-CD2 4.24Å; I89-L231 HydrophobicContact CD1-CB 4.46Å; I89-L231 WeakPolarHBondContact CD1-O 3.45Å; L229-L231 PolarHBondContact O-N 3.45Å; L231-D233 PolarHBondContact O-N 3.27Å
232F88.4Confident92.8Very high116 Ų11656.2 Ų56.251%0.50928%0.284SS..  trans-101.187.9-166.9-57.6-74.2000111.8I89 F234 F244I89-F232 HydrophobicContact CD1-CD1 3.97Å; I89-F232 HydrophobicContact CD1-CE1 4.17Å; I89-F232 HydrophobicContact CG1-CE1 4.41Å; F232-F234 HydrophobicContact CB-CD2 4.25Å; F232-F234 HydrophobicContact CB-CE2 3.67Å; F232-F234 HydrophobicContact CB-CZ 4.2Å; F232-F234 HydrophobicContact CD1-CZ 4.31Å; F232-F234 HydrophobicContact CG-CE2 4.39Å; F232-F244 HydrophobicContact CD1-CD2 4.07Å
233D91.1Very high92.7Very high56 Ų5656.1 Ų56.130%0.29928%0.284SS..  trans-92.3110.9162.8-175.1-3.6000109.2L231 D235 K240 T243 F244L231-D233 PolarHBondContact O-N 3.27Å; D233-D235 VanDerWaalsContact C-N 3.34Å; D233-D235 VanDerWaalsContact OD1-CB 3.27Å; D233-D235 WeakPolarHBondContact OD1-CB 3.43Å; D233-D235 PolarHBondContact OD1-N 3.5Å; D233-K240 IonicContact OD2-NZ 2.73Å; D233-K240 PolarHBondContact OD2-NZ 2.92Å; D233-T243 CarbonylContact O-C 3.49Å; D233-T243 WeakPolarHBondContact O-CB 3.31Å; D233-F244 WeakPolarHBondContact O-CB 3.37Å; D233-F244 PolarHBondContact O-N 3.42Å
234F94.2Very high92.6Very high117 Ų11757.8 Ų57.851%0.51329%0.291SS..  trans-91.411.6-179-73.1-76.5000114.1F232 P236 F244 W245F232-F234 HydrophobicContact CB-CD2 4.25Å; F232-F234 HydrophobicContact CB-CE2 3.67Å; F232-F234 HydrophobicContact CB-CZ 4.2Å; F232-F234 HydrophobicContact CD1-CZ 4.31Å; F232-F234 HydrophobicContact CG-CE2 4.39Å; F234-P236 WeakPolarHBondContact O-CD 3.36Å; F234-F244 HydrophobicContact CD1-CB 3.88Å; F234-F244 AromaticContact CD1-CD1 3.82Å; F234-F244 HydrophobicContact CD1-CD1 3.82Å; F234-F244 AromaticContact CD1-CG 3.83Å; F234-F244 HydrophobicContact CD1-CG 3.83Å; F234-F244 HydrophobicContact CE1-CB 4Å; F234-F244 AromaticContact CE1-CD1 3.58Å; F234-F244 HydrophobicContact CE1-CD1 3.58Å; F234-F244 AromaticContact CE1-CD2 3.85Å; F234-F244 HydrophobicContact CE1-CD2 3.85Å; F234-F244 AromaticContact CE1-CE1 3.96Å; F234-F244 HydrophobicContact CE1-CE1 3.96Å; F234-F244 HydrophobicContact CE1-CE2 4.2Å; F234-F244 AromaticContact CE1-CG 3.51Å; F234-F244 HydrophobicContact CE1-CG 3.51Å; F234-F244 HydrophobicContact CE1-CZ 4.24Å; F234-F244 HydrophobicContact CZ-CD2 4.29Å; F234-F244 HydrophobicContact CZ-CG 4.34Å; F234-W245 PolarHBondContact O-NE1 2.76Å; F234-W245 VanDerWaalsContact O-NE1 3.1Å
235D93.4Very high92.6Very high54 Ų5455.4 Ų55.429%0.28928%0.281SS..  trans-59122174.7-166.8-32.4000111D233 D237 K240 T243D233-D235 VanDerWaalsContact C-N 3.34Å; D233-D235 VanDerWaalsContact OD1-CB 3.27Å; D233-D235 WeakPolarHBondContact OD1-CB 3.43Å; D233-D235 PolarHBondContact OD1-N 3.5Å; D235-D237 VanDerWaalsContact C-N 3.26Å; D235-D237 PolarHBondContact O-N 3.26Å; D235-D237 VanDerWaalsContact OD1-CB 3.29Å; D235-D237 WeakPolarHBondContact OD1-CB 3.36Å; D235-D237 PolarHBondContact OD1-N 3.08Å; D235-K240 HydrophobicContact CB-CD 3.95Å; D235-K240 WeakPolarHBondContact OD2-CE 3.33Å; D235-K240 IonicContact OD2-NZ 2.81Å; D235-K240 PolarHBondContact OD2-NZ 3.45Å; D235-T243 HydrophobicContact CB-CG2 4.35Å; D235-T243 WeakPolarHBondContact O-CB 3.17Å; D235-T243 WeakPolarHBondContact O-CG2 3.16Å; D235-T243 PolarHBondContact O-OG1 2.96Å
236P92.4Very high92.6Very high97 Ų9748 Ų4863%0.6325%0.247SC*.  trans-78.1-2.6-178.733.7-37000114.1F234 P238F234-P236 WeakPolarHBondContact O-CD 3.36Å; P236-P238 VanDerWaalsContact O-CD 3.25Å; P236-P238 WeakPolarHBondContact O-CD 3.49Å; P236-P238 VanDerWaalsContact O-N 3.13Å
237D93.1Very high92.7Very high36 Ų3647.5 Ų47.519%0.19324%0.242CC..  trans-59.3112.7178.7-176.71.6000111.2D235 L239 K240 K471D235-D237 VanDerWaalsContact C-N 3.26Å; D235-D237 PolarHBondContact O-N 3.26Å; D235-D237 VanDerWaalsContact OD1-CB 3.29Å; D235-D237 WeakPolarHBondContact OD1-CB 3.36Å; D235-D237 PolarHBondContact OD1-N 3.08Å; D237-L239 PolarHBondContact O-N 2.93Å; D237-L239 VanDerWaalsContact OD1-CB 3.23Å; D237-L239 WeakPolarHBondContact OD1-CB 3.28Å; D237-L239 VanDerWaalsContact OD1-CG 3.26Å; D237-L239 WeakPolarHBondContact OD1-CG 3.1Å; D237-L239 PolarHBondContact OD1-N 3.37Å; D237-K240 HydrophobicContact CB-CD 4.4Å; D237-K240 HydrophobicContact CB-CG 4.24Å; D237-K240 PolarHBondContact O-N 3.42Å; D237-K471 IonicContact OD2-NZ 3.89Å; D237-K471 PolarHBondContact OD2-NZ 3.34Å
238P91.8Very high92.8Very high58 Ų5847.5 Ų47.538%0.37724%0.238SC..THydrogen-bonded Turntrans-73-9.2-177.433.1-37.6000113.4P236 K240 L519 S520 Y523P236-P238 VanDerWaalsContact O-CD 3.25Å; P236-P238 WeakPolarHBondContact O-CD 3.49Å; P236-P238 VanDerWaalsContact O-N 3.13Å; P238-K240 VanDerWaalsContact C-N 3.33Å; P238-L519 HydrophobicContact CB-CD1 3.99Å; P238-S520 PolarHBondContact O-N 3.33Å; P238-S520 VanDerWaalsContact O-N 3.08Å; P238-Y523 HydrophobicContact CB-CD2 3.9Å; P238-Y523 HydrophobicContact CB-CE2 3.71Å
239L93Very high92.9Very high34 Ų3450.1 Ų50.118%0.17825%0.254CS..THydrogen-bonded Turntrans-81.3-16.4176.4-51.1-178.5000112.1D237 K471 S515 S518 L519D237-L239 PolarHBondContact O-N 2.93Å; D237-L239 VanDerWaalsContact OD1-CB 3.23Å; D237-L239 WeakPolarHBondContact OD1-CB 3.28Å; D237-L239 VanDerWaalsContact OD1-CG 3.26Å; D237-L239 WeakPolarHBondContact OD1-CG 3.1Å; D237-L239 PolarHBondContact OD1-N 3.37Å; L239-K471 HydrophobicContact CB-CD 4.02Å; L239-S515 WeakPolarHBondContact CD2-O 3.34Å; L239-S518 CarbonylContact C-O 3.55Å; L239-S518 VanDerWaalsContact CA-O 3.31Å; L239-S518 WeakPolarHBondContact CA-O 3.31Å; L239-L519 HydrophobicContact CD2-CB 4.44Å
240K91.6Very high92.9Very high44 Ų4449.1 Ų49.119%0.19125%0.249CC..SBendtrans-71.6134.4175.5-78.7-175.7163.2-1710110.6D233 D235 D237 P238 H242 T243 T246 K471 S520D233-K240 IonicContact OD2-NZ 2.73Å; D233-K240 PolarHBondContact OD2-NZ 2.92Å; D235-K240 HydrophobicContact CB-CD 3.95Å; D235-K240 WeakPolarHBondContact OD2-CE 3.33Å; D235-K240 IonicContact OD2-NZ 2.81Å; D235-K240 PolarHBondContact OD2-NZ 3.45Å; D237-K240 HydrophobicContact CB-CD 4.4Å; D237-K240 HydrophobicContact CB-CG 4.24Å; D237-K240 PolarHBondContact O-N 3.42Å; P238-K240 VanDerWaalsContact C-N 3.33Å; K240-H242 PolarHBondContact O-N 3.2Å; K240-T243 HydrophobicContact CB-CG2 3.59Å; K240-T243 HydrophobicContact CD-CG2 3.81Å; K240-T243 HydrophobicContact CG-CG2 4.38Å; K240-T246 WeakPolarHBondContact O-CG2 3.41Å; K240-K471 WeakPolarHBondContact CA-O 3.44Å; K240-S520 WeakPolarHBondContact O-CB 3.33Å
241R90.6Very high93.2Very high17 Ų1743.3 Ų43.36%0.06422%0.218CC..SBendtrans-52.4-59-178.4-174.9-168-17874.9-1.9111.3E79 T246 Q413 K471 S520 Y521E79-R241 IonicContact OE1-CZ 2.69Å; E79-R241 IonicContact OE1-NE 2.65Å; E79-R241 PolarHBondContact OE1-NE 2.8Å; E79-R241 IonicContact OE1-NH2 3.68Å; E79-R241 PolarHBondContact OE1-NH2 2.84Å; E79-R241 IonicContact OE2-NH2 2.72Å; E79-R241 PolarHBondContact OE2-NH2 2.84Å; R241-T246 PolarHBondContact O-OG1 2.82Å; R241-Q413 VanDerWaalsContact NH1-CD 3.34Å; R241-Q413 VanDerWaalsContact NH2-OE1 3.1Å; R241-K471 PolarHBondContact N-O 2.82Å; R241-S520 PolarHBondContact O-OG 2.87Å; R241-Y521 HydrophobicContact CG-CE1 4.08Å
242H93.1Very high93.8Very high25 Ų2542 Ų4212%0.11621%0.211CC..SBendtrans-127.7121.4179.7-55.8156.9000111E79 A86 F87 K240 T246 I247 Y521E79-H242 IonicContact OE1-CE1 2.74Å; E79-H242 PolarHBondContact OE1-CE1 2.69Å; E79-H242 IonicContact OE1-NE2 3.66Å; E79-H242 PolarHBondContact OE1-NE2 3.05Å; A86-H242 HydrophobicContact CB-CB 3.95Å; F87-H242 AromaticContact CE1-CE1 3.61Å; F87-H242 AromaticContact CE1-NE2 3.46Å; F87-H242 WeakPolarHBondContact CE1-NE2 3.08Å; K240-H242 PolarHBondContact O-N 3.2Å; H242-T246 WeakPolarHBondContact CA-OG1 3.47Å; H242-I247 HydrophobicContact CB-CD1 4.25Å; H242-Y521 PolarHBondContact NE2-OH 2.96Å; H242-Y521 VanDerWaalsContact NE2-OH 3.09Å
243T94.4Very high94.2Very high4 Ų438 Ų383%0.02520%0.196CC..  trans-138.2169.3165.270.70000107.4D233 D235 K240 W245 T246 I247D233-T243 CarbonylContact O-C 3.49Å; D233-T243 WeakPolarHBondContact O-CB 3.31Å; D235-T243 HydrophobicContact CB-CG2 4.35Å; D235-T243 WeakPolarHBondContact O-CB 3.17Å; D235-T243 WeakPolarHBondContact O-CG2 3.16Å; D235-T243 PolarHBondContact O-OG1 2.96Å; K240-T243 HydrophobicContact CB-CG2 3.59Å; K240-T243 HydrophobicContact CD-CG2 3.81Å; K240-T243 HydrophobicContact CG-CG2 4.38Å; T243-W245 PolarHBondContact O-N 3.23Å; T243-W245 PolarHBondContact OG1-N 2.96Å; T243-T246 HydrophobicContact CG2-CG2 4.36Å; T243-T246 PolarHBondContact N-OG1 3.28Å; T243-T246 PolarHBondContact O-N 3.45Å; T243-T246 PolarHBondContact O-OG1 3.4Å; T243-T246 VanDerWaalsContact OG1-CG2 3.24Å; T243-T246 WeakPolarHBondContact OG1-CG2 3.31Å; T243-T246 PolarHBondContact OG1-N 2.95Å; T243-I247 WeakPolarHBondContact O-CG1 3.16Å; T243-I247 PolarHBondContact O-N 2.95Å; T243-I247 VanDerWaalsContact O-N 3.09Å
244F95.3Very high94.4Very high36 Ų3635.3 Ų35.316%0.15818%0.182CC..Hα-helixtrans-51.5-43.6171.5178.8-93.9000110.9I89 I92 F232 D233 F234 V248I89-F244 HydrophobicContact CD1-CD2 4.41Å; I89-F244 HydrophobicContact CG2-CD2 4.34Å; I92-F244 HydrophobicContact CD1-CE2 4.13Å; F232-F244 HydrophobicContact CD1-CD2 4.07Å; D233-F244 WeakPolarHBondContact O-CB 3.37Å; D233-F244 PolarHBondContact O-N 3.42Å; F234-F244 HydrophobicContact CD1-CB 3.88Å; F234-F244 AromaticContact CD1-CD1 3.82Å; F234-F244 HydrophobicContact CD1-CD1 3.82Å; F234-F244 AromaticContact CD1-CG 3.83Å; F234-F244 HydrophobicContact CD1-CG 3.83Å; F234-F244 HydrophobicContact CE1-CB 4Å; F234-F244 AromaticContact CE1-CD1 3.58Å; F234-F244 HydrophobicContact CE1-CD1 3.58Å; F234-F244 AromaticContact CE1-CD2 3.85Å; F234-F244 HydrophobicContact CE1-CD2 3.85Å; F234-F244 AromaticContact CE1-CE1 3.96Å; F234-F244 HydrophobicContact CE1-CE1 3.96Å; F234-F244 HydrophobicContact CE1-CE2 4.2Å; F234-F244 AromaticContact CE1-CG 3.51Å; F234-F244 HydrophobicContact CE1-CG 3.51Å; F234-F244 HydrophobicContact CE1-CZ 4.24Å; F234-F244 HydrophobicContact CZ-CD2 4.29Å; F234-F244 HydrophobicContact CZ-CG 4.34Å; F244-V248 HydrophobicContact CD1-CG2 4.41Å; F244-V248 HydrophobicContact CD2-CG2 4.11Å; F244-V248 HydrophobicContact CE1-CB 4.49Å; F244-V248 HydrophobicContact CE1-CG2 4.15Å; F244-V248 HydrophobicContact CE2-CG2 3.83Å; F244-V248 HydrophobicContact CG-CG2 4.4Å; F244-V248 HydrophobicContact CZ-CG2 3.85Å; F244-V248 VanDerWaalsContact O-CB 3.24Å; F244-V248 WeakPolarHBondContact O-CB 3.5Å; F244-V248 VanDerWaalsContact O-CG2 3.25Å; F244-V248 WeakPolarHBondContact O-CG2 3.46Å; F244-V248 PolarHBondContact O-N 3.12Å
245W95.6Very high94.5Very high107 Ų10730.2 Ų30.241%0.40516%0.159SC..Hα-helixtrans-69.8-40.7-179.4-57.9110.1000112.8F234 T243 I247 V249 Y523F234-W245 PolarHBondContact O-NE1 2.76Å; F234-W245 VanDerWaalsContact O-NE1 3.1Å; T243-W245 PolarHBondContact O-N 3.23Å; T243-W245 PolarHBondContact OG1-N 2.96Å; W245-I247 VanDerWaalsContact C-N 3.34Å; W245-I247 PolarHBondContact O-N 2.96Å; W245-V249 HydrophobicContact CE3-CG2 4.08Å; W245-V249 WeakPolarHBondContact O-CA 3.31Å; W245-V249 VanDerWaalsContact O-CB 3.24Å; W245-V249 WeakPolarHBondContact O-CB 3.22Å; W245-V249 PolarHBondContact O-N 3.38Å; W245-Y523 PolarHBondContact O-OH 2.91Å; W245-Y523 VanDerWaalsContact O-OH 3.06Å
246T94.5Very high94.7Very high0 Ų027.9 Ų27.90%015%0.148CC..Iπ-helixtrans-66.6-40.2-178.973.30000111K240 R241 H242 T243 G250 G251 Y523K240-T246 WeakPolarHBondContact O-CG2 3.41Å; R241-T246 PolarHBondContact O-OG1 2.82Å; H242-T246 WeakPolarHBondContact CA-OG1 3.47Å; T243-T246 HydrophobicContact CG2-CG2 4.36Å; T243-T246 PolarHBondContact N-OG1 3.28Å; T243-T246 PolarHBondContact O-N 3.45Å; T243-T246 PolarHBondContact O-OG1 3.4Å; T243-T246 VanDerWaalsContact OG1-CG2 3.24Å; T243-T246 WeakPolarHBondContact OG1-CG2 3.31Å; T243-T246 PolarHBondContact OG1-N 2.95Å; T246-G250 VanDerWaalsContact O-CA 3.25Å; T246-G250 WeakPolarHBondContact O-CA 3.3Å; T246-G250 PolarHBondContact O-N 3.18Å; T246-G250 VanDerWaalsContact O-N 3.12Å; T246-G251 PolarHBondContact O-N 2.73Å; T246-G251 VanDerWaalsContact O-N 3.09Å; T246-Y523 WeakPolarHBondContact CA-OH 3.05Å; T246-Y523 HydrophobicContact CG2-CD2 4.1Å; T246-Y523 HydrophobicContact CG2-CE2 3.36Å; T246-Y523 PolarHBondContact N-OH 2.72Å
247I95.3Very high94.8Very high0 Ų023.2 Ų23.20%012%0.118CC..Iπ-helixtrans-76-46179.9-62.2-177000111.7A86 I89 F90 S93 H242 T243 W245 G251 L522A86-I247 VanDerWaalsContact C-CD1 3.48Å; A86-I247 HydrophobicContact CB-CD1 3.66Å; A86-I247 WeakPolarHBondContact O-CD1 3.36Å; I89-I247 HydrophobicContact CB-CG2 3.94Å; I89-I247 HydrophobicContact CG2-CB 4.3Å; I89-I247 HydrophobicContact CG2-CG2 3.85Å; F90-I247 HydrophobicContact CD1-CG2 3.63Å; F90-I247 HydrophobicContact CD2-CG2 4.37Å; F90-I247 HydrophobicContact CE1-CG2 3.81Å; F90-I247 HydrophobicContact CG-CG2 3.92Å; F90-I247 HydrophobicContact CZ-CG2 4.25Å; S93-I247 PolarHBondContact OG-O 3.02Å; H242-I247 HydrophobicContact CB-CD1 4.25Å; T243-I247 WeakPolarHBondContact O-CG1 3.16Å; T243-I247 PolarHBondContact O-N 2.95Å; T243-I247 VanDerWaalsContact O-N 3.09Å; W245-I247 VanDerWaalsContact C-N 3.34Å; W245-I247 PolarHBondContact O-N 2.96Å; I247-G251 WeakPolarHBondContact O-CA 3.44Å; I247-G251 PolarHBondContact O-N 3.31Å; I247-G251 VanDerWaalsContact O-N 3.15Å; I247-L522 HydrophobicContact CG1-CD1 3.97Å
248V96.8Very high94.9Very high16 Ų1621.5 Ų21.510%0.09711%0.108CC..Iπ-helixtrans-72.4-55.9-178.9176.70000110.3I89 I92 I96 F244 S252I89-V248 HydrophobicContact CG2-CG2 3.63Å; I92-V248 HydrophobicContact CB-CG2 4.34Å; I92-V248 HydrophobicContact CD1-CG2 4.42Å; I92-V248 HydrophobicContact CG2-CG1 4.13Å; I92-V248 HydrophobicContact CG2-CG2 4.26Å; I96-V248 HydrophobicContact CD1-CG1 4.09Å; F244-V248 HydrophobicContact CD1-CG2 4.41Å; F244-V248 HydrophobicContact CD2-CG2 4.11Å; F244-V248 HydrophobicContact CE1-CB 4.49Å; F244-V248 HydrophobicContact CE1-CG2 4.15Å; F244-V248 HydrophobicContact CE2-CG2 3.83Å; F244-V248 HydrophobicContact CG-CG2 4.4Å; F244-V248 HydrophobicContact CZ-CG2 3.85Å; F244-V248 VanDerWaalsContact O-CB 3.24Å; F244-V248 WeakPolarHBondContact O-CB 3.5Å; F244-V248 VanDerWaalsContact O-CG2 3.25Å; F244-V248 WeakPolarHBondContact O-CG2 3.46Å; F244-V248 PolarHBondContact O-N 3.12Å; V248-S252 WeakPolarHBondContact O-CB 3.32Å; V248-S252 PolarHBondContact O-N 3.36Å; V248-S252 PolarHBondContact O-OG 2.96Å
249V96.7Very high95Very high57 Ų5718.8 Ų18.835%0.3459%0.091SC..Iπ-helixtrans-75.6-56.6-174.7-175.40000111.3W245 S252 V253 Y523 L526W245-V249 HydrophobicContact CE3-CG2 4.08Å; W245-V249 WeakPolarHBondContact O-CA 3.31Å; W245-V249 VanDerWaalsContact O-CB 3.24Å; W245-V249 WeakPolarHBondContact O-CB 3.22Å; W245-V249 PolarHBondContact O-N 3.38Å; V249-S252 PolarHBondContact O-N 3.29Å; V249-V253 PolarHBondContact O-N 2.93Å; V249-Y523 HydrophobicContact CB-CE1 4.24Å; V249-Y523 HydrophobicContact CG1-CE1 4.34Å; V249-L526 HydrophobicContact CG1-CD2 4.04Å
250G95.8Very high95.1Very high0 Ų017.1 Ų17.10%08%0.082CC..Iπ-helixtrans-63.1-47.7-179.700000111.4T246 S252 V253 M254 L522T246-G250 VanDerWaalsContact O-CA 3.25Å; T246-G250 WeakPolarHBondContact O-CA 3.3Å; T246-G250 PolarHBondContact O-N 3.18Å; T246-G250 VanDerWaalsContact O-N 3.12Å; G250-S252 PolarHBondContact O-N 3.04Å; G250-V253 PolarHBondContact O-N 3.32Å; G250-M254 WeakPolarHBondContact O-CB 3.19Å; G250-M254 PolarHBondContact O-N 3.38Å; G250-L522 CarbonylContact C-O 3.51Å; G250-L522 WeakPolarHBondContact CA-O 3.21Å
251G95.4Very high95.3Very high0 Ų015.2 Ų15.20%07%0.074CC..Hα-helixtrans-61.1-43.3176.700000113.8T246 I247 V253 M254 W255T246-G251 PolarHBondContact O-N 2.73Å; T246-G251 VanDerWaalsContact O-N 3.09Å; I247-G251 WeakPolarHBondContact O-CA 3.44Å; I247-G251 PolarHBondContact O-N 3.31Å; I247-G251 VanDerWaalsContact O-N 3.15Å; G251-V253 VanDerWaalsContact C-N 3.34Å; G251-V253 PolarHBondContact O-N 2.93Å; G251-M254 PolarHBondContact O-N 3.4Å; G251-W255 WeakPolarHBondContact O-CB 3.49Å; G251-W255 PolarHBondContact O-N 3.05Å
252S97.1Very high95.4Very high7 Ų714.9 Ų14.95%0.0497%0.073CC..Hα-helixtrans-59.3-43.9177.8-78.90000112.7S93 I96 V248 V249 G250 A256S93-S252 WeakPolarHBondContact CA-OG 3.17Å; I96-S252 WeakPolarHBondContact CB-OG 3.24Å; I96-S252 WeakPolarHBondContact CD1-OG 3.3Å; V248-S252 WeakPolarHBondContact O-CB 3.32Å; V248-S252 PolarHBondContact O-N 3.36Å; V248-S252 PolarHBondContact O-OG 2.96Å; V249-S252 PolarHBondContact O-N 3.29Å; G250-S252 PolarHBondContact O-N 3.04Å; S252-A256 WeakPolarHBondContact O-CB 3.39Å; S252-A256 PolarHBondContact O-N 3.17Å
253V97.5Very high95.3Very high32 Ų3213.7 Ų13.719%0.1947%0.068CC..Hα-helixtrans-68.8-40.4179.1179.60000110.9V249 G250 G251 A256 S257 L427 C525 L526V249-V253 PolarHBondContact O-N 2.93Å; G250-V253 PolarHBondContact O-N 3.32Å; G251-V253 VanDerWaalsContact C-N 3.34Å; G251-V253 PolarHBondContact O-N 2.93Å; V253-A256 PolarHBondContact O-N 3.08Å; V253-S257 PolarHBondContact O-N 2.73Å; V253-L427 HydrophobicContact CG1-CD2 3.76Å; V253-C525 HydrophobicContact CG1-CB 4.49Å; V253-L526 HydrophobicContact CG2-CD1 3.96Å
254M96Very high95Very high0 Ų013.9 Ų13.90%07%0.069CC..Hα-helixtrans-59.7-52.8174.1-175.7-174.869.300111.7F90 G250 G251 A256 S257 I258 L416 L522 C525F90-M254 HydrophobicContact CE1-CE 4.34Å; F90-M254 HydrophobicContact CZ-CE 4.44Å; G250-M254 WeakPolarHBondContact O-CB 3.19Å; G250-M254 PolarHBondContact O-N 3.38Å; G251-M254 PolarHBondContact O-N 3.4Å; M254-A256 VanDerWaalsContact C-N 3.34Å; M254-A256 PolarHBondContact O-N 3.08Å; M254-S257 WeakPolarHBondContact O-CB 3.3Å; M254-S257 PolarHBondContact O-N 2.93Å; M254-S257 VanDerWaalsContact O-N 3.14Å; M254-S257 PolarHBondContact O-OG 3.41Å; M254-I258 HydrophobicContact CG-CD1 4.1Å; M254-I258 WeakPolarHBondContact O-CG1 3.37Å; M254-I258 PolarHBondContact O-N 3.4Å; M254-L416 HydrophobicContact CE-CD1 4.36Å; M254-L416 HydrophobicContact CE-CD2 3.74Å; M254-L416 HydrophobicContact CE-CG 4.45Å; M254-L416 HydrophobicContact SD-CB 4Å; M254-L416 HydrophobicContact SD-CD2 3.93Å; M254-L416 HydrophobicContact SD-CG 4.43Å; M254-L522 HydrophobicContact CE-CD2 3.53Å; M254-L522 HydrophobicContact SD-CD2 3.76Å; M254-C525 HydrophobicContact CB-CB 3.95Å; M254-C525 HydrophobicContact CG-CB 4.42Å
255W95.8Very high94.9Very high10 Ų1012.3 Ų12.34%0.0386%0.062CC..Hα-helixtrans-64.1-39178.9-73.6115.7000111.8F67 F90 Y94 M97 G251 S257 I258 Y259F67-W255 HydrophobicContact CD1-CE3 4.38Å; F67-W255 AromaticContact CD1-CH2 3.39Å; F67-W255 HydrophobicContact CD1-CH2 3.39Å; F67-W255 AromaticContact CD1-CZ3 3.17Å; F67-W255 HydrophobicContact CD1-CZ3 3.17Å; F67-W255 HydrophobicContact CE1-CE3 4.2Å; F67-W255 AromaticContact CE1-CH2 3.3Å; F67-W255 HydrophobicContact CE1-CH2 3.3Å; F67-W255 HydrophobicContact CE1-CZ2 4.4Å; F67-W255 AromaticContact CE1-CZ3 3.18Å; F67-W255 HydrophobicContact CE1-CZ3 3.18Å; F67-W255 HydrophobicContact CG-CZ3 4.03Å; F67-W255 HydrophobicContact CZ-CH2 4.46Å; F67-W255 HydrophobicContact CZ-CZ3 4.09Å; F90-W255 AromaticContact CD1-CD1 3.75Å; F90-W255 AromaticContact CD1-NE1 3.24Å; F90-W255 AromaticContact CE1-CD1 3.93Å; F90-W255 AromaticContact CE1-NE1 3.34Å; F90-W255 VanDerWaalsContact CE1-NE1 3.34Å; F90-W255 AromaticContact CG-NE1 3.91Å; Y94-W255 HydrophobicContact CD1-CD2 4.1Å; Y94-W255 HydrophobicContact CD1-CE3 4.46Å; Y94-W255 HydrophobicContact CD1-CG 4.18Å; Y94-W255 AromaticContact CE1-CD2 3.58Å; Y94-W255 HydrophobicContact CE1-CD2 3.58Å; Y94-W255 AromaticContact CE1-CE2 3.38Å; Y94-W255 AromaticContact CE1-CE3 3.92Å; Y94-W255 HydrophobicContact CE1-CE3 3.92Å; Y94-W255 HydrophobicContact CE1-CG 4.07Å; Y94-W255 AromaticContact CE1-CH2 3.9Å; Y94-W255 HydrophobicContact CE1-CH2 3.9Å; Y94-W255 AromaticContact CE1-CZ2 3.59Å; Y94-W255 HydrophobicContact CE1-CZ2 3.59Å; Y94-W255 HydrophobicContact CE1-CZ3 4.04Å; Y94-W255 AromaticContact CE1-NE1 3.7Å; Y94-W255 AromaticContact CZ-CZ2 3.98Å; Y94-W255 WeakPolarHBondContact OH-CZ2 3.45Å; M97-W255 HydrophobicContact CB-CB 3.89Å; M97-W255 VanDerWaalsContact CG-C 3.4Å; M97-W255 HydrophobicContact CG-CB 3.83Å; M97-W255 WeakPolarHBondContact CG-O 3.4Å; G251-W255 WeakPolarHBondContact O-CB 3.49Å; G251-W255 PolarHBondContact O-N 3.05Å; W255-S257 VanDerWaalsContact C-N 3.32Å; W255-S257 PolarHBondContact O-N 2.91Å; W255-I258 HydrophobicContact CD2-CD1 4.31Å; W255-I258 HydrophobicContact CE3-CD1 3.89Å; W255-I258 HydrophobicContact CE3-CG2 4.39Å; W255-I258 HydrophobicContact CZ3-CD1 4.24Å; W255-I258 WeakPolarHBondContact O-CB 3.44Å; W255-I258 PolarHBondContact O-N 2.76Å; W255-Y259 HydrophobicContact CE3-CD2 4.23Å; W255-Y259 AromaticContact CE3-CE2 3.92Å; W255-Y259 HydrophobicContact CE3-CE2 3.92Å; W255-Y259 HydrophobicContact CZ3-CE2 4.09Å; W255-Y259 PolarHBondContact O-N 2.86Å
256A96.7Very high94.8Very high5 Ų57.3 Ų7.34%0.0414%0.043CC..Hα-helixtrans-59-44.417300000110.7I100 S252 V253 M254 I258 Y259 S260I100-A256 HydrophobicContact CG2-CB 4.38Å; S252-A256 WeakPolarHBondContact O-CB 3.39Å; S252-A256 PolarHBondContact O-N 3.17Å; V253-A256 PolarHBondContact O-N 3.08Å; M254-A256 VanDerWaalsContact C-N 3.34Å; M254-A256 PolarHBondContact O-N 3.08Å; A256-I258 VanDerWaalsContact C-N 3.3Å; A256-I258 PolarHBondContact O-N 2.88Å; A256-Y259 PolarHBondContact O-N 3.38Å; A256-S260 WeakPolarHBondContact O-CA 3.42Å; A256-S260 WeakPolarHBondContact O-CB 3.31Å; A256-S260 PolarHBondContact O-N 3.32Å; A256-S260 PolarHBondContact O-OG 3.35Å; A256-S260 VanDerWaalsContact O-OG 3.08Å
257S95.8Very high94.5Very high0 Ų07.4 Ų7.40%04%0.044CC..Hα-helixtrans-59.4-41.6175.4800000112.2V253 M254 W255 Y259 I261 S423 C525V253-S257 PolarHBondContact O-N 2.73Å; M254-S257 WeakPolarHBondContact O-CB 3.3Å; M254-S257 PolarHBondContact O-N 2.93Å; M254-S257 VanDerWaalsContact O-N 3.14Å; M254-S257 PolarHBondContact O-OG 3.41Å; W255-S257 VanDerWaalsContact C-N 3.32Å; W255-S257 PolarHBondContact O-N 2.91Å; S257-Y259 PolarHBondContact O-N 3.29Å; S257-I261 WeakPolarHBondContact O-CG1 3.28Å; S257-I261 PolarHBondContact O-N 3.47Å; S257-S423 WeakPolarHBondContact OG-CB 3.47Å; S257-C525 PolarHBondContact OG-SG 3.35Å
258I94.2Very high94.2Very high0 Ų07.5 Ų7.50%04%0.044CC..Hα-helixtrans-64.4-43.2-179.9-73.9157.5000111.3F67 M254 W255 A256 N262 Q265 F419F67-I258 HydrophobicContact CD2-CG2 3.52Å; F67-I258 HydrophobicContact CE1-CD1 3.96Å; F67-I258 HydrophobicContact CE1-CG2 4.29Å; F67-I258 HydrophobicContact CE2-CB 4.24Å; F67-I258 HydrophobicContact CE2-CD1 4.13Å; F67-I258 HydrophobicContact CE2-CG1 4.07Å; F67-I258 HydrophobicContact CE2-CG2 3.16Å; F67-I258 HydrophobicContact CG-CG2 4.24Å; F67-I258 HydrophobicContact CZ-CB 4.33Å; F67-I258 HydrophobicContact CZ-CD1 3.4Å; F67-I258 HydrophobicContact CZ-CG1 3.84Å; F67-I258 HydrophobicContact CZ-CG2 3.59Å; M254-I258 HydrophobicContact CG-CD1 4.1Å; M254-I258 WeakPolarHBondContact O-CG1 3.37Å; M254-I258 PolarHBondContact O-N 3.4Å; W255-I258 HydrophobicContact CD2-CD1 4.31Å; W255-I258 HydrophobicContact CE3-CD1 3.89Å; W255-I258 HydrophobicContact CE3-CG2 4.39Å; W255-I258 HydrophobicContact CZ3-CD1 4.24Å; W255-I258 WeakPolarHBondContact O-CB 3.44Å; W255-I258 PolarHBondContact O-N 2.76Å; A256-I258 VanDerWaalsContact C-N 3.3Å; A256-I258 PolarHBondContact O-N 2.88Å; I258-N262 WeakPolarHBondContact O-CB 3.23Å; I258-Q265 HydrophobicContact CG2-CG 4.43Å; I258-Q265 VanDerWaalsContact O-CG 3.31Å; I258-Q265 WeakPolarHBondContact O-CG 3.4Å; I258-F419 HydrophobicContact CD1-CB 4.39Å; I258-F419 HydrophobicContact CD1-CD1 4.42Å; I258-F419 HydrophobicContact CD1-CD2 4.36Å; I258-F419 HydrophobicContact CD1-CG 4.14Å; I258-F419 HydrophobicContact CG1-CB 4.46Å; I258-F419 HydrophobicContact CG1-CD1 3.78Å; I258-F419 HydrophobicContact CG1-CE1 4.15Å; I258-F419 HydrophobicContact CG1-CG 4.01Å
259Y95Very high94Very high0 Ų06.7 Ų6.70%04%0.04CC..Hα-helixtrans-95.1-25.7-173.4-86.4-92.6000114.1L63 M97 W255 A256 S257 Q265 Y269 L282 N285 L289L63-Y259 HydrophobicContact CB-CE1 4.23Å; L63-Y259 HydrophobicContact CD2-CE1 4.26Å; L63-Y259 PolarHBondContact O-OH 3.26Å; M97-Y259 HydrophobicContact CE-CD1 3.64Å; M97-Y259 HydrophobicContact CE-CD2 3.81Å; M97-Y259 HydrophobicContact CE-CG 3.21Å; M97-Y259 HydrophobicContact CG-CD2 4.27Å; M97-Y259 HydrophobicContact CG-CG 4.47Å; M97-Y259 HydrophobicContact SD-CD1 4.3Å; M97-Y259 HydrophobicContact SD-CD2 3.51Å; M97-Y259 VanDerWaalsContact SD-CD2 3.51Å; M97-Y259 HydrophobicContact SD-CE2 4.15Å; M97-Y259 HydrophobicContact SD-CG 3.62Å; W255-Y259 HydrophobicContact CE3-CD2 4.23Å; W255-Y259 AromaticContact CE3-CE2 3.92Å; W255-Y259 HydrophobicContact CE3-CE2 3.92Å; W255-Y259 HydrophobicContact CZ3-CE2 4.09Å; W255-Y259 PolarHBondContact O-N 2.86Å; A256-Y259 PolarHBondContact O-N 3.38Å; S257-Y259 PolarHBondContact O-N 3.29Å; Y259-Q265 HydrophobicContact CD1-CB 4.29Å; Y259-Q265 HydrophobicContact CD1-CG 4.31Å; Y259-Y269 WeakPolarHBondContact O-CE1 3.35Å; Y259-Y269 PolarHBondContact O-OH 2.95Å; Y259-L282 HydrophobicContact CD1-CD2 4.07Å; Y259-N285 WeakPolarHBondContact CE1-ND2 3.37Å; Y259-N285 VanDerWaalsContact CZ-ND2 3.31Å; Y259-N285 PolarHBondContact OH-ND2 2.6Å; Y259-N285 PolarHBondContact OH-OD1 3.21Å; Y259-L289 HydrophobicContact CE2-CD1 4.08Å
260S94.9Very high93.6Very high0 Ų04.3 Ų4.30%03%0.025CC..Hα-helixtrans-86.3-29.6-176.1-66.70000113.8T101 F105 F109 A256T101-S260 PolarHBondContact OG1-OG 3.19Å; F105-S260 WeakPolarHBondContact CD1-O 3.41Å; F105-S260 VanDerWaalsContact CD2-OG 3.26Å; F105-S260 WeakPolarHBondContact CD2-OG 3.36Å; F105-S260 VanDerWaalsContact CG-CB 3.48Å; F109-S260 VanDerWaalsContact CE2-O 3.23Å; F109-S260 WeakPolarHBondContact CE2-O 3.11Å; A256-S260 WeakPolarHBondContact O-CA 3.42Å; A256-S260 WeakPolarHBondContact O-CB 3.31Å; A256-S260 PolarHBondContact O-N 3.32Å; A256-S260 PolarHBondContact O-OG 3.35Å; A256-S260 VanDerWaalsContact O-OG 3.08Å
261I94.7Very high93.2Very high3 Ų34.3 Ų4.32%0.0153%0.025CC..THydrogen-bonded Turntrans-132.4-10.8-172.163.5157.5000114.3F105 S257 Q263 L426 L427 Y430F105-I261 HydrophobicContact CD1-CG2 4.18Å; F105-I261 HydrophobicContact CE1-CG2 3.65Å; F105-I261 HydrophobicContact CZ-CG2 4.5Å; S257-I261 WeakPolarHBondContact O-CG1 3.28Å; S257-I261 PolarHBondContact O-N 3.47Å; I261-Q263 PolarHBondContact O-N 3.14Å; I261-L426 HydrophobicContact CD1-CB 3.6Å; I261-L427 HydrophobicContact CD1-CB 3.97Å; I261-L427 VanDerWaalsContact CD1-N 3.34Å; I261-L427 HydrophobicContact CG2-CD1 4.32Å; I261-Y430 HydrophobicContact CB-CD2 3.93Å; I261-Y430 HydrophobicContact CB-CE2 3.88Å; I261-Y430 HydrophobicContact CD1-CD2 4.06Å; I261-Y430 HydrophobicContact CD1-CE2 4.29Å; I261-Y430 HydrophobicContact CG2-CD1 4.08Å; I261-Y430 HydrophobicContact CG2-CD2 3.45Å; I261-Y430 VanDerWaalsContact CG2-CD2 3.45Å; I261-Y430 HydrophobicContact CG2-CE1 4.41Å; I261-Y430 HydrophobicContact CG2-CE2 3.85Å; I261-Y430 HydrophobicContact CG2-CG 3.59Å
262N92.8Very high92.9Very high11 Ų114.3 Ų4.36%0.0593%0.025CC..  trans-71.7121.5173.9-171.6-60.5000109.5I258 S264 Q265 V266I258-N262 WeakPolarHBondContact O-CB 3.23Å; N262-S264 PolarHBondContact O-N 3.37Å; N262-S264 VanDerWaalsContact O-N 3.12Å; N262-S264 VanDerWaalsContact OD1-CB 3.22Å; N262-S264 WeakPolarHBondContact OD1-CB 3.41Å; N262-S264 PolarHBondContact OD1-N 3.23Å; N262-Q265 HydrophobicContact CB-CG 4.36Å; N262-Q265 PolarHBondContact O-N 2.57Å; N262-V266 VanDerWaalsContact O-CG2 3.28Å; N262-V266 WeakPolarHBondContact O-CG2 3.47Å; N262-V266 PolarHBondContact O-N 3.05Å
263Q91.7Very high92.3Very high0 Ų08.6 Ų8.60%04%0.043CC..Hα-helixtrans-54.2-38.5-176.3-177.567.514.700112.9T115 T117 Y137 I261 Q265 V266 Q267 A361 V365T115-Q263 PolarHBondContact O-NE2 3.39Å; T117-Q263 PolarHBondContact OG1-OE1 3.33Å; Y137-Q263 HydrophobicContact CE1-CB 3.95Å; Y137-Q263 HydrophobicContact CE2-CB 3.99Å; I261-Q263 PolarHBondContact O-N 3.14Å; Q263-Q265 VanDerWaalsContact C-N 3.28Å; Q263-Q265 PolarHBondContact O-N 3.14Å; Q263-V266 PolarHBondContact O-N 3.25Å; Q263-Q267 WeakPolarHBondContact O-CB 3.49Å; Q263-Q267 PolarHBondContact O-N 3.18Å; Q263-A361 HydrophobicContact CB-CB 4.28Å; Q263-A361 HydrophobicContact CG-CB 4.07Å; Q263-V365 HydrophobicContact CB-CG1 3.89Å; Q263-V365 HydrophobicContact CG-CG1 3.55Å
264S88.8Confident92Very high7 Ų79.1 Ų9.15%0.0495%0.046CC..Hα-helixtrans-60.4-37.5-179-164.40000112.9N262 R268 S357N262-S264 PolarHBondContact O-N 3.37Å; N262-S264 VanDerWaalsContact O-N 3.12Å; N262-S264 VanDerWaalsContact OD1-CB 3.22Å; N262-S264 WeakPolarHBondContact OD1-CB 3.41Å; N262-S264 PolarHBondContact OD1-N 3.23Å; S264-R268 WeakPolarHBondContact O-CD 3.34Å; S264-R268 WeakPolarHBondContact O-CG 3.29Å; S264-S357 VanDerWaalsContact OG-C 3.27Å; S264-S357 WeakPolarHBondContact OG-CB 3.46Å; S264-S357 PolarHBondContact OG-O 3.4Å
265Q92.3Very high91.7Very high4 Ų411.4 Ų11.42%0.0196%0.058CC..Hα-helixtrans-79.5-44.9176.6-56.1-54.3-35.400111L63 I258 Y259 N262 Q263 Q267 R268 Y269L63-Q265 HydrophobicContact CD2-CB 4.29Å; I258-Q265 HydrophobicContact CG2-CG 4.43Å; I258-Q265 VanDerWaalsContact O-CG 3.31Å; I258-Q265 WeakPolarHBondContact O-CG 3.4Å; Y259-Q265 HydrophobicContact CD1-CB 4.29Å; Y259-Q265 HydrophobicContact CD1-CG 4.31Å; N262-Q265 HydrophobicContact CB-CG 4.36Å; N262-Q265 PolarHBondContact O-N 2.57Å; Q263-Q265 VanDerWaalsContact C-N 3.28Å; Q263-Q265 PolarHBondContact O-N 3.14Å; Q265-Q267 VanDerWaalsContact C-N 3.34Å; Q265-Q267 PolarHBondContact O-N 3.4Å; Q265-R268 WeakPolarHBondContact O-CB 3.17Å; Q265-R268 PolarHBondContact O-N 2.88Å; Q265-R268 VanDerWaalsContact O-N 3.14Å; Q265-Y269 VanDerWaalsContact O-CD1 3.22Å; Q265-Y269 WeakPolarHBondContact O-CD1 3.31Å; Q265-Y269 PolarHBondContact O-N 3.2Å
266V93.1Very high91.5Very high1 Ų116 Ų161%0.0069%0.087CC..Hα-helixtrans-59.1-46.6-178.3-1790000111.9F109 T117 N262 Q263 R268 Y269 I270F109-V266 HydrophobicContact CD2-CG1 3.68Å; F109-V266 HydrophobicContact CE2-CG1 3.92Å; F109-V266 HydrophobicContact CE2-CG2 4.11Å; T117-V266 HydrophobicContact CG2-CB 3.57Å; T117-V266 HydrophobicContact CG2-CG1 3.5Å; T117-V266 HydrophobicContact CG2-CG2 3.42Å; T117-V266 VanDerWaalsContact CG2-CG2 3.42Å; N262-V266 VanDerWaalsContact O-CG2 3.28Å; N262-V266 WeakPolarHBondContact O-CG2 3.47Å; N262-V266 PolarHBondContact O-N 3.05Å; Q263-V266 PolarHBondContact O-N 3.25Å; V266-R268 PolarHBondContact O-N 3.46Å; V266-R268 VanDerWaalsContact O-N 3.13Å; V266-Y269 VanDerWaalsContact CA-CE1 3.5Å; V266-Y269 VanDerWaalsContact CA-CZ 3.42Å; V266-Y269 HydrophobicContact CB-CE1 4.37Å; V266-Y269 HydrophobicContact CB-CE2 4.34Å; V266-Y269 HydrophobicContact CG1-CE2 3.83Å; V266-Y269 HydrophobicContact CG2-CE1 4.31Å; V266-Y269 WeakPolarHBondContact CG2-OH 3.48Å; V266-Y269 PolarHBondContact O-N 2.86Å; V266-I270 HydrophobicContact CG1-CD1 4.41Å; V266-I270 HydrophobicContact CG1-CG2 3.99Å; V266-I270 VanDerWaalsContact O-CG1 3.31Å; V266-I270 WeakPolarHBondContact O-CG1 3.25Å; V266-I270 WeakPolarHBondContact O-CG2 3.35Å; V266-I270 PolarHBondContact O-N 3.3Å; V266-I270 VanDerWaalsContact O-N 3.08Å
267Q88.6Confident91.4Very high2 Ų218.7 Ų18.71%0.00910%0.099CC..Hα-helixtrans-57.3-30.3-179.5-169170.84.600112.9L48 L49 L184 Q263 Q265 I270 S271 N360L48-Q267 PolarHBondContact O-NE2 3.43Å; L49-Q267 HydrophobicContact CD2-CG 4.11Å; L184-Q267 HydrophobicContact CD2-CG 4.47Å; Q263-Q267 WeakPolarHBondContact O-CB 3.49Å; Q263-Q267 PolarHBondContact O-N 3.18Å; Q265-Q267 VanDerWaalsContact C-N 3.34Å; Q265-Q267 PolarHBondContact O-N 3.4Å; Q267-I270 WeakPolarHBondContact O-CG1 3.17Å; Q267-S271 PolarHBondContact O-N 3Å; Q267-N360 PolarHBondContact NE2-ND2 3.09Å
268R89.8Confident91.2Very high2 Ų218.7 Ų18.71%0.00810%0.099CC..Hα-helixtrans-74.4-51.6-179.4-70.9172.4173.1-73.57.5112.1V59 S62 L63 S66 I188 D191 S264 Q265 V266 S271 S357V59-R268 HydrophobicContact CG1-CB 4.22Å; V59-R268 WeakPolarHBondContact CG1-O 3.45Å; S62-R268 PolarHBondContact OG-NH1 3.38Å; L63-R268 HydrophobicContact CD2-CB 3.76Å; L63-R268 HydrophobicContact CD2-CG 4.43Å; L63-R268 HydrophobicContact CG-CB 4.27Å; S66-R268 PolarHBondContact OG-NE 2.96Å; S66-R268 VanDerWaalsContact OG-NE 3.14Å; S66-R268 PolarHBondContact OG-NH2 3.22Å; I188-R268 VanDerWaalsContact CG1-NH1 3.3Å; D191-R268 IonicContact OD2-CZ 2.85Å; D191-R268 VanDerWaalsContact OD2-CZ 3.24Å; D191-R268 IonicContact OD2-NH1 2.9Å; D191-R268 PolarHBondContact OD2-NH1 2.69Å; D191-R268 VanDerWaalsContact OD2-NH1 3.1Å; D191-R268 IonicContact OD2-NH2 3.54Å; D191-R268 PolarHBondContact OD2-NH2 3.1Å; S264-R268 WeakPolarHBondContact O-CD 3.34Å; S264-R268 WeakPolarHBondContact O-CG 3.29Å; Q265-R268 WeakPolarHBondContact O-CB 3.17Å; Q265-R268 PolarHBondContact O-N 2.88Å; Q265-R268 VanDerWaalsContact O-N 3.14Å; V266-R268 PolarHBondContact O-N 3.46Å; V266-R268 VanDerWaalsContact O-N 3.13Å; R268-S271 WeakPolarHBondContact O-CB 3.22Å; R268-S271 PolarHBondContact O-N 3.13Å; R268-S271 PolarHBondContact O-OG 3.38Å; R268-S357 PolarHBondContact NH2-OG 3Å
269Y91.5Very high91.3Very high0 Ų020 Ų200%010%0.104CC..Hα-helixtrans-75.4-26.1-178.358.3-112.2000112.9T101 V106 F109 Y110 Y259 Q265 V266 S271 C272 A278 L282T101-Y269 HydrophobicContact CG2-CE1 4.2Å; V106-Y269 HydrophobicContact CG1-CD2 4.4Å; V106-Y269 HydrophobicContact CG2-CD2 3.83Å; V106-Y269 HydrophobicContact CG2-CE2 3.68Å; V106-Y269 HydrophobicContact CG2-CG 4.41Å; F109-Y269 HydrophobicContact CD2-CE2 4.41Å; Y110-Y269 PolarHBondContact OH-O 3.34Å; Y259-Y269 WeakPolarHBondContact O-CE1 3.35Å; Y259-Y269 PolarHBondContact O-OH 2.95Å; Q265-Y269 VanDerWaalsContact O-CD1 3.22Å; Q265-Y269 WeakPolarHBondContact O-CD1 3.31Å; Q265-Y269 PolarHBondContact O-N 3.2Å; V266-Y269 VanDerWaalsContact CA-CE1 3.5Å; V266-Y269 VanDerWaalsContact CA-CZ 3.42Å; V266-Y269 HydrophobicContact CB-CE1 4.37Å; V266-Y269 HydrophobicContact CB-CE2 4.34Å; V266-Y269 HydrophobicContact CG1-CE2 3.83Å; V266-Y269 HydrophobicContact CG2-CE1 4.31Å; V266-Y269 WeakPolarHBondContact CG2-OH 3.48Å; V266-Y269 PolarHBondContact O-N 2.86Å; Y269-S271 PolarHBondContact O-N 3.22Å; Y269-C272 VanDerWaalsContact O-CB 3.31Å; Y269-C272 WeakPolarHBondContact O-CB 3.1Å; Y269-C272 PolarHBondContact O-N 3.2Å; Y269-A278 VanDerWaalsContact O-CB 3.3Å; Y269-A278 WeakPolarHBondContact O-CB 3.12Å; Y269-L282 HydrophobicContact CD1-CD1 4.46Å; Y269-L282 HydrophobicContact CD1-CD2 3.98Å; Y269-L282 HydrophobicContact CD1-CG 4.42Å; Y269-L282 HydrophobicContact CE1-CD2 4.36Å
270I88.6Confident91.3Very high6 Ų623.7 Ų23.73%0.03112%0.124CC..THydrogen-bonded Turntrans-73.2-13.5171.771.4-178.9000113L49 F109 Y110 V266 Q267 C272L49-I270 HydrophobicContact CD2-CD1 4.14Å; L49-I270 HydrophobicContact CD2-CG1 4.29Å; F109-I270 HydrophobicContact CB-CG2 4.46Å; Y110-I270 HydrophobicContact CD2-CG2 4.46Å; Y110-I270 HydrophobicContact CE2-CB 4.39Å; Y110-I270 HydrophobicContact CE2-CG2 4.19Å; V266-I270 HydrophobicContact CG1-CD1 4.41Å; V266-I270 HydrophobicContact CG1-CG2 3.99Å; V266-I270 VanDerWaalsContact O-CG1 3.31Å; V266-I270 WeakPolarHBondContact O-CG1 3.25Å; V266-I270 WeakPolarHBondContact O-CG2 3.35Å; V266-I270 PolarHBondContact O-N 3.3Å; V266-I270 VanDerWaalsContact O-N 3.08Å; Q267-I270 WeakPolarHBondContact O-CG1 3.17Å; I270-C272 PolarHBondContact O-N 3.3Å
271S86.4Confident91.4Very high0 Ų023.7 Ų23.70%012%0.124CC..THydrogen-bonded Turntrans-74.4-6.8170.582.20000113.1L49 R52 Q53 M54 Q267 R268 Y269L49-S271 VanDerWaalsContact O-CB 3.3Å; L49-S271 WeakPolarHBondContact O-CB 3.37Å; R52-S271 CarbonylContact C-O 3.6Å; R52-S271 WeakPolarHBondContact CA-O 3.3Å; Q53-S271 PolarHBondContact N-O 3.44Å; M54-S271 WeakPolarHBondContact CG-OG 3.5Å; M54-S271 PolarHBondContact N-O 2.89Å; Q267-S271 PolarHBondContact O-N 3Å; R268-S271 WeakPolarHBondContact O-CB 3.22Å; R268-S271 PolarHBondContact O-N 3.13Å; R268-S271 PolarHBondContact O-OG 3.38Å; Y269-S271 PolarHBondContact O-N 3.22Å
272C88.8Confident91.4Very high0 Ų023.6 Ų23.60%012%0.123CC..BIsolated β-bridgetrans-72.3146.4175.8-71.50000112M54 Y110 Y269 I270 T274 Q277 A278M54-C272 VanDerWaalsContact O-CA 3.32Å; M54-C272 WeakPolarHBondContact O-CA 3.36Å; Y110-C272 WeakPolarHBondContact OH-CB 3.37Å; Y110-C272 PolarHBondContact OH-O 2.99Å; Y269-C272 VanDerWaalsContact O-CB 3.31Å; Y269-C272 WeakPolarHBondContact O-CB 3.1Å; Y269-C272 PolarHBondContact O-N 3.2Å; I270-C272 PolarHBondContact O-N 3.3Å; C272-T274 VanDerWaalsContact C-N 3.3Å; C272-T274 PolarHBondContact O-N 2.92Å; C272-Q277 HydrophobicContact CB-CB 3.98Å; C272-A278 HydrophobicContact CB-CB 4.07Å
273K86.2Confident91.6Very high98 Ų9826.6 Ų26.643%0.42613%0.134SC..SBendtrans-56.3-42.1-179.8-69-177.5-174.1-170.40113.5R52 Q53 M54R52-K273 WeakPolarHBondContact O-CA 3.37Å; Q53-K273 WeakPolarHBondContact O-CE 3.35Å; M54-K273 PolarHBondContact O-N 2.91Å
274T90.2Very high91.8Very high43 Ų4328.9 Ų28.926%0.26415%0.148SC..SBendtrans-134.7156-173.267.30000110.9C272 T276 Q277 A278C272-T274 VanDerWaalsContact C-N 3.3Å; C272-T274 PolarHBondContact O-N 2.92Å; T274-T276 PolarHBondContact O-N 3.5Å; T274-Q277 PolarHBondContact O-N 3.32Å; T274-Q277 VanDerWaalsContact O-N 3.08Å; T274-Q277 VanDerWaalsContact OG1-CG 3.3Å; T274-Q277 WeakPolarHBondContact OG1-CG 3.21Å; T274-Q277 PolarHBondContact OG1-N 3.37Å; T274-A278 PolarHBondContact O-N 3.37Å
275L90.4Very high92.1Very high48 Ų4828.6 Ų28.625%0.25115%0.146SC..Hα-helixtrans-53.5-41.9174.5177.459.1000111.6V106 P107 Y110 Q277 A278 K279V106-L275 HydrophobicContact CB-CD1 4.42Å; V106-L275 HydrophobicContact CG1-CD1 3.51Å; P107-L275 HydrophobicContact CB-CD2 4.48Å; P107-L275 HydrophobicContact CG-CD1 4.37Å; Y110-L275 HydrophobicContact CD1-CB 4.37Å; Y110-L275 HydrophobicContact CD2-CD1 4.02Å; Y110-L275 HydrophobicContact CG-CD1 4.03Å; L275-Q277 PolarHBondContact O-N 2.97Å; L275-A278 WeakPolarHBondContact O-CB 3.49Å; L275-A278 PolarHBondContact O-N 3.21Å; L275-K279 HydrophobicContact CD1-CG 4.38Å; L275-K279 WeakPolarHBondContact O-CG 3.39Å; L275-K279 PolarHBondContact O-N 3.05Å
276T92.1Very high92.2Very high105 Ų10531 Ų3164%0.64416%0.158SC*.Hα-helixtrans-61.9-41.4177.9-46.90000112.2T274 A278 K279 L280T274-T276 PolarHBondContact O-N 3.5Å; T276-A278 VanDerWaalsContact C-N 3.34Å; T276-K279 PolarHBondContact O-N 3.27Å; T276-L280 VanDerWaalsContact O-CB 3.24Å; T276-L280 WeakPolarHBondContact O-CB 3.44Å; T276-L280 PolarHBondContact O-N 3.22Å
277Q92.8Very high92.3Very high63 Ų6335.5 Ų35.529%0.29418%0.181SC..Hα-helixtrans-66.9-37.5176.9-70.1-72.5-36.400111.3A56 C272 T274 L275 S281A56-Q277 WeakPolarHBondContact CB-O 3.43Å; A56-Q277 VanDerWaalsContact CB-OE1 3.26Å; C272-Q277 HydrophobicContact CB-CB 3.98Å; T274-Q277 PolarHBondContact O-N 3.32Å; T274-Q277 VanDerWaalsContact O-N 3.08Å; T274-Q277 VanDerWaalsContact OG1-CG 3.3Å; T274-Q277 WeakPolarHBondContact OG1-CG 3.21Å; T274-Q277 PolarHBondContact OG1-N 3.37Å; L275-Q277 PolarHBondContact O-N 2.97Å; Q277-S281 WeakPolarHBondContact O-CB 3.22Å; Q277-S281 PolarHBondContact O-N 3.3Å
278A93.4Very high92.5Very high0 Ų036.3 Ų36.30%019%0.19CC..Hα-helixtrans-63.1-49.3174.200000111.9V106 Y110 Y269 C272 T274 L275 T276 L280 S281 L282V106-A278 HydrophobicContact CG1-CB 3.77Å; Y110-A278 HydrophobicContact CD2-CB 4.46Å; Y110-A278 HydrophobicContact CE2-CB 3.45Å; Y110-A278 VanDerWaalsContact CE2-CB 3.45Å; Y110-A278 WeakPolarHBondContact OH-CB 3.37Å; Y269-A278 VanDerWaalsContact O-CB 3.3Å; Y269-A278 WeakPolarHBondContact O-CB 3.12Å; C272-A278 HydrophobicContact CB-CB 4.07Å; T274-A278 PolarHBondContact O-N 3.37Å; L275-A278 WeakPolarHBondContact O-CB 3.49Å; L275-A278 PolarHBondContact O-N 3.21Å; T276-A278 VanDerWaalsContact C-N 3.34Å; A278-L280 PolarHBondContact O-N 3.44Å; A278-S281 WeakPolarHBondContact O-CB 3.43Å; A278-S281 PolarHBondContact O-N 2.79Å; A278-S281 PolarHBondContact O-OG 2.63Å; A278-L282 PolarHBondContact O-N 3.11Å
279K95.6Very high92.7Very high26 Ų2636.2 Ų36.211%0.11319%0.19CC..Hα-helixtrans-59.2-47.8175.4-67.6-168.4-177.7-165.50111.5A102 E103 L275 T276 S281 L282 Y283A102-K279 HydrophobicContact CB-CB 4.28Å; A102-K279 HydrophobicContact CB-CG 4.19Å; A102-K279 WeakPolarHBondContact O-CE 3.48Å; A102-K279 WeakPolarHBondContact O-CG 3.2Å; E103-K279 IonicContact OE1-NZ 3.18Å; E103-K279 IonicContact OE2-NZ 3.37Å; E103-K279 PolarHBondContact OE2-NZ 2.94Å; L275-K279 HydrophobicContact CD1-CG 4.38Å; L275-K279 WeakPolarHBondContact O-CG 3.39Å; L275-K279 PolarHBondContact O-N 3.05Å; T276-K279 PolarHBondContact O-N 3.27Å; K279-S281 PolarHBondContact O-N 3.26Å; K279-L282 PolarHBondContact O-N 3.13Å; K279-L282 VanDerWaalsContact O-N 3.1Å; K279-Y283 HydrophobicContact CB-CE2 4.34Å; K279-Y283 WeakPolarHBondContact O-CD2 3.42Å; K279-Y283 PolarHBondContact O-N 3.21Å
280L95.3Very high92.8Very high79 Ų7941.7 Ų41.741%0.41421%0.21SC..Hα-helixtrans-58.7-37.7177.5-17762.9000111.7A56 T276 A278 L282 Y283 V284A56-L280 HydrophobicContact CB-CB 3.86Å; A56-L280 HydrophobicContact CB-CD2 3.74Å; A56-L280 HydrophobicContact CB-CG 3.74Å; T276-L280 VanDerWaalsContact O-CB 3.24Å; T276-L280 WeakPolarHBondContact O-CB 3.44Å; T276-L280 PolarHBondContact O-N 3.22Å; A278-L280 PolarHBondContact O-N 3.44Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 2.85Å; L280-Y283 PolarHBondContact O-N 3.33Å; L280-V284 HydrophobicContact CD1-CG2 4.18Å; L280-V284 HydrophobicContact CG-CG2 4.31Å; L280-V284 WeakPolarHBondContact O-CG2 3.45Å; L280-V284 PolarHBondContact O-N 3.18Å
281S95.4Very high93.1Very high0 Ų044.7 Ų44.70%023%0.228CC..Hα-helixtrans-61.2-37.1177.3800000112.6A56 A60 Q277 A278 K279 N285A56-S281 WeakPolarHBondContact O-CB 3.14Å; A60-S281 WeakPolarHBondContact CB-O 3.37Å; Q277-S281 WeakPolarHBondContact O-CB 3.22Å; Q277-S281 PolarHBondContact O-N 3.3Å; A278-S281 WeakPolarHBondContact O-CB 3.43Å; A278-S281 PolarHBondContact O-N 2.79Å; A278-S281 PolarHBondContact O-OG 2.63Å; K279-S281 PolarHBondContact O-N 3.26Å; S281-N285 WeakPolarHBondContact O-CB 3.27Å; S281-N285 PolarHBondContact O-N 3.09Å
282L96Very high93.5Very high0 Ų044.7 Ų44.70%023%0.229CC..Hα-helixtrans-72.3-37.1177.7-70.4167.8000112.4L63 M97 S98 T101 A102 V106 Y259 Y269 A278 K279 L280 N285 M286L63-L282 HydrophobicContact CD1-CD2 4.15Å; M97-L282 HydrophobicContact CE-CD2 4.2Å; S98-L282 PolarHBondContact OG-O 3.07Å; S98-L282 VanDerWaalsContact OG-O 3.11Å; T101-L282 HydrophobicContact CG2-CD1 3.68Å; T101-L282 HydrophobicContact CG2-CD2 4.2Å; A102-L282 HydrophobicContact CB-CB 4.38Å; A102-L282 HydrophobicContact CB-CD1 3.86Å; V106-L282 HydrophobicContact CG2-CD1 3.47Å; V106-L282 VanDerWaalsContact CG2-CD1 3.47Å; Y259-L282 HydrophobicContact CD1-CD2 4.07Å; Y269-L282 HydrophobicContact CD1-CD1 4.46Å; Y269-L282 HydrophobicContact CD1-CD2 3.98Å; Y269-L282 HydrophobicContact CD1-CG 4.42Å; Y269-L282 HydrophobicContact CE1-CD2 4.36Å; A278-L282 PolarHBondContact O-N 3.11Å; K279-L282 PolarHBondContact O-N 3.13Å; K279-L282 VanDerWaalsContact O-N 3.1Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 2.85Å; L282-N285 PolarHBondContact O-N 3.48Å; L282-M286 PolarHBondContact O-N 3.36Å
283Y96.4Very high93.7Very high75 Ų7544.8 Ų44.829%0.29423%0.229SC..Hα-helixtrans-70.4-37.9175.3-68.1-58.7000112.4I99 A102 E103 K279 L280 M286I99-Y283 HydrophobicContact CG1-CE1 4.29Å; A102-Y283 HydrophobicContact CB-CE2 4.07Å; E103-Y283 PolarHBondContact OE1-OH 2.94Å; K279-Y283 HydrophobicContact CB-CE2 4.34Å; K279-Y283 WeakPolarHBondContact O-CD2 3.42Å; K279-Y283 PolarHBondContact O-N 3.21Å; L280-Y283 PolarHBondContact O-N 3.33Å; Y283-M286 VanDerWaalsContact O-CB 3.32Å; Y283-M286 WeakPolarHBondContact O-CB 3.45Å; Y283-M286 PolarHBondContact O-N 3.14Å
284V95.6Very high94.2Very high48 Ų4841.8 Ų41.829%0.29122%0.221SC..Hα-helixtrans-69-38.5172.9176.40000110.6A60 L280 M286 I287 G288A60-V284 HydrophobicContact CB-CB 3.61Å; A60-V284 HydrophobicContact CB-CG1 3.53Å; L280-V284 HydrophobicContact CD1-CG2 4.18Å; L280-V284 HydrophobicContact CG-CG2 4.31Å; L280-V284 WeakPolarHBondContact O-CG2 3.45Å; L280-V284 PolarHBondContact O-N 3.18Å; V284-M286 VanDerWaalsContact C-N 3.3Å; V284-M286 PolarHBondContact O-N 3.03Å; V284-I287 PolarHBondContact O-N 3.29Å; V284-G288 PolarHBondContact O-N 3.44Å; V284-G288 VanDerWaalsContact O-N 3.13Å
285N94.8Very high94.5Very high0 Ų041.6 Ų41.60%022%0.218CC..Hα-helixtrans-59.1-39.7174.2171.870.5000112.2A60 L63 T64 Y259 S281 L282 I287 G288 L289A60-N285 HydrophobicContact CB-CB 4.34Å; L63-N285 VanDerWaalsContact C-OD1 3.23Å; L63-N285 HydrophobicContact CB-CB 4.12Å; L63-N285 WeakPolarHBondContact CB-OD1 3.14Å; L63-N285 HydrophobicContact CD1-CB 4.28Å; T64-N285 VanDerWaalsContact CA-OD1 3.27Å; T64-N285 WeakPolarHBondContact CA-OD1 3.25Å; T64-N285 PolarHBondContact N-OD1 3.08Å; T64-N285 PolarHBondContact OG1-O 3.07Å; T64-N285 PolarHBondContact OG1-OD1 3.11Å; Y259-N285 WeakPolarHBondContact CE1-ND2 3.37Å; Y259-N285 VanDerWaalsContact CZ-ND2 3.31Å; Y259-N285 PolarHBondContact OH-ND2 2.6Å; Y259-N285 PolarHBondContact OH-OD1 3.21Å; S281-N285 WeakPolarHBondContact O-CB 3.27Å; S281-N285 PolarHBondContact O-N 3.09Å; L282-N285 PolarHBondContact O-N 3.48Å; N285-I287 VanDerWaalsContact C-N 3.27Å; N285-I287 PolarHBondContact O-N 3.41Å; N285-G288 PolarHBondContact O-N 3.45Å; N285-G288 VanDerWaalsContact O-N 3.09Å; N285-L289 WeakPolarHBondContact ND2-CD1 3.49Å; N285-L289 WeakPolarHBondContact O-CG 3.47Å; N285-L289 PolarHBondContact O-N 3.31Å
286M95.1Very high94.7Very high55 Ų5539.3 Ų39.327%0.27121%0.206SC..Hα-helixtrans-52.9-45.2174.9-175.2-167.672.200112A95 L282 Y283 V284 W290A95-M286 VanDerWaalsContact CA-SD 3.55Å; A95-M286 HydrophobicContact CB-SD 3.8Å; L282-M286 PolarHBondContact O-N 3.36Å; Y283-M286 VanDerWaalsContact O-CB 3.32Å; Y283-M286 WeakPolarHBondContact O-CB 3.45Å; Y283-M286 PolarHBondContact O-N 3.14Å; V284-M286 VanDerWaalsContact C-N 3.3Å; V284-M286 PolarHBondContact O-N 3.03Å; M286-W290 PolarHBondContact O-N 3.09Å
287I94.7Very high94.9Very high96 Ų9634.5 Ų34.549%0.49218%0.176SC..Hα-helixtrans-65.6-45.1178.1-59.8170.1000109.9V284 N285 L289 W290 V291V284-I287 PolarHBondContact O-N 3.29Å; N285-I287 VanDerWaalsContact C-N 3.27Å; N285-I287 PolarHBondContact O-N 3.41Å; I287-L289 PolarHBondContact O-N 3.34Å; I287-W290 PolarHBondContact O-N 3.3Å; I287-V291 HydrophobicContact CG2-CG2 4.33Å; I287-V291 WeakPolarHBondContact O-CG2 3.47Å; I287-V291 PolarHBondContact O-N 2.89Å
288G93.2Very high95.2Very high19 Ų1933.6 Ų33.620%0.19617%0.171CC..Hα-helixtrans-57.9-45.8177.300000113.2T64 V284 N285 T292T64-G288 VanDerWaalsContact CG2-C 3.48Å; V284-G288 PolarHBondContact O-N 3.44Å; V284-G288 VanDerWaalsContact O-N 3.13Å; N285-G288 PolarHBondContact O-N 3.45Å; N285-G288 VanDerWaalsContact O-N 3.09Å; G288-T292 WeakPolarHBondContact O-CB 3.3Å; G288-T292 PolarHBondContact O-N 3.48Å; G288-T292 PolarHBondContact O-OG1 2.87Å
289L94.1Very high95.3Very high0 Ų033.6 Ų33.60%017%0.172CC..Hα-helixtrans-61.5-45.7175.6-70.5175.2000111.5T64 M68 Y94 Y259 N285 I287 T292 V293T64-L289 HydrophobicContact CG2-CD2 4.24Å; M68-L289 HydrophobicContact CG-CD2 3.78Å; M68-L289 HydrophobicContact SD-CD2 3.75Å; Y94-L289 HydrophobicContact CD1-CB 4.4Å; Y94-L289 HydrophobicContact CD1-CD1 3.72Å; Y94-L289 HydrophobicContact CD2-CB 3.76Å; Y94-L289 HydrophobicContact CD2-CD1 4.5Å; Y94-L289 HydrophobicContact CE1-CB 4.36Å; Y94-L289 HydrophobicContact CE1-CD1 3.92Å; Y94-L289 HydrophobicContact CE2-CB 3.77Å; Y94-L289 HydrophobicContact CG-CB 4.12Å; Y94-L289 HydrophobicContact CG-CD1 4.04Å; Y259-L289 HydrophobicContact CE2-CD1 4.08Å; N285-L289 WeakPolarHBondContact ND2-CD1 3.49Å; N285-L289 WeakPolarHBondContact O-CG 3.47Å; N285-L289 PolarHBondContact O-N 3.31Å; I287-L289 PolarHBondContact O-N 3.34Å; L289-T292 PolarHBondContact O-N 3.02Å; L289-V293 PolarHBondContact O-N 3.5Å
290W94.4Very high95.4Very high115 Ų11532.4 Ų32.444%0.43617%0.166SC..Hα-helixtrans-68.3-38.8-177.5-16833.5000113W88 M286 I287 T292 V293 S294W88-W290 AromaticContact CE2-NE1 3.92Å; W88-W290 HydrophobicContact CH2-CZ2 4.25Å; W88-W290 AromaticContact CZ2-CZ2 3.74Å; W88-W290 HydrophobicContact CZ2-CZ2 3.74Å; W88-W290 AromaticContact NE1-NE1 3.8Å; M286-W290 PolarHBondContact O-N 3.09Å; I287-W290 PolarHBondContact O-N 3.3Å; W290-T292 VanDerWaalsContact C-N 3.34Å; W290-V293 WeakPolarHBondContact O-CG1 3.29Å; W290-S294 VanDerWaalsContact O-CB 3.28Å; W290-S294 WeakPolarHBondContact O-CB 3.17Å; W290-S294 PolarHBondContact O-N 3.27Å; W290-S294 PolarHBondContact O-OG 3.06Å
291V95.1Very high95.5Very high68 Ų6828.9 Ų28.941%0.41215%0.148SC..Hα-helixtrans-61.3-46172.7168.90000110.4L199 I287 S294 L295L199-V291 HydrophobicContact CD2-CG1 4.28Å; I287-V291 HydrophobicContact CG2-CG2 4.33Å; I287-V291 WeakPolarHBondContact O-CG2 3.47Å; I287-V291 PolarHBondContact O-N 2.89Å; V291-S294 WeakPolarHBondContact O-CB 3.19Å; V291-S294 PolarHBondContact O-N 3.42Å; V291-L295 HydrophobicContact CG1-CD1 4.17Å; V291-L295 WeakPolarHBondContact O-CG 3.34Å; V291-L295 PolarHBondContact O-N 3.26Å
292T93.5Very high95.6Very high1 Ų128.9 Ų28.91%0.00615%0.148CC..Hα-helixtrans-69.9-42.4-175-50.40000111.9M68 M195 M198 F202 G288 L289 W290 S294 L295 A296M68-T292 HydrophobicContact CB-CG2 4.02Å; M68-T292 VanDerWaalsContact CE-CB 3.41Å; M68-T292 HydrophobicContact CE-CG2 3.56Å; M68-T292 HydrophobicContact CG-CG2 3.88Å; M68-T292 HydrophobicContact SD-CG2 4.48Å; M195-T292 HydrophobicContact CE-CG2 4.42Å; M195-T292 WeakPolarHBondContact CE-OG1 3.33Å; M198-T292 HydrophobicContact CE-CG2 3.7Å; M198-T292 HydrophobicContact SD-CG2 4.3Å; F202-T292 HydrophobicContact CE2-CG2 3.92Å; G288-T292 WeakPolarHBondContact O-CB 3.3Å; G288-T292 PolarHBondContact O-N 3.48Å; G288-T292 PolarHBondContact O-OG1 2.87Å; L289-T292 PolarHBondContact O-N 3.02Å; W290-T292 VanDerWaalsContact C-N 3.34Å; T292-S294 VanDerWaalsContact C-N 3.29Å; T292-S294 PolarHBondContact O-N 3.18Å; T292-L295 PolarHBondContact O-N 2.98Å; T292-A296 WeakPolarHBondContact O-CB 3.43Å; T292-A296 PolarHBondContact O-N 2.98Å
293V94.3Very high95.6Very high2 Ų228.9 Ų28.91%0.01215%0.148CC..Hα-helixtrans-65-35.5174.777.40000111.2M68 T76 F87 Y94 L289 W290 A296 V297M68-V293 HydrophobicContact CE-CB 4.03Å; T76-V293 HydrophobicContact CG2-CG2 4.26Å; F87-V293 HydrophobicContact CB-CG2 4.44Å; Y94-V293 HydrophobicContact CE2-CB 4.45Å; Y94-V293 HydrophobicContact CE2-CG1 4.08Å; L289-V293 PolarHBondContact O-N 3.5Å; W290-V293 WeakPolarHBondContact O-CG1 3.29Å; V293-A296 PolarHBondContact O-N 3.26Å; V293-V297 HydrophobicContact CG2-CG2 4.29Å; V293-V297 WeakPolarHBondContact O-CB 3.16Å; V293-V297 VanDerWaalsContact O-CG2 3.28Å; V293-V297 WeakPolarHBondContact O-CG2 3.36Å; V293-V297 PolarHBondContact O-N 3.49Å
294S95.9Very high95.6Very high35 Ų3526.4 Ų26.425%0.24514%0.138CC..Hα-helixtrans-63.9-46177.1-62.60000111.6W88 W290 V291 T292 F298W88-S294 PolarHBondContact NE1-OG 3Å; W88-S294 VanDerWaalsContact NE1-OG 3.14Å; W290-S294 VanDerWaalsContact O-CB 3.28Å; W290-S294 WeakPolarHBondContact O-CB 3.17Å; W290-S294 PolarHBondContact O-N 3.27Å; W290-S294 PolarHBondContact O-OG 3.06Å; V291-S294 WeakPolarHBondContact O-CB 3.19Å; V291-S294 PolarHBondContact O-N 3.42Å; T292-S294 VanDerWaalsContact C-N 3.29Å; T292-S294 PolarHBondContact O-N 3.18Å; S294-F298 VanDerWaalsContact O-CB 3.31Å; S294-F298 WeakPolarHBondContact O-CB 3.36Å; S294-F298 PolarHBondContact O-N 3.26Å
295L96.3Very high95.6Very high39 Ų3924.1 Ų24.120%0.20413%0.125CC..Hα-helixtrans-63.5-44.2175.4-70.2174.6000111.5L199 F202 V203 I206 V291 T292 F298 S299L199-L295 HydrophobicContact CD2-CD1 3.65Å; F202-L295 HydrophobicContact CB-CB 3.86Å; F202-L295 HydrophobicContact CB-CD1 4.46Å; F202-L295 HydrophobicContact CD2-CB 4.11Å; F202-L295 HydrophobicContact CG-CB 4.08Å; V203-L295 HydrophobicContact CG2-CD1 4.48Å; V203-L295 HydrophobicContact CG2-CD2 4.36Å; I206-L295 HydrophobicContact CD1-CD2 3.92Å; V291-L295 HydrophobicContact CG1-CD1 4.17Å; V291-L295 WeakPolarHBondContact O-CG 3.34Å; V291-L295 PolarHBondContact O-N 3.26Å; T292-L295 PolarHBondContact O-N 2.98Å; L295-F298 PolarHBondContact O-N 3.31Å; L295-S299 PolarHBondContact O-N 2.87Å; L295-S299 PolarHBondContact O-OG 3.39Å; L295-S299 VanDerWaalsContact O-OG 3.11Å
296A95.4Very high95.6Very high0 Ų024.7 Ų24.70%013%0.127CC..Hα-helixtrans-62.9-47.5179.100000112.3T76 P77 F202 T292 V293 F298 S299 G300T76-A296 HydrophobicContact CG2-CB 3.75Å; P77-A296 HydrophobicContact CG-CB 4.18Å; P77-A296 WeakPolarHBondContact CG-O 3.31Å; F202-A296 HydrophobicContact CD1-CB 4.48Å; F202-A296 HydrophobicContact CE1-CB 3.69Å; F202-A296 HydrophobicContact CE2-CB 4.3Å; F202-A296 HydrophobicContact CZ-CB 3.55Å; T292-A296 WeakPolarHBondContact O-CB 3.43Å; T292-A296 PolarHBondContact O-N 2.98Å; V293-A296 PolarHBondContact O-N 3.26Å; A296-F298 VanDerWaalsContact C-N 3.3Å; A296-F298 PolarHBondContact O-N 2.89Å; A296-S299 WeakPolarHBondContact O-CB 3.32Å; A296-S299 PolarHBondContact O-N 3.28Å; A296-G300 PolarHBondContact O-N 2.91Å
297V96.8Very high95.6Very high4 Ų422 Ų222%0.02411%0.114CC..Hα-helixtrans-59.1-44.6175.3169.50000110.3T76 A80 A85 F87 V293 S299 G300 L301T76-V297 HydrophobicContact CG2-CG2 4Å; A80-V297 HydrophobicContact CB-CB 4.45Å; A80-V297 HydrophobicContact CB-CG1 4.17Å; A85-V297 HydrophobicContact CB-CG1 3.69Å; F87-V297 HydrophobicContact CB-CG2 4.01Å; V293-V297 HydrophobicContact CG2-CG2 4.29Å; V293-V297 WeakPolarHBondContact O-CB 3.16Å; V293-V297 VanDerWaalsContact O-CG2 3.28Å; V293-V297 WeakPolarHBondContact O-CG2 3.36Å; V293-V297 PolarHBondContact O-N 3.49Å; V297-S299 VanDerWaalsContact C-N 3.34Å; V297-S299 PolarHBondContact O-N 3.35Å; V297-G300 WeakPolarHBondContact O-CA 3.29Å; V297-G300 PolarHBondContact O-N 3.5Å; V297-L301 HydrophobicContact CG1-CD1 4.35Å; V297-L301 HydrophobicContact CG1-CG 4.4Å; V297-L301 WeakPolarHBondContact O-CG 3.44Å; V297-L301 PolarHBondContact O-N 2.98Å
298F97.1Very high95.5Very high43 Ų4320 Ų2019%0.18910%0.102CC..Hα-helixtrans-66.2-34179.6-159.7-90.8000113I206 L216 W220 S294 L295 A296 G300 L301 T302I206-F298 HydrophobicContact CB-CD1 4.29Å; I206-F298 HydrophobicContact CD1-CB 4.1Å; I206-F298 HydrophobicContact CD1-CD1 3.83Å; I206-F298 HydrophobicContact CD1-CG 4.42Å; I206-F298 HydrophobicContact CG1-CD1 3.83Å; I206-F298 HydrophobicContact CG2-CD1 3.52Å; I206-F298 HydrophobicContact CG2-CE1 3.55Å; L216-F298 HydrophobicContact CD2-CE1 3.54Å; L216-F298 HydrophobicContact CD2-CZ 3.74Å; W220-F298 HydrophobicContact CE3-CE2 4.38Å; S294-F298 VanDerWaalsContact O-CB 3.31Å; S294-F298 WeakPolarHBondContact O-CB 3.36Å; S294-F298 PolarHBondContact O-N 3.26Å; L295-F298 PolarHBondContact O-N 3.31Å; A296-F298 VanDerWaalsContact C-N 3.3Å; A296-F298 PolarHBondContact O-N 2.89Å; F298-G300 VanDerWaalsContact C-N 3.32Å; F298-L301 HydrophobicContact CD2-CD1 4.36Å; F298-L301 PolarHBondContact O-N 2.93Å; F298-T302 WeakPolarHBondContact O-CB 3.46Å; F298-T302 PolarHBondContact O-N 3.14Å; F298-T302 PolarHBondContact O-OG1 3.07Å
299S96.7Very high95.4Very high1 Ų123.6 Ų23.61%0.00712%0.116CC..Hα-helixtrans-61.5-39.5169.2-62.60000111.8F202 I206 L295 A296 V297 T302 M303F202-S299 WeakPolarHBondContact CD1-OG 3.34Å; I206-S299 WeakPolarHBondContact CG1-OG 3.41Å; L295-S299 PolarHBondContact O-N 2.87Å; L295-S299 PolarHBondContact O-OG 3.39Å; L295-S299 VanDerWaalsContact O-OG 3.11Å; A296-S299 WeakPolarHBondContact O-CB 3.32Å; A296-S299 PolarHBondContact O-N 3.28Å; V297-S299 VanDerWaalsContact C-N 3.34Å; V297-S299 PolarHBondContact O-N 3.35Å; S299-T302 WeakPolarHBondContact O-CB 3.33Å; S299-T302 PolarHBondContact O-N 3.4Å; S299-M303 WeakPolarHBondContact O-CB 3.34Å; S299-M303 PolarHBondContact O-N 2.87Å
300G96.8Very high95.2Very high0 Ų023.6 Ų23.60%012%0.116CC..Hα-helixtrans-67.8-37.9174.900000113.7P77 A296 V297 F298 M303 Y304P77-G300 VanDerWaalsContact O-CA 3.22Å; P77-G300 WeakPolarHBondContact O-CA 3.37Å; A296-G300 PolarHBondContact O-N 2.91Å; V297-G300 WeakPolarHBondContact O-CA 3.29Å; V297-G300 PolarHBondContact O-N 3.5Å; F298-G300 VanDerWaalsContact C-N 3.32Å; G300-M303 WeakPolarHBondContact O-CB 3.43Å; G300-M303 PolarHBondContact O-N 2.8Å; G300-Y304 PolarHBondContact O-N 3.11Å
301L97.6Very high95.1Very high6 Ų618.1 Ų18.13%0.03110%0.096CC..Hα-helixtrans-64.1-41.1172-66.2-179.1000111.8A85 C223 R228 L229 V297 F298 M303 Y304 S305A85-L301 HydrophobicContact CB-CD2 4.47Å; C223-L301 HydrophobicContact CB-CD2 4.19Å; C223-L301 PolarHBondContact SG-O 3.44Å; R228-L301 HydrophobicContact CB-CD2 3.68Å; R228-L301 HydrophobicContact CG-CD2 4.31Å; L229-L301 HydrophobicContact CD2-CD1 3.69Å; L229-L301 HydrophobicContact CD2-CD2 4.23Å; V297-L301 HydrophobicContact CG1-CD1 4.35Å; V297-L301 HydrophobicContact CG1-CG 4.4Å; V297-L301 WeakPolarHBondContact O-CG 3.44Å; V297-L301 PolarHBondContact O-N 2.98Å; F298-L301 HydrophobicContact CD2-CD1 4.36Å; F298-L301 PolarHBondContact O-N 2.93Å; L301-M303 VanDerWaalsContact C-N 3.34Å; L301-M303 PolarHBondContact O-N 3.44Å; L301-Y304 PolarHBondContact O-N 3.35Å; L301-S305 PolarHBondContact O-N 3.48Å
302T97.3Very high94.8Very high0 Ų014.9 Ų14.90%08%0.076CC..Hα-helixtrans-60.2-45.3173.7-59.30000110.9I219 F298 S299 Y304 S305 I306I219-T302 HydrophobicContact CD1-CG2 3.96Å; F298-T302 WeakPolarHBondContact O-CB 3.46Å; F298-T302 PolarHBondContact O-N 3.14Å; F298-T302 PolarHBondContact O-OG1 3.07Å; S299-T302 WeakPolarHBondContact O-CB 3.33Å; S299-T302 PolarHBondContact O-N 3.4Å; T302-Y304 VanDerWaalsContact C-N 3.29Å; T302-Y304 PolarHBondContact O-N 2.84Å; T302-S305 PolarHBondContact O-N 3.48Å; T302-I306 HydrophobicContact CG2-CD1 4.03Å; T302-I306 WeakPolarHBondContact O-CG1 3.28Å; T302-I306 PolarHBondContact O-N 2.83Å; T302-I306 VanDerWaalsContact O-N 3.14Å
303M96.4Very high94.6Very high0 Ų016.8 Ų16.80%09%0.086CC..Hα-helixtrans-57.4-43174.3-170.1162.97000111.7Y81 S299 G300 L301 I306 Y307 L324 L325 L328Y81-M303 HydrophobicContact CD1-CE 4.46Å; Y81-M303 HydrophobicContact CD2-CB 4.13Å; Y81-M303 HydrophobicContact CD2-CE 3.87Å; Y81-M303 HydrophobicContact CD2-CG 3.84Å; Y81-M303 HydrophobicContact CE2-CG 4.26Å; Y81-M303 HydrophobicContact CG-CE 3.66Å; S299-M303 WeakPolarHBondContact O-CB 3.34Å; S299-M303 PolarHBondContact O-N 2.87Å; G300-M303 WeakPolarHBondContact O-CB 3.43Å; G300-M303 PolarHBondContact O-N 2.8Å; L301-M303 VanDerWaalsContact C-N 3.34Å; L301-M303 PolarHBondContact O-N 3.44Å; M303-I306 PolarHBondContact O-N 2.82Å; M303-Y307 HydrophobicContact CG-CD2 3.75Å; M303-Y307 HydrophobicContact CG-CE2 4.01Å; M303-Y307 WeakPolarHBondContact O-CD2 3.49Å; M303-Y307 PolarHBondContact O-N 3.5Å; M303-L324 HydrophobicContact CE-CB 3.82Å; M303-L324 HydrophobicContact CE-CD1 4.31Å; M303-L324 HydrophobicContact SD-CB 3.73Å; M303-L325 HydrophobicContact SD-CB 4.27Å; M303-L325 HydrophobicContact SD-CD1 4.42Å; M303-L328 HydrophobicContact CB-CD2 3.72Å; M303-L328 HydrophobicContact CG-CB 4.39Å; M303-L328 HydrophobicContact CG-CD2 3.85Å; M303-L328 HydrophobicContact CG-CG 4.48Å; M303-L328 HydrophobicContact SD-CB 4.27Å; M303-L328 HydrophobicContact SD-CD2 4.26Å
304Y96.4Very high94.2Very high23 Ų2321 Ų219%0.0911%0.112CC..Hα-helixtrans-63.9-48177.3172.3-103.6000112.6Y81 D222 G226 R228 G300 L301 T302 I306 Y307 K308Y81-Y304 HydrophobicContact CE2-CD2 4.27Å; D222-Y304 WeakPolarHBondContact O-CE1 3.29Å; G226-Y304 VanDerWaalsContact CA-OH 3.23Å; G226-Y304 WeakPolarHBondContact CA-OH 3.26Å; R228-Y304 HydrophobicContact CG-CD1 4.23Å; R228-Y304 HydrophobicContact CG-CG 4.32Å; R228-Y304 VanDerWaalsContact CZ-CD2 3.44Å; G300-Y304 PolarHBondContact O-N 3.11Å; L301-Y304 PolarHBondContact O-N 3.35Å; T302-Y304 VanDerWaalsContact C-N 3.29Å; T302-Y304 PolarHBondContact O-N 2.84Å; Y304-I306 PolarHBondContact O-N 3.31Å; Y304-Y307 CarbonylContact O-C 3.45Å; Y304-Y307 PolarHBondContact O-N 3.27Å; Y304-K308 HydrophobicContact CE2-CB 4.3Å; Y304-K308 WeakPolarHBondContact O-CA 3.26Å; Y304-K308 WeakPolarHBondContact O-CB 3.43Å; Y304-K308 PolarHBondContact O-N 2.86Å
305S96.1Very high93.8Very high0 Ų021.6 Ų21.60%011%0.113CC..Hα-helixtrans-59-36.3179.1172.10000112.2Q213 D222 L301 T302Q213-S305 WeakPolarHBondContact CG-OG 3.49Å; Q213-S305 PolarHBondContact OE1-OG 3.17Å; D222-S305 PolarHBondContact OD2-OG 2.79Å; L301-S305 PolarHBondContact O-N 3.48Å; T302-S305 PolarHBondContact O-N 3.48Å
306I95.1Very high93.2Very high11 Ų1122.7 Ų22.76%0.05613%0.133CC..Hα-helixtrans-69.3-45.8176.1-67.3165.5000112Q213 T302 M303 Y304 L328 I332Q213-I306 HydrophobicContact CG-CG1 4.02Å; T302-I306 HydrophobicContact CG2-CD1 4.03Å; T302-I306 WeakPolarHBondContact O-CG1 3.28Å; T302-I306 PolarHBondContact O-N 2.83Å; T302-I306 VanDerWaalsContact O-N 3.14Å; M303-I306 PolarHBondContact O-N 2.82Å; Y304-I306 PolarHBondContact O-N 3.31Å; I306-L328 HydrophobicContact CB-CD1 4.39Å; I306-L328 HydrophobicContact CD1-CD1 3.78Å; I306-L328 HydrophobicContact CG2-CD1 4.12Å; I306-I332 HydrophobicContact CD1-CG2 4.11Å
307Y94.7Very high92.7Very high0 Ų024.4 Ų24.40%014%0.142CC..Hα-helixtrans-97.615.4-175.3-66.1-48.9000114.4M303 Y304 N309 C310 P312 Y327 L328 D331M303-Y307 HydrophobicContact CG-CD2 3.75Å; M303-Y307 HydrophobicContact CG-CE2 4.01Å; M303-Y307 WeakPolarHBondContact O-CD2 3.49Å; M303-Y307 PolarHBondContact O-N 3.5Å; Y304-Y307 CarbonylContact O-C 3.45Å; Y304-Y307 PolarHBondContact O-N 3.27Å; Y307-N309 PolarHBondContact O-N 2.95Å; Y307-C310 VanDerWaalsContact CB-O 3.27Å; Y307-C310 WeakPolarHBondContact CB-O 3.29Å; Y307-C310 WeakPolarHBondContact CD1-O 3.19Å; Y307-C310 CarbonylContact O-C 3.21Å; Y307-C310 PolarHBondContact O-N 2.73Å; Y307-P312 HydrophobicContact CD1-CG 3.66Å; Y307-P312 HydrophobicContact CD2-CG 3.77Å; Y307-P312 HydrophobicContact CE1-CG 3.75Å; Y307-P312 HydrophobicContact CE2-CG 3.83Å; Y307-P312 HydrophobicContact CG-CG 3.7Å; Y307-Y327 HydrophobicContact CE1-CE1 4.09Å; Y307-Y327 HydrophobicContact CE2-CD1 4.33Å; Y307-Y327 AromaticContact CZ-CD1 3.91Å; Y307-Y327 AromaticContact CZ-CE1 3.73Å; Y307-Y327 WeakPolarHBondContact OH-CD1 3.46Å; Y307-Y327 VanDerWaalsContact OH-CE1 3.3Å; Y307-Y327 WeakPolarHBondContact OH-CE1 3.47Å; Y307-L328 HydrophobicContact CD2-CD1 4.4Å; Y307-L328 HydrophobicContact CE2-CB 4.02Å; Y307-L328 HydrophobicContact CE2-CD1 3.54Å; Y307-L328 HydrophobicContact CE2-CG 4.35Å; Y307-L328 WeakPolarHBondContact OH-CA 3.33Å; Y307-D331 WeakPolarHBondContact CE1-OD2 3.45Å; Y307-D331 WeakPolarHBondContact OH-CB 3.41Å; Y307-D331 PolarHBondContact OH-OD2 3.49Å
308K92.1Very high92.2Very high53 Ų5324.5 Ų24.523%0.2314%0.143CC..THydrogen-bonded Turntrans-56.2-32.1-174.570-173.2179.4-1640113.8D222 Y304D222-K308 HydrophobicContact CB-CD 4.33Å; D222-K308 IonicContact OD1-NZ 2.79Å; D222-K308 PolarHBondContact OD1-NZ 3.24Å; D222-K308 IonicContact OD2-NZ 3.46Å; D222-K308 PolarHBondContact OD2-NZ 2.75Å; Y304-K308 HydrophobicContact CE2-CB 4.3Å; Y304-K308 WeakPolarHBondContact O-CA 3.26Å; Y304-K308 WeakPolarHBondContact O-CB 3.43Å; Y304-K308 PolarHBondContact O-N 2.86Å
309N90.6Very high91.3Very high94 Ų9423.6 Ų23.650%0.50315%0.146SC..THydrogen-bonded Turntrans-103.3-11.9-178.9-65.4-31.5000113.1Y307 S478 V479 A480 G481Y307-N309 PolarHBondContact O-N 2.95Å; N309-S478 CarbonylContact C-O 3.45Å; N309-V479 CarbonylContact O-C 3.34Å; N309-A480 PolarHBondContact O-N 3.41Å; N309-G481 WeakPolarHBondContact O-CA 3.49Å; N309-G481 PolarHBondContact O-N 3.34Å
310C90.8Very high90.7Very high0 Ų024.9 Ų24.90%016%0.156CC..  trans-145.494.9179.3-179.60000109.9T5 Y307 P312 S478 C482T5-C310 VanDerWaalsContact C-SG 3.59Å; Y307-C310 VanDerWaalsContact CB-O 3.27Å; Y307-C310 WeakPolarHBondContact CB-O 3.29Å; Y307-C310 WeakPolarHBondContact CD1-O 3.19Å; Y307-C310 CarbonylContact O-C 3.21Å; Y307-C310 PolarHBondContact O-N 2.73Å; C310-P312 VanDerWaalsContact O-CD 3.29Å; C310-P312 WeakPolarHBondContact O-CD 3.28Å; C310-S478 CarbonylContact C-O 3.6Å; C310-S478 WeakPolarHBondContact CA-O 3.26Å; C310-S478 PolarHBondContact N-O 3.46Å; C310-C482 WeakPolarHBondContact CA-SG 3.24Å; C310-C482 HydrophobicContact CB-CB 3.98Å; C310-C482 WeakPolarHBondContact CB-SG 3.49Å; C310-C482 WeakPolarHBondContact SG-CA 3.29Å; C310-C482 WeakPolarHBondContact SG-CB 3.45Å; C310-C482 CovalentContact SG-SG 2.04Å; C310-C482 PolarHBondContact SG-SG 2.99Å
311D91.8Very high90.2Very high1 Ų127.1 Ų27.11%0.00517%0.168CC..  trans-74.3115.1173.8171.744.6000111.1Y81 L313 T314 N315 I477 S478Y81-D311 WeakPolarHBondContact CE1-OD1 3.49Å; Y81-D311 PolarHBondContact OH-OD1 2.78Å; D311-L313 PolarHBondContact O-N 3.42Å; D311-L313 PolarHBondContact OD1-N 3.11Å; D311-T314 WeakPolarHBondContact OD2-CB 3.35Å; D311-T314 PolarHBondContact OD2-N 3.44Å; D311-T314 PolarHBondContact OD2-OG1 3.25Å; D311-N315 WeakPolarHBondContact O-CB 3.49Å; D311-N315 PolarHBondContact O-N 3.49Å; D311-I477 HydrophobicContact CB-CB 4.16Å; D311-I477 HydrophobicContact CB-CD1 4.26Å; D311-I477 WeakPolarHBondContact OD2-CD1 3.48Å; D311-S478 PolarHBondContact N-O 2.9Å
312P89.3Confident89.7Confident0 Ų027.2 Ų27.20%017%0.169CC..Hα-helixtrans-64.3-26.9-179.3-20.833.4000113.2Y307 C310 G316 D317 V318 L324 Y327Y307-P312 HydrophobicContact CD1-CG 3.66Å; Y307-P312 HydrophobicContact CD2-CG 3.77Å; Y307-P312 HydrophobicContact CE1-CG 3.75Å; Y307-P312 HydrophobicContact CE2-CG 3.83Å; Y307-P312 HydrophobicContact CG-CG 3.7Å; C310-P312 VanDerWaalsContact O-CD 3.29Å; C310-P312 WeakPolarHBondContact O-CD 3.28Å; P312-G316 PolarHBondContact O-N 3.41Å; P312-D317 HydrophobicContact CB-CB 3.99Å; P312-D317 PolarHBondContact O-N 3.37Å; P312-V318 HydrophobicContact CB-CG2 4.31Å; P312-V318 PolarHBondContact O-N 2.95Å; P312-L324 HydrophobicContact CB-CD2 4.1Å; P312-L324 HydrophobicContact CG-CD2 4.18Å; P312-Y327 HydrophobicContact CB-CD1 4.03Å; P312-Y327 HydrophobicContact CB-CE1 3.76Å; P312-Y327 HydrophobicContact CG-CD1 4.04Å; P312-Y327 HydrophobicContact CG-CE1 3.73Å
313L88.4Confident89.4Confident41 Ų4127.5 Ų27.522%0.21517%0.17CC..Hα-helixtrans-71.7-53.3-178.4179.967.5000111.3D311 N315 G316 V318 L321 L324D311-L313 PolarHBondContact O-N 3.42Å; D311-L313 PolarHBondContact OD1-N 3.11Å; L313-N315 VanDerWaalsContact C-N 3.28Å; L313-N315 PolarHBondContact O-N 3.07Å; L313-G316 PolarHBondContact O-N 2.97Å; L313-V318 HydrophobicContact CB-CG2 4.02Å; L313-V318 HydrophobicContact CD1-CG2 3.99Å; L313-L321 HydrophobicContact CD2-CD2 3.49Å; L313-L321 VanDerWaalsContact CD2-CD2 3.49Å; L313-L321 HydrophobicContact CD2-CG 3.84Å; L313-L324 HydrophobicContact CB-CD2 4.26Å
314T87.1Confident89.2Confident90 Ų9027.5 Ų27.555%0.55217%0.17SC*.Hα-helixtrans-72.7-24.4179.7-50.40000111.7D311 G316 I477 V479D311-T314 WeakPolarHBondContact OD2-CB 3.35Å; D311-T314 PolarHBondContact OD2-N 3.44Å; D311-T314 PolarHBondContact OD2-OG1 3.25Å; T314-G316 VanDerWaalsContact C-N 3.27Å; T314-I477 VanDerWaalsContact OG1-CD1 3.29Å; T314-I477 WeakPolarHBondContact OG1-CD1 3.06Å; T314-V479 HydrophobicContact CG2-CG1 4.09Å
315N86.8Confident89Confident48 Ų4826.5 Ų26.526%0.25717%0.166SC..Hα-helixtrans-74.3-15.9172.1-166.256.5000113.2D311 L313 D317 V479D311-N315 WeakPolarHBondContact O-CB 3.49Å; D311-N315 PolarHBondContact O-N 3.49Å; L313-N315 VanDerWaalsContact C-N 3.28Å; L313-N315 PolarHBondContact O-N 3.07Å; N315-D317 PolarHBondContact ND2-OD1 2.9Å; N315-D317 PolarHBondContact ND2-OD2 3.37Å; N315-V479 HydrophobicContact CB-CG1 4.48Å
316G83.8Confident88.8Confident61 Ų6126.5 Ų26.563%0.62917%0.166SC*.THydrogen-bonded Turntrans85.613179.300000115P312 L313 T314 V318P312-G316 PolarHBondContact O-N 3.41Å; L313-G316 PolarHBondContact O-N 2.97Å; T314-G316 VanDerWaalsContact C-N 3.27Å; G316-V318 VanDerWaalsContact C-N 3.32Å
317D85.3Confident88.6Confident37 Ų3726.2 Ų26.220%0.19816%0.164CC..SBendtrans-73.3-27.3175.3-61.4-48.6000111.9G6 G7 P312 N315 Y327G6-D317 VanDerWaalsContact CA-OD2 3.24Å; G6-D317 WeakPolarHBondContact CA-OD2 3.44Å; G7-D317 VanDerWaalsContact CA-OD1 3.32Å; G7-D317 WeakPolarHBondContact CA-OD1 3.3Å; G7-D317 VanDerWaalsContact N-CG 3.28Å; G7-D317 PolarHBondContact N-OD1 2.92Å; G7-D317 PolarHBondContact N-OD2 2.96Å; P312-D317 HydrophobicContact CB-CB 3.99Å; P312-D317 PolarHBondContact O-N 3.37Å; N315-D317 PolarHBondContact ND2-OD1 2.9Å; N315-D317 PolarHBondContact ND2-OD2 3.37Å; D317-Y327 HydrophobicContact CB-CE2 3.95Å
318V86.2Confident88.6Confident6 Ų626.2 Ų26.24%0.03616%0.164CC..  trans-127.4145.7173.6-60.90000110.8P312 L313 G316 Q323 L324 Y327P312-V318 HydrophobicContact CB-CG2 4.31Å; P312-V318 PolarHBondContact O-N 2.95Å; L313-V318 HydrophobicContact CB-CG2 4.02Å; L313-V318 HydrophobicContact CD1-CG2 3.99Å; G316-V318 VanDerWaalsContact C-N 3.32Å; V318-Q323 HydrophobicContact CB-CB 4.03Å; V318-Q323 HydrophobicContact CG1-CB 4.24Å; V318-L324 HydrophobicContact CG2-CD2 3.76Å; V318-L324 HydrophobicContact CG2-CG 4.15Å; V318-Y327 HydrophobicContact CG1-CD1 4.36Å; V318-Y327 HydrophobicContact CG1-CD2 3.81Å; V318-Y327 HydrophobicContact CG1-CG 3.65Å
319G78.9Confident88.6Confident24 Ų2423.8 Ų23.825%0.24715%0.154CC..SBendtrans-87.8-21.3-178.300000114.1V500G319-V500 VanDerWaalsContact O-CG2 3.29Å; G319-V500 WeakPolarHBondContact O-CG2 3.33Å
320A83.9Confident88.6Confident28 Ų2819.4 Ų19.423%0.23113%0.131CC..SBendtrans-141.5154.6-176.700000112.5D322 Q323A320-D322 VanDerWaalsContact C-N 3.26Å; A320-D322 PolarHBondContact O-N 3.06Å; A320-Q323 HydrophobicContact CB-CG 4.32Å; A320-Q323 WeakPolarHBondContact O-CB 3.19Å; A320-Q323 PolarHBondContact O-N 3.24Å
321L86.1Confident88.7Confident46 Ų4620.5 Ų20.524%0.24114%0.136CC..G310 helixtrans-55.8-41.2176.2-79.8165.5000112.2A78 R82 L313 Q323 L324A78-L321 WeakPolarHBondContact CB-O 3.39Å; R82-L321 HydrophobicContact CB-CD2 4.32Å; R82-L321 HydrophobicContact CG-CD2 4.36Å; L313-L321 HydrophobicContact CD2-CD2 3.49Å; L313-L321 VanDerWaalsContact CD2-CD2 3.49Å; L313-L321 HydrophobicContact CD2-CG 3.84Å; L321-Q323 PolarHBondContact O-N 3.4Å; L321-Q323 VanDerWaalsContact O-N 3.17Å; L321-L324 HydrophobicContact CD2-CD1 3.98Å; L321-L324 WeakPolarHBondContact O-CB 3.45Å; L321-L324 WeakPolarHBondContact O-CG 3.22Å; L321-L324 PolarHBondContact O-N 3.16Å
322D87.1Confident88.7Confident9 Ų920.6 Ų20.65%0.04814%0.137CC..G310 helixtrans-70.4-6.5-179.8-61.3-68.3000112.9I74 L154 A320 I411I74-D322 HydrophobicContact CG2-CB 3.9Å; I74-D322 WeakPolarHBondContact CG2-O 3.43Å; L154-D322 HydrophobicContact CD2-CB 4.18Å; A320-D322 VanDerWaalsContact C-N 3.26Å; A320-D322 PolarHBondContact O-N 3.06Å; D322-I411 HydrophobicContact CB-CD1 4.08Å; D322-I411 PolarHBondContact OD2-N 2.58Å
323Q90.4Very high88.7Confident6 Ų621 Ų213%0.02814%0.139CC..G310 helixtrans-92.8-10.3174.2-69.2176.7-26.600113.5L154 Q158 V318 A320 L321 L325 P326 Y327L154-Q323 HydrophobicContact CD1-CG 4.31Å; L154-Q323 HydrophobicContact CD2-CG 4.16Å; L154-Q323 HydrophobicContact CG-CG 3.94Å; Q158-Q323 HydrophobicContact CB-CG 4.23Å; Q158-Q323 HydrophobicContact CG-CB 4.12Å; Q158-Q323 HydrophobicContact CG-CG 4.31Å; Q158-Q323 VanDerWaalsContact OE1-CD 3.31Å; V318-Q323 HydrophobicContact CB-CB 4.03Å; V318-Q323 HydrophobicContact CG1-CB 4.24Å; A320-Q323 HydrophobicContact CB-CG 4.32Å; A320-Q323 WeakPolarHBondContact O-CB 3.19Å; A320-Q323 PolarHBondContact O-N 3.24Å; L321-Q323 PolarHBondContact O-N 3.4Å; L321-Q323 VanDerWaalsContact O-N 3.17Å; Q323-L325 PolarHBondContact O-N 3.37Å; Q323-P326 WeakPolarHBondContact O-CD 3.48Å; Q323-Y327 WeakPolarHBondContact O-CB 3.49Å; Q323-Y327 PolarHBondContact O-N 2.95Å
324L91.6Very high88.7Confident0 Ų020.5 Ų20.50%014%0.141CC..Hα-helixtrans-60.3-45.9-176.1-79168.9000113.2Y81 M303 P312 L313 V318 L321 Y327 L328Y81-L324 HydrophobicContact CD1-CD1 3.78Å; Y81-L324 HydrophobicContact CE1-CD1 4.05Å; Y81-L324 HydrophobicContact CG-CD1 4.47Å; M303-L324 HydrophobicContact CE-CB 3.82Å; M303-L324 HydrophobicContact CE-CD1 4.31Å; M303-L324 HydrophobicContact SD-CB 3.73Å; P312-L324 HydrophobicContact CB-CD2 4.1Å; P312-L324 HydrophobicContact CG-CD2 4.18Å; L313-L324 HydrophobicContact CB-CD2 4.26Å; V318-L324 HydrophobicContact CG2-CD2 3.76Å; V318-L324 HydrophobicContact CG2-CG 4.15Å; L321-L324 HydrophobicContact CD2-CD1 3.98Å; L321-L324 WeakPolarHBondContact O-CB 3.45Å; L321-L324 WeakPolarHBondContact O-CG 3.22Å; L321-L324 PolarHBondContact O-N 3.16Å; L324-Y327 WeakPolarHBondContact O-CB 3.38Å; L324-Y327 PolarHBondContact O-N 2.85Å; L324-L328 PolarHBondContact O-N 3.03Å
325L92.7Very high88.7Confident1 Ų120.1 Ų20.11%0.00515%0.147CC..Hα-helixtrans-71.3-44.4-177.5-17872.3000112.8V73 P77 V205 M303 Q323 Y327 L328 V329 F343V73-L325 WeakPolarHBondContact O-CD2 3.08Å; P77-L325 HydrophobicContact CB-CD1 4.14Å; P77-L325 HydrophobicContact CB-CD2 3.85Å; P77-L325 HydrophobicContact CB-CG 4.44Å; P77-L325 HydrophobicContact CG-CD2 3.62Å; V205-L325 HydrophobicContact CG1-CD1 4.38Å; M303-L325 HydrophobicContact SD-CB 4.27Å; M303-L325 HydrophobicContact SD-CD1 4.42Å; Q323-L325 PolarHBondContact O-N 3.37Å; L325-Y327 VanDerWaalsContact C-N 3.27Å; L325-Y327 PolarHBondContact O-N 3.24Å; L325-L328 HydrophobicContact CD1-CD2 4.14Å; L325-L328 WeakPolarHBondContact O-CB 3.3Å; L325-L328 PolarHBondContact O-N 2.59Å; L325-V329 VanDerWaalsContact O-CG2 3.31Å; L325-V329 WeakPolarHBondContact O-CG2 3.35Å; L325-V329 PolarHBondContact O-N 2.9Å; L325-F343 HydrophobicContact CD2-CE2 3.83Å; L325-F343 HydrophobicContact CD2-CZ 3.52Å; L325-F343 HydrophobicContact CG-CE2 4.07Å; L325-F343 HydrophobicContact CG-CZ 3.66Å
326P92.1Very high88.8Confident1 Ų123 Ų231%0.00616%0.155CC..Hα-helixtrans-55.4-41.4169.3-26.833.7000113.3A155 I159 Q323 V329 M330A155-P326 HydrophobicContact CB-CB 4.04Å; A155-P326 HydrophobicContact CB-CG 3.37Å; I159-P326 HydrophobicContact CG2-CB 3.85Å; Q323-P326 WeakPolarHBondContact O-CD 3.48Å; P326-V329 PolarHBondContact O-N 2.81Å; P326-M330 PolarHBondContact O-N 3.14Å
327Y91.6Very high88.9Confident5 Ų524 Ų242%0.0215%0.15CC..Hα-helixtrans-62.2-47.1175.1175.9-92.1000111.8G7 V9 Y307 P312 D317 V318 Q323 L324 L325 V329 M330 D331G7-Y327 PolarHBondContact N-OH 3.36Å; G7-Y327 PolarHBondContact O-OH 2.88Å; V9-Y327 HydrophobicContact CB-CE2 4.29Å; V9-Y327 HydrophobicContact CG1-CD2 3.91Å; V9-Y327 HydrophobicContact CG1-CE1 4.35Å; V9-Y327 HydrophobicContact CG1-CE2 3.41Å; V9-Y327 VanDerWaalsContact CG1-CE2 3.41Å; V9-Y327 HydrophobicContact CG2-CD2 3.85Å; V9-Y327 HydrophobicContact CG2-CE2 3.93Å; Y307-Y327 HydrophobicContact CE1-CE1 4.09Å; Y307-Y327 HydrophobicContact CE2-CD1 4.33Å; Y307-Y327 AromaticContact CZ-CD1 3.91Å; Y307-Y327 AromaticContact CZ-CE1 3.73Å; Y307-Y327 WeakPolarHBondContact OH-CD1 3.46Å; Y307-Y327 VanDerWaalsContact OH-CE1 3.3Å; Y307-Y327 WeakPolarHBondContact OH-CE1 3.47Å; P312-Y327 HydrophobicContact CB-CD1 4.03Å; P312-Y327 HydrophobicContact CB-CE1 3.76Å; P312-Y327 HydrophobicContact CG-CD1 4.04Å; P312-Y327 HydrophobicContact CG-CE1 3.73Å; D317-Y327 HydrophobicContact CB-CE2 3.95Å; V318-Y327 HydrophobicContact CG1-CD1 4.36Å; V318-Y327 HydrophobicContact CG1-CD2 3.81Å; V318-Y327 HydrophobicContact CG1-CG 3.65Å; Q323-Y327 WeakPolarHBondContact O-CB 3.49Å; Q323-Y327 PolarHBondContact O-N 2.95Å; L324-Y327 WeakPolarHBondContact O-CB 3.38Å; L324-Y327 PolarHBondContact O-N 2.85Å; L325-Y327 VanDerWaalsContact C-N 3.27Å; L325-Y327 PolarHBondContact O-N 3.24Å; Y327-V329 VanDerWaalsContact C-N 3.3Å; Y327-V329 PolarHBondContact O-N 3.28Å; Y327-M330 PolarHBondContact O-N 3.39Å; Y327-M330 VanDerWaalsContact O-N 3.17Å; Y327-D331 PolarHBondContact O-N 2.85Å
328L93.1Very high89Confident0 Ų022.7 Ų22.70%015%0.145CC..Hα-helixtrans-53.9-49174.8178.269.6000110.9V205 M303 I306 Y307 L324 L325 M330 D331 I332V205-L328 HydrophobicContact CG1-CD2 3.97Å; M303-L328 HydrophobicContact CB-CD2 3.72Å; M303-L328 HydrophobicContact CG-CB 4.39Å; M303-L328 HydrophobicContact CG-CD2 3.85Å; M303-L328 HydrophobicContact CG-CG 4.48Å; M303-L328 HydrophobicContact SD-CB 4.27Å; M303-L328 HydrophobicContact SD-CD2 4.26Å; I306-L328 HydrophobicContact CB-CD1 4.39Å; I306-L328 HydrophobicContact CD1-CD1 3.78Å; I306-L328 HydrophobicContact CG2-CD1 4.12Å; Y307-L328 HydrophobicContact CD2-CD1 4.4Å; Y307-L328 HydrophobicContact CE2-CB 4.02Å; Y307-L328 HydrophobicContact CE2-CD1 3.54Å; Y307-L328 HydrophobicContact CE2-CG 4.35Å; Y307-L328 WeakPolarHBondContact OH-CA 3.33Å; L324-L328 PolarHBondContact O-N 3.03Å; L325-L328 HydrophobicContact CD1-CD2 4.14Å; L325-L328 WeakPolarHBondContact O-CB 3.3Å; L325-L328 PolarHBondContact O-N 2.59Å; L328-M330 VanDerWaalsContact C-N 3.27Å; L328-M330 PolarHBondContact O-N 2.65Å; L328-D331 WeakPolarHBondContact O-CB 3.48Å; L328-D331 PolarHBondContact O-N 2.9Å; L328-I332 HydrophobicContact CD1-CG1 4.36Å; L328-I332 HydrophobicContact CD1-CG2 3.85Å; L328-I332 HydrophobicContact CG-CD1 4.3Å; L328-I332 HydrophobicContact CG-CG1 4.19Å; L328-I332 WeakPolarHBondContact O-CG1 3.38Å; L328-I332 PolarHBondContact O-N 2.67Å
329V93Very high89.1Confident2 Ų224.5 Ų24.51%0.01216%0.156CC..Hα-helixtrans-55.3-44.7-178.9167.40000111V205 L325 P326 Y327 L333 P340 F343V205-V329 HydrophobicContact CG2-CG2 3.76Å; L325-V329 VanDerWaalsContact O-CG2 3.31Å; L325-V329 WeakPolarHBondContact O-CG2 3.35Å; L325-V329 PolarHBondContact O-N 2.9Å; P326-V329 PolarHBondContact O-N 2.81Å; Y327-V329 VanDerWaalsContact C-N 3.3Å; Y327-V329 PolarHBondContact O-N 3.28Å; V329-L333 HydrophobicContact CG1-CD1 4.22Å; V329-L333 WeakPolarHBondContact O-CA 3.23Å; V329-L333 VanDerWaalsContact O-CB 3.23Å; V329-L333 WeakPolarHBondContact O-CB 3.45Å; V329-L333 PolarHBondContact O-N 3.12Å; V329-P340 HydrophobicContact CG1-CB 4.08Å; V329-F343 HydrophobicContact CB-CD1 4.12Å; V329-F343 HydrophobicContact CB-CG 4.35Å; V329-F343 HydrophobicContact CG1-CB 3.96Å; V329-F343 HydrophobicContact CG1-CD1 3.95Å; V329-F343 HydrophobicContact CG1-CG 4Å; V329-F343 HydrophobicContact CG2-CB 4.31Å; V329-F343 HydrophobicContact CG2-CD1 3.59Å; V329-F343 HydrophobicContact CG2-CD2 3.74Å; V329-F343 HydrophobicContact CG2-CE1 3.79Å; V329-F343 HydrophobicContact CG2-CE2 3.93Å; V329-F343 HydrophobicContact CG2-CG 3.57Å; V329-F343 HydrophobicContact CG2-CZ 3.96Å
330M91.6Very high89.7Confident2 Ų223.3 Ų23.31%0.0114%0.144CC..Hα-helixtrans-69-37.3176.4-63.5-51.1-66.600112.6V9 A10 S11 F12 I159 P326 Y327 L328 I332 A334 P340V9-M330 HydrophobicContact CB-CB 3.95Å; V9-M330 HydrophobicContact CG2-CB 3.87Å; A10-M330 WeakPolarHBondContact O-CE 3.46Å; S11-M330 VanDerWaalsContact C-CE 3.49Å; F12-M330 HydrophobicContact CD2-CE 4.42Å; F12-M330 HydrophobicContact CD2-SD 4.34Å; I159-M330 HydrophobicContact CB-CG 3.75Å; I159-M330 HydrophobicContact CB-SD 4.16Å; I159-M330 HydrophobicContact CG2-CG 3.45Å; I159-M330 VanDerWaalsContact CG2-CG 3.45Å; I159-M330 HydrophobicContact CG2-SD 4.29Å; P326-M330 PolarHBondContact O-N 3.14Å; Y327-M330 PolarHBondContact O-N 3.39Å; Y327-M330 VanDerWaalsContact O-N 3.17Å; L328-M330 VanDerWaalsContact C-N 3.27Å; L328-M330 PolarHBondContact O-N 2.65Å; M330-I332 PolarHBondContact O-N 2.66Å; M330-A334 HydrophobicContact CE-CB 4.32Å; M330-A334 WeakPolarHBondContact O-CB 3.45Å; M330-A334 PolarHBondContact O-N 2.86Å; M330-P340 HydrophobicContact SD-CB 3.68Å; M330-P340 HydrophobicContact SD-CG 4.21Å
331D91.3Very high89.9Confident23 Ų2322 Ų2212%0.12313%0.133CC..Hα-helixtrans-62.2-43.5177.1-169.718.7000112T3 G4 V9 Y307 Y327 L328T3-D331 WeakPolarHBondContact CA-OD1 3.32Å; G4-D331 PolarHBondContact N-OD2 3.29Å; V9-D331 HydrophobicContact CG1-CB 3.9Å; Y307-D331 WeakPolarHBondContact CE1-OD2 3.45Å; Y307-D331 WeakPolarHBondContact OH-CB 3.41Å; Y307-D331 PolarHBondContact OH-OD2 3.49Å; Y327-D331 PolarHBondContact O-N 2.85Å; L328-D331 WeakPolarHBondContact O-CB 3.48Å; L328-D331 PolarHBondContact O-N 2.9Å
332I92Very high90Very high3 Ų322.2 Ų22.22%0.01513%0.134CC..Hα-helixtrans-99.1-24.1-171.463.1153000115.6V205 R208 I212 I306 L328 M330V205-I332 HydrophobicContact CG1-CD1 4.35Å; R208-I332 HydrophobicContact CB-CD1 4.03Å; R208-I332 HydrophobicContact CG-CB 4.06Å; R208-I332 HydrophobicContact CG-CD1 3.85Å; R208-I332 HydrophobicContact CG-CG1 4.27Å; R208-I332 WeakPolarHBondContact CG-O 3.32Å; R208-I332 PolarHBondContact NE-O 3.16Å; I212-I332 HydrophobicContact CD1-CB 3.53Å; I212-I332 HydrophobicContact CD1-CG2 3.41Å; I212-I332 VanDerWaalsContact CD1-CG2 3.41Å; I306-I332 HydrophobicContact CD1-CG2 4.11Å; L328-I332 HydrophobicContact CD1-CG1 4.36Å; L328-I332 HydrophobicContact CD1-CG2 3.85Å; L328-I332 HydrophobicContact CG-CD1 4.3Å; L328-I332 HydrophobicContact CG-CG1 4.19Å; L328-I332 WeakPolarHBondContact O-CG1 3.38Å; L328-I332 PolarHBondContact O-N 2.67Å; M330-I332 PolarHBondContact O-N 2.66Å
333L90.4Very high90.1Very high8 Ų822 Ų224%0.04213%0.133CC..Hα-helixtrans-117-6.9-171.5-68.2161.1000114.7V205 R208 V329 A335 Y336 V339 P340V205-L333 HydrophobicContact CG2-CD1 4.22Å; R208-L333 HydrophobicContact CB-CD2 3.66Å; R208-L333 HydrophobicContact CB-CG 4.3Å; R208-L333 HydrophobicContact CG-CD2 3.66Å; R208-L333 HydrophobicContact CG-CG 4.12Å; V329-L333 HydrophobicContact CG1-CD1 4.22Å; V329-L333 WeakPolarHBondContact O-CA 3.23Å; V329-L333 VanDerWaalsContact O-CB 3.23Å; V329-L333 WeakPolarHBondContact O-CB 3.45Å; V329-L333 PolarHBondContact O-N 3.12Å; L333-A335 PolarHBondContact O-N 3.14Å; L333-Y336 HydrophobicContact CD2-CD2 4.27Å; L333-Y336 PolarHBondContact O-N 3.37Å; L333-V339 HydrophobicContact CD1-CG1 4.07Å; L333-V339 HydrophobicContact CD2-CB 4.44Å; L333-V339 HydrophobicContact CD2-CG1 3.84Å; L333-V339 HydrophobicContact CG-CG1 4.38Å; L333-P340 HydrophobicContact CB-CG 4.07Å
334A87.8Confident90Very high31 Ų3121.8 Ų21.826%0.25613%0.132SC..THydrogen-bonded Turntrans-58.3-24.1-179.600000114.5A10 M330 Y336A10-A334 HydrophobicContact CB-CB 3.72Å; M330-A334 HydrophobicContact CE-CB 4.32Å; M330-A334 WeakPolarHBondContact O-CB 3.45Å; M330-A334 PolarHBondContact O-N 2.86Å; A334-Y336 PolarHBondContact O-N 3.3Å
335A86.9Confident89.9Confident82 Ų8221.8 Ų21.868%0.67813%0.132SC*.THydrogen-bonded Turntrans-70.7-10.9175.100000114L333 P337L333-A335 PolarHBondContact O-N 3.14Å; A335-P337 WeakPolarHBondContact O-CD 3.39Å
336Y89.1Confident89.7Confident109 Ų10921.8 Ų21.843%0.42713%0.132SC..SBendtrans-114.690.8-179.6-58.1-84.7000109.6R208 L333 A334 G338 V339 P340R208-Y336 PolarHBondContact NH1-OH 3.29Å; L333-Y336 HydrophobicContact CD2-CD2 4.27Å; L333-Y336 PolarHBondContact O-N 3.37Å; A334-Y336 PolarHBondContact O-N 3.3Å; Y336-G338 PolarHBondContact O-N 3.47Å; Y336-V339 PolarHBondContact O-N 2.96Å; Y336-V339 VanDerWaalsContact O-N 3.15Å; Y336-P340 VanDerWaalsContact O-CD 3.29Å; Y336-P340 WeakPolarHBondContact O-CD 3.22Å
337P86.4Confident89.6Confident82 Ų8221.8 Ų21.853%0.53213%0.132SC..THydrogen-bonded Turntrans-55.8128.8-175.1-23.232.3000111.8W15 A335W15-P337 HydrophobicContact CB-CB 3.74Å; W15-P337 HydrophobicContact CG-CB 4Å; A335-P337 WeakPolarHBondContact O-CD 3.39Å
338G86.6Confident89.4Confident8 Ų822.1 Ų22.18%0.08213%0.133CC..THydrogen-bonded Turntrans97.4-23.3179.700000114.9D16 Y336 G341 L342D16-G338 WeakPolarHBondContact OD1-CA 3.27Å; D16-G338 PolarHBondContact OD1-N 2.9Å; Y336-G338 PolarHBondContact O-N 3.47Å; G338-G341 PolarHBondContact O-N 2.95Å; G338-L342 PolarHBondContact O-N 3.5Å
339V88.7Confident89.1Confident44 Ų4422.2 Ų22.227%0.26713%0.134SC..Hα-helixtrans-73-43.3179.9-172.50000112.1A204 L333 Y336 G341 L342 F343A204-V339 HydrophobicContact CB-CG1 4.06Å; L333-V339 HydrophobicContact CD1-CG1 4.07Å; L333-V339 HydrophobicContact CD2-CB 4.44Å; L333-V339 HydrophobicContact CD2-CG1 3.84Å; L333-V339 HydrophobicContact CG-CG1 4.38Å; Y336-V339 PolarHBondContact O-N 2.96Å; Y336-V339 VanDerWaalsContact O-N 3.15Å; V339-G341 VanDerWaalsContact C-N 3.26Å; V339-G341 PolarHBondContact O-N 2.84Å; V339-L342 WeakPolarHBondContact O-CB 3.34Å; V339-L342 PolarHBondContact O-N 3.45Å; V339-L342 VanDerWaalsContact O-N 3.15Å; V339-F343 PolarHBondContact O-N 3.5Å; V339-F343 VanDerWaalsContact O-N 3.07Å
340P90.8Very high88.8Confident0 Ų022.2 Ų22.20%013%0.134CC..Hα-helixtrans-54.8-42.5166.7-26.334.1000112.6F12 D16 V329 M330 L333 Y336 L342 F343 V344F12-P340 HydrophobicContact CD2-CB 4.26Å; F12-P340 HydrophobicContact CE2-CB 3.88Å; D16-P340 VanDerWaalsContact OD1-CD 3.27Å; D16-P340 WeakPolarHBondContact OD1-CD 3.42Å; V329-P340 HydrophobicContact CG1-CB 4.08Å; M330-P340 HydrophobicContact SD-CB 3.68Å; M330-P340 HydrophobicContact SD-CG 4.21Å; L333-P340 HydrophobicContact CB-CG 4.07Å; Y336-P340 VanDerWaalsContact O-CD 3.29Å; Y336-P340 WeakPolarHBondContact O-CD 3.22Å; P340-L342 VanDerWaalsContact C-N 3.31Å; P340-L342 PolarHBondContact O-N 3Å; P340-F343 PolarHBondContact O-N 3.08Å; P340-V344 WeakPolarHBondContact O-CG2 3.49Å; P340-V344 PolarHBondContact O-N 3.43Å; P340-V344 VanDerWaalsContact O-N 3.11Å
341G89.6Confident88.7Confident0 Ų022.1 Ų22.10%013%0.134CC..Hα-helixtrans-57.2-41.4174.300000113.2D16 G338 V339 V344 A345D16-G341 WeakPolarHBondContact O-CA 3.37Å; D16-G341 PolarHBondContact OD1-N 3.25Å; D16-G341 VanDerWaalsContact OD1-N 3.1Å; G338-G341 PolarHBondContact O-N 2.95Å; V339-G341 VanDerWaalsContact C-N 3.26Å; V339-G341 PolarHBondContact O-N 2.84Å; G341-V344 PolarHBondContact O-N 2.98Å; G341-A345 VanDerWaalsContact O-CB 3.32Å; G341-A345 WeakPolarHBondContact O-CB 3.36Å; G341-A345 PolarHBondContact O-N 3.38Å
342L88.3Confident88.4Confident51 Ų5121.4 Ų21.427%0.26713%0.13SC..Hα-helixtrans-63.9-41.6175.6-179.366.8000112.6V19 I197 G338 V339 P340 A345 A346V19-L342 HydrophobicContact CG1-CB 4.11Å; I197-L342 HydrophobicContact CG2-CD1 4.02Å; G338-L342 PolarHBondContact O-N 3.5Å; V339-L342 WeakPolarHBondContact O-CB 3.34Å; V339-L342 PolarHBondContact O-N 3.45Å; V339-L342 VanDerWaalsContact O-N 3.15Å; P340-L342 VanDerWaalsContact C-N 3.31Å; P340-L342 PolarHBondContact O-N 3Å; L342-A345 WeakPolarHBondContact O-CB 3.36Å; L342-A345 PolarHBondContact O-N 2.94Å; L342-A346 PolarHBondContact O-N 3.39Å
343F88.6Confident88.1Confident4 Ų421.2 Ų21.22%0.01813%0.129CC..Hα-helixtrans-63.1-42.8177.6172-92000111.9V73 V205 L325 V329 V339 P340 A345 A346 A347V73-F343 HydrophobicContact CG1-CE2 4.17Å; V73-F343 HydrophobicContact CG1-CZ 4.2Å; V205-F343 HydrophobicContact CG2-CD2 3.93Å; V205-F343 HydrophobicContact CG2-CE2 4.26Å; L325-F343 HydrophobicContact CD2-CE2 3.83Å; L325-F343 HydrophobicContact CD2-CZ 3.52Å; L325-F343 HydrophobicContact CG-CE2 4.07Å; L325-F343 HydrophobicContact CG-CZ 3.66Å; V329-F343 HydrophobicContact CB-CD1 4.12Å; V329-F343 HydrophobicContact CB-CG 4.35Å; V329-F343 HydrophobicContact CG1-CB 3.96Å; V329-F343 HydrophobicContact CG1-CD1 3.95Å; V329-F343 HydrophobicContact CG1-CG 4Å; V329-F343 HydrophobicContact CG2-CB 4.31Å; V329-F343 HydrophobicContact CG2-CD1 3.59Å; V329-F343 HydrophobicContact CG2-CD2 3.74Å; V329-F343 HydrophobicContact CG2-CE1 3.79Å; V329-F343 HydrophobicContact CG2-CE2 3.93Å; V329-F343 HydrophobicContact CG2-CG 3.57Å; V329-F343 HydrophobicContact CG2-CZ 3.96Å; V339-F343 PolarHBondContact O-N 3.5Å; V339-F343 VanDerWaalsContact O-N 3.07Å; P340-F343 PolarHBondContact O-N 3.08Å; F343-A345 VanDerWaalsContact C-N 3.31Å; F343-A346 WeakPolarHBondContact O-CA 3.27Å; F343-A346 VanDerWaalsContact O-CB 3.24Å; F343-A346 WeakPolarHBondContact O-CB 3.35Å; F343-A346 PolarHBondContact O-N 3Å; F343-A346 VanDerWaalsContact O-N 3.12Å; F343-A347 PolarHBondContact O-N 3.29Å; F343-A347 VanDerWaalsContact O-N 3.09Å
344V88.9Confident88.1Confident2 Ų220.9 Ų20.91%0.01213%0.128CC..Hα-helixtrans-69.5-37.1178.1177.90000110.4F12 F20 L156 I159 P340 G341 A346 A347 Y348F12-V344 HydrophobicContact CE1-CG2 4.43Å; F12-V344 HydrophobicContact CE2-CG2 4.18Å; F12-V344 HydrophobicContact CZ-CB 3.87Å; F12-V344 HydrophobicContact CZ-CG1 4.22Å; F12-V344 HydrophobicContact CZ-CG2 3.56Å; F20-V344 HydrophobicContact CD2-CB 4.35Å; F20-V344 HydrophobicContact CD2-CG1 3.93Å; F20-V344 HydrophobicContact CE2-CG1 3.85Å; F20-V344 HydrophobicContact CZ-CG1 4.48Å; L156-V344 HydrophobicContact CD1-CG1 3.97Å; I159-V344 HydrophobicContact CD1-CB 4.4Å; I159-V344 HydrophobicContact CD1-CG1 4.44Å; I159-V344 HydrophobicContact CD1-CG2 3.19Å; P340-V344 WeakPolarHBondContact O-CG2 3.49Å; P340-V344 PolarHBondContact O-N 3.43Å; P340-V344 VanDerWaalsContact O-N 3.11Å; G341-V344 PolarHBondContact O-N 2.98Å; V344-A346 VanDerWaalsContact C-N 3.25Å; V344-A346 PolarHBondContact O-N 3.28Å; V344-A347 PolarHBondContact O-N 2.86Å; V344-Y348 HydrophobicContact CG1-CD2 3.92Å; V344-Y348 HydrophobicContact CG1-CE2 4.17Å; V344-Y348 WeakPolarHBondContact O-CB 3.24Å; V344-Y348 WeakPolarHBondContact O-CD2 3.39Å; V344-Y348 PolarHBondContact O-N 3.03Å
345A88.7Confident88.2Confident0 Ų019.5 Ų19.50%012%0.116CC..Hα-helixtrans-59.4-36.4170.100000112.1F20 T23 I197 G341 L342 F343 S349F20-A345 HydrophobicContact CD2-CB 4.14Å; T23-A345 HydrophobicContact CG2-CB 3.75Å; I197-A345 HydrophobicContact CG2-CB 4.38Å; G341-A345 VanDerWaalsContact O-CB 3.32Å; G341-A345 WeakPolarHBondContact O-CB 3.36Å; G341-A345 PolarHBondContact O-N 3.38Å; L342-A345 WeakPolarHBondContact O-CB 3.36Å; L342-A345 PolarHBondContact O-N 2.94Å; F343-A345 VanDerWaalsContact C-N 3.31Å; A345-S349 WeakPolarHBondContact O-CA 3.08Å; A345-S349 WeakPolarHBondContact O-CB 3.41Å; A345-S349 PolarHBondContact O-N 2.87Å; A345-S349 PolarHBondContact O-OG 2.94Å
346A89.1Confident88.1Confident1 Ų115.6 Ų15.61%0.0088%0.084CC..Hα-helixtrans-62.4-48.1172.300000112.9I197 M198 L342 F343 V344 Y348 S349 G350I197-A346 HydrophobicContact CG2-CB 4.11Å; M198-A346 HydrophobicContact CB-CB 4.49Å; L342-A346 PolarHBondContact O-N 3.39Å; F343-A346 WeakPolarHBondContact O-CA 3.27Å; F343-A346 VanDerWaalsContact O-CB 3.24Å; F343-A346 WeakPolarHBondContact O-CB 3.35Å; F343-A346 PolarHBondContact O-N 3Å; F343-A346 VanDerWaalsContact O-N 3.12Å; V344-A346 VanDerWaalsContact C-N 3.25Å; V344-A346 PolarHBondContact O-N 3.28Å; A346-Y348 PolarHBondContact O-N 2.71Å; A346-S349 WeakPolarHBondContact O-CB 3.38Å; A346-S349 PolarHBondContact O-N 3.44Å; A346-G350 PolarHBondContact O-N 3.37Å; A346-G350 VanDerWaalsContact O-N 3.1Å
347A89.6Confident88Confident1 Ų110.6 Ų10.61%0.0087%0.065CC..Hα-helixtrans-62.8-41.5177.200000112.4G70 V73 I74 P152 F343 V344 T351G70-A347 WeakPolarHBondContact CA-O 3.23Å; V73-A347 HydrophobicContact CB-CB 4.46Å; V73-A347 HydrophobicContact CG1-CB 4.09Å; I74-A347 HydrophobicContact CD1-CB 4.13Å; I74-A347 HydrophobicContact CG1-CB 4.43Å; P152-A347 HydrophobicContact CB-CB 4.25Å; F343-A347 PolarHBondContact O-N 3.29Å; F343-A347 VanDerWaalsContact O-N 3.09Å; V344-A347 PolarHBondContact O-N 2.86Å; A347-T351 PolarHBondContact O-N 2.81Å; A347-T351 PolarHBondContact O-OG1 3.17Å
348Y87.8Confident88.2Confident11 Ų117 Ų74%0.0434%0.041CC..Hα-helixtrans-67.8-36.1174.3-94.2-98.4000112.6F20 P152 L156 V167 T171 V344 A346 T351 L352F20-Y348 HydrophobicContact CE2-CD1 4.24Å; F20-Y348 AromaticContact CE2-CD2 3.61Å; F20-Y348 HydrophobicContact CE2-CD2 3.61Å; F20-Y348 HydrophobicContact CE2-CE2 4.18Å; F20-Y348 AromaticContact CE2-CG 3.67Å; F20-Y348 HydrophobicContact CE2-CG 3.67Å; F20-Y348 HydrophobicContact CZ-CD1 4.1Å; F20-Y348 AromaticContact CZ-CD2 3.89Å; F20-Y348 HydrophobicContact CZ-CD2 3.89Å; F20-Y348 HydrophobicContact CZ-CE1 4.19Å; F20-Y348 HydrophobicContact CZ-CE2 4.02Å; F20-Y348 AromaticContact CZ-CG 3.95Å; F20-Y348 HydrophobicContact CZ-CG 3.95Å; P152-Y348 HydrophobicContact CB-CD2 3.7Å; P152-Y348 HydrophobicContact CB-CE2 3.67Å; P152-Y348 HydrophobicContact CB-CG 4.29Å; P152-Y348 HydrophobicContact CG-CE2 4.37Å; L156-Y348 HydrophobicContact CB-CE2 4.15Å; L156-Y348 HydrophobicContact CD2-CE2 4.25Å; V167-Y348 WeakPolarHBondContact CG1-OH 3.39Å; T171-Y348 HydrophobicContact CG2-CD1 4.15Å; T171-Y348 HydrophobicContact CG2-CE1 3.48Å; T171-Y348 VanDerWaalsContact CG2-CE1 3.48Å; T171-Y348 VanDerWaalsContact OG1-CE1 3.23Å; T171-Y348 WeakPolarHBondContact OG1-CE1 3.31Å; T171-Y348 PolarHBondContact OG1-OH 3.36Å; V344-Y348 HydrophobicContact CG1-CD2 3.92Å; V344-Y348 HydrophobicContact CG1-CE2 4.17Å; V344-Y348 WeakPolarHBondContact O-CB 3.24Å; V344-Y348 WeakPolarHBondContact O-CD2 3.39Å; V344-Y348 PolarHBondContact O-N 3.03Å; A346-Y348 PolarHBondContact O-N 2.71Å; Y348-T351 WeakPolarHBondContact O-CB 3.34Å; Y348-T351 PolarHBondContact O-N 3.21Å; Y348-L352 WeakPolarHBondContact O-CB 3.41Å; Y348-L352 VanDerWaalsContact O-CG 3.26Å; Y348-L352 WeakPolarHBondContact O-CG 3.28Å; Y348-L352 PolarHBondContact O-N 3.22Å
349S85.9Confident88.4Confident2 Ų26.6 Ų6.61%0.0144%0.037CC..Hα-helixtrans-62.9-46.8178.5-72.90000111.5Q194 A345 A346 T351 L352 S353Q194-S349 VanDerWaalsContact CD-O 3.27Å; Q194-S349 PolarHBondContact OE1-O 3.5Å; A345-S349 WeakPolarHBondContact O-CA 3.08Å; A345-S349 WeakPolarHBondContact O-CB 3.41Å; A345-S349 PolarHBondContact O-N 2.87Å; A345-S349 PolarHBondContact O-OG 2.94Å; A346-S349 WeakPolarHBondContact O-CB 3.38Å; A346-S349 PolarHBondContact O-N 3.44Å; S349-T351 VanDerWaalsContact C-N 3.28Å; S349-T351 PolarHBondContact O-N 2.7Å; S349-L352 PolarHBondContact O-N 3.36Å; S349-S353 PolarHBondContact O-N 3.05Å
350G87Confident88.2Confident2 Ų25 Ų52%0.0213%0.027CC..Hα-helixtrans-61.3-37.3173.100000112.6A346 T354A346-G350 PolarHBondContact O-N 3.37Å; A346-G350 VanDerWaalsContact O-N 3.1Å; G350-T354 WeakPolarHBondContact O-CB 3.36Å; G350-T354 PolarHBondContact O-N 3.36Å; G350-T354 VanDerWaalsContact O-N 3.11Å; G350-T354 PolarHBondContact O-OG1 3.24Å
351T88.7Confident88.2Confident0 Ų05 Ų50%03%0.027CC..Hα-helixtrans-66.7-49177.2-62.50000112.3G70 V148 P152 A347 Y348 S349 S353 T354 V355G70-T351 WeakPolarHBondContact CA-OG1 3.42Å; G70-T351 PolarHBondContact N-OG1 3.48Å; V148-T351 HydrophobicContact CG1-CG2 3.84Å; V148-T351 WeakPolarHBondContact O-CG2 3.01Å; V148-T351 PolarHBondContact O-OG1 3.1Å; P152-T351 HydrophobicContact CG-CG2 3.83Å; P152-T351 VanDerWaalsContact CG-OG1 3.28Å; P152-T351 WeakPolarHBondContact CG-OG1 3.43Å; A347-T351 PolarHBondContact O-N 2.81Å; A347-T351 PolarHBondContact O-OG1 3.17Å; Y348-T351 WeakPolarHBondContact O-CB 3.34Å; Y348-T351 PolarHBondContact O-N 3.21Å; S349-T351 VanDerWaalsContact C-N 3.28Å; S349-T351 PolarHBondContact O-N 2.7Å; T351-S353 VanDerWaalsContact C-N 3.32Å; T351-S353 PolarHBondContact O-N 3.26Å; T351-T354 PolarHBondContact O-N 3.38Å; T351-V355 HydrophobicContact CG2-CG2 4.03Å; T351-V355 WeakPolarHBondContact O-CB 3.35Å; T351-V355 WeakPolarHBondContact O-CG2 2.91Å; T351-V355 PolarHBondContact O-N 2.98Å
352L85.4Confident88.3Confident8 Ų85 Ų54%0.0423%0.027CC..Hα-helixtrans-60.1-42.3178.9-74.6164.3000111.4V24 V174 C175 Q194 Y348 S349 S356V24-L352 HydrophobicContact CG1-CD1 4.5Å; V174-L352 HydrophobicContact CG1-CD2 4.28Å; C175-L352 WeakPolarHBondContact SG-CD2 3.32Å; Q194-L352 VanDerWaalsContact NE2-CB 3.31Å; Y348-L352 WeakPolarHBondContact O-CB 3.41Å; Y348-L352 VanDerWaalsContact O-CG 3.26Å; Y348-L352 WeakPolarHBondContact O-CG 3.28Å; Y348-L352 PolarHBondContact O-N 3.22Å; S349-L352 PolarHBondContact O-N 3.36Å; L352-S356 WeakPolarHBondContact O-CB 3.34Å; L352-S356 PolarHBondContact O-N 2.91Å; L352-S356 PolarHBondContact O-OG 3.2Å
353S86.7Confident88.4Confident0 Ų02.6 Ų2.60%02%0.015CC..Hα-helixtrans-57.3-51.7173.5-176.50000111S66 D191 Q194 S349 T351 S356 S357S66-S353 WeakPolarHBondContact CA-OG 3.44Å; S66-S353 PolarHBondContact N-OG 3.34Å; D191-S353 WeakPolarHBondContact OD1-CA 3.21Å; D191-S353 VanDerWaalsContact OD1-CB 3.23Å; D191-S353 WeakPolarHBondContact OD1-CB 3.39Å; D191-S353 PolarHBondContact OD1-OG 3.5Å; Q194-S353 VanDerWaalsContact OE1-CB 3.27Å; S349-S353 PolarHBondContact O-N 3.05Å; T351-S353 VanDerWaalsContact C-N 3.32Å; T351-S353 PolarHBondContact O-N 3.26Å; S353-S356 PolarHBondContact O-OG 2.71Å; S353-S357 WeakPolarHBondContact O-CB 3.5Å; S353-S357 PolarHBondContact O-N 3.05Å; S353-S357 VanDerWaalsContact O-N 3.07Å; S353-S357 PolarHBondContact O-OG 3.24Å
354T90.1Very high88.4Confident1 Ų12.4 Ų2.41%0.0061%0.014CC..Hα-helixtrans-65.8-44.9-176.7-54.10000112.8S66 S69 Y144 V148 G350 T351 S357 S358S66-T354 WeakPolarHBondContact O-CB 3.22Å; S66-T354 WeakPolarHBondContact O-CG2 3.32Å; S66-T354 PolarHBondContact O-OG1 3.11Å; S69-T354 WeakPolarHBondContact CA-OG1 3.36Å; S69-T354 WeakPolarHBondContact CB-OG1 3.47Å; Y144-T354 HydrophobicContact CD1-CG2 4.43Å; Y144-T354 HydrophobicContact CE1-CG2 3.43Å; Y144-T354 VanDerWaalsContact CE1-CG2 3.43Å; V148-T354 HydrophobicContact CB-CG2 4.34Å; V148-T354 HydrophobicContact CG1-CG2 3.84Å; V148-T354 HydrophobicContact CG2-CG2 3.87Å; G350-T354 WeakPolarHBondContact O-CB 3.36Å; G350-T354 PolarHBondContact O-N 3.36Å; G350-T354 VanDerWaalsContact O-N 3.11Å; G350-T354 PolarHBondContact O-OG1 3.24Å; T351-T354 PolarHBondContact O-N 3.38Å; T354-S357 PolarHBondContact O-N 3.05Å; T354-S358 WeakPolarHBondContact O-CB 3.28Å; T354-S358 PolarHBondContact O-N 3.3Å; T354-S358 PolarHBondContact O-OG 3.47Å
355V89.1Confident88.5Confident1 Ų12.3 Ų2.31%0.0061%0.014CC..Hα-helixtrans-64.1-45.1-178.9173.20000110.4T145 V148 I149 C175 T351 S357 S358 I359T145-V355 HydrophobicContact CG2-CB 4.12Å; T145-V355 HydrophobicContact CG2-CG1 3.95Å; T145-V355 HydrophobicContact CG2-CG2 3.8Å; V148-V355 HydrophobicContact CG1-CG2 4.25Å; I149-V355 HydrophobicContact CD1-CG1 4.48Å; I149-V355 HydrophobicContact CD1-CG2 4.21Å; I149-V355 HydrophobicContact CG1-CG2 3.6Å; C175-V355 HydrophobicContact CB-CG1 3.75Å; T351-V355 HydrophobicContact CG2-CG2 4.03Å; T351-V355 WeakPolarHBondContact O-CB 3.35Å; T351-V355 WeakPolarHBondContact O-CG2 2.91Å; T351-V355 PolarHBondContact O-N 2.98Å; V355-S357 PolarHBondContact O-N 2.93Å; V355-S358 PolarHBondContact O-N 2.82Å; V355-I359 HydrophobicContact CG1-CD1 3.69Å; V355-I359 HydrophobicContact CG1-CG1 4.33Å; V355-I359 WeakPolarHBondContact O-CB 3.44Å; V355-I359 WeakPolarHBondContact O-CG1 3.34Å; V355-I359 PolarHBondContact O-N 3.35Å
356S85.1Confident88.7Confident1 Ų13.2 Ų3.21%0.0072%0.019CC..Hα-helixtrans-64.9-40.5178.661.50000113.3C179 L352 S353 S358 N360C179-S356 WeakPolarHBondContact SG-CA 3.32Å; C179-S356 VanDerWaalsContact SG-CB 3.54Å; L352-S356 WeakPolarHBondContact O-CB 3.34Å; L352-S356 PolarHBondContact O-N 2.91Å; L352-S356 PolarHBondContact O-OG 3.2Å; S353-S356 PolarHBondContact O-OG 2.71Å; S356-S358 VanDerWaalsContact C-N 3.31Å; S356-S358 PolarHBondContact O-N 3.36Å; S356-N360 VanDerWaalsContact O-CB 3.3Å; S356-N360 WeakPolarHBondContact O-CB 3.4Å; S356-N360 PolarHBondContact O-N 3.47Å
357S87.6Confident88.7Confident4 Ų43.1 Ų3.13%0.0282%0.018CC..Hα-helixtrans-60.3-41.9173.4-49.70000112.6S66 S264 R268 S353 T354 V355 A361S66-S357 PolarHBondContact OG-OG 3.49Å; S264-S357 VanDerWaalsContact OG-C 3.27Å; S264-S357 WeakPolarHBondContact OG-CB 3.46Å; S264-S357 PolarHBondContact OG-O 3.4Å; R268-S357 PolarHBondContact NH2-OG 3Å; S353-S357 WeakPolarHBondContact O-CB 3.5Å; S353-S357 PolarHBondContact O-N 3.05Å; S353-S357 VanDerWaalsContact O-N 3.07Å; S353-S357 PolarHBondContact O-OG 3.24Å; T354-S357 PolarHBondContact O-N 3.05Å; V355-S357 PolarHBondContact O-N 2.93Å; S357-A361 VanDerWaalsContact O-CB 3.31Å; S357-A361 WeakPolarHBondContact O-CB 3.32Å; S357-A361 PolarHBondContact O-N 3.07Å; S357-A361 VanDerWaalsContact O-N 3.11Å
358S90.8Very high88.5Confident5 Ų54.2 Ų4.24%0.0352%0.023CC..Hα-helixtrans-72-46.7-177.1-61.40000111T145 T354 V355 S356 A361 L362T145-S358 WeakPolarHBondContact OG1-CB 3.24Å; T145-S358 PolarHBondContact OG1-OG 2.79Å; T354-S358 WeakPolarHBondContact O-CB 3.28Å; T354-S358 PolarHBondContact O-N 3.3Å; T354-S358 PolarHBondContact O-OG 3.47Å; V355-S358 PolarHBondContact O-N 2.82Å; S356-S358 VanDerWaalsContact C-N 3.31Å; S356-S358 PolarHBondContact O-N 3.36Å; S358-A361 PolarHBondContact O-N 3.48Å; S358-L362 WeakPolarHBondContact O-CB 3.48Å; S358-L362 VanDerWaalsContact O-CG 3.23Å; S358-L362 WeakPolarHBondContact O-CG 3.25Å; S358-L362 PolarHBondContact O-N 2.96Å
359I89.2Confident88.6Confident1 Ų13.9 Ų3.91%0.0052%0.022CC..Hα-helixtrans-61.9-46.6176.7-69174.7000110.6C179 V355 A361 L362 V363C179-I359 HydrophobicContact CB-CB 4.47Å; C179-I359 HydrophobicContact CB-CD1 4.39Å; C179-I359 HydrophobicContact CB-CG2 4.1Å; V355-I359 HydrophobicContact CG1-CD1 3.69Å; V355-I359 HydrophobicContact CG1-CG1 4.33Å; V355-I359 WeakPolarHBondContact O-CB 3.44Å; V355-I359 WeakPolarHBondContact O-CG1 3.34Å; V355-I359 PolarHBondContact O-N 3.35Å; I359-A361 VanDerWaalsContact C-N 3.29Å; I359-A361 PolarHBondContact O-N 3.25Å; I359-L362 WeakPolarHBondContact O-CB 3.43Å; I359-L362 PolarHBondContact O-N 3.45Å; I359-V363 HydrophobicContact CG2-CG2 4.39Å; I359-V363 VanDerWaalsContact O-CG2 3.3Å; I359-V363 WeakPolarHBondContact O-CG2 2.92Å; I359-V363 PolarHBondContact O-N 3.21Å
360N86.1Confident88.8Confident10 Ų106.5 Ų6.55%0.0533%0.033CC..Hα-helixtrans-59.9-41.2178.1-177.962.5000111.8Q267 S356 V363 A364Q267-N360 PolarHBondContact NE2-ND2 3.09Å; S356-N360 VanDerWaalsContact O-CB 3.3Å; S356-N360 WeakPolarHBondContact O-CB 3.4Å; S356-N360 PolarHBondContact O-N 3.47Å; N360-V363 PolarHBondContact O-N 3.43Å; N360-A364 WeakPolarHBondContact O-CB 3.44Å; N360-A364 PolarHBondContact O-N 3.4Å
361A89.8Confident88.9Confident0 Ų07.8 Ų7.80%04%0.039CC..Hα-helixtrans-69.2-38.917700000112.5Y137 Q263 S357 S358 I359 A364 V365Y137-A361 WeakPolarHBondContact OH-CB 3.23Å; Q263-A361 HydrophobicContact CB-CB 4.28Å; Q263-A361 HydrophobicContact CG-CB 4.07Å; S357-A361 VanDerWaalsContact O-CB 3.31Å; S357-A361 WeakPolarHBondContact O-CB 3.32Å; S357-A361 PolarHBondContact O-N 3.07Å; S357-A361 VanDerWaalsContact O-N 3.11Å; S358-A361 PolarHBondContact O-N 3.48Å; I359-A361 VanDerWaalsContact C-N 3.29Å; I359-A361 PolarHBondContact O-N 3.25Å; A361-A364 PolarHBondContact O-N 3.37Å; A361-V365 WeakPolarHBondContact O-CG1 3.36Å; A361-V365 WeakPolarHBondContact O-CG2 3.5Å; A361-V365 PolarHBondContact O-N 2.8Å
362L92.8Very high88.7Confident0 Ų011.7 Ų11.70%05%0.054CC..Hα-helixtrans-60.6-43.9174-75.9170000111.8Y137 I138 T141 S358 I359 V365 T366 F394Y137-L362 HydrophobicContact CE1-CD2 4.34Å; I138-L362 HydrophobicContact CB-CD2 4.03Å; I138-L362 HydrophobicContact CG1-CD2 3.87Å; I138-L362 HydrophobicContact CG2-CD2 4.03Å; T141-L362 HydrophobicContact CG2-CD1 4.04Å; T141-L362 HydrophobicContact CG2-CD2 4.14Å; T141-L362 HydrophobicContact CG2-CG 3.9Å; S358-L362 WeakPolarHBondContact O-CB 3.48Å; S358-L362 VanDerWaalsContact O-CG 3.23Å; S358-L362 WeakPolarHBondContact O-CG 3.25Å; S358-L362 PolarHBondContact O-N 2.96Å; I359-L362 WeakPolarHBondContact O-CB 3.43Å; I359-L362 PolarHBondContact O-N 3.45Å; L362-V365 WeakPolarHBondContact O-CG2 3.2Å; L362-T366 VanDerWaalsContact O-CB 3.29Å; L362-T366 WeakPolarHBondContact O-CB 3.41Å; L362-T366 PolarHBondContact O-N 2.9Å; L362-T366 PolarHBondContact O-OG1 3Å; L362-F394 HydrophobicContact CB-CD1 4.13Å; L362-F394 HydrophobicContact CB-CD2 3.76Å; L362-F394 HydrophobicContact CB-CE1 4.27Å; L362-F394 HydrophobicContact CB-CE2 3.91Å; L362-F394 HydrophobicContact CB-CG 3.89Å; L362-F394 HydrophobicContact CB-CZ 4.16Å; L362-F394 HydrophobicContact CD1-CB 4.11Å; L362-F394 HydrophobicContact CD1-CD1 3.81Å; L362-F394 HydrophobicContact CD1-CE1 4.41Å; L362-F394 HydrophobicContact CD1-CG 3.97Å; L362-F394 HydrophobicContact CD2-CD1 4.41Å; L362-F394 HydrophobicContact CD2-CE1 4.2Å; L362-F394 HydrophobicContact CG-CD1 4.36Å; L362-F394 HydrophobicContact CG-CG 4.49Å
363V89.8Confident88.7Confident0 Ų013.5 Ų13.50%07%0.067CC..Hα-helixtrans-62.4-48.8174174.10000110.1I359 N360 V365 T366 V367 N387 L390 F394I359-V363 HydrophobicContact CG2-CG2 4.39Å; I359-V363 VanDerWaalsContact O-CG2 3.3Å; I359-V363 WeakPolarHBondContact O-CG2 2.92Å; I359-V363 PolarHBondContact O-N 3.21Å; N360-V363 PolarHBondContact O-N 3.43Å; V363-V365 PolarHBondContact O-N 2.99Å; V363-T366 PolarHBondContact O-N 3.35Å; V363-V367 HydrophobicContact CG1-CG2 4.26Å; V363-V367 WeakPolarHBondContact O-CB 3.34Å; V363-V367 VanDerWaalsContact O-CG2 3.25Å; V363-V367 WeakPolarHBondContact O-CG2 3.42Å; V363-V367 PolarHBondContact O-N 3.5Å; V363-N387 HydrophobicContact CG1-CB 3.91Å; V363-L390 HydrophobicContact CG1-CB 4.28Å; V363-L390 HydrophobicContact CG1-CD1 4.38Å; V363-L390 HydrophobicContact CG2-CB 3.81Å; V363-F394 HydrophobicContact CG2-CD2 4.24Å
364A87.4Confident88.7Confident1 Ų119.7 Ų19.71%0.00810%0.097CC..Hα-helixtrans-55.4-53.2-179.600000112.1L48 N360 A361 T366 V367 E368L48-A364 HydrophobicContact CD1-CB 4.47Å; L48-A364 HydrophobicContact CD2-CB 3.91Å; N360-A364 WeakPolarHBondContact O-CB 3.44Å; N360-A364 PolarHBondContact O-N 3.4Å; A361-A364 PolarHBondContact O-N 3.37Å; A364-T366 VanDerWaalsContact C-N 3.32Å; A364-T366 PolarHBondContact O-N 3.2Å; A364-V367 PolarHBondContact O-N 3.36Å; A364-E368 WeakPolarHBondContact O-CB 3.29Å; A364-E368 WeakPolarHBondContact O-CG 3.49Å; A364-E368 PolarHBondContact O-N 3.48Å
365V91.8Very high88.4Confident0 Ų026.4 Ų26.40%012%0.123CC..Hα-helixtrans-66.6-35.4-179.5-58.30000112.2Y118 T134 Y137 I138 Q263 A361 L362 V363 V367 D369Y118-V365 HydrophobicContact CD2-CG1 4.15Å; Y118-V365 HydrophobicContact CE2-CG1 4.03Å; T134-V365 HydrophobicContact CG2-CB 3.75Å; T134-V365 HydrophobicContact CG2-CG2 3.86Å; Y137-V365 HydrophobicContact CD1-CG1 4.16Å; Y137-V365 HydrophobicContact CD1-CG2 3.96Å; Y137-V365 HydrophobicContact CE1-CG1 3.98Å; Y137-V365 HydrophobicContact CE1-CG2 3.95Å; I138-V365 HydrophobicContact CD1-CG2 4.22Å; I138-V365 HydrophobicContact CG1-CG2 3.96Å; Q263-V365 HydrophobicContact CB-CG1 3.89Å; Q263-V365 HydrophobicContact CG-CG1 3.55Å; A361-V365 WeakPolarHBondContact O-CG1 3.36Å; A361-V365 WeakPolarHBondContact O-CG2 3.5Å; A361-V365 PolarHBondContact O-N 2.8Å; L362-V365 WeakPolarHBondContact O-CG2 3.2Å; V363-V365 PolarHBondContact O-N 2.99Å; V365-V367 VanDerWaalsContact C-N 3.34Å; V365-V367 PolarHBondContact O-N 3.31Å; V365-D369 WeakPolarHBondContact O-CA 3.43Å; V365-D369 WeakPolarHBondContact O-CB 3.32Å; V365-D369 PolarHBondContact O-N 3.04Å
366T92.9Very high87.7Confident18 Ų1835.1 Ų35.111%0.1116%0.161CC..Hα-helixtrans-65.6-43.3179.6-58.30000110.7L362 V363 A364 F370 I371 L390 F394L362-T366 VanDerWaalsContact O-CB 3.29Å; L362-T366 WeakPolarHBondContact O-CB 3.41Å; L362-T366 PolarHBondContact O-N 2.9Å; L362-T366 PolarHBondContact O-OG1 3Å; V363-T366 PolarHBondContact O-N 3.35Å; A364-T366 VanDerWaalsContact C-N 3.32Å; A364-T366 PolarHBondContact O-N 3.2Å; T366-F370 WeakPolarHBondContact O-CB 3.48Å; T366-F370 PolarHBondContact O-N 3.16Å; T366-F370 VanDerWaalsContact O-N 3.12Å; T366-I371 HydrophobicContact CG2-CD1 4.32Å; T366-I371 PolarHBondContact O-N 3.23Å; T366-I371 VanDerWaalsContact O-N 3.16Å; T366-L390 HydrophobicContact CG2-CD1 4.13Å; T366-L390 HydrophobicContact CG2-CD2 4.16Å; T366-F394 WeakPolarHBondContact OG1-CE2 3.5Å; T366-F394 VanDerWaalsContact OG1-CZ 3.3Å; T366-F394 WeakPolarHBondContact OG1-CZ 3.48Å
367V88.6Confident87.4Confident0 Ų042.5 Ų42.50%020%0.2CC..Iπ-helixtrans-67.7-49.5179.4173.50000111.1V363 A364 V365 I371 R372 M386 N387 L390V363-V367 HydrophobicContact CG1-CG2 4.26Å; V363-V367 WeakPolarHBondContact O-CB 3.34Å; V363-V367 VanDerWaalsContact O-CG2 3.25Å; V363-V367 WeakPolarHBondContact O-CG2 3.42Å; V363-V367 PolarHBondContact O-N 3.5Å; A364-V367 PolarHBondContact O-N 3.36Å; V365-V367 VanDerWaalsContact C-N 3.34Å; V365-V367 PolarHBondContact O-N 3.31Å; V367-I371 HydrophobicContact CG2-CD1 4.32Å; V367-I371 PolarHBondContact O-N 3.04Å; V367-R372 HydrophobicContact CG1-CG 4.28Å; V367-R372 WeakPolarHBondContact O-CG 3.39Å; V367-R372 PolarHBondContact O-N 3.03Å; V367-M386 HydrophobicContact CG1-CE 3.97Å; V367-M386 HydrophobicContact CG2-CE 3.88Å; V367-N387 WeakPolarHBondContact CG2-OD1 3.36Å; V367-L390 HydrophobicContact CG2-CD1 3.69Å
368E86.3Confident87.1Confident23 Ų2344.7 Ų44.711%0.10721%0.212CC..Iπ-helixtrans-72.2-41-176.2-66.8-56.8144.700112.9T115 R130 A364 R372 P373T115-E368 HydrophobicContact CG2-CG 4.1Å; R130-E368 PolarHBondContact NH2-O 3.47Å; R130-E368 VanDerWaalsContact NH2-O 3.1Å; A364-E368 WeakPolarHBondContact O-CB 3.29Å; A364-E368 WeakPolarHBondContact O-CG 3.49Å; A364-E368 PolarHBondContact O-N 3.48Å; E368-R372 VanDerWaalsContact CD-NE 3.26Å; E368-R372 IonicContact OE1-CZ 3.24Å; E368-R372 IonicContact OE1-NE 2.81Å; E368-R372 PolarHBondContact OE1-NE 2.94Å; E368-R372 IonicContact OE1-NH2 3.1Å; E368-R372 PolarHBondContact OE1-NH2 3.36Å; E368-R372 WeakPolarHBondContact OE2-CD 3.44Å; E368-R372 IonicContact OE2-NE 2.66Å; E368-R372 PolarHBondContact OE2-NE 3.46Å; E368-P373 WeakPolarHBondContact O-CD 3.14Å
369D89.3Confident86.7Confident4 Ų448.4 Ų48.42%0.02123%0.234CC..Iπ-helixtrans-92.8-27.4-170.8-57-29.4000113.6S116 R130 T134 V365S116-D369 WeakPolarHBondContact CB-OD1 3.4Å; S116-D369 PolarHBondContact OG-OD1 2.8Å; S116-D369 PolarHBondContact OG-OD2 2.92Å; S116-D369 VanDerWaalsContact OG-OD2 3.07Å; R130-D369 IonicContact CZ-OD1 2.73Å; R130-D369 IonicContact NE-OD1 2.92Å; R130-D369 PolarHBondContact NE-OD1 3.01Å; R130-D369 IonicContact NH2-OD1 3.24Å; R130-D369 PolarHBondContact NH2-OD1 3.17Å; T134-D369 WeakPolarHBondContact CB-OD2 3.33Å; T134-D369 HydrophobicContact CG2-CB 3.95Å; T134-D369 WeakPolarHBondContact CG2-OD2 3.49Å; T134-D369 PolarHBondContact OG1-OD2 3.49Å; V365-D369 WeakPolarHBondContact O-CA 3.43Å; V365-D369 WeakPolarHBondContact O-CB 3.32Å; V365-D369 PolarHBondContact O-N 3.04Å
370F90.6Very high86.1Confident57 Ų5752.8 Ų52.825%0.2526%0.257CS..Iπ-helixtrans-112.1-47.1-179-65-82.2000113.1V131 T134 I138 T366 M374V131-F370 HydrophobicContact CG1-CE1 3.8Å; V131-F370 HydrophobicContact CG1-CZ 4.19Å; V131-F370 HydrophobicContact CG2-CE1 4.43Å; T134-F370 HydrophobicContact CG2-CD2 4.4Å; T134-F370 HydrophobicContact CG2-CE2 3.63Å; T134-F370 HydrophobicContact CG2-CZ 4.41Å; I138-F370 HydrophobicContact CD1-CE2 3.92Å; T366-F370 WeakPolarHBondContact O-CB 3.48Å; T366-F370 PolarHBondContact O-N 3.16Å; T366-F370 VanDerWaalsContact O-N 3.12Å; F370-M374 WeakPolarHBondContact O-CE 3.48Å; F370-M374 WeakPolarHBondContact O-CG 3.42Å
371I89.4Confident85.8Confident29 Ų2959.9 Ų59.915%0.14929%0.288CS..Iπ-helixtrans-82.1-54-168.1-57.5-179.9000112.2T366 V367 P373 M374 Y375 L378 M386 L390T366-I371 HydrophobicContact CG2-CD1 4.32Å; T366-I371 PolarHBondContact O-N 3.23Å; T366-I371 VanDerWaalsContact O-N 3.16Å; V367-I371 HydrophobicContact CG2-CD1 4.32Å; V367-I371 PolarHBondContact O-N 3.04Å; I371-P373 VanDerWaalsContact C-CD 3.47Å; I371-P373 VanDerWaalsContact C-N 3.33Å; I371-M374 CarbonylContact O-C 3.45Å; I371-M374 WeakPolarHBondContact O-CA 3.38Å; I371-M374 PolarHBondContact O-N 2.97Å; I371-Y375 HydrophobicContact CG2-CD2 4.05Å; I371-Y375 PolarHBondContact O-N 3.29Å; I371-L378 HydrophobicContact CG2-CD1 4.03Å; I371-M386 HydrophobicContact CB-SD 4.47Å; I371-M386 HydrophobicContact CD1-CE 4.18Å; I371-M386 HydrophobicContact CD1-CG 4.2Å; I371-M386 HydrophobicContact CD1-SD 3.44Å; I371-M386 WeakPolarHBondContact CD1-SD 2.85Å; I371-M386 HydrophobicContact CG1-SD 4.48Å; I371-M386 HydrophobicContact CG2-CE 4.05Å; I371-M386 HydrophobicContact CG2-SD 3.7Å; I371-L390 HydrophobicContact CD1-CD1 3.92Å
372R84.9Confident85.5Confident83 Ų8364.8 Ų64.831%0.31331%0.311SS..Hα-helixtrans-57.4-37.5-179.2-74.8-171.1-168.8-95.110114.1S44 V367 E368 M374 Y375S44-R372 PolarHBondContact OG-NH2 3.4Å; V367-R372 HydrophobicContact CG1-CG 4.28Å; V367-R372 WeakPolarHBondContact O-CG 3.39Å; V367-R372 PolarHBondContact O-N 3.03Å; E368-R372 VanDerWaalsContact CD-NE 3.26Å; E368-R372 IonicContact OE1-CZ 3.24Å; E368-R372 IonicContact OE1-NE 2.81Å; E368-R372 PolarHBondContact OE1-NE 2.94Å; E368-R372 IonicContact OE1-NH2 3.1Å; E368-R372 PolarHBondContact OE1-NH2 3.36Å; E368-R372 WeakPolarHBondContact OE2-CD 3.44Å; E368-R372 IonicContact OE2-NE 2.66Å; E368-R372 PolarHBondContact OE2-NE 3.46Å; R372-M374 PolarHBondContact O-N 3.27Å; R372-Y375 CarbonylContact O-C 3.51Å; R372-Y375 PolarHBondContact O-N 2.97Å
373P85.2Confident84.9Confident46 Ų4665 Ų6530%0.29931%0.312SS..Hα-helixtrans-62.6-26.7174.5-26.737.6000113.7E368 I371E368-P373 WeakPolarHBondContact O-CD 3.14Å; I371-P373 VanDerWaalsContact C-CD 3.47Å; I371-P373 VanDerWaalsContact C-N 3.33Å
374M85.9Confident84.3Confident129 Ų12967.2 Ų67.264%0.63533%0.326SS*.Hα-helixtrans-90.4-34177.4-65.4-168.7-76.800112.7F370 I371 R372F370-M374 WeakPolarHBondContact O-CE 3.48Å; F370-M374 WeakPolarHBondContact O-CG 3.42Å; I371-M374 CarbonylContact O-C 3.45Å; I371-M374 WeakPolarHBondContact O-CA 3.38Å; I371-M374 PolarHBondContact O-N 2.97Å; R372-M374 PolarHBondContact O-N 3.27Å
375Y83.9Confident84.1Confident143 Ų14376.5 Ų76.556%0.56136%0.361SS*.  trans-128.196.5-174.9-59.8-82000111.1I371 R372I371-Y375 HydrophobicContact CG2-CD2 4.05Å; I371-Y375 PolarHBondContact O-N 3.29Å; R372-Y375 CarbonylContact O-C 3.51Å; R372-Y375 PolarHBondContact O-N 2.97Å
376K73.9Confident83.8Confident184 Ų18478.6 Ų78.680%0.837%0.371SS*.SBendtrans-79.6-22.6-174.8-67.9-175.3177.7-177.60114.9
377N79.1Confident83.4Confident155 Ų15577.9 Ų77.983%0.82937%0.366SS*.  trans-116.864.6-173.8-66-12.9000111.3
378L80.8Confident83.1Confident51 Ų5180.5 Ų80.527%0.26738%0.38SS..  trans-91.5133.5173.5-65.2171.9000110I371 V383 M386I371-L378 HydrophobicContact CG2-CD1 4.03Å; L378-V383 HydrophobicContact CB-CG2 3.59Å; L378-V383 HydrophobicContact CD1-CG2 4.25Å; L378-M386 HydrophobicContact CD1-CE 3.97Å
379T83.4Confident83.3Confident83 Ų8381.4 Ų81.451%0.50940%0.395SS..  trans-74.6147.7173.6-500000110K381 Q382 V383T379-K381 PolarHBondContact O-N 3.3Å; T379-Q382 WeakPolarHBondContact O-CA 3.03Å; T379-Q382 WeakPolarHBondContact O-CB 3.44Å; T379-Q382 PolarHBondContact O-N 3.15Å; T379-Q382 PolarHBondContact OG1-OE1 2.94Å; T379-Q382 VanDerWaalsContact OG1-OE1 3.14Å; T379-V383 PolarHBondContact O-N 3.18Å
380D77.2Confident83.3Confident92 Ų9282.7 Ų82.749%0.49240%0.401SS..Hα-helixtrans-50.9-37.7178.1-67.9-33.4000113.8V383 T384D380-V383 PolarHBondContact O-N 3.35Å; D380-T384 WeakPolarHBondContact O-CB 3.21Å; D380-T384 PolarHBondContact O-N 3.34Å; D380-T384 PolarHBondContact O-OG1 3.27Å
381K78.9Confident83.2Confident160 Ų16080 Ų8070%0.69639%0.39SS*.Hα-helixtrans-63-45.2173.9-70.9-174.9-179.6178.10112.1T379 T384 W385T379-K381 PolarHBondContact O-N 3.3Å; K381-T384 PolarHBondContact O-N 3.31Å; K381-W385 PolarHBondContact O-N 2.93Å
382Q84.2Confident83.2Confident102 Ų10281.1 Ų81.148%0.47740%0.398SS..Hα-helixtrans-64.7-42.8179.3-66.9171.7-50.300110.7T379 T384 W385 M386T379-Q382 WeakPolarHBondContact O-CA 3.03Å; T379-Q382 WeakPolarHBondContact O-CB 3.44Å; T379-Q382 PolarHBondContact O-N 3.15Å; T379-Q382 PolarHBondContact OG1-OE1 2.94Å; T379-Q382 VanDerWaalsContact OG1-OE1 3.14Å; Q382-T384 VanDerWaalsContact C-N 3.32Å; Q382-T384 PolarHBondContact O-N 3.41Å; Q382-W385 PolarHBondContact O-N 2.85Å; Q382-M386 WeakPolarHBondContact O-CB 3.2Å; Q382-M386 PolarHBondContact O-N 3.18Å
383V79.6Confident83.5Confident6 Ų682.9 Ų82.94%0.03641%0.408CS..Hα-helixtrans-60.6-42.9175.4179.60000110.9L378 T379 D380 M386 N387L378-V383 HydrophobicContact CB-CG2 3.59Å; L378-V383 HydrophobicContact CD1-CG2 4.25Å; T379-V383 PolarHBondContact O-N 3.18Å; D380-V383 PolarHBondContact O-N 3.35Å; V383-M386 HydrophobicContact CG1-CE 4.46Å; V383-M386 PolarHBondContact O-N 2.85Å; V383-N387 WeakPolarHBondContact O-CB 3.44Å; V383-N387 PolarHBondContact O-N 3.01Å; V383-N387 PolarHBondContact O-OD1 3.47Å
384T77.1Confident83.9Confident46 Ų4681 Ų8128%0.28240%0.395SS..Hα-helixtrans-63.2-49.8178.8-57.20000112.3D380 K381 Q382 M386 N387 M388D380-T384 WeakPolarHBondContact O-CB 3.21Å; D380-T384 PolarHBondContact O-N 3.34Å; D380-T384 PolarHBondContact O-OG1 3.27Å; K381-T384 PolarHBondContact O-N 3.31Å; Q382-T384 VanDerWaalsContact C-N 3.32Å; Q382-T384 PolarHBondContact O-N 3.41Å; T384-M386 VanDerWaalsContact C-N 3.29Å; T384-M386 PolarHBondContact O-N 3.19Å; T384-N387 PolarHBondContact O-N 3.3Å; T384-M388 HydrophobicContact CG2-CE 3.96Å; T384-M388 HydrophobicContact CG2-SD 4.46Å; T384-M388 WeakPolarHBondContact O-CG 3.37Å; T384-M388 PolarHBondContact O-N 3.18Å
385W82.5Confident84Confident196 Ų19675 Ų7574%0.74237%0.366SS*.Hα-helixtrans-62.7-37.4177.8-81.8104000112.3K381 Q382 M388 G389K381-W385 PolarHBondContact O-N 2.93Å; Q382-W385 PolarHBondContact O-N 2.85Å; W385-M388 PolarHBondContact O-N 3.35Å; W385-G389 PolarHBondContact O-N 3.12Å
386M86.8Confident84.3Confident43 Ų4374.2 Ų74.221%0.21237%0.366CS..Hα-helixtrans-65-46.4175.4-179.9176.467.600112V367 I371 L378 Q382 V383 T384 M388 G389 L390V367-M386 HydrophobicContact CG1-CE 3.97Å; V367-M386 HydrophobicContact CG2-CE 3.88Å; I371-M386 HydrophobicContact CB-SD 4.47Å; I371-M386 HydrophobicContact CD1-CE 4.18Å; I371-M386 HydrophobicContact CD1-CG 4.2Å; I371-M386 HydrophobicContact CD1-SD 3.44Å; I371-M386 WeakPolarHBondContact CD1-SD 2.85Å; I371-M386 HydrophobicContact CG1-SD 4.48Å; I371-M386 HydrophobicContact CG2-CE 4.05Å; I371-M386 HydrophobicContact CG2-SD 3.7Å; L378-M386 HydrophobicContact CD1-CE 3.97Å; Q382-M386 WeakPolarHBondContact O-CB 3.2Å; Q382-M386 PolarHBondContact O-N 3.18Å; V383-M386 HydrophobicContact CG1-CE 4.46Å; V383-M386 PolarHBondContact O-N 2.85Å; T384-M386 VanDerWaalsContact C-N 3.29Å; T384-M386 PolarHBondContact O-N 3.19Å; M386-M388 VanDerWaalsContact C-N 3.3Å; M386-M388 PolarHBondContact O-N 3.17Å; M386-G389 PolarHBondContact O-N 3.34Å; M386-L390 HydrophobicContact CG-CD1 4.1Å; M386-L390 HydrophobicContact CG-CG 4.48Å; M386-L390 WeakPolarHBondContact O-CB 3.41Å; M386-L390 WeakPolarHBondContact O-CG 3.34Å; M386-L390 PolarHBondContact O-N 2.92Å
387N83.9Confident85.2Confident3 Ų368.4 Ų68.42%0.01634%0.343CS..Hα-helixtrans-58.4-44.3176-70.5-4.3000110.9F47 V363 V367 V383 T384 L390 S391F47-N387 HydrophobicContact CE1-CB 4.14Å; V363-N387 HydrophobicContact CG1-CB 3.91Å; V367-N387 WeakPolarHBondContact CG2-OD1 3.36Å; V383-N387 WeakPolarHBondContact O-CB 3.44Å; V383-N387 PolarHBondContact O-N 3.01Å; V383-N387 PolarHBondContact O-OD1 3.47Å; T384-N387 PolarHBondContact O-N 3.3Å; N387-L390 PolarHBondContact O-N 3.45Å; N387-S391 PolarHBondContact O-N 3.02Å; N387-S391 PolarHBondContact O-OG 3.31Å; N387-S391 VanDerWaalsContact O-OG 3.12Å
388M82.8Confident85.8Confident56 Ų5661 Ų6128%0.27630%0.304SS..Hα-helixtrans-61.2-45.3175.5-70.4177.8175.600112T384 W385 M386 S391 V392T384-M388 HydrophobicContact CG2-CE 3.96Å; T384-M388 HydrophobicContact CG2-SD 4.46Å; T384-M388 WeakPolarHBondContact O-CG 3.37Å; T384-M388 PolarHBondContact O-N 3.18Å; W385-M388 PolarHBondContact O-N 3.35Å; M386-M388 VanDerWaalsContact C-N 3.3Å; M386-M388 PolarHBondContact O-N 3.17Å; M388-S391 PolarHBondContact O-N 2.96Å; M388-V392 WeakPolarHBondContact O-CG2 3.33Å; M388-V392 PolarHBondContact O-N 3.06Å; M388-V392 VanDerWaalsContact O-N 3.15Å
389G89.1Confident86.1Confident42 Ų4259.7 Ų59.743%0.43330%0.297SS..Hα-helixtrans-62.5-43.2177.200000113.1W385 M386 V392 F393W385-G389 PolarHBondContact O-N 3.12Å; M386-G389 PolarHBondContact O-N 3.34Å; G389-V392 PolarHBondContact O-N 2.81Å; G389-F393 PolarHBondContact O-N 3.06Å
390L90.5Very high86.3Confident30 Ų3057.8 Ų57.816%0.15729%0.293CS..Hα-helixtrans-65.3-38.6175.9-72.5172.2000111.9V363 T366 V367 I371 M386 N387 V392 F393 F394V363-L390 HydrophobicContact CG1-CB 4.28Å; V363-L390 HydrophobicContact CG1-CD1 4.38Å; V363-L390 HydrophobicContact CG2-CB 3.81Å; T366-L390 HydrophobicContact CG2-CD1 4.13Å; T366-L390 HydrophobicContact CG2-CD2 4.16Å; V367-L390 HydrophobicContact CG2-CD1 3.69Å; I371-L390 HydrophobicContact CD1-CD1 3.92Å; M386-L390 HydrophobicContact CG-CD1 4.1Å; M386-L390 HydrophobicContact CG-CG 4.48Å; M386-L390 WeakPolarHBondContact O-CB 3.41Å; M386-L390 WeakPolarHBondContact O-CG 3.34Å; M386-L390 PolarHBondContact O-N 2.92Å; N387-L390 PolarHBondContact O-N 3.45Å; L390-V392 VanDerWaalsContact C-N 3.31Å; L390-V392 PolarHBondContact O-N 3.03Å; L390-F393 PolarHBondContact O-N 3.41Å; L390-F394 HydrophobicContact CB-CD2 4.42Å; L390-F394 HydrophobicContact CD2-CE2 4.41Å; L390-F394 VanDerWaalsContact O-CD2 3.26Å; L390-F394 WeakPolarHBondContact O-CD2 3.27Å; L390-F394 PolarHBondContact O-N 3.35Å
391S87.8Confident87Confident2 Ų255 Ų551%0.01428%0.278CS..Hα-helixtrans-58.7-43.1174-69.40000111.8N387 M388 G395N387-S391 PolarHBondContact O-N 3.02Å; N387-S391 PolarHBondContact O-OG 3.31Å; N387-S391 VanDerWaalsContact O-OG 3.12Å; M388-S391 PolarHBondContact O-N 2.96Å; S391-G395 PolarHBondContact O-N 3.06Å
392V89.5Confident87.3Confident52 Ų5247.4 Ų47.432%0.31525%0.245SC..Hα-helixtrans-64.8-47.1176.1175.80000110.8I176 T180 M388 G389 L390 G395 F396I176-V392 HydrophobicContact CG2-CB 4.42Å; I176-V392 HydrophobicContact CG2-CG2 3.94Å; T180-V392 HydrophobicContact CG2-CG2 3.57Å; M388-V392 WeakPolarHBondContact O-CG2 3.33Å; M388-V392 PolarHBondContact O-N 3.06Å; M388-V392 VanDerWaalsContact O-N 3.15Å; G389-V392 PolarHBondContact O-N 2.81Å; L390-V392 VanDerWaalsContact C-N 3.31Å; L390-V392 PolarHBondContact O-N 3.03Å; V392-G395 PolarHBondContact O-N 3.04Å; V392-F396 HydrophobicContact CG1-CD2 3.73Å; V392-F396 HydrophobicContact CG1-CE2 3.52Å; V392-F396 VanDerWaalsContact O-CD2 3.29Å; V392-F396 WeakPolarHBondContact O-CD2 3.36Å; V392-F396 PolarHBondContact O-N 3.45Å
393F92.5Very high87.1Confident119 Ų11944 Ų4452%0.52223%0.234SC..Hα-helixtrans-57.3-52.4178.2169.3-101.2000112.2G389 L390 G395 F396 L397G389-F393 PolarHBondContact O-N 3.06Å; L390-F393 PolarHBondContact O-N 3.41Å; F393-G395 VanDerWaalsContact C-N 3.29Å; F393-G395 PolarHBondContact O-N 3.33Å; F393-F396 PolarHBondContact O-N 3.21Å; F393-L397 PolarHBondContact O-N 2.96Å
394F92Very high87.3Confident7 Ų747.7 Ų47.73%0.03125%0.253CS..Hα-helixtrans-66-32.7179.3-77.6-60.4000112.3I138 L362 V363 T366 L390 L397 C398I138-F394 HydrophobicContact CG2-CE1 3.93Å; I138-F394 HydrophobicContact CG2-CZ 4.45Å; L362-F394 HydrophobicContact CB-CD1 4.13Å; L362-F394 HydrophobicContact CB-CD2 3.76Å; L362-F394 HydrophobicContact CB-CE1 4.27Å; L362-F394 HydrophobicContact CB-CE2 3.91Å; L362-F394 HydrophobicContact CB-CG 3.89Å; L362-F394 HydrophobicContact CB-CZ 4.16Å; L362-F394 HydrophobicContact CD1-CB 4.11Å; L362-F394 HydrophobicContact CD1-CD1 3.81Å; L362-F394 HydrophobicContact CD1-CE1 4.41Å; L362-F394 HydrophobicContact CD1-CG 3.97Å; L362-F394 HydrophobicContact CD2-CD1 4.41Å; L362-F394 HydrophobicContact CD2-CE1 4.2Å; L362-F394 HydrophobicContact CG-CD1 4.36Å; L362-F394 HydrophobicContact CG-CG 4.49Å; V363-F394 HydrophobicContact CG2-CD2 4.24Å; T366-F394 WeakPolarHBondContact OG1-CE2 3.5Å; T366-F394 VanDerWaalsContact OG1-CZ 3.3Å; T366-F394 WeakPolarHBondContact OG1-CZ 3.48Å; L390-F394 HydrophobicContact CB-CD2 4.42Å; L390-F394 HydrophobicContact CD2-CE2 4.41Å; L390-F394 VanDerWaalsContact O-CD2 3.26Å; L390-F394 WeakPolarHBondContact O-CD2 3.27Å; L390-F394 PolarHBondContact O-N 3.35Å; F394-L397 HydrophobicContact CD1-CD2 3.94Å; F394-L397 HydrophobicContact CE1-CD2 4.26Å; F394-L397 PolarHBondContact O-N 3.41Å; F394-C398 WeakPolarHBondContact O-CB 3.45Å; F394-C398 PolarHBondContact O-N 3.39Å; F394-C398 PolarHBondContact O-SG 3.11Å
395G89.4Confident87.5Confident2 Ų245.6 Ų45.62%0.02124%0.24CC..Hα-helixtrans-61.1-48.6172.800000112.7S391 V392 F393 L397 C398 I399S391-G395 PolarHBondContact O-N 3.06Å; V392-G395 PolarHBondContact O-N 3.04Å; F393-G395 VanDerWaalsContact C-N 3.29Å; F393-G395 PolarHBondContact O-N 3.33Å; G395-L397 VanDerWaalsContact C-N 3.34Å; G395-L397 PolarHBondContact O-N 2.85Å; G395-C398 PolarHBondContact O-N 3.23Å; G395-I399 VanDerWaalsContact O-CG1 3.32Å; G395-I399 WeakPolarHBondContact O-CG1 3.35Å; G395-I399 PolarHBondContact O-N 3.06Å
396F90.5Very high87.4Confident128 Ų12837.7 Ų37.756%0.56122%0.215SC*.Hα-helixtrans-62.8-39.8174.2-78.7-64.7000112.5I176 V392 F393 C398 I399 G400I176-F396 HydrophobicContact CD1-CD2 4.46Å; I176-F396 HydrophobicContact CD1-CG 4.46Å; V392-F396 HydrophobicContact CG1-CD2 3.73Å; V392-F396 HydrophobicContact CG1-CE2 3.52Å; V392-F396 VanDerWaalsContact O-CD2 3.29Å; V392-F396 WeakPolarHBondContact O-CD2 3.36Å; V392-F396 PolarHBondContact O-N 3.45Å; F393-F396 PolarHBondContact O-N 3.21Å; F396-C398 PolarHBondContact O-N 2.8Å; F396-I399 HydrophobicContact CD1-CD1 4.4Å; F396-I399 PolarHBondContact O-N 3.43Å; F396-G400 PolarHBondContact O-N 2.97Å
397L92.3Very high87.1Confident62 Ų6242.6 Ų42.633%0.32524%0.241SC..Hα-helixtrans-58.3-48.2174.8-17768000111A142 F393 F394 G395 I399 G400 M401A142-L397 HydrophobicContact CB-CD2 3.99Å; A142-L397 HydrophobicContact CB-CG 4.41Å; F393-L397 PolarHBondContact O-N 2.96Å; F394-L397 HydrophobicContact CD1-CD2 3.94Å; F394-L397 HydrophobicContact CE1-CD2 4.26Å; F394-L397 PolarHBondContact O-N 3.41Å; G395-L397 VanDerWaalsContact C-N 3.34Å; G395-L397 PolarHBondContact O-N 2.85Å; L397-I399 PolarHBondContact O-N 3.18Å; L397-G400 WeakPolarHBondContact O-CA 3.44Å; L397-G400 PolarHBondContact O-N 3.21Å; L397-G400 VanDerWaalsContact O-N 3.09Å; L397-M401 WeakPolarHBondContact O-CG 3.4Å; L397-M401 PolarHBondContact O-N 3.2Å
398C90.4Very high86.6Confident0 Ų044.9 Ų44.90%025%0.253CS..Hα-helixtrans-64.6-37.3-179.8-65.30000112.7T145 G146 I149 F394 G395 F396 G400 M401 A402T145-C398 HydrophobicContact CG2-CB 3.75Å; T145-C398 VanDerWaalsContact CG2-SG 3.57Å; G146-C398 VanDerWaalsContact CA-O 3.29Å; G146-C398 WeakPolarHBondContact CA-O 3.34Å; I149-C398 HydrophobicContact CD1-CB 3.94Å; F394-C398 WeakPolarHBondContact O-CB 3.45Å; F394-C398 PolarHBondContact O-N 3.39Å; F394-C398 PolarHBondContact O-SG 3.11Å; G395-C398 PolarHBondContact O-N 3.23Å; F396-C398 PolarHBondContact O-N 2.8Å; C398-G400 VanDerWaalsContact C-N 3.31Å; C398-G400 PolarHBondContact O-N 2.79Å; C398-M401 PolarHBondContact O-N 3.26Å; C398-A402 PolarHBondContact O-N 2.96Å; C398-A402 VanDerWaalsContact O-N 3.11Å
399I88.3Confident86.2Confident23 Ų2344.8 Ų44.812%0.11827%0.266CS..Hα-helixtrans-59.4-44.4171.2-68166.8000110.1L168 I176 G395 F396 L397 M401 A402L168-I399 HydrophobicContact CD2-CB 4.43Å; L168-I399 HydrophobicContact CD2-CG2 3.67Å; I176-I399 HydrophobicContact CD1-CD1 3.9Å; G395-I399 VanDerWaalsContact O-CG1 3.32Å; G395-I399 WeakPolarHBondContact O-CG1 3.35Å; G395-I399 PolarHBondContact O-N 3.06Å; F396-I399 HydrophobicContact CD1-CD1 4.4Å; F396-I399 PolarHBondContact O-N 3.43Å; L397-I399 PolarHBondContact O-N 3.18Å; I399-M401 VanDerWaalsContact C-N 3.32Å; I399-M401 PolarHBondContact O-N 3.4Å; I399-A402 WeakPolarHBondContact O-CB 3.43Å; I399-A402 PolarHBondContact O-N 2.85Å
400G88.3Confident85.9Confident42 Ų4243.9 Ų43.943%0.43325%0.253SS..Hα-helixtrans-59.5-40.8173.700000112.8F396 L397 C398 A402 A403F396-G400 PolarHBondContact O-N 2.97Å; L397-G400 WeakPolarHBondContact O-CA 3.44Å; L397-G400 PolarHBondContact O-N 3.21Å; L397-G400 VanDerWaalsContact O-N 3.09Å; C398-G400 VanDerWaalsContact C-N 3.31Å; C398-G400 PolarHBondContact O-N 2.79Å; G400-A402 VanDerWaalsContact C-N 3.26Å; G400-A402 PolarHBondContact O-N 3.32Å; G400-A403 VanDerWaalsContact O-CB 3.28Å; G400-A403 WeakPolarHBondContact O-CB 3.37Å; G400-A403 PolarHBondContact O-N 2.97Å
401M90.1Very high85.7Confident35 Ų3542.6 Ų42.617%0.17225%0.246CC..Hα-helixtrans-67.5-23.8177.9-59.5-44-68.200113.5A142 L143 L397 C398 I399 A403 I404 A405A142-M401 HydrophobicContact CB-CG 4.27Å; A142-M401 WeakPolarHBondContact O-CB 3.44Å; L143-M401 HydrophobicContact CD2-CE 3.15Å; L143-M401 HydrophobicContact CG-CE 3.75Å; L397-M401 WeakPolarHBondContact O-CG 3.4Å; L397-M401 PolarHBondContact O-N 3.2Å; C398-M401 PolarHBondContact O-N 3.26Å; I399-M401 VanDerWaalsContact C-N 3.32Å; I399-M401 PolarHBondContact O-N 3.4Å; M401-A403 PolarHBondContact O-N 3.19Å; M401-I404 HydrophobicContact CE-CD1 3.48Å; M401-I404 VanDerWaalsContact CE-CD1 3.48Å; M401-I404 WeakPolarHBondContact O-CB 3.34Å; M401-I404 PolarHBondContact O-N 3.42Å; M401-I404 HydrophobicContact SD-CD1 4.1Å; M401-A405 PolarHBondContact O-N 3.31Å; M401-A405 VanDerWaalsContact O-N 3.13Å
402A85.9Confident85.7Confident0 Ų043 Ų430%025%0.248CC..Hα-helixtrans-67-24.6175.600000112.7G146 L168 C398 I399 G400 I404 A405 S406G146-A402 VanDerWaalsContact O-CB 3.26Å; G146-A402 WeakPolarHBondContact O-CB 3.36Å; L168-A402 HydrophobicContact CD1-CB 3.71Å; L168-A402 HydrophobicContact CD2-CB 3.91Å; L168-A402 HydrophobicContact CG-CB 4.08Å; C398-A402 PolarHBondContact O-N 2.96Å; C398-A402 VanDerWaalsContact O-N 3.11Å; I399-A402 WeakPolarHBondContact O-CB 3.43Å; I399-A402 PolarHBondContact O-N 2.85Å; G400-A402 VanDerWaalsContact C-N 3.26Å; G400-A402 PolarHBondContact O-N 3.32Å; A402-I404 VanDerWaalsContact C-N 3.28Å; A402-I404 PolarHBondContact O-N 3.14Å; A402-A405 WeakPolarHBondContact O-CB 3.41Å; A402-A405 PolarHBondContact O-N 3.5Å; A402-S406 PolarHBondContact O-N 3.32Å
403A80.9Confident85.8Confident31 Ų3142.6 Ų42.626%0.25624%0.243SC..Hα-helixtrans-64.5-32.9169.700000112.5W165 G400 M401 S406W165-A403 HydrophobicContact CH2-CB 3.52Å; W165-A403 HydrophobicContact CZ3-CB 3.82Å; G400-A403 VanDerWaalsContact O-CB 3.28Å; G400-A403 WeakPolarHBondContact O-CB 3.37Å; G400-A403 PolarHBondContact O-N 2.97Å; M401-A403 PolarHBondContact O-N 3.19Å; A403-S406 PolarHBondContact O-OG 3.01Å
404I83.3Confident85.7Confident82 Ų8237 Ų3742%0.42122%0.219SC..Hα-helixtrans-75.9-37.6175.8-64.8165.3000109.4M401 A402 S406 L407M401-I404 HydrophobicContact CE-CD1 3.48Å; M401-I404 VanDerWaalsContact CE-CD1 3.48Å; M401-I404 WeakPolarHBondContact O-CB 3.34Å; M401-I404 PolarHBondContact O-N 3.42Å; M401-I404 HydrophobicContact SD-CD1 4.1Å; A402-I404 VanDerWaalsContact C-N 3.28Å; A402-I404 PolarHBondContact O-N 3.14Å; I404-S406 PolarHBondContact O-N 2.93Å; I404-L407 WeakPolarHBondContact O-CB 3.5Å; I404-L407 PolarHBondContact O-N 3.37Å
405A80.7Confident85.6Confident2 Ų236.9 Ų36.92%0.01722%0.219CC..Hα-helixtrans-58.2-32.9176.300000113.2M147 Y150 M401 A402 L407 M408M147-A405 HydrophobicContact CB-CB 4.17Å; M147-A405 HydrophobicContact CG-CB 3.55Å; Y150-A405 HydrophobicContact CD1-CB 4.18Å; Y150-A405 HydrophobicContact CG-CB 4.07Å; M401-A405 PolarHBondContact O-N 3.31Å; M401-A405 VanDerWaalsContact O-N 3.13Å; A402-A405 WeakPolarHBondContact O-CB 3.41Å; A402-A405 PolarHBondContact O-N 3.5Å; A405-L407 PolarHBondContact O-N 3.05Å; A405-M408 WeakPolarHBondContact O-CB 3.47Å; A405-M408 PolarHBondContact O-N 3.1Å; A405-M408 VanDerWaalsContact O-N 3.11Å
406S80.4Confident85.8Confident31 Ų3137.3 Ų37.322%0.21722%0.22CC..THydrogen-bonded Turntrans-69.2-14.9177.673.20000114.5Y150 A402 A403 I404Y150-S406 VanDerWaalsContact CZ-CA 3.5Å; A402-S406 PolarHBondContact O-N 3.32Å; A403-S406 PolarHBondContact O-OG 3.01Å; I404-S406 PolarHBondContact O-N 2.93Å
407L80Confident86Confident146 Ų14631.3 Ų31.376%0.76419%0.194SC*.THydrogen-bonded Turntrans-91.8-7.6175.1-55.8176.8000112.3I404 A405I404-L407 WeakPolarHBondContact O-CB 3.5Å; I404-L407 PolarHBondContact O-N 3.37Å; A405-L407 PolarHBondContact O-N 3.05Å
408M74.3Confident86Confident51 Ų5128.8 Ų28.825%0.25118%0.181SC..SBendtrans-88.1154.9-179.5-54-17684.100109.9M147 A405 A414 I418M147-M408 HydrophobicContact CG-SD 4.34Å; M147-M408 HydrophobicContact SD-CE 4.49Å; M147-M408 HydrophobicContact SD-SD 3.86Å; A405-M408 WeakPolarHBondContact O-CB 3.47Å; A405-M408 PolarHBondContact O-N 3.1Å; A405-M408 VanDerWaalsContact O-N 3.11Å; M408-A414 HydrophobicContact CB-CB 4.08Å; M408-A414 HydrophobicContact CE-CB 3.55Å; M408-A414 HydrophobicContact SD-CB 4Å; M408-I418 HydrophobicContact CE-CD1 3.88Å; M408-I418 HydrophobicContact SD-CD1 4.38Å
409G74.8Confident86.1Confident54 Ų5428.9 Ų28.956%0.55718%0.182SC*.SBendtrans-70.1-128.4175.800000112.7I411G409-I411 PolarHBondContact O-N 3.24Å; G409-I411 VanDerWaalsContact O-N 3.08Å
410S82.3Confident86.3Confident22 Ų2227.8 Ų27.815%0.15418%0.176CC..SBendtrans-55.4119.9174.5169.70000110.8L412 Q413 A414S410-L412 VanDerWaalsContact C-N 3.27Å; S410-L412 PolarHBondContact O-N 3.07Å; S410-Q413 PolarHBondContact O-N 3.42Å; S410-A414 WeakPolarHBondContact O-CB 3.34Å; S410-A414 PolarHBondContact O-N 3.36Å
411I85.6Confident86.7Confident4 Ų426.7 Ų26.72%0.02116%0.16CC..Hα-helixtrans-63-38.3-174.4-57.2166.2000110.3I71 M147 Y150 A151 L154 D322 G409 A414 A415I71-I411 HydrophobicContact CD1-CG2 3.98Å; I71-I411 HydrophobicContact CG1-CG2 3.99Å; I71-I411 HydrophobicContact CG2-CG2 4.2Å; M147-I411 HydrophobicContact CB-CG2 4.1Å; Y150-I411 HydrophobicContact CD1-CD1 3.58Å; Y150-I411 HydrophobicContact CD1-CG1 4.1Å; Y150-I411 HydrophobicContact CE1-CD1 3.71Å; Y150-I411 HydrophobicContact CE1-CG1 4.2Å; A151-I411 HydrophobicContact CB-CD1 4.07Å; A151-I411 HydrophobicContact CB-CG2 4.33Å; L154-I411 HydrophobicContact CD2-CD1 4.09Å; D322-I411 HydrophobicContact CB-CD1 4.08Å; D322-I411 PolarHBondContact OD2-N 2.58Å; G409-I411 PolarHBondContact O-N 3.24Å; G409-I411 VanDerWaalsContact O-N 3.08Å; I411-A414 PolarHBondContact O-N 2.81Å; I411-A415 WeakPolarHBondContact O-CB 3.23Å; I411-A415 PolarHBondContact O-N 2.9Å
412L88.7Confident87Confident9 Ų925.8 Ų25.85%0.04716%0.155CC..Hα-helixtrans-62-49.9177.3-179.265.3000112.1I71 E79 F87 S410 A414 A415 L416I71-L412 HydrophobicContact CG2-CB 3.97Å; I71-L412 HydrophobicContact CG2-CD1 3.84Å; E79-L412 HydrophobicContact CB-CD2 4.12Å; F87-L412 HydrophobicContact CD2-CD2 4.45Å; F87-L412 HydrophobicContact CE2-CD2 3.47Å; F87-L412 VanDerWaalsContact CE2-CD2 3.47Å; F87-L412 HydrophobicContact CE2-CG 4.29Å; F87-L412 HydrophobicContact CZ-CD2 3.91Å; S410-L412 VanDerWaalsContact C-N 3.27Å; S410-L412 PolarHBondContact O-N 3.07Å; L412-A414 VanDerWaalsContact C-N 3.35Å; L412-A414 PolarHBondContact O-N 2.72Å; L412-A415 PolarHBondContact O-N 2.59Å; L412-L416 HydrophobicContact CD1-CD1 4.32Å; L412-L416 HydrophobicContact CG-CD1 4.41Å; L412-L416 WeakPolarHBondContact O-CG 3.41Å; L412-L416 PolarHBondContact O-N 3.1Å; L412-L416 VanDerWaalsContact O-N 3.08Å
413Q90.4Very high87.4Confident45 Ų4525.9 Ų25.921%0.2116%0.156CC..Hα-helixtrans-63.1-43.6178.3179.5-176.9-21.900111.3R241 S410 A415 L416 S417 Y521R241-Q413 VanDerWaalsContact NH1-CD 3.34Å; R241-Q413 VanDerWaalsContact NH2-OE1 3.1Å; S410-Q413 PolarHBondContact O-N 3.42Å; Q413-A415 VanDerWaalsContact C-N 3.34Å; Q413-A415 PolarHBondContact O-N 3.18Å; Q413-L416 PolarHBondContact O-N 2.87Å; Q413-S417 WeakPolarHBondContact O-CB 2.96Å; Q413-S417 PolarHBondContact O-N 3.02Å; Q413-S417 PolarHBondContact O-OG 2.81Å; Q413-Y521 HydrophobicContact CG-CD1 3.73Å; Q413-Y521 HydrophobicContact CG-CD2 4.4Å; Q413-Y521 HydrophobicContact CG-CE1 4.04Å; Q413-Y521 HydrophobicContact CG-CG 3.94Å
414A90.8Very high88.2Confident2 Ų224.4 Ų24.42%0.01714%0.144CC..Hα-helixtrans-57.7-46.6177.200000111.7M147 M408 S410 I411 L412 S417 I418M147-A414 HydrophobicContact SD-CB 3.84Å; M408-A414 HydrophobicContact CB-CB 4.08Å; M408-A414 HydrophobicContact CE-CB 3.55Å; M408-A414 HydrophobicContact SD-CB 4Å; S410-A414 WeakPolarHBondContact O-CB 3.34Å; S410-A414 PolarHBondContact O-N 3.36Å; I411-A414 PolarHBondContact O-N 2.81Å; L412-A414 VanDerWaalsContact C-N 3.35Å; L412-A414 PolarHBondContact O-N 2.72Å; A414-S417 PolarHBondContact O-N 3.39Å; A414-I418 PolarHBondContact O-N 2.89Å
415A91.2Very high88.9Confident4 Ų420.5 Ų20.53%0.03312%0.124CC..Hα-helixtrans-60.5-49.2177.900000112.6I71 Y144 M147 I411 L412 Q413 S417 I418 F419I71-A415 HydrophobicContact CD1-CB 3.94Å; Y144-A415 HydrophobicContact CD2-CB 4.16Å; Y144-A415 HydrophobicContact CE2-CB 4.23Å; M147-A415 HydrophobicContact CE-CB 3.94Å; M147-A415 HydrophobicContact SD-CB 4.17Å; I411-A415 WeakPolarHBondContact O-CB 3.23Å; I411-A415 PolarHBondContact O-N 2.9Å; L412-A415 PolarHBondContact O-N 2.59Å; Q413-A415 VanDerWaalsContact C-N 3.34Å; Q413-A415 PolarHBondContact O-N 3.18Å; A415-S417 VanDerWaalsContact C-N 3.31Å; A415-S417 PolarHBondContact O-N 3.47Å; A415-I418 PolarHBondContact O-N 3.11Å; A415-F419 WeakPolarHBondContact O-CD2 3.37Å; A415-F419 PolarHBondContact O-N 3.04Å; A415-F419 VanDerWaalsContact O-N 3.1Å
416L92.8Very high89.7Confident10 Ų1020.4 Ų20.45%0.05212%0.123CC..Hα-helixtrans-66.1-34.3178.8-64.4179.5000112.1F87 M254 L412 Q413 F419 G420 Y521 L522F87-L416 HydrophobicContact CZ-CD1 4.41Å; M254-L416 HydrophobicContact CE-CD1 4.36Å; M254-L416 HydrophobicContact CE-CD2 3.74Å; M254-L416 HydrophobicContact CE-CG 4.45Å; M254-L416 HydrophobicContact SD-CB 4Å; M254-L416 HydrophobicContact SD-CD2 3.93Å; M254-L416 HydrophobicContact SD-CG 4.43Å; L412-L416 HydrophobicContact CD1-CD1 4.32Å; L412-L416 HydrophobicContact CG-CD1 4.41Å; L412-L416 WeakPolarHBondContact O-CG 3.41Å; L412-L416 PolarHBondContact O-N 3.1Å; L412-L416 VanDerWaalsContact O-N 3.08Å; Q413-L416 PolarHBondContact O-N 2.87Å; L416-F419 PolarHBondContact O-N 2.83Å; L416-G420 PolarHBondContact O-N 3.43Å; L416-Y521 HydrophobicContact CB-CD2 3.86Å; L416-Y521 HydrophobicContact CB-CE2 3.86Å; L416-Y521 HydrophobicContact CD1-CE2 3.72Å; L416-Y521 HydrophobicContact CG-CE2 4.44Å; L416-L522 HydrophobicContact CD1-CD2 4.33Å
417S94Very high90.5Very high2 Ų219.2 Ų19.21%0.01411%0.114CC..Hα-helixtrans-64-43.7175-57.20000111.8Q413 A414 A415 F419 G420 M421 Y521Q413-S417 WeakPolarHBondContact O-CB 2.96Å; Q413-S417 PolarHBondContact O-N 3.02Å; Q413-S417 PolarHBondContact O-OG 2.81Å; A414-S417 PolarHBondContact O-N 3.39Å; A415-S417 VanDerWaalsContact C-N 3.31Å; A415-S417 PolarHBondContact O-N 3.47Å; S417-F419 VanDerWaalsContact C-N 3.33Å; S417-F419 PolarHBondContact O-N 3.43Å; S417-G420 PolarHBondContact O-N 3.47Å; S417-M421 WeakPolarHBondContact O-CB 3.42Å; S417-M421 WeakPolarHBondContact O-CG 3.42Å; S417-M421 PolarHBondContact O-N 3.37Å; S417-Y521 WeakPolarHBondContact OG-CB 3.46Å
418I93.1Very high91.4Very high10 Ų1012.2 Ų12.25%0.0518%0.078CC..Hα-helixtrans-63.8-39.4176.9-76.2163.3000111.3Q140 L143 M147 M408 A414 A415 M421 I422Q140-I418 HydrophobicContact CG-CG2 4.07Å; Q140-I418 PolarHBondContact NE2-O 2.87Å; Q140-I418 VanDerWaalsContact NE2-O 3.11Å; L143-I418 HydrophobicContact CB-CD1 4.3Å; L143-I418 HydrophobicContact CB-CG2 4.35Å; M147-I418 HydrophobicContact CE-CB 4.41Å; M147-I418 HydrophobicContact CE-CD1 3.34Å; M147-I418 HydrophobicContact CE-CG1 4.41Å; M147-I418 HydrophobicContact SD-CD1 3.85Å; M408-I418 HydrophobicContact CE-CD1 3.88Å; M408-I418 HydrophobicContact SD-CD1 4.38Å; A414-I418 PolarHBondContact O-N 2.89Å; A415-I418 PolarHBondContact O-N 3.11Å; I418-M421 HydrophobicContact CG1-CE 4.14Å; I418-I422 HydrophobicContact CG2-CD1 4.5Å; I418-I422 PolarHBondContact O-N 3.23Å
419F92Very high92.5Very high2 Ų29.8 Ų9.81%0.0097%0.066CC..Hα-helixtrans-59.9-50170.8-84.2-63.5000111.6F67 Q140 Y144 I258 A415 L416 S417 M421 S423F67-F419 HydrophobicContact CE2-CE1 4.38Å; F67-F419 AromaticContact CE2-CE2 3.81Å; F67-F419 HydrophobicContact CE2-CE2 3.81Å; F67-F419 AromaticContact CE2-CZ 3.67Å; F67-F419 HydrophobicContact CE2-CZ 3.67Å; F67-F419 HydrophobicContact CZ-CD2 4.03Å; F67-F419 AromaticContact CZ-CE2 3.53Å; F67-F419 HydrophobicContact CZ-CE2 3.53Å; F67-F419 AromaticContact CZ-CZ 3.88Å; F67-F419 HydrophobicContact CZ-CZ 3.88Å; Q140-F419 PolarHBondContact NE2-O 3.3Å; Y144-F419 HydrophobicContact CD1-CE2 4.1Å; Y144-F419 AromaticContact CD1-CZ 3.81Å; Y144-F419 HydrophobicContact CD1-CZ 3.81Å; Y144-F419 HydrophobicContact CD2-CD2 4.37Å; Y144-F419 AromaticContact CD2-CE2 3.46Å; Y144-F419 HydrophobicContact CD2-CE2 3.46Å; Y144-F419 VanDerWaalsContact CD2-CE2 3.46Å; Y144-F419 HydrophobicContact CD2-CZ 4.01Å; Y144-F419 HydrophobicContact CE1-CE2 4.19Å; Y144-F419 HydrophobicContact CE1-CZ 4.02Å; Y144-F419 AromaticContact CE2-CE2 3.58Å; Y144-F419 HydrophobicContact CE2-CE2 3.58Å; Y144-F419 HydrophobicContact CE2-CZ 4.24Å; Y144-F419 AromaticContact CG-CE2 3.74Å; Y144-F419 HydrophobicContact CG-CE2 3.74Å; Y144-F419 AromaticContact CG-CZ 3.78Å; Y144-F419 HydrophobicContact CG-CZ 3.78Å; Y144-F419 AromaticContact CZ-CE2 3.94Å; I258-F419 HydrophobicContact CD1-CB 4.39Å; I258-F419 HydrophobicContact CD1-CD1 4.42Å; I258-F419 HydrophobicContact CD1-CD2 4.36Å; I258-F419 HydrophobicContact CD1-CG 4.14Å; I258-F419 HydrophobicContact CG1-CB 4.46Å; I258-F419 HydrophobicContact CG1-CD1 3.78Å; I258-F419 HydrophobicContact CG1-CE1 4.15Å; I258-F419 HydrophobicContact CG1-CG 4.01Å; A415-F419 WeakPolarHBondContact O-CD2 3.37Å; A415-F419 PolarHBondContact O-N 3.04Å; A415-F419 VanDerWaalsContact O-N 3.1Å; L416-F419 PolarHBondContact O-N 2.83Å; S417-F419 VanDerWaalsContact C-N 3.33Å; S417-F419 PolarHBondContact O-N 3.43Å; F419-M421 PolarHBondContact O-N 3.47Å; F419-S423 WeakPolarHBondContact O-CA 3.42Å; F419-S423 WeakPolarHBondContact O-CB 3.42Å; F419-S423 PolarHBondContact O-N 3.3Å; F419-S423 PolarHBondContact O-OG 3.48Å
420G93.3Very high93.6Very high0 Ų07.2 Ų7.20%04%0.039CC..Hα-helixtrans-60.7-45.5-179.800000113.7L416 S417 I422 G424 F524 C525L416-G420 PolarHBondContact O-N 3.43Å; S417-G420 PolarHBondContact O-N 3.47Å; G420-I422 PolarHBondContact O-N 3.46Å; G420-G424 PolarHBondContact O-N 3.33Å; G420-F524 CarbonylContact O-C 3.03Å; G420-C525 WeakPolarHBondContact O-CA 3.29Å; G420-C525 PolarHBondContact O-N 2.81Å
421M95.9Very high94.3Very high18 Ų188 Ų89%0.0894%0.041CC..Hα-helixtrans-65.7-41.2-175.4-72.8-175.1-72.900113.4S417 I418 F419 P425 T455 L456 G459 F524S417-M421 WeakPolarHBondContact O-CB 3.42Å; S417-M421 WeakPolarHBondContact O-CG 3.42Å; S417-M421 PolarHBondContact O-N 3.37Å; I418-M421 HydrophobicContact CG1-CE 4.14Å; F419-M421 PolarHBondContact O-N 3.47Å; M421-P425 WeakPolarHBondContact O-CD 3.43Å; M421-P425 WeakPolarHBondContact O-CG 3.25Å; M421-T455 PolarHBondContact O-OG1 3.24Å; M421-L456 HydrophobicContact CB-CD2 4.33Å; M421-L456 HydrophobicContact SD-CD2 4.18Å; M421-G459 VanDerWaalsContact SD-CA 3.58Å; M421-F524 HydrophobicContact CG-CB 4.5Å; M421-F524 HydrophobicContact CG-CD2 3.92Å; M421-F524 HydrophobicContact CG-CG 4.49Å
422I96.4Very high94.8Very high16 Ų167.8 Ų7.88%0.0824%0.04CC..Hα-helixtrans-101.3-40.5-173-56.3170.8000112.1M136 Q140 I418 G420 P425 L426 L452M136-I422 HydrophobicContact CB-CG2 3.96Å; M136-I422 HydrophobicContact CE-CG2 3.82Å; Q140-I422 HydrophobicContact CB-CB 4.2Å; Q140-I422 HydrophobicContact CB-CD1 3.86Å; Q140-I422 HydrophobicContact CB-CG2 3.96Å; Q140-I422 HydrophobicContact CG-CB 4.35Å; Q140-I422 HydrophobicContact CG-CD1 4.39Å; I418-I422 HydrophobicContact CG2-CD1 4.5Å; I418-I422 PolarHBondContact O-N 3.23Å; G420-I422 PolarHBondContact O-N 3.46Å; I422-P425 WeakPolarHBondContact O-CD 3.32Å; I422-L426 HydrophobicContact CG2-CD1 4.47Å; I422-L452 HydrophobicContact CG1-CD1 4.37Å
423S94.8Very high95Very high2 Ų27.4 Ų7.41%0.0144%0.038CC..Hα-helixtrans-74.7-27.1179.6-57.60000112.7Q140 S257 F419 L426 L427Q140-S423 VanDerWaalsContact NE2-N 3.2Å; Q140-S423 PolarHBondContact NE2-OG 3.3Å; Q140-S423 PolarHBondContact OE1-OG 3.45Å; S257-S423 WeakPolarHBondContact OG-CB 3.47Å; F419-S423 WeakPolarHBondContact O-CA 3.42Å; F419-S423 WeakPolarHBondContact O-CB 3.42Å; F419-S423 PolarHBondContact O-N 3.3Å; F419-S423 PolarHBondContact O-OG 3.48Å; S423-L426 PolarHBondContact O-N 3.38Å; S423-L427 WeakPolarHBondContact O-CB 3.33Å; S423-L427 PolarHBondContact O-N 3.36Å
424G97.1Very high95.2Very high0 Ų05.3 Ų5.30%03%0.029CC..Hα-helixtrans-58-56.7177.200000112.8G420 L426 L427 G428 C525 T529G420-G424 PolarHBondContact O-N 3.33Å; G424-L426 VanDerWaalsContact C-N 3.28Å; G424-L426 PolarHBondContact O-N 3.4Å; G424-L427 PolarHBondContact O-N 3.01Å; G424-L427 VanDerWaalsContact O-N 3.16Å; G424-G428 PolarHBondContact O-N 3.39Å; G424-C525 WeakPolarHBondContact CA-O 3.32Å; G424-C525 WeakPolarHBondContact CA-SG 3.45Å; G424-T529 WeakPolarHBondContact O-CA 3.32Å; G424-T529 PolarHBondContact O-N 3.01Å; G424-T529 PolarHBondContact O-OG1 3.38Å; G424-T529 VanDerWaalsContact O-OG1 3.09Å
425P98.1Very high95.3Very high0 Ų09.3 Ų9.30%05%0.046CC..Hα-helixtrans-58-38.3176.4-26.234.8000113.4M421 I422 G428 L429 L448 G451 L452 T455 T532M421-P425 WeakPolarHBondContact O-CD 3.43Å; M421-P425 WeakPolarHBondContact O-CG 3.25Å; I422-P425 WeakPolarHBondContact O-CD 3.32Å; P425-G428 PolarHBondContact O-N 3.27Å; P425-L429 PolarHBondContact O-N 3.24Å; P425-L429 VanDerWaalsContact O-N 3.08Å; P425-L448 HydrophobicContact CB-CD1 3.95Å; P425-G451 VanDerWaalsContact CG-C 3.48Å; P425-L452 HydrophobicContact CB-CB 4.41Å; P425-L452 HydrophobicContact CG-CB 4.29Å; P425-T455 HydrophobicContact CG-CG2 4.39Å; P425-T532 VanDerWaalsContact CA-OG1 3.32Å; P425-T532 WeakPolarHBondContact CA-OG1 3.43Å; P425-T532 WeakPolarHBondContact O-CG2 3.39Å; P425-T532 PolarHBondContact O-OG1 3.34Å
426L97.6Very high95.3Very high1 Ų113.6 Ų13.61%0.0056%0.061CC..Hα-helixtrans-64.4-46.3174.9-70.8171.4000111.6M136 I261 I422 S423 G424 G428 L429 Y430 L448M136-L426 HydrophobicContact CB-CD1 4.13Å; M136-L426 HydrophobicContact CB-CD2 4.49Å; M136-L426 HydrophobicContact CE-CD1 4.37Å; M136-L426 HydrophobicContact CE-CD2 4.18Å; M136-L426 HydrophobicContact CE-CG 3.9Å; M136-L426 HydrophobicContact SD-CD2 4.02Å; M136-L426 HydrophobicContact SD-CG 4.4Å; I261-L426 HydrophobicContact CD1-CB 3.6Å; I422-L426 HydrophobicContact CG2-CD1 4.47Å; S423-L426 PolarHBondContact O-N 3.38Å; G424-L426 VanDerWaalsContact C-N 3.28Å; G424-L426 PolarHBondContact O-N 3.4Å; L426-G428 VanDerWaalsContact C-N 3.28Å; L426-G428 PolarHBondContact O-N 3.44Å; L426-L429 WeakPolarHBondContact O-CB 3.48Å; L426-L429 PolarHBondContact O-N 3.03Å; L426-Y430 VanDerWaalsContact O-CD2 3.26Å; L426-Y430 WeakPolarHBondContact O-CD2 3.39Å; L426-Y430 PolarHBondContact O-N 2.95Å; L426-L448 HydrophobicContact CD2-CD1 3.93Å; L426-L448 HydrophobicContact CG-CD1 4.4Å
427L98Very high95Very high5 Ų521.5 Ų21.53%0.0269%0.09CC..Hα-helixtrans-58.7-43.9177178.964.9000110.5F105 V253 I261 S423 G424 L429 Y430 L431 T529F105-L427 HydrophobicContact CE1-CD1 4.44Å; F105-L427 HydrophobicContact CZ-CD1 3.84Å; V253-L427 HydrophobicContact CG1-CD2 3.76Å; I261-L427 HydrophobicContact CD1-CB 3.97Å; I261-L427 VanDerWaalsContact CD1-N 3.34Å; I261-L427 HydrophobicContact CG2-CD1 4.32Å; S423-L427 WeakPolarHBondContact O-CB 3.33Å; S423-L427 PolarHBondContact O-N 3.36Å; G424-L427 PolarHBondContact O-N 3.01Å; G424-L427 VanDerWaalsContact O-N 3.16Å; L427-L429 VanDerWaalsContact C-N 3.27Å; L427-L429 PolarHBondContact O-N 3.33Å; L427-Y430 PolarHBondContact O-N 2.67Å; L427-L431 HydrophobicContact CD1-CD1 4.42Å; L427-L431 HydrophobicContact CD1-CG 4.23Å; L427-L431 HydrophobicContact CG-CD1 4.06Å; L427-L431 HydrophobicContact CG-CG 4.3Å; L427-L431 WeakPolarHBondContact O-CG 3.45Å; L427-L431 PolarHBondContact O-N 3.29Å; L427-T529 HydrophobicContact CD2-CG2 4.44Å; L427-T529 HydrophobicContact CG-CG2 4.4Å
428G97.8Very high94.7Very high0 Ų024.3 Ų24.30%011%0.107CC..Hα-helixtrans-55.9-41.3174.200000112.8G424 P425 L426 L432 V533G424-G428 PolarHBondContact O-N 3.39Å; P425-G428 PolarHBondContact O-N 3.27Å; L426-G428 VanDerWaalsContact C-N 3.28Å; L426-G428 PolarHBondContact O-N 3.44Å; G428-L432 WeakPolarHBondContact O-CB 3.14Å; G428-L432 PolarHBondContact O-N 3.22Å; G428-V533 WeakPolarHBondContact O-CG2 3.5Å
429L97.9Very high94.6Very high0 Ų023.8 Ų23.80%011%0.105CC..Hα-helixtrans-66.7-42.1176.7176.866.9000112.6L121 F125 I129 P425 L426 L427 L432 G433 L448 T532L121-L429 HydrophobicContact CD1-CD2 3.9Å; L121-L429 HydrophobicContact CD2-CD2 3.97Å; L121-L429 HydrophobicContact CD2-CG 4.02Å; F125-L429 HydrophobicContact CD2-CD1 4.13Å; F125-L429 HydrophobicContact CE2-CD1 3.56Å; F125-L429 HydrophobicContact CE2-CG 4.18Å; F125-L429 HydrophobicContact CZ-CD1 3.96Å; I129-L429 HydrophobicContact CG2-CD1 4.4Å; I129-L429 HydrophobicContact CG2-CD2 3.44Å; I129-L429 VanDerWaalsContact CG2-CD2 3.44Å; I129-L429 HydrophobicContact CG2-CG 4.42Å; P425-L429 PolarHBondContact O-N 3.24Å; P425-L429 VanDerWaalsContact O-N 3.08Å; L426-L429 WeakPolarHBondContact O-CB 3.48Å; L426-L429 PolarHBondContact O-N 3.03Å; L427-L429 VanDerWaalsContact C-N 3.27Å; L427-L429 PolarHBondContact O-N 3.33Å; L429-L432 PolarHBondContact O-N 3.39Å; L429-G433 PolarHBondContact O-N 3.5Å; L429-L448 HydrophobicContact CB-CD1 4.4Å; L429-L448 HydrophobicContact CD2-CD1 4.29Å; L429-L448 HydrophobicContact CD2-CD2 4.03Å; L429-T532 HydrophobicContact CB-CG2 4.19Å
430Y97.3Very high94.6Very high0 Ų024.5 Ų24.50%011%0.109CC..Hα-helixtrans-62.9-49174.7-83.3-86.1000111.1F109 T117 Y118 Y120 L121 I261 L426 L427 L432 G433 M434F109-Y430 HydrophobicContact CZ-CE1 4.42Å; T117-Y430 VanDerWaalsContact CB-OH 3.28Å; T117-Y430 WeakPolarHBondContact CB-OH 3.48Å; T117-Y430 PolarHBondContact O-OH 3.38Å; T117-Y430 PolarHBondContact OG1-OH 2.91Å; Y118-Y430 WeakPolarHBondContact CD1-OH 3.23Å; Y118-Y430 PolarHBondContact N-OH 3.17Å; Y120-Y430 AromaticContact CD1-CD1 3.44Å; Y120-Y430 HydrophobicContact CD1-CD1 3.44Å; Y120-Y430 VanDerWaalsContact CD1-CD1 3.44Å; Y120-Y430 AromaticContact CD1-CE1 3.52Å; Y120-Y430 HydrophobicContact CD1-CE1 3.52Å; Y120-Y430 AromaticContact CE1-CD1 3.81Å; Y120-Y430 HydrophobicContact CE1-CD1 3.81Å; Y120-Y430 HydrophobicContact CE1-CE1 4.35Å; Y120-Y430 HydrophobicContact CG-CD1 4.48Å; Y120-Y430 HydrophobicContact CG-CE1 4.29Å; L121-Y430 HydrophobicContact CD1-CE2 4.04Å; L121-Y430 HydrophobicContact CD2-CD1 4.05Å; L121-Y430 HydrophobicContact CD2-CD2 4.26Å; L121-Y430 HydrophobicContact CD2-CE1 3.92Å; L121-Y430 HydrophobicContact CD2-CE2 4.12Å; L121-Y430 HydrophobicContact CD2-CG 4.22Å; L121-Y430 HydrophobicContact CG-CE1 4.11Å; L121-Y430 HydrophobicContact CG-CE2 4.23Å; I261-Y430 HydrophobicContact CB-CD2 3.93Å; I261-Y430 HydrophobicContact CB-CE2 3.88Å; I261-Y430 HydrophobicContact CD1-CD2 4.06Å; I261-Y430 HydrophobicContact CD1-CE2 4.29Å; I261-Y430 HydrophobicContact CG2-CD1 4.08Å; I261-Y430 HydrophobicContact CG2-CD2 3.45Å; I261-Y430 VanDerWaalsContact CG2-CD2 3.45Å; I261-Y430 HydrophobicContact CG2-CE1 4.41Å; I261-Y430 HydrophobicContact CG2-CE2 3.85Å; I261-Y430 HydrophobicContact CG2-CG 3.59Å; L426-Y430 VanDerWaalsContact O-CD2 3.26Å; L426-Y430 WeakPolarHBondContact O-CD2 3.39Å; L426-Y430 PolarHBondContact O-N 2.95Å; L427-Y430 PolarHBondContact O-N 2.67Å; Y430-L432 VanDerWaalsContact C-N 3.3Å; Y430-L432 PolarHBondContact O-N 2.92Å; Y430-G433 PolarHBondContact O-N 2.93Å; Y430-G433 VanDerWaalsContact O-N 3.13Å; Y430-M434 HydrophobicContact CD1-CE 3.78Å; Y430-M434 HydrophobicContact CG-CE 4.45Å; Y430-M434 WeakPolarHBondContact O-CB 3.34Å; Y430-M434 WeakPolarHBondContact O-CG 3.4Å; Y430-M434 PolarHBondContact O-N 3.23Å
431L97.3Very high94.6Very high38 Ų3825.7 Ų25.720%0.19912%0.117CC..Hα-helixtrans-59.2-43.1177.3-66.7176.9000111.4F105 L427 G433 M434 F435 T529F105-L431 HydrophobicContact CE2-CD2 4.35Å; F105-L431 HydrophobicContact CZ-CD2 3.95Å; L427-L431 HydrophobicContact CD1-CD1 4.42Å; L427-L431 HydrophobicContact CD1-CG 4.23Å; L427-L431 HydrophobicContact CG-CD1 4.06Å; L427-L431 HydrophobicContact CG-CG 4.3Å; L427-L431 WeakPolarHBondContact O-CG 3.45Å; L427-L431 PolarHBondContact O-N 3.29Å; L431-G433 VanDerWaalsContact C-N 3.33Å; L431-G433 PolarHBondContact O-N 3.31Å; L431-M434 PolarHBondContact O-N 3.37Å; L431-F435 HydrophobicContact CB-CD2 4.4Å; L431-F435 HydrophobicContact CD2-CD2 4.05Å; L431-F435 HydrophobicContact CD2-CE2 3.65Å; L431-F435 WeakPolarHBondContact O-CB 3.35Å; L431-F435 WeakPolarHBondContact O-CD2 3.38Å; L431-F435 PolarHBondContact O-N 3.42Å; L431-T529 HydrophobicContact CD1-CG2 3.77Å
432L95.6Very high94.6Very high0 Ų028.5 Ų28.50%014%0.135CC..Hα-helixtrans-57.2-46.7175.1-176.266.9000111.4G428 L429 Y430 W436 A439 L537G428-L432 WeakPolarHBondContact O-CB 3.14Å; G428-L432 PolarHBondContact O-N 3.22Å; L429-L432 PolarHBondContact O-N 3.39Å; Y430-L432 VanDerWaalsContact C-N 3.3Å; Y430-L432 PolarHBondContact O-N 2.92Å; L432-W436 HydrophobicContact CD1-CB 4.32Å; L432-W436 HydrophobicContact CD1-CD2 4.5Å; L432-W436 HydrophobicContact CD1-CE3 4.35Å; L432-W436 WeakPolarHBondContact O-CB 3.25Å; L432-W436 PolarHBondContact O-N 3.33Å; L432-A439 HydrophobicContact CD1-CB 3.67Å; L432-A439 HydrophobicContact CD2-CB 4.1Å; L432-A439 HydrophobicContact CG-CB 3.55Å; L432-L537 HydrophobicContact CD1-CD2 3.54Å; L432-L537 HydrophobicContact CD1-CG 3.67Å
433G93.8Very high94.6Very high0 Ų027.8 Ų27.80%013%0.131CC..Hα-helixtrans-64.7-40.2177.600000113.7Y120 R124 L429 Y430 L431 F556Y120-G433 PolarHBondContact OH-O 3.41Å; R124-G433 PolarHBondContact NE-O 2.82Å; L429-G433 PolarHBondContact O-N 3.5Å; Y430-G433 PolarHBondContact O-N 2.93Å; Y430-G433 VanDerWaalsContact O-N 3.13Å; L431-G433 VanDerWaalsContact C-N 3.33Å; L431-G433 PolarHBondContact O-N 3.31Å; G433-F556 WeakPolarHBondContact O-CE1 3.44Å
434M94.3Very high94.6Very high2 Ų227.7 Ų27.71%0.0113%0.131CC..Hα-helixtrans-78.5-36.7-172-74.5-177.7-171.800113.7F105 L108 F109 Y120 Y430 L431 V557F105-M434 HydrophobicContact CD1-CE 3.38Å; F105-M434 HydrophobicContact CD1-SD 3.94Å; F105-M434 HydrophobicContact CE1-CE 3.38Å; F105-M434 HydrophobicContact CE1-SD 3.68Å; F105-M434 HydrophobicContact CG-CE 4.35Å; F105-M434 HydrophobicContact CZ-CE 4.34Å; F105-M434 HydrophobicContact CZ-SD 4.06Å; L108-M434 HydrophobicContact CD2-CE 3.4Å; L108-M434 VanDerWaalsContact CD2-CE 3.4Å; L108-M434 HydrophobicContact CD2-CG 3.66Å; L108-M434 HydrophobicContact CD2-SD 3.72Å; F109-M434 HydrophobicContact CE1-CE 4Å; F109-M434 HydrophobicContact CZ-CE 4.17Å; Y120-M434 HydrophobicContact CE1-CE 4.17Å; Y120-M434 HydrophobicContact CE1-CG 4.06Å; Y120-M434 VanDerWaalsContact OH-CA 3.28Å; Y120-M434 WeakPolarHBondContact OH-CA 3.31Å; Y120-M434 VanDerWaalsContact OH-CG 3.22Å; Y120-M434 WeakPolarHBondContact OH-CG 3.32Å; Y120-M434 PolarHBondContact OH-N 2.89Å; Y120-M434 VanDerWaalsContact OH-N 3.09Å; Y430-M434 HydrophobicContact CD1-CE 3.78Å; Y430-M434 HydrophobicContact CG-CE 4.45Å; Y430-M434 WeakPolarHBondContact O-CB 3.34Å; Y430-M434 WeakPolarHBondContact O-CG 3.4Å; Y430-M434 PolarHBondContact O-N 3.23Å; L431-M434 PolarHBondContact O-N 3.37Å; M434-V557 HydrophobicContact CB-CG2 4.06Å; M434-V557 PolarHBondContact O-N 3.41Å
435F93.3Very high94.6Very high85 Ų8529.3 Ų29.337%0.37314%0.139SC..Hα-helixtrans-106.5-26.1-171.6-69.6-74.1000113.9I104 L431 V557I104-F435 HydrophobicContact CD1-CZ 4.18Å; I104-F435 HydrophobicContact CG2-CE2 4.19Å; I104-F435 HydrophobicContact CG2-CZ 3.67Å; L431-F435 HydrophobicContact CB-CD2 4.4Å; L431-F435 HydrophobicContact CD2-CD2 4.05Å; L431-F435 HydrophobicContact CD2-CE2 3.65Å; L431-F435 WeakPolarHBondContact O-CB 3.35Å; L431-F435 WeakPolarHBondContact O-CD2 3.38Å; L431-F435 PolarHBondContact O-N 3.42Å; F435-V557 HydrophobicContact CE1-CB 4.07Å; F435-V557 HydrophobicContact CE1-CG1 4.21Å; F435-V557 HydrophobicContact CE1-CG2 4Å; F435-V557 HydrophobicContact CZ-CG2 4Å
436W91.6Very high94.6Very high95 Ų9531.5 Ų31.536%0.3615%0.153SC..  trans-110.3113.7-177.2-71.7-94.4000112.6R124 L432 T438 A439 V533 L537R124-W436 PolarHBondContact NH2-O 2.95Å; L432-W436 HydrophobicContact CD1-CB 4.32Å; L432-W436 HydrophobicContact CD1-CD2 4.5Å; L432-W436 HydrophobicContact CD1-CE3 4.35Å; L432-W436 WeakPolarHBondContact O-CB 3.25Å; L432-W436 PolarHBondContact O-N 3.33Å; W436-T438 VanDerWaalsContact C-N 3.29Å; W436-T438 PolarHBondContact O-N 3.06Å; W436-A439 HydrophobicContact CB-CB 4.19Å; W436-A439 PolarHBondContact O-N 3.39Å; W436-V533 HydrophobicContact CH2-CG1 3.89Å; W436-V533 HydrophobicContact CZ2-CG1 4.3Å; W436-V533 HydrophobicContact CZ3-CG1 4.12Å; W436-L537 HydrophobicContact CB-CD2 3.88Å; W436-L537 HydrophobicContact CD2-CD1 4.32Å; W436-L537 HydrophobicContact CD2-CD2 4.04Å; W436-L537 HydrophobicContact CG-CD2 3.5Å; W436-L537 HydrophobicContact CZ2-CD1 4.14Å
437R86.9Confident94.6Very high175 Ų17531.5 Ų31.566%0.6615%0.153SC*.THydrogen-bonded Turntrans-70.4-23.5174.6-68.6-173.5176.1-171.4-0.1113.8A439 Q548 F556R437-A439 VanDerWaalsContact C-N 3.32Å; R437-Q548 PolarHBondContact O-OE1 3.47Å; R437-F556 HydrophobicContact CB-CE1 4.25Å; R437-F556 HydrophobicContact CB-CZ 4.3Å; R437-F556 HydrophobicContact CG-CD1 3.99Å; R437-F556 HydrophobicContact CG-CE1 3.68Å; R437-F556 HydrophobicContact CG-CE2 4.25Å; R437-F556 HydrophobicContact CG-CG 4.41Å; R437-F556 HydrophobicContact CG-CZ 3.82Å
438T86.5Confident94.7Very high61 Ų6131.3 Ų31.337%0.37415%0.152SC..THydrogen-bonded Turntrans-84-8-179.352.80000112.9W436 N440 S540 G545W436-T438 VanDerWaalsContact C-N 3.29Å; W436-T438 PolarHBondContact O-N 3.06Å; T438-N440 PolarHBondContact O-N 3.47Å; T438-S540 WeakPolarHBondContact O-CB 3.27Å; T438-G545 CarbonylContact O-C 3.48Å; T438-G545 WeakPolarHBondContact O-CA 3.45Å
439A91.3Very high94.7Very high0 Ų035.2 Ų35.20%017%0.172CC..  trans-74.9117.5-177.300000111.6R124 F125 L432 W436 R437 S540 Q548R124-A439 VanDerWaalsContact CZ-O 3.26Å; R124-A439 PolarHBondContact NH1-O 2.89Å; R124-A439 PolarHBondContact NH2-O 3.38Å; F125-A439 HydrophobicContact CE1-CB 4.35Å; L432-A439 HydrophobicContact CD1-CB 3.67Å; L432-A439 HydrophobicContact CD2-CB 4.1Å; L432-A439 HydrophobicContact CG-CB 3.55Å; W436-A439 HydrophobicContact CB-CB 4.19Å; W436-A439 PolarHBondContact O-N 3.39Å; R437-A439 VanDerWaalsContact C-N 3.32Å; A439-S540 WeakPolarHBondContact CA-OG 3.26Å; A439-Q548 PolarHBondContact O-NE2 3.41Å; A439-Q548 PolarHBondContact O-OE1 3.06Å
440N92.2Very high94.7Very high17 Ų1739.1 Ų39.19%0.09119%0.191CC..  trans-99.2171.2178.57026.4000112T438 T442 G443 G444 S540 T543 Q548T438-N440 PolarHBondContact O-N 3.47Å; N440-T442 VanDerWaalsContact C-N 3.3Å; N440-T442 PolarHBondContact O-N 2.91Å; N440-T442 PolarHBondContact OD1-N 2.9Å; N440-G443 PolarHBondContact O-N 3.47Å; N440-G443 PolarHBondContact OD1-N 3.25Å; N440-G444 PolarHBondContact O-N 3.44Å; N440-S540 PolarHBondContact N-OG 2.95Å; N440-T543 PolarHBondContact ND2-O 3.42Å; N440-T543 PolarHBondContact ND2-OG1 2.77Å; N440-T543 PolarHBondContact OD1-OG1 2.88Å; N440-Q548 HydrophobicContact CB-CG 4.46Å
441S94.1Very high94.7Very high25 Ų2539.1 Ų39.118%0.17519%0.191CC..Hα-helixtrans-65.6-31.5-175.6-43.50000112.8F125 N126 I129 L445F125-S441 VanDerWaalsContact C-OG 3.25Å; F125-S441 WeakPolarHBondContact CA-OG 3Å; F125-S441 PolarHBondContact O-OG 3.4Å; N126-S441 WeakPolarHBondContact ND2-CB 3.33Å; I129-S441 WeakPolarHBondContact CD1-O 3.49Å; S441-L445 VanDerWaalsContact O-CB 3.29Å; S441-L445 WeakPolarHBondContact O-CB 3.04Å; S441-L445 PolarHBondContact O-N 3.16Å
442T94.8Very high94.7Very high77 Ų7739.2 Ų39.247%0.47219%0.191SC..Hα-helixtrans-67.4-45.2175.5-51.60000111.1N440 T446 V539 T543N440-T442 VanDerWaalsContact C-N 3.3Å; N440-T442 PolarHBondContact O-N 2.91Å; N440-T442 PolarHBondContact OD1-N 2.9Å; T442-T446 WeakPolarHBondContact O-CB 3.32Å; T442-T446 VanDerWaalsContact O-CG2 3.32Å; T442-T446 WeakPolarHBondContact O-CG2 3.24Å; T442-T446 PolarHBondContact O-N 3.33Å; T442-T446 PolarHBondContact O-OG1 2.04Å; T442-V539 HydrophobicContact CG2-CG1 4.28Å; T442-T543 HydrophobicContact CG2-CG2 4.13Å
443G95.8Very high94.9Very high0 Ų043.1 Ų43.10%022%0.215CC..Hα-helixtrans-64.5-45174.200000112.4N440 L445 T446 G447 G536 S540N440-G443 PolarHBondContact O-N 3.47Å; N440-G443 PolarHBondContact OD1-N 3.25Å; G443-L445 PolarHBondContact O-N 3.48Å; G443-T446 WeakPolarHBondContact CA-OG1 3.29Å; G443-T446 PolarHBondContact O-N 2.79Å; G443-T446 PolarHBondContact O-OG1 3.25Å; G443-T446 VanDerWaalsContact O-OG1 3.1Å; G443-G447 PolarHBondContact O-N 3.02Å; G443-G536 WeakPolarHBondContact O-CA 3.23Å; G443-S540 WeakPolarHBondContact CA-OG 3.41Å
444G96.4Very high95Very high0 Ų045.1 Ų45.10%023%0.225CC..Hα-helixtrans-57.2-46.9175.500000112.8N440 L448N440-G444 PolarHBondContact O-N 3.44Å; G444-L448 WeakPolarHBondContact O-CB 3.26Å; G444-L448 PolarHBondContact O-N 3.44Å
445L97.4Very high95.2Very high35 Ų3545 Ų4518%0.18323%0.225CC..Hα-helixtrans-66.8-48179.8179.261.8000112.5L128 I129 I132 S441 G443 L448 I449L128-L445 HydrophobicContact CD2-CD2 3.79Å; I129-L445 HydrophobicContact CD1-CB 4.02Å; I129-L445 HydrophobicContact CG1-CB 4.15Å; I129-L445 HydrophobicContact CG1-CD1 4.36Å; I132-L445 HydrophobicContact CD1-CD1 3.47Å; I132-L445 VanDerWaalsContact CD1-CD1 3.47Å; S441-L445 VanDerWaalsContact O-CB 3.29Å; S441-L445 WeakPolarHBondContact O-CB 3.04Å; S441-L445 PolarHBondContact O-N 3.16Å; G443-L445 PolarHBondContact O-N 3.48Å; L445-L448 PolarHBondContact O-N 3.25Å; L445-I449 HydrophobicContact CD1-CD1 3.86Å; L445-I449 HydrophobicContact CD1-CG1 4.27Å; L445-I449 HydrophobicContact CG-CD1 3.97Å; L445-I449 WeakPolarHBondContact O-CG1 3.3Å; L445-I449 PolarHBondContact O-N 2.88Å
446T97.6Very high95.3Very high46 Ų4643.7 Ų43.728%0.28222%0.221SC..Hα-helixtrans-64.9-41179.449.90000111.6T442 G443 I449 M450 V539T442-T446 WeakPolarHBondContact O-CB 3.32Å; T442-T446 VanDerWaalsContact O-CG2 3.32Å; T442-T446 WeakPolarHBondContact O-CG2 3.24Å; T442-T446 PolarHBondContact O-N 3.33Å; T442-T446 PolarHBondContact O-OG1 2.04Å; G443-T446 WeakPolarHBondContact CA-OG1 3.29Å; G443-T446 PolarHBondContact O-N 2.79Å; G443-T446 PolarHBondContact O-OG1 3.25Å; G443-T446 VanDerWaalsContact O-OG1 3.1Å; T446-I449 PolarHBondContact O-N 3.34Å; T446-M450 WeakPolarHBondContact O-CB 3.39Å; T446-M450 VanDerWaalsContact O-CG 3.27Å; T446-M450 WeakPolarHBondContact O-CG 3.49Å; T446-M450 PolarHBondContact O-N 3.22Å; T446-V539 HydrophobicContact CG2-CG1 4.34Å; T446-V539 WeakPolarHBondContact OG1-CG1 3.33Å
447G98.1Very high95.5Very high0 Ų044.3 Ų44.30%022%0.224CC..Hα-helixtrans-57.5-50.2172.100000111.8G443 I449 M450 G451 T532G443-G447 PolarHBondContact O-N 3.02Å; G447-I449 PolarHBondContact O-N 2.89Å; G447-M450 PolarHBondContact O-N 3.31Å; G447-G451 PolarHBondContact O-N 2.87Å; G447-T532 WeakPolarHBondContact O-CA 3.38Å; G447-T532 PolarHBondContact O-OG1 3.04Å
448L98.2Very high95.9Very high1 Ų136 Ų361%0.00519%0.192CC..Hα-helixtrans-57.8-48.5178.9178.768.4000112I132 M136 P425 L426 L429 G444 L445 G451 L452I132-L448 HydrophobicContact CG2-CD2 3.78Å; M136-L448 HydrophobicContact CE-CD1 4.07Å; M136-L448 HydrophobicContact SD-CD1 3.95Å; M136-L448 HydrophobicContact SD-CD2 3.95Å; M136-L448 HydrophobicContact SD-CG 4.09Å; P425-L448 HydrophobicContact CB-CD1 3.95Å; L426-L448 HydrophobicContact CD2-CD1 3.93Å; L426-L448 HydrophobicContact CG-CD1 4.4Å; L429-L448 HydrophobicContact CB-CD1 4.4Å; L429-L448 HydrophobicContact CD2-CD1 4.29Å; L429-L448 HydrophobicContact CD2-CD2 4.03Å; G444-L448 WeakPolarHBondContact O-CB 3.26Å; G444-L448 PolarHBondContact O-N 3.44Å; L445-L448 PolarHBondContact O-N 3.25Å; L448-G451 PolarHBondContact O-N 3.33Å; L448-L452 WeakPolarHBondContact O-CB 3.37Å; L448-L452 PolarHBondContact O-N 3.48Å
449I98.1Very high96.1Very high82 Ų8233 Ų3342%0.42117%0.174SC..Hα-helixtrans-64.3-46.8-179-67.5170.4000110.5L445 T446 G447 L452 V453L445-I449 HydrophobicContact CD1-CD1 3.86Å; L445-I449 HydrophobicContact CD1-CG1 4.27Å; L445-I449 HydrophobicContact CG-CD1 3.97Å; L445-I449 WeakPolarHBondContact O-CG1 3.3Å; L445-I449 PolarHBondContact O-N 2.88Å; T446-I449 PolarHBondContact O-N 3.34Å; G447-I449 PolarHBondContact O-N 2.89Å; I449-L452 PolarHBondContact O-N 2.97Å; I449-V453 HydrophobicContact CG2-CG2 4.3Å; I449-V453 VanDerWaalsContact O-CG2 3.29Å; I449-V453 WeakPolarHBondContact O-CG2 3.45Å; I449-V453 PolarHBondContact O-N 3.48Å
450M98.3Very high96.1Very high82 Ų8237.4 Ų37.440%0.40420%0.197SC..Hα-helixtrans-65.7-40.4179.8-70.6-55.9-59.100112.2T446 G447 L452 V453 I454 V531 V535T446-M450 WeakPolarHBondContact O-CB 3.39Å; T446-M450 VanDerWaalsContact O-CG 3.27Å; T446-M450 WeakPolarHBondContact O-CG 3.49Å; T446-M450 PolarHBondContact O-N 3.22Å; G447-M450 PolarHBondContact O-N 3.31Å; M450-L452 VanDerWaalsContact C-N 3.34Å; M450-V453 PolarHBondContact O-N 2.94Å; M450-I454 HydrophobicContact CE-CD1 4.44Å; M450-I454 WeakPolarHBondContact O-CB 3.23Å; M450-I454 WeakPolarHBondContact O-CG1 3.46Å; M450-I454 PolarHBondContact O-N 3.46Å; M450-V531 HydrophobicContact CB-CG1 4.38Å; M450-V535 HydrophobicContact CB-CG1 4.16Å; M450-V535 HydrophobicContact CB-CG2 4.3Å; M450-V535 HydrophobicContact CG-CG1 4.05Å
451G98Very high96Very high0 Ų036.9 Ų36.90%020%0.195CC..Hα-helixtrans-56.7-49.4172.800000111.3P425 G447 L448 I454 T455P425-G451 VanDerWaalsContact CG-C 3.48Å; G447-G451 PolarHBondContact O-N 2.87Å; L448-G451 PolarHBondContact O-N 3.33Å; G451-I454 PolarHBondContact O-N 3.22Å; G451-T455 WeakPolarHBondContact O-CG2 3.33Å; G451-T455 PolarHBondContact O-N 2.85Å; G451-T455 PolarHBondContact O-OG1 3Å
452L97.8Very high95.7Very high40 Ų4036.3 Ų36.321%0.20919%0.192CC..Hα-helixtrans-63.9-44.3179.2-176.162.8000112.8M136 I422 P425 L448 I449 M450 T455 L456M136-L452 HydrophobicContact CE-CB 4.38Å; M136-L452 HydrophobicContact CE-CD1 3.73Å; M136-L452 HydrophobicContact CE-CD2 3.8Å; M136-L452 HydrophobicContact CE-CG 4.18Å; M136-L452 HydrophobicContact CG-CD2 4.46Å; M136-L452 HydrophobicContact SD-CD2 4.08Å; I422-L452 HydrophobicContact CG1-CD1 4.37Å; P425-L452 HydrophobicContact CB-CB 4.41Å; P425-L452 HydrophobicContact CG-CB 4.29Å; L448-L452 WeakPolarHBondContact O-CB 3.37Å; L448-L452 PolarHBondContact O-N 3.48Å; I449-L452 PolarHBondContact O-N 2.97Å; M450-L452 VanDerWaalsContact C-N 3.34Å; L452-T455 PolarHBondContact O-OG1 2.96Å; L452-L456 HydrophobicContact CD1-CD1 3.78Å; L452-L456 HydrophobicContact CD1-CG 3.92Å; L452-L456 HydrophobicContact CD2-CD1 4.44Å; L452-L456 HydrophobicContact CG-CD1 3.75Å; L452-L456 HydrophobicContact CG-CG 4.28Å; L452-L456 VanDerWaalsContact O-CB 3.25Å; L452-L456 WeakPolarHBondContact O-CB 3.44Å; L452-L456 WeakPolarHBondContact O-CG 3.28Å; L452-L456 PolarHBondContact O-N 2.82Å
453V98Very high95.2Very high82 Ų8236.4 Ų36.450%0.49719%0.187SC..Hα-helixtrans-61.8-46178.9168.30000110.7I449 M450 W457I449-V453 HydrophobicContact CG2-CG2 4.3Å; I449-V453 VanDerWaalsContact O-CG2 3.29Å; I449-V453 WeakPolarHBondContact O-CG2 3.45Å; I449-V453 PolarHBondContact O-N 3.48Å; M450-V453 PolarHBondContact O-N 2.94Å; V453-W457 VanDerWaalsContact O-CB 3.24Å; V453-W457 WeakPolarHBondContact O-CB 3.47Å; V453-W457 PolarHBondContact O-N 2.91Å
454I97.6Very high94.8Very high42 Ų4241.1 Ų41.122%0.21521%0.212CC..Hα-helixtrans-66.8-45.3-178.9-74.3166000111M450 G451 W457 V458 L527 V531M450-I454 HydrophobicContact CE-CD1 4.44Å; M450-I454 WeakPolarHBondContact O-CB 3.23Å; M450-I454 WeakPolarHBondContact O-CG1 3.46Å; M450-I454 PolarHBondContact O-N 3.46Å; G451-I454 PolarHBondContact O-N 3.22Å; I454-W457 PolarHBondContact O-N 3.26Å; I454-V458 WeakPolarHBondContact O-CB 3.42Å; I454-V458 WeakPolarHBondContact O-CG2 3.43Å; I454-V458 PolarHBondContact O-N 2.87Å; I454-L527 HydrophobicContact CG2-CD1 4.47Å; I454-L527 HydrophobicContact CG2-CD2 4.05Å; I454-L527 HydrophobicContact CG2-CG 4.25Å; I454-V531 HydrophobicContact CD1-CG1 3.62Å; I454-V531 HydrophobicContact CD1-CG2 4.19Å; I454-V531 HydrophobicContact CG2-CG2 4.28Å
455T96.6Very high94.3Very high0 Ų044 Ų440%022%0.223CC..Hα-helixtrans-68.7-38179.9530000112.8M421 P425 G451 L452 G459 F524 L527 G528M421-T455 PolarHBondContact O-OG1 3.24Å; P425-T455 HydrophobicContact CG-CG2 4.39Å; G451-T455 WeakPolarHBondContact O-CG2 3.33Å; G451-T455 PolarHBondContact O-N 2.85Å; G451-T455 PolarHBondContact O-OG1 3Å; L452-T455 PolarHBondContact O-OG1 2.96Å; T455-G459 PolarHBondContact O-N 3.4Å; T455-F524 WeakPolarHBondContact CG2-O 3.44Å; T455-L527 HydrophobicContact CG2-CB 4.49Å; T455-L527 HydrophobicContact CG2-CG 4.4Å; T455-G528 VanDerWaalsContact CG2-N 3.32Å
456L96Very high93.6Very high57 Ų5744.7 Ų44.730%0.29823%0.229SC..Hα-helixtrans-66.1-41.9173.9-72.8175.4000111.5M421 L452 V458 G459 I460M421-L456 HydrophobicContact CB-CD2 4.33Å; M421-L456 HydrophobicContact SD-CD2 4.18Å; L452-L456 HydrophobicContact CD1-CD1 3.78Å; L452-L456 HydrophobicContact CD1-CG 3.92Å; L452-L456 HydrophobicContact CD2-CD1 4.44Å; L452-L456 HydrophobicContact CG-CD1 3.75Å; L452-L456 HydrophobicContact CG-CG 4.28Å; L452-L456 VanDerWaalsContact O-CB 3.25Å; L452-L456 WeakPolarHBondContact O-CB 3.44Å; L452-L456 WeakPolarHBondContact O-CG 3.28Å; L452-L456 PolarHBondContact O-N 2.82Å; L456-V458 PolarHBondContact O-N 3.24Å; L456-G459 PolarHBondContact O-N 2.99Å; L456-I460 HydrophobicContact CB-CD1 4.3Å; L456-I460 WeakPolarHBondContact O-CB 3.2Å; L456-I460 WeakPolarHBondContact O-CG1 3.35Å; L456-I460 PolarHBondContact O-N 2.77Å
457W95.9Very high93Very high108 Ų10844 Ų4441%0.40923%0.225SC..Hα-helixtrans-59.3-48.1176.3170.956.4000111.7V453 I454 G461 L512 W516 Y517V453-W457 VanDerWaalsContact O-CB 3.24Å; V453-W457 WeakPolarHBondContact O-CB 3.47Å; V453-W457 PolarHBondContact O-N 2.91Å; I454-W457 PolarHBondContact O-N 3.26Å; W457-G461 PolarHBondContact O-N 3.34Å; W457-L512 HydrophobicContact CH2-CD2 4.35Å; W457-L512 HydrophobicContact CZ2-CD2 4.33Å; W457-W516 HydrophobicContact CH2-CD2 4.39Å; W457-W516 HydrophobicContact CH2-CG 4.28Å; W457-W516 HydrophobicContact CZ3-CD2 4.21Å; W457-W516 HydrophobicContact CZ3-CE3 4.26Å; W457-W516 HydrophobicContact CZ3-CG 4.5Å; W457-Y517 HydrophobicContact CZ2-CE1 4.39Å; W457-Y517 PolarHBondContact NE1-OH 2.86Å
458V94.6Very high92.4Very high0 Ų046.9 Ų46.90%024%0.241CC..Hα-helixtrans-66.2-48.2178.7170.10000111.4I454 L456 G461 A462 W516 L519 F524 L527I454-V458 WeakPolarHBondContact O-CB 3.42Å; I454-V458 WeakPolarHBondContact O-CG2 3.43Å; I454-V458 PolarHBondContact O-N 2.87Å; L456-V458 PolarHBondContact O-N 3.24Å; V458-G461 PolarHBondContact O-N 2.93Å; V458-A462 WeakPolarHBondContact O-CB 3.23Å; V458-A462 PolarHBondContact O-N 3.37Å; V458-W516 WeakPolarHBondContact CG1-O 3.45Å; V458-W516 HydrophobicContact CG2-CE3 3.67Å; V458-W516 HydrophobicContact CG2-CZ3 4.3Å; V458-L519 HydrophobicContact CG1-CB 4.43Å; V458-L519 HydrophobicContact CG1-CD2 4.25Å; V458-F524 HydrophobicContact CG1-CD1 4.22Å; V458-F524 HydrophobicContact CG1-CE1 3.75Å; V458-F524 HydrophobicContact CG1-CZ 4.44Å; V458-L527 HydrophobicContact CB-CD2 4.39Å; V458-L527 HydrophobicContact CG1-CD2 4.45Å; V458-L527 HydrophobicContact CG2-CD2 4.08Å
459G92.3Very high91.6Very high0 Ų049.7 Ų49.70%026%0.264CS..Hα-helixtrans-73-37.5-174.500000113.9M421 T455 L456 A462 Q463M421-G459 VanDerWaalsContact SD-CA 3.58Å; T455-G459 PolarHBondContact O-N 3.4Å; L456-G459 PolarHBondContact O-N 2.99Å; G459-A462 PolarHBondContact O-N 3.26Å; G459-Q463 WeakPolarHBondContact O-CG 3.39Å; G459-Q463 PolarHBondContact O-N 3.09Å
460I90.8Very high90.7Very high91 Ų9152.4 Ų52.447%0.46728%0.28SS..Hα-helixtrans-67.6-41.7171.5-64.3169000109.7L456 A462 Q463 I464L456-I460 HydrophobicContact CB-CD1 4.3Å; L456-I460 WeakPolarHBondContact O-CB 3.2Å; L456-I460 WeakPolarHBondContact O-CG1 3.35Å; L456-I460 PolarHBondContact O-N 2.77Å; I460-A462 VanDerWaalsContact C-N 3.28Å; I460-A462 PolarHBondContact O-N 3.32Å; I460-Q463 PolarHBondContact O-N 3.39Å; I460-Q463 VanDerWaalsContact O-N 3.07Å; I460-I464 HydrophobicContact CG2-CD1 3.88Å; I460-I464 HydrophobicContact CG2-CG1 4.43Å; I460-I464 WeakPolarHBondContact O-CG1 3.43Å; I460-I464 PolarHBondContact O-N 2.97Å
461G90.1Very high90Very high6 Ų651.2 Ų51.26%0.06227%0.272CS..Hα-helixtrans-56.7-40.9173.700000112.8W457 V458 Q463 I464 Y465W457-G461 PolarHBondContact O-N 3.34Å; V458-G461 PolarHBondContact O-N 2.93Å; G461-Q463 VanDerWaalsContact C-N 3.3Å; G461-Q463 PolarHBondContact O-N 3.47Å; G461-I464 PolarHBondContact O-N 3.24Å; G461-Y465 PolarHBondContact O-N 3.23Å
462A87.9Confident89.2Confident13 Ų1352.6 Ų52.611%0.10728%0.281CS..Hα-helixtrans-67.4-24.8175.900000114.2V458 G459 I460 P466 Y517 F524V458-A462 WeakPolarHBondContact O-CB 3.23Å; V458-A462 PolarHBondContact O-N 3.37Å; G459-A462 PolarHBondContact O-N 3.26Å; I460-A462 VanDerWaalsContact C-N 3.28Å; I460-A462 PolarHBondContact O-N 3.32Å; A462-P466 WeakPolarHBondContact O-CA 3.42Å; A462-Y517 WeakPolarHBondContact CB-O 3.5Å; A462-F524 HydrophobicContact CB-CZ 4.02Å
463Q84.7Confident88.6Confident80 Ų8055.6 Ų55.637%0.37430%0.297SS..Hα-helixtrans-79.9-37.7173.6-65.9-66.1-25.500111.7G459 I460 G461G459-Q463 WeakPolarHBondContact O-CG 3.39Å; G459-Q463 PolarHBondContact O-N 3.09Å; I460-Q463 PolarHBondContact O-N 3.39Å; I460-Q463 VanDerWaalsContact O-N 3.07Å; G461-Q463 VanDerWaalsContact C-N 3.3Å; G461-Q463 PolarHBondContact O-N 3.47Å
464I85.9Confident88.1Confident99 Ų9953.5 Ų53.551%0.50829%0.285SS..Hα-helixtrans-74.4-42.9178.5-61.5170.6000110.8I460 G461 P466I460-I464 HydrophobicContact CG2-CD1 3.88Å; I460-I464 HydrophobicContact CG2-CG1 4.43Å; I460-I464 WeakPolarHBondContact O-CG1 3.43Å; I460-I464 PolarHBondContact O-N 2.97Å; G461-I464 PolarHBondContact O-N 3.24Å; I464-P466 VanDerWaalsContact O-CD 3.32Å; I464-P466 WeakPolarHBondContact O-CD 3.42Å
465Y86.6Confident87.8Confident59 Ų5952.8 Ų52.823%0.23128%0.282CS..SBendtrans-116.882179.6-59.7-83.3000109.8G461 P506 P510 A513 Y517G461-Y465 PolarHBondContact O-N 3.23Å; Y465-P506 HydrophobicContact CD1-CB 4.48Å; Y465-P506 HydrophobicContact CD1-CG 3.87Å; Y465-P506 HydrophobicContact CE1-CB 3.97Å; Y465-P506 HydrophobicContact CE1-CG 3.74Å; Y465-P510 HydrophobicContact CE1-CG 4.2Å; Y465-P510 HydrophobicContact CE2-CG 4.39Å; Y465-A513 HydrophobicContact CD1-CB 4.41Å; Y465-A513 HydrophobicContact CG-CB 4.16Å; Y465-Y517 AromaticContact CD2-CD2 3.81Å; Y465-Y517 HydrophobicContact CD2-CD2 3.81Å; Y465-Y517 AromaticContact CD2-CE2 3.92Å; Y465-Y517 HydrophobicContact CD2-CE2 3.92Å; Y465-Y517 HydrophobicContact CE2-CE2 4.4Å; Y465-Y517 HydrophobicContact CG-CD2 4.29Å
466P83.3Confident87.4Confident50 Ų5057.5 Ų57.533%0.32531%0.312SS..PPolyproline II helixtrans-59.7146.5-177.522.1-32.1000112A462 I464 R509A462-P466 WeakPolarHBondContact O-CA 3.42Å; I464-P466 VanDerWaalsContact O-CD 3.32Å; I464-P466 WeakPolarHBondContact O-CD 3.42Å; P466-R509 PolarHBondContact O-NH1 3.34Å; P466-R509 PolarHBondContact O-NH2 3.27Å; P466-R509 VanDerWaalsContact O-NH2 3.08Å
467P84.7Confident87.1Confident31 Ų3157.2 Ų57.220%0.20131%0.311CS..PPolyproline II helixtrans-60.5146.5178.2-1626.1000111.5K471 T472P467-K471 HydrophobicContact CB-CB 4.19Å; P467-T472 HydrophobicContact CB-CG2 4.06Å
468L84.4Confident86.8Confident61 Ų6154.2 Ų54.232%0.31931%0.306SS..PPolyproline II helixtrans-62.8161.4179.4-73.6160.3000112.2D470 K471 T472 L505 D514L468-D470 PolarHBondContact O-N 3.12Å; L468-K471 PolarHBondContact O-N 2.88Å; L468-T472 PolarHBondContact O-N 2.63Å; L468-T472 VanDerWaalsContact O-N 3.07Å; L468-T472 PolarHBondContact O-OG1 2.8Å; L468-L505 HydrophobicContact CD2-CD2 4.45Å; L468-D514 WeakPolarHBondContact CD1-OD1 3.45Å
469A81.4Confident86.5Confident61 Ų6156.4 Ų56.450%0.50432%0.319SS..Hα-helixtrans-54.9-36.5176.900000112.2K471 T472 N473A469-K471 PolarHBondContact O-N 3.33Å; A469-T472 WeakPolarHBondContact CA-OG1 3.44Å; A469-T472 PolarHBondContact O-N 2.88Å; A469-T472 PolarHBondContact O-OG1 2.6Å; A469-N473 WeakPolarHBondContact O-CA 3.47Å; A469-N473 PolarHBondContact O-N 3.26Å
470D80.6Confident86.1Confident138 Ų13860.9 Ų60.974%0.73836%0.356SS*.Hα-helixtrans-64.9-27179.3-56-17.6000113.1L468L468-D470 PolarHBondContact O-N 3.12Å
471K83.6Confident85.7Confident57 Ų5758.4 Ų58.425%0.24835%0.353CS..Hα-helixtrans-90.6-28.1177.8-62.4-55.3-170.4-177.80112.5D237 L239 K240 R241 P467 L468 A469D237-K471 IonicContact OD2-NZ 3.89Å; D237-K471 PolarHBondContact OD2-NZ 3.34Å; L239-K471 HydrophobicContact CB-CD 4.02Å; K240-K471 WeakPolarHBondContact CA-O 3.44Å; R241-K471 PolarHBondContact N-O 2.82Å; P467-K471 HydrophobicContact CB-CB 4.19Å; L468-K471 PolarHBondContact O-N 2.88Å; A469-K471 PolarHBondContact O-N 3.33Å
472T81.5Confident85.5Confident30 Ų3058.8 Ų58.818%0.18436%0.355CS..Hα-helixtrans-89.9-22.8178.452.70000114F83 P467 L468 A469F83-T472 WeakPolarHBondContact CD1-O 3.34Å; F83-T472 WeakPolarHBondContact CE1-O 3.31Å; P467-T472 HydrophobicContact CB-CG2 4.06Å; L468-T472 PolarHBondContact O-N 2.63Å; L468-T472 VanDerWaalsContact O-N 3.07Å; L468-T472 PolarHBondContact O-OG1 2.8Å; A469-T472 WeakPolarHBondContact CA-OG1 3.44Å; A469-T472 PolarHBondContact O-N 2.88Å; A469-T472 PolarHBondContact O-OG1 2.6Å
473N84.8Confident84.9Confident103 Ų10362.9 Ų62.955%0.55138%0.375SS*.  trans41.858178.4-164.224.9000114.4A469 L475A469-N473 WeakPolarHBondContact O-CA 3.47Å; A469-N473 PolarHBondContact O-N 3.26Å; N473-L475 PolarHBondContact O-N 3.07Å
474P88.1Confident83.8Confident38 Ų3869.1 Ų69.125%0.24740%0.395CS..PPolyproline II helixtrans-63.3135.4174.527.5-33.1000110.8R82 F83R82-P474 VanDerWaalsContact CZ-CB 3.46Å; F83-P474 HydrophobicContact CD1-CB 4.41Å; F83-P474 HydrophobicContact CE1-CB 3.96Å
475L90.9Very high82Confident27 Ų2769.6 Ų69.614%0.14140%0.402CS..PPolyproline II helixtrans-75149.7-179.1-66.6173.8000111.5R82 R228 N473R82-L475 PolarHBondContact O-N 3.39Å; R228-L475 HydrophobicContact CB-CD1 4.37Å; R228-L475 HydrophobicContact CG-CD1 3.78Å; N473-L475 PolarHBondContact O-N 3.07Å
476P88.6Confident79.8Confident99 Ų9974.1 Ų74.164%0.64343%0.426SS*.PPolyproline II helixtrans-62.7143.2-176.123.7-32.8000111.7R228R228-P476 VanDerWaalsContact CZ-O 3.29Å; R228-P476 PolarHBondContact NH1-O 2.98Å; R228-P476 PolarHBondContact NH2-O 3.26Å
477I89.1Confident78Confident51 Ų5179.9 Ų79.926%0.26245%0.454SS..  trans-135.7155.6-179.346.5163.9000108.4Y81 R82 D311 T314Y81-I477 HydrophobicContact CE1-CG2 4.29Å; R82-I477 VanDerWaalsContact NH1-CD1 3.27Å; D311-I477 HydrophobicContact CB-CB 4.16Å; D311-I477 HydrophobicContact CB-CD1 4.26Å; D311-I477 WeakPolarHBondContact OD2-CD1 3.48Å; T314-I477 VanDerWaalsContact OG1-CD1 3.29Å; T314-I477 WeakPolarHBondContact OG1-CD1 3.06Å
478S88.9Confident76Confident44 Ų4483.3 Ų83.331%0.30847%0.47SS..  trans-131.1144.9-174.5-176.10000111.6N309 C310 D311 A480N309-S478 CarbonylContact C-O 3.45Å; C310-S478 CarbonylContact C-O 3.6Å; C310-S478 WeakPolarHBondContact CA-O 3.26Å; C310-S478 PolarHBondContact N-O 3.46Å; D311-S478 PolarHBondContact N-O 2.9Å; S478-A480 WeakPolarHBondContact OG-CB 3.11Å; S478-A480 PolarHBondContact OG-N 3.44Å
479V87.9Confident73.6Confident47 Ų4788.3 Ų88.329%0.28550%0.497SS..  trans-112.97.8170.3-63.40000112N309 T314 N315 G481 C482N309-V479 CarbonylContact O-C 3.34Å; T314-V479 HydrophobicContact CG2-CG1 4.09Å; N315-V479 HydrophobicContact CB-CG1 4.48Å; V479-G481 PolarHBondContact O-N 3.43Å; V479-C482 WeakPolarHBondContact O-CB 3.39Å; V479-C482 PolarHBondContact O-N 2.9Å; V479-C482 VanDerWaalsContact O-N 3.16Å
480A85.2Confident71.5Confident93 Ų9393.7 Ų93.777%0.76951%0.506SS*.THydrogen-bonded Turntrans-64.8-27.4-171.700000113.6N309 S478N309-A480 PolarHBondContact O-N 3.41Å; S478-A480 WeakPolarHBondContact OG-CB 3.11Å; S478-A480 PolarHBondContact OG-N 3.44Å
481G80.9Confident69.2Low39 Ų3993.4 Ų93.440%0.40251%0.509SS..THydrogen-bonded Turntrans-100.98.3178.100000114.3N309 V479N309-G481 WeakPolarHBondContact O-CA 3.49Å; N309-G481 PolarHBondContact O-N 3.34Å; V479-G481 PolarHBondContact O-N 3.43Å
482C85.9Confident66.9Low15 Ų1596.3 Ų96.310%0.10153%0.532CS..  trans-71.2133.9175.2-66.90000110.6C310 V479 R484C310-C482 WeakPolarHBondContact CA-SG 3.24Å; C310-C482 HydrophobicContact CB-CB 3.98Å; C310-C482 WeakPolarHBondContact CB-SG 3.49Å; C310-C482 WeakPolarHBondContact SG-CA 3.29Å; C310-C482 WeakPolarHBondContact SG-CB 3.45Å; C310-C482 CovalentContact SG-SG 2.04Å; C310-C482 PolarHBondContact SG-SG 2.99Å; V479-C482 WeakPolarHBondContact O-CB 3.39Å; V479-C482 PolarHBondContact O-N 2.9Å; V479-C482 VanDerWaalsContact O-N 3.16Å; C482-R484 VanDerWaalsContact C-N 3.35Å; C482-R484 PolarHBondContact O-N 3.24Å
483N75.8Confident64.7Low99 Ų99102.1 Ų102.153%0.52956%0.561SS.*  trans-72.395168.9-111.1-6.8000107.6T5 T485T5-N483 PolarHBondContact O-N 3.4Å; N483-T485 PolarHBondContact O-N 3.26Å
484R62.2Low62.3Low210 Ų21099.8 Ų99.879%0.79256%0.555SS**  trans-6789.3168-72.4-174.6-179.3162.20.5108C482 Q486C482-R484 VanDerWaalsContact C-N 3.35Å; C482-R484 PolarHBondContact O-N 3.24Å; R484-Q486 PolarHBondContact O-N 3.35Å
485T47Very low59.8Low109 Ų109103 Ų10367%0.66958%0.577SS**  trans-68.486.7165.945.40000108.2N483N483-T485 PolarHBondContact O-N 3.26Å
486Q41.4Very low57.2Low155 Ų155111.8 Ų111.872%0.72461%0.608SS**  trans64.5130.8154.9-68176-23.700119.1R484 L488R484-Q486 PolarHBondContact O-N 3.35Å; Q486-L488 VanDerWaalsContact C-N 3.32Å; Q486-L488 HydrophobicContact CB-CG 4.46Å; Q486-L488 PolarHBondContact O-N 3.39Å
487D45.8Very low54.6Low171 Ų171110.6 Ų110.691%0.91460%0.599SS**  trans-45.491.4145.4-66.5-58.1000110.9
488L42.2Very low51.9Low103 Ų103112.9 Ų112.954%0.53962%0.619SS.*  trans-143.7124163.8-80174.5000110.9Q486 Y490Q486-L488 VanDerWaalsContact C-N 3.32Å; Q486-L488 HydrophobicContact CB-CG 4.46Å; Q486-L488 PolarHBondContact O-N 3.39Å; L488-Y490 HydrophobicContact CB-CD2 3.7Å; L488-Y490 HydrophobicContact CB-CE2 3.66Å; L488-Y490 HydrophobicContact CD1-CE2 3.83Å; L488-Y490 HydrophobicContact CG-CE2 4.25Å; L488-Y490 PolarHBondContact O-N 2.94Å
489N34.5Very low49Very low166 Ų166114.1 Ų114.189%0.88863%0.633SS**  trans-4673.6161.2-76.2-35.1000112.7
490Y35.6Very low46.5Very low174 Ų174116.7 Ų116.768%0.68265%0.648SS**  trans-117.896.1160.5-66.5-73000107.7L488 T492L488-Y490 HydrophobicContact CB-CD2 3.7Å; L488-Y490 HydrophobicContact CB-CE2 3.66Å; L488-Y490 HydrophobicContact CD1-CE2 3.83Å; L488-Y490 HydrophobicContact CG-CE2 4.25Å; L488-Y490 PolarHBondContact O-N 2.94Å; Y490-T492 PolarHBondContact O-N 3.35Å
491T32.2Very low43.8Very low132 Ų132117.2 Ų117.281%0.8164%0.642SS**  trans-58.770.614241.10000108.3L493T491-L493 PolarHBondContact O-N 3.1Å
492T35.9Very low41.7Very low118 Ų118123.2 Ų123.272%0.72466%0.662SS**  trans-70.591146.9440000104.4Y490 A494Y490-T492 PolarHBondContact O-N 3.35Å; T492-A494 PolarHBondContact O-N 3.39Å
493L35.8Very low39.4Very low152 Ų152126.8 Ų126.880%0.79668%0.683SS**  trans-51.493.5153.6-70.3162.4000105T491 P495T491-L493 PolarHBondContact O-N 3.1Å; L493-P495 VanDerWaalsContact C-N 3.33Å; L493-P495 WeakPolarHBondContact O-CD 3.07Å
494A34.2Very low37.9Very low53 Ų53127.1 Ų127.144%0.43869%0.69SS.*  trans-55.1108.7155.200000103.6T492 W496 T497T492-A494 PolarHBondContact O-N 3.39Å; A494-W496 PolarHBondContact O-N 3.3Å; A494-T497 HydrophobicContact CB-CG2 4.09Å; A494-T497 WeakPolarHBondContact CB-OG1 3.49Å
495P35.4Very low37.5Very low107 Ų107121.9 Ų121.970%0.69568%0.678SS**THydrogen-bonded Turntrans-66.4110.9179.7-1027.5000103.7L493L493-P495 VanDerWaalsContact C-N 3.33Å; L493-P495 WeakPolarHBondContact O-CD 3.07Å
496W36.4Very low38Very low211 Ų211118.9 Ų118.980%0.79966%0.66SS**THydrogen-bonded Turntrans77.440.7171.1-41.889.7000117.4A494A494-W496 PolarHBondContact O-N 3.3Å
497T34.2Very low38.8Very low73 Ų73119.7 Ų119.745%0.44867%0.669SS.*  trans-88.5108.2149.350.60000107.8A494 A499A494-T497 HydrophobicContact CB-CG2 4.09Å; A494-T497 WeakPolarHBondContact CB-OG1 3.49Å; T497-A499 VanDerWaalsContact C-N 3.31Å; T497-A499 PolarHBondContact O-N 3.43Å
498S31.7Very low40Very low99 Ų99118.4 Ų118.469%0.69266%0.662SS**  trans-52.8108.8156-56.30000105V500S498-V500 PolarHBondContact O-N 3.24Å
499A28.3Very low41.8Very low71 Ų71116 Ų11659%0.58765%0.646SS**  trans-46.2141.5164.700000106.3T497 T501T497-A499 VanDerWaalsContact C-N 3.31Å; T497-A499 PolarHBondContact O-N 3.43Å; A499-T501 PolarHBondContact O-N 2.95Å; A499-T501 PolarHBondContact O-OG1 3.45Å
500V34.9Very low44.2Very low100 Ų100110.3 Ų110.361%0.60662%0.618SS**  trans-58.490.2153.6179.80000103.7G319 S498 M502G319-V500 VanDerWaalsContact O-CG2 3.29Å; G319-V500 WeakPolarHBondContact O-CG2 3.33Å; S498-V500 PolarHBondContact O-N 3.24Å; V500-M502 PolarHBondContact O-N 3.26Å
501T29.7Very low46.5Very low105 Ų105106.1 Ų106.164%0.64462%0.619SS**  trans-59.397.3156-27.30000100.2A499 T503A499-T501 PolarHBondContact O-N 2.95Å; A499-T501 PolarHBondContact O-OG1 3.45Å; T501-T503 PolarHBondContact O-N 2.99Å
502M36Very low49.1Very low165 Ų165103.5 Ų103.581%0.81360%0.6SS**  trans-52.597.4145.6-72.5-154.3172.800101.5V500 P504V500-M502 PolarHBondContact O-N 3.26Å; M502-P504 WeakPolarHBondContact O-CD 3.22Å
503T39.1Very low51.4Low89 Ų8997.9 Ų97.955%0.54657%0.566SS.*  trans-49.8116.3169.530.60000102.6T501 L505T501-T503 PolarHBondContact O-N 2.99Å; T503-L505 PolarHBondContact O-N 3.49Å
504P43.5Very low53.6Low106 Ų10693.9 Ų93.969%0.68855%0.545SS*.  trans-49.1126.5172.7-19.730000104.1M502 P506M502-P504 WeakPolarHBondContact O-CD 3.22Å; P504-P506 WeakPolarHBondContact O-CD 2.91Å
505L54Low56.1Low101 Ų10193.7 Ų93.753%0.52954%0.54SS..  trans-44.2121.9172.8-86.3155.7000105.5L468 T503 D507L468-L505 HydrophobicContact CD2-CD2 4.45Å; T503-L505 PolarHBondContact O-N 3.49Å; L505-D507 PolarHBondContact O-N 3.39Å; L505-D507 VanDerWaalsContact O-N 3.12Å
506P56.7Low58.7Low46 Ų4694 Ų9430%0.29953%0.528SS..  trans-49.8128.6-178-27.533.9000108Y465 P504 D508 R509Y465-P506 HydrophobicContact CD1-CB 4.48Å; Y465-P506 HydrophobicContact CD1-CG 3.87Å; Y465-P506 HydrophobicContact CE1-CB 3.97Å; Y465-P506 HydrophobicContact CE1-CG 3.74Å; P504-P506 WeakPolarHBondContact O-CD 2.91Å; P506-D508 CarbonylContact O-C 3.49Å; P506-D508 PolarHBondContact O-N 3.48Å; P506-R509 PolarHBondContact O-N 2.97Å
507D58.8Low61.2Low171 Ų17185 Ų8591%0.91449%0.494SS*.SBendtrans-52.5-27.2-174.7-76.8-38.9000111.5L505L505-D507 PolarHBondContact O-N 3.39Å; L505-D507 VanDerWaalsContact O-N 3.12Å
508D70.4Confident63.9Low144 Ų14481.6 Ų81.677%0.7747%0.473SS*.SBendtrans-110.995.1168-71.7-45.3000112P506 P510P506-D508 CarbonylContact O-C 3.49Å; P506-D508 PolarHBondContact O-N 3.48Å; D508-P510 WeakPolarHBondContact O-CD 3.24Å
509R80.1Confident66.9Low53 Ų5378.1 Ų78.120%0.245%0.447CS..  trans-89.7114172.7-174.6173.8178.9111.37.4110.3P466 P506 A513 D514P466-R509 PolarHBondContact O-NH1 3.34Å; P466-R509 PolarHBondContact O-NH2 3.27Å; P466-R509 VanDerWaalsContact O-NH2 3.08Å; P506-R509 PolarHBondContact O-N 2.97Å; R509-A513 HydrophobicContact CG-CB 3.71Å; R509-D514 IonicContact CZ-OD1 2.66Å; R509-D514 IonicContact NE-OD1 3.19Å; R509-D514 PolarHBondContact NE-OD1 3.41Å; R509-D514 IonicContact NE-OD2 3.57Å; R509-D514 IonicContact NH2-OD1 3.87Å; R509-D514 PolarHBondContact NH2-OD1 2.76Å
510P85.4Confident70Confident46 Ų4675 Ų7530%0.29942%0.42SS..  trans-70.8151.1-178.828.3-33.5000111.4Y465 D508 L512 A513Y465-P510 HydrophobicContact CE1-CG 4.2Å; Y465-P510 HydrophobicContact CE2-CG 4.39Å; D508-P510 WeakPolarHBondContact O-CD 3.24Å; P510-L512 PolarHBondContact O-N 3.18Å; P510-A513 HydrophobicContact CG-CB 4.2Å; P510-A513 WeakPolarHBondContact O-CA 3.19Å; P510-A513 WeakPolarHBondContact O-CB 3.39Å; P510-A513 PolarHBondContact O-N 3.48Å
511A84Confident72.8Confident86 Ų8670.5 Ų70.571%0.71139%0.393SS*.THydrogen-bonded Turntrans-59.3-22.3176.700000113.9A513 D514 S515A511-A513 PolarHBondContact O-N 3.26Å; A511-D514 PolarHBondContact O-N 3.4Å; A511-S515 PolarHBondContact O-OG 2.87Å; A511-S515 VanDerWaalsContact O-OG 3.09Å
512L86.1Confident75.9Confident77 Ų7765.5 Ų65.540%0.40336%0.362SS..THydrogen-bonded Turntrans-63.8-27.4171-73.8158.5000112.5W457 P510 D514 S515 W516 Y517W457-L512 HydrophobicContact CH2-CD2 4.35Å; W457-L512 HydrophobicContact CZ2-CD2 4.33Å; P510-L512 PolarHBondContact O-N 3.18Å; L512-D514 VanDerWaalsContact C-N 3.35Å; L512-S515 WeakPolarHBondContact CA-OG 3.34Å; L512-S515 PolarHBondContact O-N 3.4Å; L512-S515 PolarHBondContact O-OG 3.09Å; L512-W516 HydrophobicContact CD2-CG 4.47Å; L512-W516 PolarHBondContact O-N 2.95Å; L512-Y517 HydrophobicContact CB-CE2 4.24Å; L512-Y517 PolarHBondContact O-N 3.43Å; L512-Y517 VanDerWaalsContact O-N 3.12Å
513A83.8Confident78.8Confident0 Ų058.9 Ų58.90%033%0.328CS..THydrogen-bonded Turntrans-65.7-38.217900000112.4Y465 R509 P510 A511 S515 Y517 S518Y465-A513 HydrophobicContact CD1-CB 4.41Å; Y465-A513 HydrophobicContact CG-CB 4.16Å; R509-A513 HydrophobicContact CG-CB 3.71Å; P510-A513 HydrophobicContact CG-CB 4.2Å; P510-A513 WeakPolarHBondContact O-CA 3.19Å; P510-A513 WeakPolarHBondContact O-CB 3.39Å; P510-A513 PolarHBondContact O-N 3.48Å; A511-A513 PolarHBondContact O-N 3.26Å; A513-S515 VanDerWaalsContact C-N 3.31Å; A513-Y517 HydrophobicContact CB-CD2 4.17Å; A513-Y517 CarbonylContact O-C 3.59Å; A513-S518 PolarHBondContact O-N 3.35Å; A513-S518 PolarHBondContact O-OG 2.87Å
514D83.3Confident81.5Confident68 Ų6854.8 Ų54.836%0.36430%0.303SS..THydrogen-bonded Turntrans-86.5-6.4-177.6-60.9-30.4000113.3L468 R509 A511 L512L468-D514 WeakPolarHBondContact CD1-OD1 3.45Å; R509-D514 IonicContact CZ-OD1 2.66Å; R509-D514 IonicContact NE-OD1 3.19Å; R509-D514 PolarHBondContact NE-OD1 3.41Å; R509-D514 IonicContact NE-OD2 3.57Å; R509-D514 IonicContact NH2-OD1 3.87Å; R509-D514 PolarHBondContact NH2-OD1 2.76Å; A511-D514 PolarHBondContact O-N 3.4Å; L512-D514 VanDerWaalsContact C-N 3.35Å
515S87Confident84.1Confident49 Ų4949.8 Ų49.834%0.34327%0.27SS..THydrogen-bonded Turntrans-111.3-91173.952.10000110L239 A511 L512 A513 Y517 S518L239-S515 WeakPolarHBondContact CD2-O 3.34Å; A511-S515 PolarHBondContact O-OG 2.87Å; A511-S515 VanDerWaalsContact O-OG 3.09Å; L512-S515 WeakPolarHBondContact CA-OG 3.34Å; L512-S515 PolarHBondContact O-N 3.4Å; L512-S515 PolarHBondContact O-OG 3.09Å; A513-S515 VanDerWaalsContact C-N 3.31Å; S515-Y517 PolarHBondContact O-N 3.15Å; S515-S518 PolarHBondContact O-N 2.73Å; S515-S518 VanDerWaalsContact O-N 3.12Å
516W89.4Confident86.1Confident115 Ų11546.8 Ų46.844%0.43626%0.255SS..G310 helixtrans-59.9-41.5-172.2-74.989.9000113.8W457 V458 L512 S518 L519 L527W457-W516 HydrophobicContact CH2-CD2 4.39Å; W457-W516 HydrophobicContact CH2-CG 4.28Å; W457-W516 HydrophobicContact CZ3-CD2 4.21Å; W457-W516 HydrophobicContact CZ3-CE3 4.26Å; W457-W516 HydrophobicContact CZ3-CG 4.5Å; V458-W516 WeakPolarHBondContact CG1-O 3.45Å; V458-W516 HydrophobicContact CG2-CE3 3.67Å; V458-W516 HydrophobicContact CG2-CZ3 4.3Å; L512-W516 HydrophobicContact CD2-CG 4.47Å; L512-W516 PolarHBondContact O-N 2.95Å; W516-S518 VanDerWaalsContact C-N 3.29Å; W516-S518 PolarHBondContact O-N 2.89Å; W516-L519 WeakPolarHBondContact O-CB 3.47Å; W516-L519 PolarHBondContact O-N 2.82Å; W516-L527 HydrophobicContact CZ3-CD1 4.49Å; W516-L527 HydrophobicContact CZ3-CD2 4.49Å
517Y90Very high88.1Confident22 Ų2246.1 Ų46.19%0.08625%0.248CC..G310 helixtrans-82-9.5-178.5-50.2-28000113.5W457 A462 Y465 L512 A513 S515W457-Y517 HydrophobicContact CZ2-CE1 4.39Å; W457-Y517 PolarHBondContact NE1-OH 2.86Å; A462-Y517 WeakPolarHBondContact CB-O 3.5Å; Y465-Y517 AromaticContact CD2-CD2 3.81Å; Y465-Y517 HydrophobicContact CD2-CD2 3.81Å; Y465-Y517 AromaticContact CD2-CE2 3.92Å; Y465-Y517 HydrophobicContact CD2-CE2 3.92Å; Y465-Y517 HydrophobicContact CE2-CE2 4.4Å; Y465-Y517 HydrophobicContact CG-CD2 4.29Å; L512-Y517 HydrophobicContact CB-CE2 4.24Å; L512-Y517 PolarHBondContact O-N 3.43Å; L512-Y517 VanDerWaalsContact O-N 3.12Å; A513-Y517 HydrophobicContact CB-CD2 4.17Å; A513-Y517 CarbonylContact O-C 3.59Å; S515-Y517 PolarHBondContact O-N 3.15Å
518S90.6Very high89.9Confident1 Ų138 Ų381%0.00721%0.205CC..G310 helixtrans-88.9-2.4172.9-69.20000113.2L239 A513 S515 W516 S520L239-S518 CarbonylContact C-O 3.55Å; L239-S518 VanDerWaalsContact CA-O 3.31Å; L239-S518 WeakPolarHBondContact CA-O 3.31Å; A513-S518 PolarHBondContact O-N 3.35Å; A513-S518 PolarHBondContact O-OG 2.87Å; S515-S518 PolarHBondContact O-N 2.73Å; S515-S518 VanDerWaalsContact O-N 3.12Å; W516-S518 VanDerWaalsContact C-N 3.29Å; W516-S518 PolarHBondContact O-N 2.89Å; S518-S520 PolarHBondContact O-N 3.01Å
519L93.2Very high91.3Very high26 Ų2631.5 Ų31.514%0.13617%0.17CC..SBendtrans-57.6132.5176.8-175.570000110.7P238 L239 V458 W516 Y521 Y523 F524 L527P238-L519 HydrophobicContact CB-CD1 3.99Å; L239-L519 HydrophobicContact CD2-CB 4.44Å; V458-L519 HydrophobicContact CG1-CB 4.43Å; V458-L519 HydrophobicContact CG1-CD2 4.25Å; W516-L519 WeakPolarHBondContact O-CB 3.47Å; W516-L519 PolarHBondContact O-N 2.82Å; L519-Y521 PolarHBondContact O-N 2.78Å; L519-Y523 HydrophobicContact CD1-CD2 4.27Å; L519-F524 HydrophobicContact CB-CE1 4.25Å; L519-F524 HydrophobicContact CD2-CD1 4.08Å; L519-F524 HydrophobicContact CD2-CE1 4.26Å; L519-F524 HydrophobicContact CG-CD1 4.5Å; L519-F524 HydrophobicContact CG-CE1 4.37Å; L519-F524 WeakPolarHBondContact O-CE1 3.37Å; L519-L527 HydrophobicContact CD2-CD2 3.98Å
520S94Very high92.1Very high5 Ų533.1 Ų33.14%0.03518%0.183CC..  trans-56.2135.3177.2179.90000111.2P238 K240 R241 S518 L522 Y523P238-S520 PolarHBondContact O-N 3.33Å; P238-S520 VanDerWaalsContact O-N 3.08Å; K240-S520 WeakPolarHBondContact O-CB 3.33Å; R241-S520 PolarHBondContact O-OG 2.87Å; S518-S520 PolarHBondContact O-N 3.01Å; S520-L522 PolarHBondContact O-N 2.83Å; S520-Y523 PolarHBondContact O-N 3.29Å
521Y93.2Very high92.8Very high6 Ų632 Ų322%0.02418%0.175CC..G310 helixtrans-58.1-24.6-179.664.3-89.7000113.2F87 R241 H242 Q413 L416 S417 L519 Y523 F524F87-Y521 WeakPolarHBondContact CZ-OH 3.42Å; R241-Y521 HydrophobicContact CG-CE1 4.08Å; H242-Y521 PolarHBondContact NE2-OH 2.96Å; H242-Y521 VanDerWaalsContact NE2-OH 3.09Å; Q413-Y521 HydrophobicContact CG-CD1 3.73Å; Q413-Y521 HydrophobicContact CG-CD2 4.4Å; Q413-Y521 HydrophobicContact CG-CE1 4.04Å; Q413-Y521 HydrophobicContact CG-CG 3.94Å; L416-Y521 HydrophobicContact CB-CD2 3.86Å; L416-Y521 HydrophobicContact CB-CE2 3.86Å; L416-Y521 HydrophobicContact CD1-CE2 3.72Å; L416-Y521 HydrophobicContact CG-CE2 4.44Å; S417-Y521 WeakPolarHBondContact OG-CB 3.46Å; L519-Y521 PolarHBondContact O-N 2.78Å; Y521-Y523 VanDerWaalsContact C-N 3.26Å; Y521-Y523 PolarHBondContact O-N 3Å; Y521-F524 PolarHBondContact O-N 3.26Å
522L94.8Very high93.4Very high0 Ų027.9 Ų27.90%014%0.141CC..G310 helixtrans-69.5-22.8175.3-65.3178.1000112.9F90 I247 G250 M254 L416 S520F90-L522 HydrophobicContact CE1-CD1 4.41Å; F90-L522 HydrophobicContact CE1-CD2 4.35Å; F90-L522 HydrophobicContact CZ-CD1 3.95Å; F90-L522 HydrophobicContact CZ-CD2 3.88Å; I247-L522 HydrophobicContact CG1-CD1 3.97Å; G250-L522 CarbonylContact C-O 3.51Å; G250-L522 WeakPolarHBondContact CA-O 3.21Å; M254-L522 HydrophobicContact CE-CD2 3.53Å; M254-L522 HydrophobicContact SD-CD2 3.76Å; L416-L522 HydrophobicContact CD1-CD2 4.33Å; S520-L522 PolarHBondContact O-N 2.83Å
523Y96.7Very high94Very high25 Ų2525.1 Ų25.110%0.09813%0.127CC..G310 helixtrans-86.6-8.6176.8-77.7-53.7000114.3P238 W245 T246 V249 L519 S520 Y521 C525 L526 L527P238-Y523 HydrophobicContact CB-CD2 3.9Å; P238-Y523 HydrophobicContact CB-CE2 3.71Å; W245-Y523 PolarHBondContact O-OH 2.91Å; W245-Y523 VanDerWaalsContact O-OH 3.06Å; T246-Y523 WeakPolarHBondContact CA-OH 3.05Å; T246-Y523 HydrophobicContact CG2-CD2 4.1Å; T246-Y523 HydrophobicContact CG2-CE2 3.36Å; T246-Y523 PolarHBondContact N-OH 2.72Å; V249-Y523 HydrophobicContact CB-CE1 4.24Å; V249-Y523 HydrophobicContact CG1-CE1 4.34Å; L519-Y523 HydrophobicContact CD1-CD2 4.27Å; S520-Y523 PolarHBondContact O-N 3.29Å; Y521-Y523 VanDerWaalsContact C-N 3.26Å; Y521-Y523 PolarHBondContact O-N 3Å; Y523-C525 PolarHBondContact O-N 2.83Å; Y523-L526 HydrophobicContact CD1-CB 4.23Å; Y523-L526 HydrophobicContact CD1-CD2 3.62Å; Y523-L526 HydrophobicContact CE1-CD2 3.84Å; Y523-L526 PolarHBondContact O-N 2.85Å; Y523-L526 VanDerWaalsContact O-N 3.16Å; Y523-L527 WeakPolarHBondContact O-CB 3.35Å; Y523-L527 PolarHBondContact O-N 2.88Å
524F96.9Very high94.7Very high4 Ų430 Ų302%0.01815%0.152CC..Hα-helixtrans-58.3-39.4177.7-65.1-9.4000111.9G420 M421 T455 V458 A462 L519 Y521 L527 G528G420-F524 CarbonylContact O-C 3.03Å; M421-F524 HydrophobicContact CG-CB 4.5Å; M421-F524 HydrophobicContact CG-CD2 3.92Å; M421-F524 HydrophobicContact CG-CG 4.49Å; T455-F524 WeakPolarHBondContact CG2-O 3.44Å; V458-F524 HydrophobicContact CG1-CD1 4.22Å; V458-F524 HydrophobicContact CG1-CE1 3.75Å; V458-F524 HydrophobicContact CG1-CZ 4.44Å; A462-F524 HydrophobicContact CB-CZ 4.02Å; L519-F524 HydrophobicContact CB-CE1 4.25Å; L519-F524 HydrophobicContact CD2-CD1 4.08Å; L519-F524 HydrophobicContact CD2-CE1 4.26Å; L519-F524 HydrophobicContact CG-CD1 4.5Å; L519-F524 HydrophobicContact CG-CE1 4.37Å; L519-F524 WeakPolarHBondContact O-CE1 3.37Å; Y521-F524 PolarHBondContact O-N 3.26Å; F524-L527 PolarHBondContact O-N 3.13Å; F524-G528 PolarHBondContact O-N 2.95Å
525C97.1Very high95.4Very high0 Ų028.5 Ų28.50%015%0.145CC..Hα-helixtrans-63.9-46.3177-165.40000111.9V253 M254 S257 G420 G424 Y523 G528 T529V253-C525 HydrophobicContact CG1-CB 4.49Å; M254-C525 HydrophobicContact CB-CB 3.95Å; M254-C525 HydrophobicContact CG-CB 4.42Å; S257-C525 PolarHBondContact OG-SG 3.35Å; G420-C525 WeakPolarHBondContact O-CA 3.29Å; G420-C525 PolarHBondContact O-N 2.81Å; G424-C525 WeakPolarHBondContact CA-O 3.32Å; G424-C525 WeakPolarHBondContact CA-SG 3.45Å; Y523-C525 PolarHBondContact O-N 2.83Å; C525-G528 PolarHBondContact O-N 2.89Å; C525-T529 WeakPolarHBondContact O-CB 3.29Å; C525-T529 PolarHBondContact O-N 2.61Å; C525-T529 PolarHBondContact O-OG1 3.46Å
526L97.4Very high95.9Very high39 Ų3926.2 Ų26.220%0.20413%0.129CC..Hα-helixtrans-62.1-46.7178178.466.8000111V249 V253 Y523 G528 T529 L530V249-L526 HydrophobicContact CG1-CD2 4.04Å; V253-L526 HydrophobicContact CG2-CD1 3.96Å; Y523-L526 HydrophobicContact CD1-CB 4.23Å; Y523-L526 HydrophobicContact CD1-CD2 3.62Å; Y523-L526 HydrophobicContact CE1-CD2 3.84Å; Y523-L526 PolarHBondContact O-N 2.85Å; Y523-L526 VanDerWaalsContact O-N 3.16Å; L526-G528 PolarHBondContact O-N 3.45Å; L526-T529 PolarHBondContact O-N 3.31Å; L526-L530 HydrophobicContact CD1-CD1 3.93Å; L526-L530 HydrophobicContact CD1-CG 4.01Å; L526-L530 HydrophobicContact CG-CD1 3.88Å; L526-L530 HydrophobicContact CG-CG 4.31Å; L526-L530 WeakPolarHBondContact O-CB 3.39Å; L526-L530 VanDerWaalsContact O-CG 3.31Å; L526-L530 WeakPolarHBondContact O-CG 3.44Å; L526-L530 PolarHBondContact O-N 3.38Å
527L97.8Very high96.2Very high31 Ų3122.8 Ų22.816%0.16212%0.119CC..Hα-helixtrans-56.7-51.2177.6178.664.1000111.1I454 T455 V458 W516 L519 Y523 F524 T529 L530 V531I454-L527 HydrophobicContact CG2-CD1 4.47Å; I454-L527 HydrophobicContact CG2-CD2 4.05Å; I454-L527 HydrophobicContact CG2-CG 4.25Å; T455-L527 HydrophobicContact CG2-CB 4.49Å; T455-L527 HydrophobicContact CG2-CG 4.4Å; V458-L527 HydrophobicContact CB-CD2 4.39Å; V458-L527 HydrophobicContact CG1-CD2 4.45Å; V458-L527 HydrophobicContact CG2-CD2 4.08Å; W516-L527 HydrophobicContact CZ3-CD1 4.49Å; W516-L527 HydrophobicContact CZ3-CD2 4.49Å; L519-L527 HydrophobicContact CD2-CD2 3.98Å; Y523-L527 WeakPolarHBondContact O-CB 3.35Å; Y523-L527 PolarHBondContact O-N 2.88Å; F524-L527 PolarHBondContact O-N 3.13Å; L527-T529 VanDerWaalsContact C-N 3.33Å; L527-T529 PolarHBondContact O-N 2.68Å; L527-L530 PolarHBondContact O-N 3.41Å; L527-V531 HydrophobicContact CD1-CG2 4.05Å; L527-V531 HydrophobicContact CG-CG2 4.49Å; L527-V531 WeakPolarHBondContact O-CB 3.33Å; L527-V531 VanDerWaalsContact O-CG2 3.25Å; L527-V531 WeakPolarHBondContact O-CG2 3.47Å; L527-V531 PolarHBondContact O-N 2.99Å
528G97.8Very high96.5Very high0 Ų025.6 Ų25.60%014%0.138CC..Hα-helixtrans-61.3-41.8178.500000112.9T455 F524 C525 L526 T532T455-G528 VanDerWaalsContact CG2-N 3.32Å; F524-G528 PolarHBondContact O-N 2.95Å; C525-G528 PolarHBondContact O-N 2.89Å; L526-G528 PolarHBondContact O-N 3.45Å; G528-T532 WeakPolarHBondContact O-CB 3.22Å; G528-T532 PolarHBondContact O-N 2.77Å; G528-T532 PolarHBondContact O-OG1 3.34Å
529T98.3Very high96.8Very high9 Ų927.1 Ų27.16%0.05515%0.148CC..Hα-helixtrans-61.4-50177.7-57.50000111G424 L427 L431 C525 L526 L527 T532 V533G424-T529 WeakPolarHBondContact O-CA 3.32Å; G424-T529 PolarHBondContact O-N 3.01Å; G424-T529 PolarHBondContact O-OG1 3.38Å; G424-T529 VanDerWaalsContact O-OG1 3.09Å; L427-T529 HydrophobicContact CD2-CG2 4.44Å; L427-T529 HydrophobicContact CG-CG2 4.4Å; L431-T529 HydrophobicContact CD1-CG2 3.77Å; C525-T529 WeakPolarHBondContact O-CB 3.29Å; C525-T529 PolarHBondContact O-N 2.61Å; C525-T529 PolarHBondContact O-OG1 3.46Å; L526-T529 PolarHBondContact O-N 3.31Å; L527-T529 VanDerWaalsContact C-N 3.33Å; L527-T529 PolarHBondContact O-N 2.68Å; T529-T532 PolarHBondContact O-N 3.49Å; T529-V533 WeakPolarHBondContact O-CG2 3.33Å; T529-V533 PolarHBondContact O-N 2.94Å
530L98.2Very high96.8Very high87 Ų8725.9 Ų25.946%0.45514%0.141SC..Hα-helixtrans-65.1-46.7-178.2-71.1176.4000111.8L526 L527 T532 V533 I534L526-L530 HydrophobicContact CD1-CD1 3.93Å; L526-L530 HydrophobicContact CD1-CG 4.01Å; L526-L530 HydrophobicContact CG-CD1 3.88Å; L526-L530 HydrophobicContact CG-CG 4.31Å; L526-L530 WeakPolarHBondContact O-CB 3.39Å; L526-L530 VanDerWaalsContact O-CG 3.31Å; L526-L530 WeakPolarHBondContact O-CG 3.44Å; L526-L530 PolarHBondContact O-N 3.38Å; L527-L530 PolarHBondContact O-N 3.41Å; L530-T532 VanDerWaalsContact C-N 3.35Å; L530-T532 PolarHBondContact O-N 2.98Å; L530-V533 PolarHBondContact O-N 2.89Å; L530-I534 HydrophobicContact CB-CD1 4.45Å; L530-I534 WeakPolarHBondContact O-CB 3.43Å; L530-I534 WeakPolarHBondContact O-CD1 3.42Å; L530-I534 WeakPolarHBondContact O-CG1 3.15Å; L530-I534 PolarHBondContact O-N 3.3Å
531V98.4Very high96.7Very high22 Ų2229.1 Ų29.113%0.13317%0.168CC..Hα-helixtrans-59.6-47.1178.2171.20000110.4M450 I454 L527 V533 I534 V535M450-V531 HydrophobicContact CB-CG1 4.38Å; I454-V531 HydrophobicContact CD1-CG1 3.62Å; I454-V531 HydrophobicContact CD1-CG2 4.19Å; I454-V531 HydrophobicContact CG2-CG2 4.28Å; L527-V531 HydrophobicContact CD1-CG2 4.05Å; L527-V531 HydrophobicContact CG-CG2 4.49Å; L527-V531 WeakPolarHBondContact O-CB 3.33Å; L527-V531 VanDerWaalsContact O-CG2 3.25Å; L527-V531 WeakPolarHBondContact O-CG2 3.47Å; L527-V531 PolarHBondContact O-N 2.99Å; V531-V533 PolarHBondContact O-N 3.04Å; V531-I534 PolarHBondContact O-N 2.7Å; V531-V535 HydrophobicContact CG1-CG2 4.16Å; V531-V535 VanDerWaalsContact O-CB 3.3Å; V531-V535 WeakPolarHBondContact O-CB 3.42Å; V531-V535 VanDerWaalsContact O-CG2 3.31Å; V531-V535 WeakPolarHBondContact O-CG2 3.47Å; V531-V535 PolarHBondContact O-N 3.22Å
532T98.4Very high96.8Very high0 Ų035.4 Ų35.40%020%0.201CC..Hα-helixtrans-59.8-45.9178.6-66.40000112.1P425 L429 G447 G528 T529 L530 G536P425-T532 VanDerWaalsContact CA-OG1 3.32Å; P425-T532 WeakPolarHBondContact CA-OG1 3.43Å; P425-T532 WeakPolarHBondContact O-CG2 3.39Å; P425-T532 PolarHBondContact O-OG1 3.34Å; L429-T532 HydrophobicContact CB-CG2 4.19Å; G447-T532 WeakPolarHBondContact O-CA 3.38Å; G447-T532 PolarHBondContact O-OG1 3.04Å; G528-T532 WeakPolarHBondContact O-CB 3.22Å; G528-T532 PolarHBondContact O-N 2.77Å; G528-T532 PolarHBondContact O-OG1 3.34Å; T529-T532 PolarHBondContact O-N 3.49Å; L530-T532 VanDerWaalsContact C-N 3.35Å; L530-T532 PolarHBondContact O-N 2.98Å; T532-G536 WeakPolarHBondContact O-CA 3.43Å; T532-G536 PolarHBondContact O-N 3.35Å
533V98.2Very high96.6Very high19 Ų1938.3 Ų38.312%0.11522%0.219CC..Hα-helixtrans-66.3-48.5-179.8171.70000110.9G428 W436 T529 L530 V531 G536 L537G428-V533 WeakPolarHBondContact O-CG2 3.5Å; W436-V533 HydrophobicContact CH2-CG1 3.89Å; W436-V533 HydrophobicContact CZ2-CG1 4.3Å; W436-V533 HydrophobicContact CZ3-CG1 4.12Å; T529-V533 WeakPolarHBondContact O-CG2 3.33Å; T529-V533 PolarHBondContact O-N 2.94Å; L530-V533 PolarHBondContact O-N 2.89Å; V531-V533 PolarHBondContact O-N 3.04Å; V533-G536 PolarHBondContact O-N 2.89Å; V533-L537 HydrophobicContact CG1-CD1 3.82Å; V533-L537 HydrophobicContact CG1-CG 4.41Å; V533-L537 WeakPolarHBondContact O-CB 3.39Å; V533-L537 WeakPolarHBondContact O-CG 3.4Å; V533-L537 PolarHBondContact O-N 3.45Å
534I98Very high95.9Very high102 Ų10238.5 Ų38.552%0.52323%0.228SC..Hα-helixtrans-63.5-53.9-177.1-67.5166.5000110.5L530 V531 G536 L537 V538L530-I534 HydrophobicContact CB-CD1 4.45Å; L530-I534 WeakPolarHBondContact O-CB 3.43Å; L530-I534 WeakPolarHBondContact O-CD1 3.42Å; L530-I534 WeakPolarHBondContact O-CG1 3.15Å; L530-I534 PolarHBondContact O-N 3.3Å; V531-I534 PolarHBondContact O-N 2.7Å; I534-G536 VanDerWaalsContact C-N 3.3Å; I534-G536 PolarHBondContact O-N 3.17Å; I534-L537 PolarHBondContact O-N 3.35Å; I534-V538 VanDerWaalsContact O-CG2 3.32Å; I534-V538 WeakPolarHBondContact O-CG2 3.32Å; I534-V538 PolarHBondContact O-N 3.4Å
535V98.2Very high94.8Very high37 Ų3738.4 Ų38.422%0.22423%0.228CC..Hα-helixtrans-61.8-42.8179.21740000110.1M450 V531 L537 V538 V539M450-V535 HydrophobicContact CB-CG1 4.16Å; M450-V535 HydrophobicContact CB-CG2 4.3Å; M450-V535 HydrophobicContact CG-CG1 4.05Å; V531-V535 HydrophobicContact CG1-CG2 4.16Å; V531-V535 VanDerWaalsContact O-CB 3.3Å; V531-V535 WeakPolarHBondContact O-CB 3.42Å; V531-V535 VanDerWaalsContact O-CG2 3.31Å; V531-V535 WeakPolarHBondContact O-CG2 3.47Å; V531-V535 PolarHBondContact O-N 3.22Å; V535-L537 VanDerWaalsContact C-N 3.34Å; V535-L537 PolarHBondContact O-N 3.2Å; V535-V538 PolarHBondContact O-N 3.15Å; V535-V539 HydrophobicContact CG1-CG2 4.12Å; V535-V539 WeakPolarHBondContact O-CB 3.43Å; V535-V539 WeakPolarHBondContact O-CG2 3.37Å; V535-V539 PolarHBondContact O-N 2.95Å
536G97.2Very high93.1Very high0 Ų043.7 Ų43.70%026%0.264CS..Hα-helixtrans-63.1-38-179.400000113.4G443 T532 V533 I534 S540G443-G536 WeakPolarHBondContact O-CA 3.23Å; T532-G536 WeakPolarHBondContact O-CA 3.43Å; T532-G536 PolarHBondContact O-N 3.35Å; V533-G536 PolarHBondContact O-N 2.89Å; I534-G536 VanDerWaalsContact C-N 3.3Å; I534-G536 PolarHBondContact O-N 3.17Å; G536-S540 WeakPolarHBondContact O-CB 3.45Å; G536-S540 PolarHBondContact O-N 2.98Å; G536-S540 PolarHBondContact O-OG 3.11Å
537L95.8Very high91.5Very high44 Ų4450.5 Ų50.523%0.2329%0.292CS..Hα-helixtrans-69.4-45.5174.5-71.8172.5000112.4L432 W436 V533 I534 V535 S540 A541L432-L537 HydrophobicContact CD1-CD2 3.54Å; L432-L537 HydrophobicContact CD1-CG 3.67Å; W436-L537 HydrophobicContact CB-CD2 3.88Å; W436-L537 HydrophobicContact CD2-CD1 4.32Å; W436-L537 HydrophobicContact CD2-CD2 4.04Å; W436-L537 HydrophobicContact CG-CD2 3.5Å; W436-L537 HydrophobicContact CZ2-CD1 4.14Å; V533-L537 HydrophobicContact CG1-CD1 3.82Å; V533-L537 HydrophobicContact CG1-CG 4.41Å; V533-L537 WeakPolarHBondContact O-CB 3.39Å; V533-L537 WeakPolarHBondContact O-CG 3.4Å; V533-L537 PolarHBondContact O-N 3.45Å; I534-L537 PolarHBondContact O-N 3.35Å; V535-L537 VanDerWaalsContact C-N 3.34Å; V535-L537 PolarHBondContact O-N 3.2Å; L537-S540 PolarHBondContact O-N 3.07Å; L537-A541 WeakPolarHBondContact O-CB 3.43Å; L537-A541 PolarHBondContact O-N 3.38Å
538V96.2Very high89.9Confident80 Ų8051.6 Ų51.649%0.48530%0.296SS..Hα-helixtrans-61-50179.1170.60000110.5I534 V535 S540 A541 I542I534-V538 VanDerWaalsContact O-CG2 3.32Å; I534-V538 WeakPolarHBondContact O-CG2 3.32Å; I534-V538 PolarHBondContact O-N 3.4Å; V535-V538 PolarHBondContact O-N 3.15Å; V538-S540 VanDerWaalsContact C-N 3.35Å; V538-S540 PolarHBondContact O-N 3.32Å; V538-A541 WeakPolarHBondContact O-CB 3.36Å; V538-A541 PolarHBondContact O-N 2.91Å; V538-I542 HydrophobicContact CG1-CD1 3.93Å; V538-I542 WeakPolarHBondContact O-CG1 3Å; V538-I542 PolarHBondContact O-N 3.28Å; V538-I542 VanDerWaalsContact O-N 3.13Å
539V96.3Very high87.8Confident33 Ų3359.9 Ų59.920%0.234%0.335CS..Hα-helixtrans-66.7-38.2179.3176.10000111T442 T446 V535 A541 I542 T543T442-V539 HydrophobicContact CG2-CG1 4.28Å; T446-V539 HydrophobicContact CG2-CG1 4.34Å; T446-V539 WeakPolarHBondContact OG1-CG1 3.33Å; V535-V539 HydrophobicContact CG1-CG2 4.12Å; V535-V539 WeakPolarHBondContact O-CB 3.43Å; V535-V539 WeakPolarHBondContact O-CG2 3.37Å; V535-V539 PolarHBondContact O-N 2.95Å; V539-A541 VanDerWaalsContact C-N 3.32Å; V539-A541 PolarHBondContact O-N 2.96Å; V539-I542 PolarHBondContact O-N 3.5Å; V539-T543 HydrophobicContact CG1-CG2 4Å; V539-T543 WeakPolarHBondContact O-CB 3.4Å; V539-T543 WeakPolarHBondContact O-CG2 3.06Å; V539-T543 PolarHBondContact O-N 3.37Å; V539-T543 PolarHBondContact O-OG1 3.39Å
540S94.2Very high86.1Confident1 Ų169.2 Ų69.21%0.00738%0.375CS..Hα-helixtrans-61.2-40.9174.6-64.60000111.8T438 A439 N440 G443 G536 L537 V538 I542 T543 G544 G545T438-S540 WeakPolarHBondContact O-CB 3.27Å; A439-S540 WeakPolarHBondContact CA-OG 3.26Å; N440-S540 PolarHBondContact N-OG 2.95Å; G443-S540 WeakPolarHBondContact CA-OG 3.41Å; G536-S540 WeakPolarHBondContact O-CB 3.45Å; G536-S540 PolarHBondContact O-N 2.98Å; G536-S540 PolarHBondContact O-OG 3.11Å; L537-S540 PolarHBondContact O-N 3.07Å; V538-S540 VanDerWaalsContact C-N 3.35Å; V538-S540 PolarHBondContact O-N 3.32Å; S540-I542 VanDerWaalsContact C-N 3.34Å; S540-I542 PolarHBondContact O-N 2.96Å; S540-T543 PolarHBondContact O-N 3.07Å; S540-G544 PolarHBondContact O-N 3.36Å; S540-G545 WeakPolarHBondContact O-CA 3.37Å; S540-G545 PolarHBondContact O-N 3.38Å
541A92Very high84.9Confident73 Ų7368 Ų6860%0.60337%0.368SS*.Hα-helixtrans-61.9-42.517700000111.8L537 V538 V539L537-A541 WeakPolarHBondContact O-CB 3.43Å; L537-A541 PolarHBondContact O-N 3.38Å; V538-A541 WeakPolarHBondContact O-CB 3.36Å; V538-A541 PolarHBondContact O-N 2.91Å; V539-A541 VanDerWaalsContact C-N 3.32Å; V539-A541 PolarHBondContact O-N 2.96Å
542I93.9Very high83.9Confident137 Ų13769.9 Ų69.970%0.70338%0.383SS*.Hα-helixtrans-70.7-37.6-179.9-62.2163.6000111.7V538 V539 S540 G544V538-I542 HydrophobicContact CG1-CD1 3.93Å; V538-I542 WeakPolarHBondContact O-CG1 3Å; V538-I542 PolarHBondContact O-N 3.28Å; V538-I542 VanDerWaalsContact O-N 3.13Å; V539-I542 PolarHBondContact O-N 3.5Å; S540-I542 VanDerWaalsContact C-N 3.34Å; S540-I542 PolarHBondContact O-N 2.96Å; I542-G544 VanDerWaalsContact C-N 3.31Å; I542-G544 PolarHBondContact O-N 3.27Å
543T91.3Very high83Confident62 Ų6272.8 Ų72.838%0.3840%0.403SS..THydrogen-bonded Turntrans-91.715.3-173.856.60000113.8N440 T442 V539 S540N440-T543 PolarHBondContact ND2-O 3.42Å; N440-T543 PolarHBondContact ND2-OG1 2.77Å; N440-T543 PolarHBondContact OD1-OG1 2.88Å; T442-T543 HydrophobicContact CG2-CG2 4.13Å; V539-T543 HydrophobicContact CG1-CG2 4Å; V539-T543 WeakPolarHBondContact O-CB 3.4Å; V539-T543 WeakPolarHBondContact O-CG2 3.06Å; V539-T543 PolarHBondContact O-N 3.37Å; V539-T543 PolarHBondContact O-OG1 3.39Å; S540-T543 PolarHBondContact O-N 3.07Å
544G81.6Confident82.2Confident28 Ų2874.3 Ų74.329%0.28941%0.41SS..THydrogen-bonded Turntrans87.730.6171.700000115.2S540 I542 C546 K547S540-G544 PolarHBondContact O-N 3.36Å; I542-G544 VanDerWaalsContact C-N 3.31Å; I542-G544 PolarHBondContact O-N 3.27Å; G544-C546 PolarHBondContact O-N 3.43Å; G544-C546 VanDerWaalsContact O-N 3.13Å; G544-K547 WeakPolarHBondContact O-CB 3.29Å; G544-K547 PolarHBondContact O-N 3.28Å
545G73.9Confident81.6Confident2 Ų270 Ų702%0.02139%0.388CS..G310 helixtrans-54.3-28177.900000115.1T438 S540 K547 Q548T438-G545 CarbonylContact O-C 3.48Å; T438-G545 WeakPolarHBondContact O-CA 3.45Å; S540-G545 WeakPolarHBondContact O-CA 3.37Å; S540-G545 PolarHBondContact O-N 3.38Å; G545-K547 PolarHBondContact O-N 3.43Å; G545-Q548 PolarHBondContact O-N 2.89Å
546C62.7Low81.1Confident111 Ų11168.9 Ų68.975%0.7538%0.38SS*.G310 helixtrans-69.3-11174.2-600000114.1G544G544-C546 PolarHBondContact O-N 3.43Å; G544-C546 VanDerWaalsContact O-N 3.13Å
547K63.9Low80.6Confident182 Ų18270 Ų7079%0.79139%0.388SS*.G310 helixtrans-92.48.7178.1-59.5-177178.7-179.90113.4G544 G545 E549G544-K547 WeakPolarHBondContact O-CB 3.29Å; G544-K547 PolarHBondContact O-N 3.28Å; G545-K547 PolarHBondContact O-N 3.43Å; K547-E549 PolarHBondContact O-N 3.16Å
548Q63.8Low79.8Confident55 Ų5572 Ų7226%0.25739%0.392SS..  trans-7272.9175.3-70.4-158.7-47.100111.2R437 A439 N440 G545 L551R437-Q548 PolarHBondContact O-OE1 3.47Å; A439-Q548 PolarHBondContact O-NE2 3.41Å; A439-Q548 PolarHBondContact O-OE1 3.06Å; N440-Q548 HydrophobicContact CB-CG 4.46Å; G545-Q548 PolarHBondContact O-N 2.89Å; Q548-L551 HydrophobicContact CB-CD1 4.08Å
549E53.8Low78.4Confident174 Ų17478.9 Ų78.981%0.81341%0.409SS*.  trans-80.5126.7169.3-74.8-172.7157.800109.6K547K547-E549 PolarHBondContact O-N 3.16Å
550K62.8Low76.9Confident205 Ų20581.1 Ų81.189%0.89143%0.426SS*.  trans8547.9171.7-49176.1-178.51800118.1
551L71.9Confident75.5Confident61 Ų6182 Ų8232%0.31943%0.431SS..  trans-87.5143155.9-84.790.7000111.1Q548 L555 F556Q548-L551 HydrophobicContact CB-CD1 4.08Å; L551-L555 HydrophobicContact CD2-CD1 4.15Å; L551-F556 HydrophobicContact CB-CE2 4.07Å; L551-F556 HydrophobicContact CB-CZ 4.47Å; L551-F556 HydrophobicContact CD2-CZ 4.31Å
552S77.5Confident73.8Confident62 Ų6282.2 Ų82.243%0.43442%0.422SS..  trans-63.8138.5176.763.90000110.8D554 L555S552-D554 PolarHBondContact O-N 2.98Å; S552-D554 VanDerWaalsContact O-N 3.15Å; S552-L555 PolarHBondContact O-N 2.98Å; S552-L555 WeakPolarHBondContact OG-CD1 3.27Å; S552-L555 WeakPolarHBondContact OG-CG 3.25Å
553S79.8Confident71.6Confident61 Ų6183.4 Ų83.443%0.42742%0.422SS..G310 helixtrans-65.2-16.7179.873.90000113.2L555 R558S553-L555 VanDerWaalsContact C-N 3.29Å; S553-L555 PolarHBondContact O-N 3.05Å; S553-R558 PolarHBondContact OG-NH2 2.86Å
554D81.8Confident69.1Low51 Ų5185.6 Ų85.627%0.27344%0.438SS..G310 helixtrans-71.5-20.6-179.2-66.3-56000113.5L108 R111 L112 S552 F556 R558L108-D554 VanDerWaalsContact CD1-O 3.26Å; L108-D554 WeakPolarHBondContact CD1-O 3.5Å; R111-D554 VanDerWaalsContact CD-OD1 3.32Å; R111-D554 WeakPolarHBondContact CD-OD1 3.37Å; L112-D554 HydrophobicContact CD2-CB 4.44Å; S552-D554 PolarHBondContact O-N 2.98Å; S552-D554 VanDerWaalsContact O-N 3.15Å; D554-F556 VanDerWaalsContact C-N 3.26Å; D554-F556 PolarHBondContact O-N 3.45Å; D554-R558 IonicContact OD1-CZ 3.24Å; D554-R558 VanDerWaalsContact OD1-CZ 3.24Å; D554-R558 IonicContact OD1-NH1 3.54Å; D554-R558 IonicContact OD1-NH2 2.6Å; D554-R558 PolarHBondContact OD1-NH2 2.61Å
555L84.5Confident66.9Low10 Ų1088.8 Ų88.85%0.05246%0.462CS..G310 helixtrans-78.5-7.1179.3-66.3168.9000114L112 Y120 M123 L551 S552 S553L112-L555 HydrophobicContact CD1-CD2 4.34Å; L112-L555 HydrophobicContact CD2-CD2 4.02Å; Y120-L555 HydrophobicContact CD2-CD2 4.32Å; Y120-L555 HydrophobicContact CE2-CD2 4.27Å; Y120-L555 WeakPolarHBondContact CE2-O 3.15Å; Y120-L555 PolarHBondContact OH-O 3.45Å; Y120-L555 VanDerWaalsContact OH-O 3.07Å; M123-L555 HydrophobicContact CB-CD2 3.68Å; M123-L555 HydrophobicContact SD-CD2 4.46Å; L551-L555 HydrophobicContact CD2-CD1 4.15Å; S552-L555 PolarHBondContact O-N 2.98Å; S552-L555 WeakPolarHBondContact OG-CD1 3.27Å; S552-L555 WeakPolarHBondContact OG-CG 3.25Å; S553-L555 VanDerWaalsContact C-N 3.29Å; S553-L555 PolarHBondContact O-N 3.05Å
556F89.1Confident64.8Low14 Ų1491.6 Ų91.66%0.06149%0.491CS..SBendtrans-114.1153-177.5-60.2-83.4000111G433 R437 L551 D554 R558G433-F556 WeakPolarHBondContact O-CE1 3.44Å; R437-F556 HydrophobicContact CB-CE1 4.25Å; R437-F556 HydrophobicContact CB-CZ 4.3Å; R437-F556 HydrophobicContact CG-CD1 3.99Å; R437-F556 HydrophobicContact CG-CE1 3.68Å; R437-F556 HydrophobicContact CG-CE2 4.25Å; R437-F556 HydrophobicContact CG-CG 4.41Å; R437-F556 HydrophobicContact CG-CZ 3.82Å; L551-F556 HydrophobicContact CB-CE2 4.07Å; L551-F556 HydrophobicContact CB-CZ 4.47Å; L551-F556 HydrophobicContact CD2-CZ 4.31Å; D554-F556 VanDerWaalsContact C-N 3.26Å; D554-F556 PolarHBondContact O-N 3.45Å; F556-R558 PolarHBondContact O-N 3.18Å
557V85.2Confident63.4Low25 Ų2593.2 Ų93.215%0.15250%0.502CS..  trans-64127172.8177.70000108.9I104 M434 F435 L562I104-V557 HydrophobicContact CG2-CG1 4.45Å; I104-V557 HydrophobicContact CG2-CG2 3.68Å; M434-V557 HydrophobicContact CB-CG2 4.06Å; M434-V557 PolarHBondContact O-N 3.41Å; F435-V557 HydrophobicContact CE1-CB 4.07Å; F435-V557 HydrophobicContact CE1-CG1 4.21Å; F435-V557 HydrophobicContact CE1-CG2 4Å; F435-V557 HydrophobicContact CZ-CG2 4Å; V557-L562 HydrophobicContact CG1-CD1 4.18Å; V557-L562 HydrophobicContact CG1-CD2 4.36Å; V557-L562 HydrophobicContact CG1-CG 4.05Å
558R79.9Confident62.1Low86 Ų8687.6 Ų87.633%0.32550%0.496SS..  trans-91.5152.8176.8-64.8-178.3172165.5-4.6110.5S553 D554 F556 S560 D561S553-R558 PolarHBondContact OG-NH2 2.86Å; D554-R558 IonicContact OD1-CZ 3.24Å; D554-R558 VanDerWaalsContact OD1-CZ 3.24Å; D554-R558 IonicContact OD1-NH1 3.54Å; D554-R558 IonicContact OD1-NH2 2.6Å; D554-R558 PolarHBondContact OD1-NH2 2.61Å; F556-R558 PolarHBondContact O-N 3.18Å; R558-S560 WeakPolarHBondContact CB-OG 3.35Å; R558-S560 PolarHBondContact O-N 3.5Å; R558-D561 WeakPolarHBondContact CB-OD2 3.28Å; R558-D561 PolarHBondContact N-OD2 3.49Å; R558-D561 WeakPolarHBondContact O-CB 3.42Å; R558-D561 PolarHBondContact O-N 3.39Å
559R67.3Low60.2Low223 Ų22394.3 Ų94.384%0.84252%0.524SS*.Hα-helixtrans-58-30.9171-75.5-170.4178.9-178.40.2112.5D561 L562 F563R559-D561 PolarHBondContact O-N 2.85Å; R559-L562 PolarHBondContact O-N 2.87Å; R559-F563 PolarHBondContact O-N 3.46Å
560S64.4Low59.5Low80 Ų8093.8 Ų93.856%0.55953%0.527SS*.Hα-helixtrans-66.4-22.1174.557.40000113.9R558R558-S560 WeakPolarHBondContact CB-OG 3.35Å; R558-S560 PolarHBondContact O-N 3.5Å
561D63.9Low57.8Low19 Ų1989.3 Ų89.310%0.10252%0.522CS..Hα-helixtrans-81-32.3-179.4-56.5-32.2000111.3P107 R111 R558 R559P107-D561 HydrophobicContact CB-CB 4.34Å; R111-D561 IonicContact CZ-OD2 3.16Å; R111-D561 IonicContact NH1-OD2 3.74Å; R111-D561 IonicContact NH2-OD1 3.26Å; R111-D561 PolarHBondContact NH2-OD1 3.44Å; R111-D561 IonicContact NH2-OD2 2.66Å; R111-D561 PolarHBondContact NH2-OD2 2.85Å; R558-D561 WeakPolarHBondContact CB-OD2 3.28Å; R558-D561 PolarHBondContact N-OD2 3.49Å; R558-D561 WeakPolarHBondContact O-CB 3.42Å; R558-D561 PolarHBondContact O-N 3.39Å; R559-D561 PolarHBondContact O-N 2.85Å
562L57.6Low56.1Low79 Ų7996 Ų9641%0.41455%0.551SS.*Hα-helixtrans-80-25.9-178.5-67.9165.7000113.4I104 V557 R559I104-L562 HydrophobicContact CD1-CD2 4.33Å; I104-L562 HydrophobicContact CG1-CD2 4.03Å; V557-L562 HydrophobicContact CG1-CD1 4.18Å; V557-L562 HydrophobicContact CG1-CD2 4.36Å; V557-L562 HydrophobicContact CG1-CG 4.05Å; R559-L562 PolarHBondContact O-N 2.87Å
563F47.9Very low53.6Low162 Ų16297.4 Ų97.471%0.71157%0.567SS**  trans-122.183.1-178.9-66.4-81.3000110.3R559 A565R559-F563 PolarHBondContact O-N 3.46Å; F563-A565 PolarHBondContact O-N 3.41Å
564C38.3Very low51Low107 Ų10799.9 Ų99.972%0.72358%0.584SS**  trans-7857.6162.8-1320000109.8
565A34Very low48.4Very low95 Ų95106.8 Ų106.879%0.78562%0.615SS**  trans-101.982.2167.200000107.7F563F563-A565 PolarHBondContact O-N 3.41Å
566G30.7Very low45.6Very low62 Ų62111.7 Ų111.764%0.63965%0.647SS**  trans176.143.9-176.500000113.7G568G566-G568 VanDerWaalsContact C-N 3.32Å; G566-G568 PolarHBondContact O-N 3.31Å
567C33Very low42.6Very low145 Ų145120.8 Ų120.898%0.9869%0.69SS**SBendtrans-64.7103.6151.8-92.70000107
568G36.2Very low39.8Very low64 Ų64127.1 Ų127.166%0.6672%0.721SS**SBendtrans97.492.4169.400000114.8G566G566-G568 VanDerWaalsContact C-N 3.32Å; G566-G568 PolarHBondContact O-N 3.31Å
569K25.3Very low37.1Very low195 Ų195131 Ų13185%0.84875%0.748SS**  179122.8124-98.5168.4-178.2-179.80110S571K569-S571 PolarHBondContact O-N 2.85Å
570D39.1Very low35.2Very low164 Ų164128.7 Ų128.788%0.87775%0.747SS**  trans-52.8131.3159.6-61.1-52.3000109.2
571S25.4Very low33.2Very low111 Ų111134.1 Ų134.178%0.77676%0.761SS**  trans-154.3108.3163.6-66.20000109.1K569K569-S571 PolarHBondContact O-N 2.85Å
572E37.4Very low31.4Very low200 Ų200138.1 Ų138.194%0.93580%0.797SS**  trans-52.6133.4163.2-66.6169.6138.200110.4
573A25.3Very low29.9Very low92 Ų92138.4 Ų138.476%0.7682%0.818SS**  trans-156.3103.5160.100000111.8
574S24.9Very low28.8Very low113 Ų113136 Ų13679%0.7982%0.821SS**  trans42.3117.7144.758.70000121.2
575E27.9Very low28.2Very low197 Ų197138.3 Ų138.392%0.92182%0.822SS**  trans-55.6146.8165.8-67177.5140.100113.7
576P25.7Very low27.9Very low113 Ų113141.5 Ų141.573%0.73483%0.825SS**  trans-115.4137145.328.6-15000111.4
577E24.6Very low27.7Very low204 Ų204145 Ų14595%0.95382%0.822SS**PPolyproline II helixtrans-49.3131.9-178.6-66.5173.4144.700113.8
578I26.4Very low27.4Very low159 Ų159148.6 Ų148.682%0.81582%0.821SS**PPolyproline II helixtrans-98.6118.6177.2-64.8173.2000108.9
579N23.7Very low27Very low167 Ų167148.4 Ų148.489%0.89382%0.82SS**PPolyproline II helixtrans-82.7129.3162.7-113.7-28.3000109.8
580E26.9Very low27.4Very low174 Ų174144.3 Ų144.381%0.81382%0.816SS**PPolyproline II helixtrans-61131.8-177-67.7179120.700114.4
581K23.8Very low27.3Very low194 Ų194142.2 Ų142.284%0.84380%0.804SS**  160.7115.3109.5-93-174.4177.7172.20111.8
582A24.8Very low27.9Very low104 Ų104137.8 Ų137.886%0.8677%0.772SS**  167.3119.8117.700000108.3
583G25.9Very low27.9Very low84 Ų84132.4 Ų132.487%0.86676%0.761SS**  trans-71.8132.8-16000000116.1
584S25.8Very low28.5Very low111 Ų111130.5 Ų130.578%0.77675%0.751SS**  -169.1142117.754.10000107.4L586S584-L586 PolarHBondContact O-N 3.29Å
585E25.4Very low29.1Very low157 Ų157129.3 Ų129.373%0.73473%0.731SS**  trans-57.8106.8-167.2-64.8-167.8158.400113.4K587E585-K587 IonicContact OE1-NZ 2.76Å; E585-K587 IonicContact OE2-NZ 3.27Å; E585-K587 PolarHBondContact OE2-NZ 3.46Å
586L27Very low29.5Very low162 Ų162125.2 Ų125.285%0.84871%0.713SS**  trans-94.686.6164.2-105.5150000108.5S584S584-L586 PolarHBondContact O-N 3.29Å
587K26.3Very low29.9Very low134 Ų134126 Ų12658%0.58371%0.71SS**  trans-82.9124170.3-78.3175.5-179.7140.30110.2E585E585-K587 IonicContact OE1-NZ 2.76Å; E585-K587 IonicContact OE2-NZ 3.27Å; E585-K587 PolarHBondContact OE2-NZ 3.46Å
588K27.3Very low30.3Very low221 Ų221120.2 Ų120.296%0.96169%0.689SS**  trans-57.9129.4172.8-109.3174.1174.9175.50110.9
589G27.4Very low30.4Very low61 Ų61119.5 Ų119.563%0.62968%0.682SS**  trans-178132.516500000112.9N591G589-N591 PolarHBondContact O-N 3.07Å
590S35.3Very low30.8Very low109 Ų109118.8 Ų118.876%0.76267%0.672SS**SBendtrans-64.917.3174.4176.30000114.4
591N35.8Very low31Very low119 Ų119115.1 Ų115.164%0.63666%0.658SS**SBendtrans-129.8141.1-176.9-72.8-28.3000108.9G589 A593G589-N591 PolarHBondContact O-N 3.07Å; N591-A593 PolarHBondContact O-N 2.96Å
592N38.1Very low31.5Very low19 Ų19110.6 Ų110.610%0.10264%0.642CS.*  trans-50.8124.3-174.1-145.7-34.6000111.3R52 G594 F595R52-N592 VanDerWaalsContact CD-ND2 3.33Å; R52-N592 WeakPolarHBondContact CD-ND2 3.27Å; R52-N592 PolarHBondContact NH1-OD1 3.49Å; N592-G594 PolarHBondContact O-N 3.15Å; N592-F595 PolarHBondContact O-N 3.04Å
593A38.2Very low31.9Very low86 Ų86109.9 Ų109.971%0.71163%0.627SS**G310 helixtrans-61.1-17-173.300000114.2N591 F595N591-A593 PolarHBondContact O-N 2.96Å; A593-F595 PolarHBondContact O-N 3.27Å; A593-F595 VanDerWaalsContact O-N 3.14Å
594G38.1Very low32.3Very low52 Ų52112.5 Ų112.554%0.53662%0.616SS.*G310 helixtrans-71.95.3174.500000115.8N592N592-G594 PolarHBondContact O-N 3.15Å
595F37.8Very low32.8Very low88 Ų88114.5 Ų114.539%0.38661%0.611SS.*G310 helixtrans-102.1-12.1-179.6-103.7-90.7000114.9Q53 N592 A593Q53-F595 HydrophobicContact CG-CE2 4.43Å; Q53-F595 HydrophobicContact CG-CZ 4.17Å; N592-F595 PolarHBondContact O-N 3.04Å; A593-F595 PolarHBondContact O-N 3.27Å; A593-F595 VanDerWaalsContact O-N 3.14Å
596Q35.3Very low33.2Very low112 Ų112111.6 Ų111.652%0.52360%0.601SS.*Hα-helixtrans-74.5-26.1-177.7-73.2-165.9-22.100113.1T598Q596-T598 PolarHBondContact O-N 3.35Å
597D34.4Very low33.7Very low128 Ų128108 Ų10868%0.68459%0.585SS**Hα-helixtrans-79.1-15.5-177.5-72.4-21.6000114.6N601D597-N601 PolarHBondContact O-ND2 2.9Å
598T32.8Very low34.2Very low84 Ų84108 Ų10852%0.51559%0.587SS.*Hα-helixtrans-95-25.5179.2-10.10000113.3Q596 I602Q596-T598 PolarHBondContact O-N 3.35Å; T598-I602 WeakPolarHBondContact O-CD1 3.4Å; T598-I602 WeakPolarHBondContact O-CG1 3.29Å
599Q29.4Very low34.6Very low143 Ų143105.2 Ų105.267%0.66858%0.575SS**Hα-helixtrans-78.2-34.6176.6-103.7-172.1-28.400112.6N601 I602 V603Q599-N601 PolarHBondContact O-N 2.86Å; Q599-I602 PolarHBondContact O-N 3.1Å; Q599-V603 WeakPolarHBondContact O-CG2 3.27Å; Q599-V603 PolarHBondContact O-N 2.84Å
600F30.8Very low35.1Very low153 Ų153108 Ų10867%0.67158%0.58SS**Hα-helixtrans-65.1-38.7174.9-94.9-85.4000112.3I602 V603 E604F600-I602 VanDerWaalsContact C-N 3.29Å; F600-I602 PolarHBondContact O-N 2.93Å; F600-V603 PolarHBondContact O-N 2.86Å; F600-E604 PolarHBondContact O-N 3.36Å
601N31.7Very low35.4Very low97 Ų97108.1 Ų108.152%0.51958%0.576SS.*Hα-helixtrans-70.2-19.4178.8-84.2-56.4000114.8D597 Q599D597-N601 PolarHBondContact O-ND2 2.9Å; Q599-N601 PolarHBondContact O-N 2.86Å
602I34.2Very low35.6Very low98 Ų98111 Ų11150%0.50358%0.583SS.*Hα-helixtrans-87.5-38.9175.9-63.8168.6000109.9T598 Q599 F600 K605 D606T598-I602 WeakPolarHBondContact O-CD1 3.4Å; T598-I602 WeakPolarHBondContact O-CG1 3.29Å; Q599-I602 PolarHBondContact O-N 3.1Å; F600-I602 VanDerWaalsContact C-N 3.29Å; F600-I602 PolarHBondContact O-N 2.93Å; I602-K605 PolarHBondContact O-N 3.35Å; I602-D606 WeakPolarHBondContact O-CB 3.19Å; I602-D606 PolarHBondContact O-N 2.82Å; I602-D606 VanDerWaalsContact O-N 3.07Å
603V33.6Very low35.5Very low90 Ų90121.9 Ų121.955%0.54564%0.636SS.*Hα-helixtrans-69.2-38.1176.71790000111.4Q599 F600 D606 V607Q599-V603 WeakPolarHBondContact O-CG2 3.27Å; Q599-V603 PolarHBondContact O-N 2.84Å; F600-V603 PolarHBondContact O-N 2.86Å; V603-D606 PolarHBondContact O-N 3.03Å; V603-V607 HydrophobicContact CG1-CG2 4.24Å; V603-V607 WeakPolarHBondContact O-CB 3.38Å; V603-V607 WeakPolarHBondContact O-CG2 3.41Å; V603-V607 PolarHBondContact O-N 3.31Å
604E33.5Very low35.4Very low139 Ų139123.7 Ų123.765%0.6563%0.632SS**Hα-helixtrans-66.1-39.5176.5-124.6173.4-177.200112.2F600 E608F600-E604 PolarHBondContact O-N 3.36Å; E604-E608 WeakPolarHBondContact O-CB 3.42Å; E604-E608 PolarHBondContact O-N 3.2Å
605K36Very low35.2Very low153 Ų153127.4 Ų127.467%0.66564%0.637SS**Hα-helixtrans-71.6-29.7177.5-86.1-176.5175.1173.80114.1I602 K609I602-K605 PolarHBondContact O-N 3.35Å; K605-K609 PolarHBondContact O-N 3.39Å
606D34.8Very low35.1Very low96 Ų96129.6 Ų129.651%0.51365%0.651SS.*Hα-helixtrans-81.7-31.2176.2-74.5-25.8000111.8I602 V603 K609 V610I602-D606 WeakPolarHBondContact O-CB 3.19Å; I602-D606 PolarHBondContact O-N 2.82Å; I602-D606 VanDerWaalsContact O-N 3.07Å; V603-D606 PolarHBondContact O-N 3.03Å; D606-K609 PolarHBondContact O-N 3.4Å; D606-V610 WeakPolarHBondContact O-CG2 3.33Å; D606-V610 PolarHBondContact O-N 3.25Å
607V37.6Very low35.1Very low87 Ų87130.6 Ų130.653%0.52766%0.659SS.*Hα-helixtrans-71.3-36.1172174.20000111.6V603 K609 V610 T611V603-V607 HydrophobicContact CG1-CG2 4.24Å; V603-V607 WeakPolarHBondContact O-CB 3.38Å; V603-V607 WeakPolarHBondContact O-CG2 3.41Å; V603-V607 PolarHBondContact O-N 3.31Å; V607-K609 VanDerWaalsContact C-N 3.28Å; V607-K609 PolarHBondContact O-N 3.02Å; V607-V610 PolarHBondContact O-N 3.33Å; V607-T611 PolarHBondContact O-N 3.28Å; V607-T611 PolarHBondContact O-OG1 3.3Å
608E35.6Very low35.1Very low134 Ų134130.8 Ų130.863%0.62666%0.657SS**Hα-helixtrans-70.9-23.4176.4-147.2-179.4-170.800112.8E604E604-E608 WeakPolarHBondContact O-CB 3.42Å; E604-E608 PolarHBondContact O-N 3.2Å
609K36.1Very low35.2Very low161 Ų161133.9 Ų133.970%0.767%0.666SS**Hα-helixtrans-81.4-29.1173-91.9-177.3176.2178.90114.3K605 D606 V607 T611K605-K609 PolarHBondContact O-N 3.39Å; D606-K609 PolarHBondContact O-N 3.4Å; V607-K609 VanDerWaalsContact C-N 3.28Å; V607-K609 PolarHBondContact O-N 3.02Å; K609-T611 VanDerWaalsContact C-N 3.32Å
610V38.9Very low35.7Very low120 Ų120133.3 Ų133.373%0.72767%0.666SS**Hα-helixtrans-80.1-16.9177.5175.80000112D606 V607D606-V610 WeakPolarHBondContact O-CG2 3.33Å; D606-V610 PolarHBondContact O-N 3.25Å; V607-V610 PolarHBondContact O-N 3.33Å
611T39.5Very low36Very low112 Ų112131.8 Ų131.869%0.68767%0.666SS**THydrogen-bonded Turntrans-94.56.8178.5-32.90000113.5V607 K609V607-T611 PolarHBondContact O-N 3.28Å; V607-T611 PolarHBondContact O-OG1 3.3Å; K609-T611 VanDerWaalsContact C-N 3.32Å
612K40.3Very low36.4Very low180 Ų180134.7 Ų134.778%0.78368%0.678SS**THydrogen-bonded Turntrans-128.925.9178.4-82.5-172.5178.4170.20114.4
613M36.5Very low36.6Very low246 Ų246138 Ų138100%1.21269%0.694SS**  trans-116.50163.4-93.6-173179.300111.1

Retrieved 613 of 613 residues in 2795.9 ms (Link to these results)

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