A0A096MK69_RAT Loading...

Olfactory receptor family 8 subfamily B member 37

Odorant receptor.

AlphaFold DB , UniProt , Accession A0A096MK69, Species RAT (Rattus norvegicus, Rat), Gene Or8b37, Length 308 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
1M35.1Very low53.5Low247 Ų247122.4 Ų122.4100%1.21774%0.735SS**  0101.70-69.7171.9-171.700107.4
2A32.5Very low56.2Low101 Ų101112.2 Ų112.284%0.83567%0.674SS**  trans-106.4112.6168.200000106.2G4A2-G4 PolarHBondContact O-N 3.5Å
3L42.6Very low58.6Low174 Ų174106.2 Ų106.291%0.91164%0.636SS**  trans-6791.1163.6-10286.9000106.5N5L3-N5 PolarHBondContact O-N 3.16Å
4G40.5Very low60.6Low66 Ų6699.1 Ų99.168%0.6859%0.593SS**  trans-68.8122.716400000107.8A2 A6A2-G4 PolarHBondContact O-N 3.5Å; G4-A6 PolarHBondContact O-N 2.98Å
5N41.7Very low62.2Low158 Ų15896 Ų9685%0.84557%0.572SS**  trans-45.8113.8172-78.2-24.4000109.6L3 S7L3-N5 PolarHBondContact O-N 3.16Å; N5-S7 PolarHBondContact O-N 3.27Å
6A48.1Very low63.5Low103 Ų10390.1 Ų90.185%0.85154%0.537SS*.  trans-67.285.2168.800000108G4 S8G4-A6 PolarHBondContact O-N 2.98Å; A6-S8 PolarHBondContact O-N 3.48Å
7S52.2Low64.6Low98 Ų9886.2 Ų86.269%0.68551%0.513SS*.  trans-72.398173.963.90000108N5 V9N5-S7 PolarHBondContact O-N 3.27Å; S7-V9 PolarHBondContact O-N 3.3Å
8S62.1Low65.5Low95 Ų9582.8 Ų82.866%0.66449%0.493SS*.  trans-52.2121.4167.41790000108.9A6 K10A6-S8 PolarHBondContact O-N 3.48Å; S8-K10 PolarHBondContact O-N 3.04Å; S8-K10 VanDerWaalsContact O-N 3.13Å
9V69.3Low66.3Low23 Ų2385 Ų8514%0.13950%0.497CS..  trans-61.2114.3179175.10000108.7S7 E11 F12 F167 N171S7-V9 PolarHBondContact O-N 3.3Å; V9-E11 WeakPolarHBondContact CG1-O 3.33Å; V9-F12 HydrophobicContact CB-CE1 4.45Å; V9-F12 HydrophobicContact CG1-CD1 4.03Å; V9-F12 HydrophobicContact CG1-CE1 3.74Å; V9-F12 HydrophobicContact CG1-CZ 4.06Å; V9-F167 HydrophobicContact CB-CB 4.2Å; V9-F167 HydrophobicContact CG2-CB 3.9Å; V9-F167 WeakPolarHBondContact CG2-O 3.46Å; V9-N171 HydrophobicContact CG1-CB 3.88Å
10K78.1Confident67.2Low171 Ų17186.9 Ų86.974%0.74350%0.501SS*.  trans-85-26.7-178.1-66.1-172.4177.4-178.50113.1S8 H93S8-K10 PolarHBondContact O-N 3.04Å; S8-K10 VanDerWaalsContact O-N 3.13Å; K10-H93 PolarHBondContact O-N 3.01Å
11E86.3Confident67.8Low110 Ų11089.4 Ų89.451%0.51451%0.512SS..EExtended strand (participates in β ladder)trans-141.8143-172.3-63.7178.9179.300110.7V9 I90 I91 N171V9-E11 WeakPolarHBondContact CG1-O 3.33Å; E11-I90 HydrophobicContact CB-CG2 4.11Å; E11-I90 HydrophobicContact CG-CG2 4.48Å; E11-I91 CarbonylContact C-O 3.17Å; E11-I91 WeakPolarHBondContact CA-O 3.49Å; E11-N171 VanDerWaalsContact O-CB 3.26Å; E11-N171 WeakPolarHBondContact O-CB 3.25Å; E11-N171 PolarHBondContact O-ND2 2.86Å
12F86.4Confident70.4Confident0 Ų086.1 Ų86.10%049%0.494CS..EExtended strand (participates in β ladder)trans-115.5153173.8-62.2-76.4000111V9 I90 I91 H93 C96 F167 N171 I173 L183 L186V9-F12 HydrophobicContact CB-CE1 4.45Å; V9-F12 HydrophobicContact CG1-CD1 4.03Å; V9-F12 HydrophobicContact CG1-CE1 3.74Å; V9-F12 HydrophobicContact CG1-CZ 4.06Å; F12-I90 CarbonylContact O-C 3.47Å; F12-I90 WeakPolarHBondContact O-CA 3.28Å; F12-I91 HydrophobicContact CB-CG2 3.86Å; F12-I91 PolarHBondContact N-O 3.22Å; F12-I91 PolarHBondContact O-N 3.47Å; F12-H93 HydrophobicContact CE2-CB 4.03Å; F12-H93 AromaticContact CE2-CD2 3.67Å; F12-C96 HydrophobicContact CD2-CB 4.08Å; F12-C96 HydrophobicContact CE2-CB 4.43Å; F12-F167 HydrophobicContact CE1-CD1 4.48Å; F12-F167 HydrophobicContact CE1-CG 4.33Å; F12-F167 HydrophobicContact CZ-CD1 4.37Å; F12-F167 AromaticContact CZ-CD2 4Å; F12-F167 HydrophobicContact CZ-CD2 4Å; F12-F167 HydrophobicContact CZ-CE2 4.26Å; F12-F167 HydrophobicContact CZ-CG 4.06Å; F12-N171 CarbonylContact C-O 3.6Å; F12-N171 VanDerWaalsContact CA-O 3.24Å; F12-N171 WeakPolarHBondContact CA-O 3.37Å; F12-N171 HydrophobicContact CD1-CB 4.47Å; F12-I173 HydrophobicContact CB-CD1 3.68Å; F12-I173 HydrophobicContact CB-CG1 4.21Å; F12-I173 HydrophobicContact CD1-CD1 3.93Å; F12-I173 HydrophobicContact CD1-CG1 4.13Å; F12-I173 HydrophobicContact CD2-CD1 4.36Å; F12-I173 HydrophobicContact CG-CD1 3.75Å; F12-I173 HydrophobicContact CG-CG1 4.36Å; F12-L183 HydrophobicContact CE1-CD2 4.36Å; F12-L183 HydrophobicContact CE2-CD2 4.47Å; F12-L183 HydrophobicContact CZ-CD2 4.19Å; F12-L186 HydrophobicContact CD1-CD1 4.33Å; F12-L186 HydrophobicContact CE1-CD1 4.25Å
13I86.6Confident72.9Confident35 Ų3585 Ų8518%0.17947%0.473CS..EExtended strand (participates in β ladder)trans-114.1114.8175.7-58.8165.4000107.7Q88 I90 N171 I172 I173I13-Q88 HydrophobicContact CG2-CG 4.04Å; I13-I90 HydrophobicContact CG1-CG1 4.49Å; I13-N171 PolarHBondContact N-O 3.37Å; I13-I172 CarbonylContact O-C 3.58Å; I13-I172 WeakPolarHBondContact O-CA 3.47Å; I13-I173 PolarHBondContact O-N 3.4Å
14L87.2Confident75Confident6 Ų678.3 Ų78.33%0.03144%0.438CS..EExtended strand (participates in β ladder)trans-82.9122.2174.8-67.9159.1000109.2G16 N89 I91 I173 H175L14-G16 PolarHBondContact O-N 3.47Å; L14-N89 HydrophobicContact CB-CB 4.02Å; L14-N89 PolarHBondContact N-O 3.46Å; L14-I91 HydrophobicContact CD1-CB 4.37Å; L14-I91 HydrophobicContact CD1-CG2 3.94Å; L14-I91 HydrophobicContact CG-CG2 4.16Å; L14-I173 HydrophobicContact CD2-CB 3.98Å; L14-I173 HydrophobicContact CD2-CD1 4.29Å; L14-I173 HydrophobicContact CD2-CG2 3.85Å; L14-H175 WeakPolarHBondContact CD2-O 3.38Å
15L84.6Confident77.2Confident53 Ų5379.9 Ų79.928%0.27743%0.428SS..  trans-69.1-10.9175.4-79.6168.2000112.8Q19 I172 I173 N174L15-Q19 PolarHBondContact O-NE2 3.16Å; L15-I172 HydrophobicContact CD1-CG2 3.62Å; L15-I172 HydrophobicContact CD2-CG2 4.22Å; L15-I172 HydrophobicContact CG-CG2 3.63Å; L15-I173 PolarHBondContact N-O 3.39Å; L15-N174 HydrophobicContact CD1-CB 3.82Å; L15-N174 WeakPolarHBondContact CD1-OD1 3.31Å
16G83.1Confident79.5Confident2 Ų276 Ų762%0.02141%0.412CS..  trans70.8-167.1179.100000112.8L14 H175L14-G16 PolarHBondContact O-N 3.47Å; G16-H175 PolarHBondContact N-O 2.92Å
17L81.8Confident81.4Confident24 Ų2472.7 Ų72.713%0.12638%0.38CS..SBendtrans-82.1-40.6-173.4-177.965.2000112.8L27 F31 F85 Y176 K270 I274L17-L27 HydrophobicContact CD2-CD1 4.29Å; L17-F31 HydrophobicContact CD2-CD2 4.41Å; L17-F31 HydrophobicContact CD2-CE2 3.36Å; L17-F31 HydrophobicContact CD2-CZ 3.71Å; L17-F85 HydrophobicContact CB-CE1 3.93Å; L17-F85 HydrophobicContact CB-CZ 3.86Å; L17-F85 HydrophobicContact CD2-CE1 4.41Å; L17-F85 HydrophobicContact CD2-CZ 3.92Å; L17-Y176 HydrophobicContact CD1-CD1 4.17Å; L17-Y176 HydrophobicContact CD1-CE1 4.34Å; L17-K270 HydrophobicContact CD1-CB 3.98Å; L17-I274 HydrophobicContact CD1-CD1 3.4Å; L17-I274 VanDerWaalsContact CD1-CD1 3.4Å; L17-I274 HydrophobicContact CD1-CG1 4.36Å; L17-I274 HydrophobicContact CD2-CD1 3.75Å; L17-I274 HydrophobicContact CG-CD1 4.23Å
18T81.4Confident83.3Confident24 Ų2470 Ų7015%0.14736%0.356CS..  trans-142.7147.6178.2-172.80000111.5Q20 L23 Q24 L27 F85T18-Q20 PolarHBondContact OG1-N 2.96Å; T18-Q20 VanDerWaalsContact OG1-N 3.16Å; T18-L23 HydrophobicContact CG2-CB 4.09Å; T18-Q24 HydrophobicContact CG2-CG 4.14Å; T18-Q24 PolarHBondContact O-NE2 2.99Å; T18-L27 HydrophobicContact CG2-CD1 3.61Å; T18-F85 HydrophobicContact CG2-CE1 4.25Å
19Q79.9Confident84.7Confident125 Ų12571.7 Ų71.758%0.58435%0.351SS*.  trans-99.5-2.9172.7-67.4-64.8-40.600112.4L15 L21L15-Q19 PolarHBondContact O-NE2 3.16Å; Q19-L21 PolarHBondContact O-N 3.02Å
20Q83.7Confident85.7Confident122 Ų12275.2 Ų75.257%0.5737%0.369SS*.  trans-78.8109.9177.8-67.9179.9-16.700110.2T18 E22 L23 Q24T18-Q20 PolarHBondContact OG1-N 2.96Å; T18-Q20 VanDerWaalsContact OG1-N 3.16Å; Q20-E22 PolarHBondContact O-N 3.38Å; Q20-E22 VanDerWaalsContact O-N 3.16Å; Q20-L23 HydrophobicContact CB-CB 4.42Å; Q20-L23 HydrophobicContact CB-CD1 4.37Å; Q20-L23 HydrophobicContact CB-CG 4.46Å; Q20-L23 PolarHBondContact O-N 2.83Å; Q20-Q24 PolarHBondContact O-N 2.93Å
21L81.6Confident86.3Confident140 Ų14067.5 Ų67.573%0.73334%0.335SS*.Hα-helixtrans-52.6-38.8-176.9-125.480.5000112.9Q19 L23 Q24Q19-L21 PolarHBondContact O-N 3.02Å; L21-L23 VanDerWaalsContact C-N 3.27Å; L21-L23 PolarHBondContact O-N 2.81Å; L21-Q24 PolarHBondContact O-N 3.19Å
22E88.1Confident86.6Confident179 Ų17965.2 Ų65.284%0.83633%0.326SS*.Hα-helixtrans-64.7-29.2-178.7-61-178.417900113.1Q20 P26Q20-E22 PolarHBondContact O-N 3.38Å; Q20-E22 VanDerWaalsContact O-N 3.16Å; E22-P26 VanDerWaalsContact O-CD 3.27Å; E22-P26 WeakPolarHBondContact O-CD 3.48Å; E22-P26 WeakPolarHBondContact O-CG 3.49Å
23L85.5Confident86.8Confident77 Ų7766.9 Ų66.940%0.40334%0.343SS..Hα-helixtrans-92.7-17.2-179.5-69.4-179.6000113.3T18 Q20 L21 M25 P26 L27T18-L23 HydrophobicContact CG2-CB 4.09Å; Q20-L23 HydrophobicContact CB-CB 4.42Å; Q20-L23 HydrophobicContact CB-CD1 4.37Å; Q20-L23 HydrophobicContact CB-CG 4.46Å; Q20-L23 PolarHBondContact O-N 2.83Å; L21-L23 VanDerWaalsContact C-N 3.27Å; L21-L23 PolarHBondContact O-N 2.81Å; L23-M25 PolarHBondContact O-N 3.43Å; L23-P26 WeakPolarHBondContact O-CD 3.39Å; L23-L27 HydrophobicContact CB-CD1 4.07Å; L23-L27 VanDerWaalsContact O-CB 3.28Å; L23-L27 WeakPolarHBondContact O-CB 3.47Å; L23-L27 WeakPolarHBondContact O-CG 3.28Å; L23-L27 PolarHBondContact O-N 3.41Å
24Q85.9Confident87Confident34 Ų3466.8 Ų66.816%0.15934%0.343CS..Hα-helixtrans-60.9-49-175.3-74.2-179.9-24.600112.4T18 Q20 L21 L27 F28 F85T18-Q24 HydrophobicContact CG2-CG 4.14Å; T18-Q24 PolarHBondContact O-NE2 2.99Å; Q20-Q24 PolarHBondContact O-N 2.93Å; L21-Q24 PolarHBondContact O-N 3.19Å; Q24-L27 PolarHBondContact O-N 3.37Å; Q24-F28 WeakPolarHBondContact O-CB 3.39Å; Q24-F28 PolarHBondContact O-N 3.04Å; Q24-F85 HydrophobicContact CB-CB 4.38Å; Q24-F85 HydrophobicContact CB-CD1 4.3Å; Q24-F85 HydrophobicContact CG-CD1 4.28Å
25M88.6Confident87.2Confident98 Ų9869.1 Ų69.148%0.48335%0.352SS..Hα-helixtrans-67.8-46.3-179.5-69.7-58.4-61.200113.2L23 L27 F28 F29L23-M25 PolarHBondContact O-N 3.43Å; M25-L27 PolarHBondContact O-N 3.08Å; M25-F28 WeakPolarHBondContact O-CB 3.44Å; M25-F28 PolarHBondContact O-N 3.17Å; M25-F29 HydrophobicContact CE-CE2 3.67Å; M25-F29 HydrophobicContact CE-CZ 4.01Å; M25-F29 WeakPolarHBondContact O-CD2 3.33Å; M25-F29 PolarHBondContact O-N 3.29Å
26P89.9Confident87.5Confident76 Ų7670.2 Ų70.249%0.49436%0.36SS..Hα-helixtrans-56.1-46172.7-27.534.5000113.3E22 L23 F29 L30E22-P26 VanDerWaalsContact O-CD 3.27Å; E22-P26 WeakPolarHBondContact O-CD 3.48Å; E22-P26 WeakPolarHBondContact O-CG 3.49Å; L23-P26 WeakPolarHBondContact O-CD 3.39Å; P26-F29 PolarHBondContact O-N 3.23Å; P26-L30 WeakPolarHBondContact O-CB 3.42Å; P26-L30 PolarHBondContact O-N 3.23Å
27L88.3Confident87.9Confident35 Ų3572.8 Ų72.818%0.18338%0.376CS..Hα-helixtrans-67.6-36.5179.4-68.4173.1000111.9L17 T18 L23 Q24 M25 F29 L30 F31 F85L17-L27 HydrophobicContact CD2-CD1 4.29Å; T18-L27 HydrophobicContact CG2-CD1 3.61Å; L23-L27 HydrophobicContact CB-CD1 4.07Å; L23-L27 VanDerWaalsContact O-CB 3.28Å; L23-L27 WeakPolarHBondContact O-CB 3.47Å; L23-L27 WeakPolarHBondContact O-CG 3.28Å; L23-L27 PolarHBondContact O-N 3.41Å; Q24-L27 PolarHBondContact O-N 3.37Å; M25-L27 PolarHBondContact O-N 3.08Å; L27-F29 PolarHBondContact O-N 3.15Å; L27-L30 HydrophobicContact CD2-CD2 4.18Å; L27-L30 PolarHBondContact O-N 3Å; L27-F31 HydrophobicContact CB-CD2 4.22Å; L27-F31 HydrophobicContact CB-CE2 4.28Å; L27-F31 HydrophobicContact CD2-CE2 4.11Å; L27-F31 WeakPolarHBondContact O-CB 3.41Å; L27-F31 WeakPolarHBondContact O-CD2 3.44Å; L27-F31 PolarHBondContact O-N 3.46Å; L27-F85 HydrophobicContact CB-CD1 4.39Å; L27-F85 HydrophobicContact CB-CE1 3.81Å; L27-F85 HydrophobicContact CB-CE2 4.38Å; L27-F85 HydrophobicContact CB-CZ 3.81Å; L27-F85 HydrophobicContact CD1-CE1 4.1Å
28F90.3Very high88.3Confident42 Ų4271.7 Ų71.718%0.18437%0.37CS..Hα-helixtrans-55.8-52174177.5-91.1000111.4Q24 M25 L30 F31 L32 L82 F85 V86Q24-F28 WeakPolarHBondContact O-CB 3.39Å; Q24-F28 PolarHBondContact O-N 3.04Å; M25-F28 WeakPolarHBondContact O-CB 3.44Å; M25-F28 PolarHBondContact O-N 3.17Å; F28-L30 PolarHBondContact O-N 2.71Å; F28-F31 PolarHBondContact O-N 2.94Å; F28-L32 HydrophobicContact CE1-CD2 4.02Å; F28-L32 HydrophobicContact CZ-CD2 4.49Å; F28-L32 WeakPolarHBondContact O-CB 3.24Å; F28-L32 PolarHBondContact O-N 3.32Å; F28-L82 HydrophobicContact CD2-CB 4.22Å; F28-L82 HydrophobicContact CD2-CD2 3.8Å; F28-L82 HydrophobicContact CE2-CB 3.97Å; F28-L82 HydrophobicContact CE2-CD2 4.09Å; F28-L82 HydrophobicContact CG-CD2 4.34Å; F28-L82 WeakPolarHBondContact O-CD2 3.25Å; F28-F85 HydrophobicContact CB-CB 3.95Å; F28-F85 HydrophobicContact CB-CD2 4.1Å; F28-F85 HydrophobicContact CB-CG 4.25Å; F28-F85 HydrophobicContact CD2-CB 4.11Å; F28-F85 HydrophobicContact CD2-CD2 4.33Å; F28-V86 HydrophobicContact CD2-CG2 3.72Å; F28-V86 HydrophobicContact CE2-CG2 3.55Å; F28-V86 HydrophobicContact CZ-CG2 4.29Å
29F92.1Very high88.8Confident129 Ų12972.1 Ų72.157%0.56637%0.372SS*.Hα-helixtrans-66.1-37.6179.4-70.8-64.6000112.5M25 P26 L27 G33M25-F29 HydrophobicContact CE-CE2 3.67Å; M25-F29 HydrophobicContact CE-CZ 4.01Å; M25-F29 WeakPolarHBondContact O-CD2 3.33Å; M25-F29 PolarHBondContact O-N 3.29Å; P26-F29 PolarHBondContact O-N 3.23Å; L27-F29 PolarHBondContact O-N 3.15Å; F29-G33 PolarHBondContact O-N 2.88Å
30L91Very high89.4Confident98 Ų9870.7 Ų70.751%0.51337%0.372SS..Hα-helixtrans-59.7-54.1175.7177.765.5000111.4P26 L27 F28 L32 G33 I34P26-L30 WeakPolarHBondContact O-CB 3.42Å; P26-L30 PolarHBondContact O-N 3.23Å; L27-L30 HydrophobicContact CD2-CD2 4.18Å; L27-L30 PolarHBondContact O-N 3Å; F28-L30 PolarHBondContact O-N 2.71Å; L30-L32 VanDerWaalsContact C-N 3.34Å; L30-L32 PolarHBondContact O-N 3.03Å; L30-G33 PolarHBondContact O-N 2.85Å; L30-I34 HydrophobicContact CD1-CD1 4.34Å; L30-I34 HydrophobicContact CG-CD1 4.14Å; L30-I34 WeakPolarHBondContact O-CG1 3.35Å; L30-I34 PolarHBondContact O-N 3.01Å
31F90.2Very high89.7Confident9 Ų965.8 Ų65.84%0.03936%0.355CS..Hα-helixtrans-71.3-29.1-178.2-74.4-65000113.1L17 L27 F28 I34 Y35 M81 L82 F85 I274 I278L17-F31 HydrophobicContact CD2-CD2 4.41Å; L17-F31 HydrophobicContact CD2-CE2 3.36Å; L17-F31 HydrophobicContact CD2-CZ 3.71Å; L27-F31 HydrophobicContact CB-CD2 4.22Å; L27-F31 HydrophobicContact CB-CE2 4.28Å; L27-F31 HydrophobicContact CD2-CE2 4.11Å; L27-F31 WeakPolarHBondContact O-CB 3.41Å; L27-F31 WeakPolarHBondContact O-CD2 3.44Å; L27-F31 PolarHBondContact O-N 3.46Å; F28-F31 PolarHBondContact O-N 2.94Å; F31-I34 HydrophobicContact CD1-CD1 3.93Å; F31-I34 HydrophobicContact CE1-CD1 4.28Å; F31-I34 PolarHBondContact O-N 3.47Å; F31-Y35 WeakPolarHBondContact O-CB 2.93Å; F31-Y35 PolarHBondContact O-N 3.15Å; F31-M81 HydrophobicContact CB-CE 3.58Å; F31-M81 HydrophobicContact CD1-CE 3.37Å; F31-M81 HydrophobicContact CD1-SD 4.49Å; F31-M81 HydrophobicContact CD2-CE 3.73Å; F31-M81 HydrophobicContact CD2-SD 4.39Å; F31-M81 HydrophobicContact CE1-CE 3.89Å; F31-M81 HydrophobicContact CE1-SD 4.48Å; F31-M81 HydrophobicContact CE2-CE 4.24Å; F31-M81 HydrophobicContact CE2-SD 4.44Å; F31-M81 HydrophobicContact CG-CE 3.27Å; F31-M81 HydrophobicContact CG-SD 4.43Å; F31-M81 HydrophobicContact CZ-CE 4.3Å; F31-M81 HydrophobicContact CZ-SD 4.46Å; F31-L82 HydrophobicContact CB-CD2 3.86Å; F31-F85 AromaticContact CD2-CE2 3.78Å; F31-F85 HydrophobicContact CD2-CE2 3.78Å; F31-F85 AromaticContact CD2-CZ 3.84Å; F31-F85 HydrophobicContact CD2-CZ 3.84Å; F31-F85 HydrophobicContact CE2-CE2 4.47Å; F31-F85 HydrophobicContact CE2-CZ 4.09Å; F31-I274 HydrophobicContact CE1-CG2 3.85Å; F31-I274 HydrophobicContact CZ-CD1 3.95Å; F31-I274 HydrophobicContact CZ-CG1 4.35Å; F31-I274 HydrophobicContact CZ-CG2 4.15Å; F31-I278 HydrophobicContact CD1-CD1 4.23Å; F31-I278 HydrophobicContact CD1-CG2 4.14Å; F31-I278 HydrophobicContact CE1-CD1 4.02Å; F31-I278 HydrophobicContact CE1-CG2 4.21Å
32L92.6Very high90.2Very high61 Ų6159.1 Ų59.132%0.31932%0.32SS..Hα-helixtrans-64-44.1170.4179.363.6000110.8F28 L30 Y35 V36 L82F28-L32 HydrophobicContact CE1-CD2 4.02Å; F28-L32 HydrophobicContact CZ-CD2 4.49Å; F28-L32 WeakPolarHBondContact O-CB 3.24Å; F28-L32 PolarHBondContact O-N 3.32Å; L30-L32 VanDerWaalsContact C-N 3.34Å; L30-L32 PolarHBondContact O-N 3.03Å; L32-Y35 WeakPolarHBondContact O-CB 3.42Å; L32-Y35 PolarHBondContact O-N 3.38Å; L32-V36 WeakPolarHBondContact O-CG2 3.18Å; L32-V36 PolarHBondContact O-N 3.24Å; L32-L82 HydrophobicContact CB-CD1 4.36Å; L32-L82 HydrophobicContact CB-CD2 4.26Å; L32-L82 HydrophobicContact CD1-CD1 4.02Å
33G91Very high90.5Very high35 Ų3554.3 Ų54.336%0.36130%0.299SS..Hα-helixtrans-59.1-47.3174.100000111.9F29 L30 Y35 V36 V37F29-G33 PolarHBondContact O-N 2.88Å; L30-G33 PolarHBondContact O-N 2.85Å; G33-Y35 VanDerWaalsContact C-N 3.33Å; G33-Y35 PolarHBondContact O-N 2.81Å; G33-V36 PolarHBondContact O-N 3.13Å; G33-V37 WeakPolarHBondContact O-CB 3.43Å; G33-V37 VanDerWaalsContact O-CG2 3.3Å; G33-V37 WeakPolarHBondContact O-CG2 3.39Å; G33-V37 PolarHBondContact O-N 3.27Å
34I89.8Confident90.7Very high33 Ų3352 Ų5217%0.16929%0.293CS..Hα-helixtrans-59.4-44.2176.7-66.5166.4000111.2L30 F31 V37 S38 I278 M282L30-I34 HydrophobicContact CD1-CD1 4.34Å; L30-I34 HydrophobicContact CG-CD1 4.14Å; L30-I34 WeakPolarHBondContact O-CG1 3.35Å; L30-I34 PolarHBondContact O-N 3.01Å; F31-I34 HydrophobicContact CD1-CD1 3.93Å; F31-I34 HydrophobicContact CE1-CD1 4.28Å; F31-I34 PolarHBondContact O-N 3.47Å; I34-V37 PolarHBondContact O-N 2.88Å; I34-S38 WeakPolarHBondContact O-CB 3.13Å; I34-S38 PolarHBondContact O-N 3.36Å; I34-I278 HydrophobicContact CG2-CG2 3.51Å; I34-M282 HydrophobicContact CG2-CB 3.97Å; I34-M282 HydrophobicContact CG2-CG 3.95Å
35Y91.3Very high91Very high55 Ų5550.4 Ų50.422%0.21629%0.286CS..Hα-helixtrans-58.9-50.6177177.7-114.7000112.1F31 L32 G33 V37 S38 V39 T78 P79F31-Y35 WeakPolarHBondContact O-CB 2.93Å; F31-Y35 PolarHBondContact O-N 3.15Å; L32-Y35 WeakPolarHBondContact O-CB 3.42Å; L32-Y35 PolarHBondContact O-N 3.38Å; G33-Y35 VanDerWaalsContact C-N 3.33Å; G33-Y35 PolarHBondContact O-N 2.81Å; Y35-V37 VanDerWaalsContact C-N 3.31Å; Y35-V37 PolarHBondContact O-N 2.94Å; Y35-S38 PolarHBondContact O-N 3.49Å; Y35-V39 HydrophobicContact CD2-CG2 3.98Å; Y35-V39 HydrophobicContact CE1-CG2 4.17Å; Y35-V39 HydrophobicContact CE2-CG2 3.55Å; Y35-V39 HydrophobicContact CG-CG2 4.45Å; Y35-V39 WeakPolarHBondContact O-CB 3.5Å; Y35-V39 WeakPolarHBondContact O-CG2 3.13Å; Y35-V39 PolarHBondContact O-N 3.14Å; Y35-T78 HydrophobicContact CD2-CG2 4.1Å; Y35-T78 HydrophobicContact CG-CG2 4.16Å; Y35-P79 HydrophobicContact CE2-CG 4.1Å
36V92.5Very high91.2Very high76 Ų7646.8 Ų46.846%0.46127%0.269SS..Hα-helixtrans-60.1-44.5179.4171.70000110.5L32 G33 V39 V40L32-V36 WeakPolarHBondContact O-CG2 3.18Å; L32-V36 PolarHBondContact O-N 3.24Å; G33-V36 PolarHBondContact O-N 3.13Å; V36-V39 PolarHBondContact O-N 3.09Å; V36-V40 HydrophobicContact CG1-CG2 4.18Å; V36-V40 VanDerWaalsContact O-CB 3.31Å; V36-V40 WeakPolarHBondContact O-CB 3.43Å; V36-V40 VanDerWaalsContact O-CG2 3.23Å; V36-V40 WeakPolarHBondContact O-CG2 3.34Å; V36-V40 PolarHBondContact O-N 2.97Å
37V90.2Very high91.2Very high56 Ų5647.1 Ų47.134%0.33927%0.265SS..Hα-helixtrans-62.4-44.9177.9170.80000111.5G33 I34 Y35 G41 M282 F286G33-V37 WeakPolarHBondContact O-CB 3.43Å; G33-V37 VanDerWaalsContact O-CG2 3.3Å; G33-V37 WeakPolarHBondContact O-CG2 3.39Å; G33-V37 PolarHBondContact O-N 3.27Å; I34-V37 PolarHBondContact O-N 2.88Å; Y35-V37 VanDerWaalsContact C-N 3.31Å; Y35-V37 PolarHBondContact O-N 2.94Å; V37-G41 WeakPolarHBondContact O-CA 3.25Å; V37-G41 PolarHBondContact O-N 3.41Å; V37-M282 HydrophobicContact CB-CG 4.45Å; V37-M282 HydrophobicContact CG1-CE 4.05Å; V37-M282 HydrophobicContact CG1-CG 3.98Å; V37-F286 HydrophobicContact CG1-CE2 3.46Å; V37-F286 VanDerWaalsContact CG1-CE2 3.46Å; V37-F286 HydrophobicContact CG1-CZ 3.53Å
38S90.1Very high91.3Very high2 Ų246.1 Ų46.11%0.01426%0.26CS..Hα-helixtrans-60.7-49.5177.5-178.80000111.4I34 Y35 G41 N42 S74I34-S38 WeakPolarHBondContact O-CB 3.13Å; I34-S38 PolarHBondContact O-N 3.36Å; Y35-S38 PolarHBondContact O-N 3.49Å; S38-G41 PolarHBondContact O-N 3.04Å; S38-N42 VanDerWaalsContact O-CB 3.32Å; S38-N42 WeakPolarHBondContact O-CB 3.45Å; S38-N42 PolarHBondContact O-N 2.67Å; S38-N42 PolarHBondContact O-ND2 2.91Å; S38-N42 PolarHBondContact OG-ND2 3.36Å; S38-S74 PolarHBondContact OG-OG 3.36Å
39V92.4Very high91.2Very high32 Ų3244.6 Ų44.619%0.19425%0.254CS..Hα-helixtrans-62.1-51.3-179.5168.70000111.1Y35 V36 L43 L71Y35-V39 HydrophobicContact CD2-CG2 3.98Å; Y35-V39 HydrophobicContact CE1-CG2 4.17Å; Y35-V39 HydrophobicContact CE2-CG2 3.55Å; Y35-V39 HydrophobicContact CG-CG2 4.45Å; Y35-V39 WeakPolarHBondContact O-CB 3.5Å; Y35-V39 WeakPolarHBondContact O-CG2 3.13Å; Y35-V39 PolarHBondContact O-N 3.14Å; V36-V39 PolarHBondContact O-N 3.09Å; V39-L43 WeakPolarHBondContact O-CB 3.45Å; V39-L43 PolarHBondContact O-N 3.15Å; V39-L71 HydrophobicContact CB-CD1 4.05Å; V39-L71 HydrophobicContact CG1-CD1 3.85Å; V39-L71 HydrophobicContact CG2-CD1 3.93Å
40V91.7Very high91.2Very high95 Ų9542.5 Ų42.558%0.57625%0.251SS*.Hα-helixtrans-65.7-41.6-178.3173.10000111V36 G44V36-V40 HydrophobicContact CG1-CG2 4.18Å; V36-V40 VanDerWaalsContact O-CB 3.31Å; V36-V40 WeakPolarHBondContact O-CB 3.43Å; V36-V40 VanDerWaalsContact O-CG2 3.23Å; V36-V40 WeakPolarHBondContact O-CG2 3.34Å; V36-V40 PolarHBondContact O-N 2.97Å; V40-G44 WeakPolarHBondContact O-CA 3.23Å; V40-G44 PolarHBondContact O-N 3.4Å
41G90.4Very high91.1Very high20 Ų2042 Ų4221%0.20625%0.249CC..Hα-helixtrans-63.4-51179.300000112.4V37 S38 G44 L45V37-G41 WeakPolarHBondContact O-CA 3.25Å; V37-G41 PolarHBondContact O-N 3.41Å; S38-G41 PolarHBondContact O-N 3.04Å; G41-G44 PolarHBondContact O-N 2.9Å; G41-L45 PolarHBondContact O-N 3.2Å
42N93Very high91Very high0 Ų041.7 Ų41.70%025%0.248CC..Hα-helixtrans-69.4-42.8-178.9-77.3-61000112.2S38 G44 L45 I46 S67 L71 P281 P285S38-N42 VanDerWaalsContact O-CB 3.32Å; S38-N42 WeakPolarHBondContact O-CB 3.45Å; S38-N42 PolarHBondContact O-N 2.67Å; S38-N42 PolarHBondContact O-ND2 2.91Å; S38-N42 PolarHBondContact OG-ND2 3.36Å; N42-G44 VanDerWaalsContact C-N 3.35Å; N42-G44 PolarHBondContact O-N 3.4Å; N42-L45 PolarHBondContact O-N 2.87Å; N42-I46 VanDerWaalsContact O-CG1 3.3Å; N42-I46 WeakPolarHBondContact O-CG1 3.46Å; N42-I46 PolarHBondContact O-N 3.07Å; N42-S67 WeakPolarHBondContact OD1-CA 3.3Å; N42-S67 WeakPolarHBondContact OD1-CB 3.47Å; N42-S67 PolarHBondContact OD1-OG 2.83Å; N42-L71 HydrophobicContact CB-CB 4.41Å; N42-P281 PolarHBondContact ND2-O 3.47Å; N42-P281 VanDerWaalsContact ND2-O 3.11Å; N42-P285 HydrophobicContact CB-CG 4.4Å; N42-P285 WeakPolarHBondContact OD1-CG 3.33Å
43L93.4Very high90.6Very high78 Ų7843 Ų4341%0.40826%0.26SS..Hα-helixtrans-63.8-41.4174.8-176.561000111.7V39 L45 I46 I47V39-L43 WeakPolarHBondContact O-CB 3.45Å; V39-L43 PolarHBondContact O-N 3.15Å; L43-L45 VanDerWaalsContact C-N 3.32Å; L43-L45 PolarHBondContact O-N 2.88Å; L43-I46 WeakPolarHBondContact O-CB 3.5Å; L43-I46 PolarHBondContact O-N 3.43Å; L43-I47 HydrophobicContact CD1-CD1 4.24Å; L43-I47 HydrophobicContact CD1-CG1 4.44Å; L43-I47 HydrophobicContact CG-CD1 3.93Å; L43-I47 VanDerWaalsContact O-CG1 3.28Å; L43-I47 WeakPolarHBondContact O-CG1 3.37Å; L43-I47 PolarHBondContact O-N 2.85Å
44G90.9Very high90.3Very high27 Ų2747.4 Ų47.428%0.27827%0.271SS..Hα-helixtrans-59-42.9174.800000112.1V40 G41 N42 I47 L48V40-G44 WeakPolarHBondContact O-CA 3.23Å; V40-G44 PolarHBondContact O-N 3.4Å; G41-G44 PolarHBondContact O-N 2.9Å; N42-G44 VanDerWaalsContact C-N 3.35Å; N42-G44 PolarHBondContact O-N 3.4Å; G44-I47 PolarHBondContact O-N 3.31Å; G44-L48 WeakPolarHBondContact O-CB 3.35Å; G44-L48 VanDerWaalsContact O-CG 3.22Å; G44-L48 WeakPolarHBondContact O-CG 3.3Å; G44-L48 PolarHBondContact O-N 2.78Å
45L90.8Very high90Very high2 Ų246 Ų461%0.0126%0.263CS..Hα-helixtrans-65.7-43.5178.1-168.156.7000112.2G41 N42 L43 I47 L48 I49 L63 S67 V295G41-L45 PolarHBondContact O-N 3.2Å; N42-L45 PolarHBondContact O-N 2.87Å; L43-L45 VanDerWaalsContact C-N 3.32Å; L43-L45 PolarHBondContact O-N 2.88Å; L45-I47 PolarHBondContact O-N 3.07Å; L45-L48 PolarHBondContact O-N 3.42Å; L45-I49 HydrophobicContact CD1-CD1 4.39Å; L45-I49 HydrophobicContact CG-CD1 4.06Å; L45-I49 WeakPolarHBondContact O-CD1 3.36Å; L45-I49 VanDerWaalsContact O-CG1 3.27Å; L45-I49 WeakPolarHBondContact O-CG1 3.48Å; L45-I49 PolarHBondContact O-N 3.38Å; L45-L63 HydrophobicContact CD1-CD2 4.19Å; L45-L63 HydrophobicContact CD2-CD1 3.82Å; L45-L63 HydrophobicContact CD2-CD2 3.72Å; L45-L63 HydrophobicContact CD2-CG 3.62Å; L45-L63 HydrophobicContact CG-CD2 4.23Å; L45-L63 HydrophobicContact CG-CG 4.31Å; L45-S67 VanDerWaalsContact CD2-OG 3.31Å; L45-S67 WeakPolarHBondContact CD2-OG 3.39Å; L45-V295 HydrophobicContact CD1-CG1 4.39Å
46I93Very high89.9Confident22 Ų2249.1 Ų49.111%0.11328%0.28CS..Hα-helixtrans-54.9-52.4172.8-72.3168.7000110.4N42 L43 L48 I49 V50 F64 F68N42-I46 VanDerWaalsContact O-CG1 3.3Å; N42-I46 WeakPolarHBondContact O-CG1 3.46Å; N42-I46 PolarHBondContact O-N 3.07Å; L43-I46 WeakPolarHBondContact O-CB 3.5Å; L43-I46 PolarHBondContact O-N 3.43Å; I46-L48 VanDerWaalsContact C-N 3.34Å; I46-L48 PolarHBondContact O-N 3.38Å; I46-I49 PolarHBondContact O-N 3.4Å; I46-V50 WeakPolarHBondContact O-CG2 3.28Å; I46-V50 PolarHBondContact O-N 3.47Å; I46-F64 HydrophobicContact CB-CD2 4.43Å; I46-F64 HydrophobicContact CB-CE2 4.44Å; I46-F64 HydrophobicContact CG1-CD2 4.32Å; I46-F64 HydrophobicContact CG1-CE2 4.49Å; I46-F64 HydrophobicContact CG2-CD2 4.11Å; I46-F64 HydrophobicContact CG2-CE2 3.64Å; I46-F64 HydrophobicContact CG2-CZ 4.46Å; I46-F68 HydrophobicContact CD1-CB 4.29Å
47I90.9Very high89.7Confident82 Ų8248.1 Ų48.142%0.42127%0.274SS..Hα-helixtrans-60.6-44.4-179.8-69.4167.6000110.7L43 G44 L45 I49 V50 L51L43-I47 HydrophobicContact CD1-CD1 4.24Å; L43-I47 HydrophobicContact CD1-CG1 4.44Å; L43-I47 HydrophobicContact CG-CD1 3.93Å; L43-I47 VanDerWaalsContact O-CG1 3.28Å; L43-I47 WeakPolarHBondContact O-CG1 3.37Å; L43-I47 PolarHBondContact O-N 2.85Å; G44-I47 PolarHBondContact O-N 3.31Å; L45-I47 PolarHBondContact O-N 3.07Å; I47-I49 VanDerWaalsContact C-N 3.35Å; I47-I49 PolarHBondContact O-N 3.16Å; I47-V50 PolarHBondContact O-N 3.05Å; I47-L51 HydrophobicContact CG2-CD1 3.53Å; I47-L51 HydrophobicContact CG2-CG 4.09Å; I47-L51 WeakPolarHBondContact O-CB 3.22Å; I47-L51 VanDerWaalsContact O-CG 3.28Å; I47-L51 WeakPolarHBondContact O-CG 3.43Å; I47-L51 PolarHBondContact O-N 3.02Å
48L89Confident89.8Confident15 Ų1546.6 Ų46.68%0.07927%0.265CS..Hα-helixtrans-60.3-44.4179.1-76.4167.7000112.2G44 L45 I46 N52 V295 A298 L299G44-L48 WeakPolarHBondContact O-CB 3.35Å; G44-L48 VanDerWaalsContact O-CG 3.22Å; G44-L48 WeakPolarHBondContact O-CG 3.3Å; G44-L48 PolarHBondContact O-N 2.78Å; L45-L48 PolarHBondContact O-N 3.42Å; I46-L48 VanDerWaalsContact C-N 3.34Å; I46-L48 PolarHBondContact O-N 3.38Å; L48-N52 WeakPolarHBondContact O-CB 3.38Å; L48-N52 PolarHBondContact O-N 3.07Å; L48-N52 PolarHBondContact O-ND2 3.29Å; L48-V295 HydrophobicContact CD1-CG1 4.21Å; L48-A298 HydrophobicContact CD2-CB 4.41Å; L48-L299 HydrophobicContact CD1-CD1 4.29Å; L48-L299 HydrophobicContact CD1-CD2 3.73Å; L48-L299 HydrophobicContact CD1-CG 3.64Å; L48-L299 HydrophobicContact CD2-CB 4.49Å; L48-L299 HydrophobicContact CD2-CD2 4.02Å; L48-L299 HydrophobicContact CD2-CG 3.96Å; L48-L299 HydrophobicContact CG-CD2 4.42Å; L48-L299 HydrophobicContact CG-CG 4.46Å
49I90.1Very high89.8Confident9 Ų946.8 Ų46.85%0.04627%0.266CS..Hα-helixtrans-63-47178.8-67.3163.2000109.8L45 I46 I47 L51 N52 L55 H56 Y60 L63 F64L45-I49 HydrophobicContact CD1-CD1 4.39Å; L45-I49 HydrophobicContact CG-CD1 4.06Å; L45-I49 WeakPolarHBondContact O-CD1 3.36Å; L45-I49 VanDerWaalsContact O-CG1 3.27Å; L45-I49 WeakPolarHBondContact O-CG1 3.48Å; L45-I49 PolarHBondContact O-N 3.38Å; I46-I49 PolarHBondContact O-N 3.4Å; I47-I49 VanDerWaalsContact C-N 3.35Å; I47-I49 PolarHBondContact O-N 3.16Å; I49-L51 PolarHBondContact O-N 3.45Å; I49-N52 PolarHBondContact O-N 2.92Å; I49-L55 HydrophobicContact CG1-CD1 4.33Å; I49-H56 PolarHBondContact O-CD2 2.96Å; I49-H56 PolarHBondContact O-NE2 3.04Å; I49-H56 VanDerWaalsContact O-NE2 3.15Å; I49-Y60 HydrophobicContact CG1-CD1 4.43Å; I49-L63 HydrophobicContact CD1-CB 4.4Å; I49-L63 HydrophobicContact CD1-CD2 4.44Å; I49-L63 HydrophobicContact CD1-CG 4.36Å; I49-F64 HydrophobicContact CD1-CB 4.03Å; I49-F64 HydrophobicContact CG2-CB 4.36Å; I49-F64 HydrophobicContact CG2-CD2 4.5Å
50V91.3Very high89.7Confident85 Ų8545.7 Ų45.752%0.51526%0.258SS..Hα-helixtrans-64.3-40-179.1171.70000112.6I46 I47 F64I46-V50 WeakPolarHBondContact O-CG2 3.28Å; I46-V50 PolarHBondContact O-N 3.47Å; I47-V50 PolarHBondContact O-N 3.05Å; V50-F64 HydrophobicContact CG2-CD2 4.31Å; V50-F64 HydrophobicContact CG2-CE2 3.79Å
51L89.1Confident89.8Confident87 Ų8744.3 Ų44.346%0.45524%0.243SC..Hα-helixtrans-80.8-14.3-175.7-67.6-179.1000114.2I47 I49 P53 T302I47-L51 HydrophobicContact CG2-CD1 3.53Å; I47-L51 HydrophobicContact CG2-CG 4.09Å; I47-L51 WeakPolarHBondContact O-CB 3.22Å; I47-L51 VanDerWaalsContact O-CG 3.28Å; I47-L51 WeakPolarHBondContact O-CG 3.43Å; I47-L51 PolarHBondContact O-N 3.02Å; I49-L51 PolarHBondContact O-N 3.45Å; L51-P53 WeakPolarHBondContact O-CD 3.47Å; L51-T302 HydrophobicContact CD1-CG2 3.83Å
52N87.2Confident90Very high4 Ų443.4 Ų43.42%0.02123%0.234CC..  trans-121.598.7-173.2-67.9-83.8000111.4L48 I49 H54 L55 A298 T302L48-N52 WeakPolarHBondContact O-CB 3.38Å; L48-N52 PolarHBondContact O-N 3.07Å; L48-N52 PolarHBondContact O-ND2 3.29Å; I49-N52 PolarHBondContact O-N 2.92Å; N52-H54 PolarHBondContact O-N 2.72Å; N52-L55 HydrophobicContact CB-CD1 4.12Å; N52-L55 HydrophobicContact CB-CG 4.12Å; N52-L55 WeakPolarHBondContact O-CB 3.44Å; N52-L55 PolarHBondContact O-N 3.02Å; N52-A298 HydrophobicContact CB-CB 4.17Å; N52-T302 PolarHBondContact ND2-OG1 3.48Å
53P85.4Confident90Very high89 Ų8943.5 Ų43.558%0.57823%0.234SC*.G310 helixtrans-56.9-25.2179.3-27.834.7000115L51 L55 H56L51-P53 WeakPolarHBondContact O-CD 3.47Å; P53-L55 PolarHBondContact O-N 2.9Å; P53-H56 WeakPolarHBondContact O-CB 3.25Å; P53-H56 PolarHBondContact O-N 3.37Å
54H83.7Confident90Very high127 Ų12742.8 Ų42.859%0.58823%0.228SC*.G310 helixtrans-63.9-24.1174.8-178.5-79.9000112.6N52 H56N52-H54 PolarHBondContact O-N 2.72Å; H54-H56 VanDerWaalsContact C-N 3.31Å
55L84.7Confident90.3Very high2 Ų242 Ų421%0.0122%0.218CC..G310 helixtrans-85.81.4174.5-60.8-179000112.3I49 N52 P53 T57 Y60 D294 A298I49-L55 HydrophobicContact CG1-CD1 4.33Å; N52-L55 HydrophobicContact CB-CD1 4.12Å; N52-L55 HydrophobicContact CB-CG 4.12Å; N52-L55 WeakPolarHBondContact O-CB 3.44Å; N52-L55 PolarHBondContact O-N 3.02Å; P53-L55 PolarHBondContact O-N 2.9Å; L55-T57 PolarHBondContact O-N 3.31Å; L55-Y60 HydrophobicContact CB-CD2 4.05Å; L55-Y60 HydrophobicContact CB-CG 4.13Å; L55-Y60 HydrophobicContact CD2-CD1 4.37Å; L55-Y60 HydrophobicContact CD2-CD2 4.01Å; L55-Y60 HydrophobicContact CD2-CE1 4Å; L55-Y60 HydrophobicContact CD2-CE2 3.62Å; L55-Y60 HydrophobicContact CD2-CG 4.41Å; L55-Y60 WeakPolarHBondContact O-CB 3.27Å; L55-Y60 VanDerWaalsContact O-CD2 3.24Å; L55-Y60 WeakPolarHBondContact O-CD2 3.47Å; L55-D294 HydrophobicContact CD2-CB 3.82Å; L55-A298 HydrophobicContact CD1-CB 3.63Å; L55-A298 HydrophobicContact CG-CB 4.24Å
56H87.8Confident90.4Very high121 Ų12142 Ų4256%0.5622%0.217SC*.  trans-79.158.9-179.7-64.3-178000112.2I49 P53 H54I49-H56 PolarHBondContact O-CD2 2.96Å; I49-H56 PolarHBondContact O-NE2 3.04Å; I49-H56 VanDerWaalsContact O-NE2 3.15Å; P53-H56 WeakPolarHBondContact O-CB 3.25Å; P53-H56 PolarHBondContact O-N 3.37Å; H54-H56 VanDerWaalsContact C-N 3.31Å
57T89.4Confident90.5Very high55 Ų5541 Ų4134%0.33721%0.212SC..SBendtrans-106.6159.9172.974.40000110.5L55 M59 Y60 Y61L55-T57 PolarHBondContact O-N 3.31Å; T57-M59 VanDerWaalsContact C-N 3.3Å; T57-M59 PolarHBondContact O-N 3.37Å; T57-Y60 HydrophobicContact CG2-CD2 4.44Å; T57-Y60 PolarHBondContact O-N 2.95Å; T57-Y60 VanDerWaalsContact O-N 3.13Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.46Å; T57-Y61 PolarHBondContact O-N 2.9Å
58P90.9Very high90.6Very high25 Ų2541.6 Ų41.616%0.16221%0.212CC..Hα-helixtrans-50.1-45177.8-33.239.6000114.3Y60 Y61 F62 D120 Y131 M135P58-Y60 PolarHBondContact O-N 3.3Å; P58-Y61 WeakPolarHBondContact O-CB 3.46Å; P58-Y61 PolarHBondContact O-N 3.3Å; P58-F62 WeakPolarHBondContact O-CD2 3.17Å; P58-F62 PolarHBondContact O-N 3.39Å; P58-D120 WeakPolarHBondContact CB-OD1 3.41Å; P58-Y131 WeakPolarHBondContact CG-OH 3.44Å; P58-M135 HydrophobicContact CB-CB 4.24Å; P58-M135 HydrophobicContact CG-CB 4.01Å; P58-M135 WeakPolarHBondContact CG-O 3.46Å
59M91Very high90.9Very high5 Ų540.9 Ų40.93%0.02521%0.208CC..Hα-helixtrans-56.9-49.4176.7-178.473.2179.400112.7T57 Y61 F62 L63 M117 D120 R121 Y288T57-M59 VanDerWaalsContact C-N 3.3Å; T57-M59 PolarHBondContact O-N 3.37Å; M59-Y61 VanDerWaalsContact C-N 3.29Å; M59-Y61 PolarHBondContact O-N 2.85Å; M59-F62 PolarHBondContact O-N 3.49Å; M59-L63 PolarHBondContact O-N 3.27Å; M59-M117 HydrophobicContact CE-CB 4.42Å; M59-M117 HydrophobicContact CE-CE 3.27Å; M59-M117 HydrophobicContact SD-CB 4.17Å; M59-M117 HydrophobicContact SD-CE 4.04Å; M59-M117 HydrophobicContact SD-CG 4.26Å; M59-D120 WeakPolarHBondContact CB-OD2 3.21Å; M59-R121 VanDerWaalsContact CG-NH2 3.33Å; M59-R121 HydrophobicContact SD-CG 4.45Å; M59-R121 VanDerWaalsContact SD-CZ 3.54Å; M59-R121 PolarHBondContact SD-NE 3.36Å; M59-R121 VanDerWaalsContact SD-NE 3.35Å; M59-Y288 HydrophobicContact CE-CD1 4.32Å; M59-Y288 HydrophobicContact CE-CE1 3.87Å
60Y90.6Very high91Very high9 Ų940.5 Ų40.54%0.03521%0.206CC..Hα-helixtrans-72.1-27.1-178.7-73.6-65.3000112I49 L55 T57 P58 L63 F64 N292 D294 V295I49-Y60 HydrophobicContact CG1-CD1 4.43Å; L55-Y60 HydrophobicContact CB-CD2 4.05Å; L55-Y60 HydrophobicContact CB-CG 4.13Å; L55-Y60 HydrophobicContact CD2-CD1 4.37Å; L55-Y60 HydrophobicContact CD2-CD2 4.01Å; L55-Y60 HydrophobicContact CD2-CE1 4Å; L55-Y60 HydrophobicContact CD2-CE2 3.62Å; L55-Y60 HydrophobicContact CD2-CG 4.41Å; L55-Y60 WeakPolarHBondContact O-CB 3.27Å; L55-Y60 VanDerWaalsContact O-CD2 3.24Å; L55-Y60 WeakPolarHBondContact O-CD2 3.47Å; T57-Y60 HydrophobicContact CG2-CD2 4.44Å; T57-Y60 PolarHBondContact O-N 2.95Å; T57-Y60 VanDerWaalsContact O-N 3.13Å; T57-Y60 WeakPolarHBondContact OG1-CD2 3.46Å; P58-Y60 PolarHBondContact O-N 3.3Å; Y60-L63 HydrophobicContact CD1-CD2 3.85Å; Y60-L63 HydrophobicContact CE1-CD2 4.19Å; Y60-L63 PolarHBondContact O-N 3.33Å; Y60-F64 WeakPolarHBondContact O-CB 3.29Å; Y60-F64 PolarHBondContact O-N 2.98Å; Y60-N292 VanDerWaalsContact OH-CG 3.27Å; Y60-N292 PolarHBondContact OH-ND2 3.43Å; Y60-N292 PolarHBondContact OH-OD1 3.44Å; Y60-N292 VanDerWaalsContact OH-OD1 3.12Å; Y60-D294 VanDerWaalsContact OH-CB 3.25Å; Y60-D294 WeakPolarHBondContact OH-CB 3.17Å; Y60-D294 PolarHBondContact OH-OD2 2.99Å; Y60-V295 HydrophobicContact CE1-CG2 3.96Å
61Y93.8Very high91.1Very high67 Ų6738 Ų3826%0.26319%0.19SC..Hα-helixtrans-62.9-43.6169.2169.1-96.9000111.4T57 P58 M59 F64 N65 C140 L141 T144T57-Y61 PolarHBondContact O-N 2.9Å; P58-Y61 WeakPolarHBondContact O-CB 3.46Å; P58-Y61 PolarHBondContact O-N 3.3Å; M59-Y61 VanDerWaalsContact C-N 3.29Å; M59-Y61 PolarHBondContact O-N 2.85Å; Y61-F64 WeakPolarHBondContact O-CB 3.29Å; Y61-F64 PolarHBondContact O-N 3.41Å; Y61-N65 PolarHBondContact O-N 2.98Å; Y61-N65 PolarHBondContact O-ND2 3.27Å; Y61-C140 HydrophobicContact CD1-CB 3.79Å; Y61-C140 HydrophobicContact CE1-CB 3.82Å; Y61-L141 HydrophobicContact CE2-CD2 4.47Å; Y61-T144 WeakPolarHBondContact CE1-OG1 3.49Å; Y61-T144 WeakPolarHBondContact OH-CB 3.31Å; Y61-T144 PolarHBondContact OH-OG1 3.37Å; Y61-T144 VanDerWaalsContact OH-OG1 3.09Å
62F94.2Very high91.2Very high0 Ų035.5 Ų35.50%018%0.179CC..Hα-helixtrans-67-38.6172.5-67.1-59.6000112.3P58 M59 F64 N65 L66 I113 A116 M117 M135 C140 M143P58-F62 WeakPolarHBondContact O-CD2 3.17Å; P58-F62 PolarHBondContact O-N 3.39Å; M59-F62 PolarHBondContact O-N 3.49Å; F62-F64 VanDerWaalsContact C-N 3.3Å; F62-F64 PolarHBondContact O-N 3.14Å; F62-N65 PolarHBondContact O-N 2.81Å; F62-N65 VanDerWaalsContact O-N 3.14Å; F62-L66 PolarHBondContact O-N 2.9Å; F62-I113 HydrophobicContact CB-CG2 4.32Å; F62-A116 HydrophobicContact CD1-CB 4Å; F62-A116 HydrophobicContact CE1-CB 3.76Å; F62-A116 HydrophobicContact CE2-CB 4.38Å; F62-A116 HydrophobicContact CG-CB 4.43Å; F62-A116 HydrophobicContact CZ-CB 3.96Å; F62-M117 HydrophobicContact CB-CG 3.42Å; F62-M117 VanDerWaalsContact CB-CG 3.42Å; F62-M117 HydrophobicContact CB-SD 4.14Å; F62-M117 HydrophobicContact CD2-CG 4.43Å; F62-M117 HydrophobicContact CG-CG 4.15Å; F62-M135 HydrophobicContact CE2-CE 4.37Å; F62-C140 HydrophobicContact CZ-CB 4.14Å; F62-M143 HydrophobicContact CE1-CB 4.14Å; F62-M143 HydrophobicContact CZ-CB 4.12Å; F62-M143 HydrophobicContact CZ-CE 4.38Å; F62-M143 HydrophobicContact CZ-SD 3.96Å
63L92.6Very high91.3Very high2 Ų235.3 Ų35.31%0.0118%0.178CC..Hα-helixtrans-62.3-36175.5-173.460.1000112.7L45 I49 M59 Y60 L66 S67 M117 Y288L45-L63 HydrophobicContact CD1-CD2 4.19Å; L45-L63 HydrophobicContact CD2-CD1 3.82Å; L45-L63 HydrophobicContact CD2-CD2 3.72Å; L45-L63 HydrophobicContact CD2-CG 3.62Å; L45-L63 HydrophobicContact CG-CD2 4.23Å; L45-L63 HydrophobicContact CG-CG 4.31Å; I49-L63 HydrophobicContact CD1-CB 4.4Å; I49-L63 HydrophobicContact CD1-CD2 4.44Å; I49-L63 HydrophobicContact CD1-CG 4.36Å; M59-L63 PolarHBondContact O-N 3.27Å; Y60-L63 HydrophobicContact CD1-CD2 3.85Å; Y60-L63 HydrophobicContact CE1-CD2 4.19Å; Y60-L63 PolarHBondContact O-N 3.33Å; L63-L66 HydrophobicContact CD1-CD2 4.24Å; L63-L66 PolarHBondContact O-N 2.99Å; L63-S67 PolarHBondContact O-N 3.39Å; L63-S67 PolarHBondContact O-OG 2.85Å; L63-M117 HydrophobicContact CB-CE 4.41Å; L63-M117 HydrophobicContact CD1-CE 4.23Å; L63-Y288 HydrophobicContact CD1-CD1 4.1Å; L63-Y288 HydrophobicContact CD1-CD2 3.4Å; L63-Y288 HydrophobicContact CD1-CE2 3.99Å; L63-Y288 HydrophobicContact CD1-CG 3.48Å; L63-Y288 VanDerWaalsContact CD1-CG 3.48Å; L63-Y288 HydrophobicContact CD2-CG 4.29Å
64F94.4Very high91.5Very high63 Ų6331.2 Ų31.228%0.27615%0.151SC..Hα-helixtrans-60.5-46.7172.5171-84000111.2I46 I49 V50 Y60 Y61 F62 S67 F68I46-F64 HydrophobicContact CB-CD2 4.43Å; I46-F64 HydrophobicContact CB-CE2 4.44Å; I46-F64 HydrophobicContact CG1-CD2 4.32Å; I46-F64 HydrophobicContact CG1-CE2 4.49Å; I46-F64 HydrophobicContact CG2-CD2 4.11Å; I46-F64 HydrophobicContact CG2-CE2 3.64Å; I46-F64 HydrophobicContact CG2-CZ 4.46Å; I49-F64 HydrophobicContact CD1-CB 4.03Å; I49-F64 HydrophobicContact CG2-CB 4.36Å; I49-F64 HydrophobicContact CG2-CD2 4.5Å; V50-F64 HydrophobicContact CG2-CD2 4.31Å; V50-F64 HydrophobicContact CG2-CE2 3.79Å; Y60-F64 WeakPolarHBondContact O-CB 3.29Å; Y60-F64 PolarHBondContact O-N 2.98Å; Y61-F64 WeakPolarHBondContact O-CB 3.29Å; Y61-F64 PolarHBondContact O-N 3.41Å; F62-F64 VanDerWaalsContact C-N 3.3Å; F62-F64 PolarHBondContact O-N 3.14Å; F64-S67 PolarHBondContact O-N 3.23Å; F64-F68 WeakPolarHBondContact O-CB 3.25Å; F64-F68 PolarHBondContact O-N 3.06Å
65N95.7Very high91.8Very high12 Ų1228.2 Ų28.26%0.06414%0.142CC..Hα-helixtrans-66.2-39.5177.6-71.7-81000111.1Y61 F62 F68 T69 I113 Y148Y61-N65 PolarHBondContact O-N 2.98Å; Y61-N65 PolarHBondContact O-ND2 3.27Å; F62-N65 PolarHBondContact O-N 2.81Å; F62-N65 VanDerWaalsContact O-N 3.14Å; N65-F68 PolarHBondContact O-N 3.14Å; N65-T69 WeakPolarHBondContact O-CB 3.27Å; N65-T69 PolarHBondContact O-N 3.44Å; N65-T69 PolarHBondContact O-OG1 2.8Å; N65-I113 HydrophobicContact CB-CD1 4.09Å; N65-Y148 PolarHBondContact OD1-OH 2.85Å
66L93.7Very high92.1Very high0 Ų029.7 Ų29.70%015%0.151CC..Hα-helixtrans-59.1-51.1174.8-174.163000111.1F62 L63 F68 T69 D70 E110 I113 L114 M117 Y288F62-L66 PolarHBondContact O-N 2.9Å; L63-L66 HydrophobicContact CD1-CD2 4.24Å; L63-L66 PolarHBondContact O-N 2.99Å; L66-F68 VanDerWaalsContact C-N 3.28Å; L66-F68 PolarHBondContact O-N 3.36Å; L66-T69 WeakPolarHBondContact O-CB 3.45Å; L66-T69 PolarHBondContact O-N 3.25Å; L66-D70 WeakPolarHBondContact O-CB 3.5Å; L66-D70 VanDerWaalsContact O-CG 3.3Å; L66-D70 PolarHBondContact O-N 3.45Å; L66-E110 HydrophobicContact CD1-CG 3.86Å; L66-I113 HydrophobicContact CB-CG2 3.84Å; L66-I113 HydrophobicContact CD1-CB 4.49Å; L66-I113 HydrophobicContact CD1-CG2 4.2Å; L66-L114 HydrophobicContact CD2-CD2 4.15Å; L66-M117 HydrophobicContact CD2-CE 4.42Å; L66-M117 HydrophobicContact CD2-SD 4.11Å; L66-Y288 HydrophobicContact CD2-CD2 4.39Å; L66-Y288 HydrophobicContact CD2-CE2 3.68Å
67S94.1Very high92.1Very high1 Ų124 Ų241%0.00713%0.125CC..Hα-helixtrans-64.3-32.2178.6-76.30000113.4N42 L45 L63 F64 L71N42-S67 WeakPolarHBondContact OD1-CA 3.3Å; N42-S67 WeakPolarHBondContact OD1-CB 3.47Å; N42-S67 PolarHBondContact OD1-OG 2.83Å; L45-S67 VanDerWaalsContact CD2-OG 3.31Å; L45-S67 WeakPolarHBondContact CD2-OG 3.39Å; L63-S67 PolarHBondContact O-N 3.39Å; L63-S67 PolarHBondContact O-OG 2.85Å; F64-S67 PolarHBondContact O-N 3.23Å; S67-L71 VanDerWaalsContact O-CB 3.31Å; S67-L71 WeakPolarHBondContact O-CB 3.45Å; S67-L71 PolarHBondContact O-N 3.41Å
68F94.9Very high92.1Very high95 Ų9521.4 Ų21.442%0.41711%0.109SC..Hα-helixtrans-66.4-47.5172.8178.1-100.8000111.2I46 F64 N65 L66 D70 L71 C72I46-F68 HydrophobicContact CD1-CB 4.29Å; F64-F68 WeakPolarHBondContact O-CB 3.25Å; F64-F68 PolarHBondContact O-N 3.06Å; N65-F68 PolarHBondContact O-N 3.14Å; L66-F68 VanDerWaalsContact C-N 3.28Å; L66-F68 PolarHBondContact O-N 3.36Å; F68-D70 PolarHBondContact O-N 2.91Å; F68-L71 PolarHBondContact O-N 3.22Å; F68-C72 PolarHBondContact O-N 3.35Å; F68-C72 PolarHBondContact O-SG 3.07Å; F68-C72 VanDerWaalsContact O-SG 3.41Å
69T93.9Very high92Very high1 Ų122.2 Ų22.21%0.00612%0.115CC..Hα-helixtrans-56.2-49.6173.8-68.30000111.1N65 L66 L71 C72 Y73 F106 D109 E110N65-T69 WeakPolarHBondContact O-CB 3.27Å; N65-T69 PolarHBondContact O-N 3.44Å; N65-T69 PolarHBondContact O-OG1 2.8Å; L66-T69 WeakPolarHBondContact O-CB 3.45Å; L66-T69 PolarHBondContact O-N 3.25Å; T69-L71 VanDerWaalsContact C-N 3.32Å; T69-L71 PolarHBondContact O-N 3.46Å; T69-C72 PolarHBondContact O-N 2.75Å; T69-Y73 WeakPolarHBondContact O-CB 3.46Å; T69-Y73 PolarHBondContact O-N 2.96Å; T69-F106 HydrophobicContact CG2-CB 3.9Å; T69-F106 HydrophobicContact CG2-CD1 3.85Å; T69-F106 HydrophobicContact CG2-CG 4.26Å; T69-F106 WeakPolarHBondContact CG2-O 3.48Å; T69-D109 HydrophobicContact CG2-CB 4.31Å; T69-E110 HydrophobicContact CG2-CB 4.46Å
70D92.3Very high91.9Very high0 Ų025.6 Ų25.60%013%0.127CC..Hα-helixtrans-59.1-40.4179.1-74.9-11.5000112.8L66 F68 S74 P281 N284L66-D70 WeakPolarHBondContact O-CB 3.5Å; L66-D70 VanDerWaalsContact O-CG 3.3Å; L66-D70 PolarHBondContact O-N 3.45Å; F68-D70 PolarHBondContact O-N 2.91Å; D70-S74 VanDerWaalsContact O-CB 3.27Å; D70-S74 WeakPolarHBondContact O-CB 3.27Å; D70-S74 PolarHBondContact O-N 2.99Å; D70-S74 PolarHBondContact O-OG 3.12Å; D70-P281 HydrophobicContact CB-CB 3.9Å; D70-N284 PolarHBondContact OD1-ND2 2.96Å; D70-N284 VanDerWaalsContact OD2-CB 3.26Å; D70-N284 WeakPolarHBondContact OD2-CB 3.49Å; D70-N284 PolarHBondContact OD2-ND2 3.07Å
71L93.1Very high91.7Very high34 Ų3425.2 Ų25.218%0.17813%0.126CC..Hα-helixtrans-65.3-50.2177.8179.468.6000111.2V39 N42 S67 F68 T69 Y73 T75V39-L71 HydrophobicContact CB-CD1 4.05Å; V39-L71 HydrophobicContact CG1-CD1 3.85Å; V39-L71 HydrophobicContact CG2-CD1 3.93Å; N42-L71 HydrophobicContact CB-CB 4.41Å; S67-L71 VanDerWaalsContact O-CB 3.31Å; S67-L71 WeakPolarHBondContact O-CB 3.45Å; S67-L71 PolarHBondContact O-N 3.41Å; F68-L71 PolarHBondContact O-N 3.22Å; T69-L71 VanDerWaalsContact C-N 3.32Å; T69-L71 PolarHBondContact O-N 3.46Å; L71-Y73 VanDerWaalsContact C-N 3.33Å; L71-T75 WeakPolarHBondContact O-CB 3.47Å; L71-T75 PolarHBondContact O-N 3.04Å; L71-T75 VanDerWaalsContact O-N 3.11Å; L71-T75 PolarHBondContact O-OG1 3.4Å
72C92.8Very high91.5Very high33 Ų3322.7 Ų22.722%0.22312%0.117CC..Hα-helixtrans-62.6-44.4178.6-68.90000111F68 T69 T75 V76 F106F68-C72 PolarHBondContact O-N 3.35Å; F68-C72 PolarHBondContact O-SG 3.07Å; F68-C72 VanDerWaalsContact O-SG 3.41Å; T69-C72 PolarHBondContact O-N 2.75Å; C72-T75 WeakPolarHBondContact O-CB 3.36Å; C72-T75 PolarHBondContact O-N 3Å; C72-V76 WeakPolarHBondContact O-CG2 3.49Å; C72-V76 PolarHBondContact O-N 3.42Å; C72-F106 HydrophobicContact CB-CD1 4.41Å; C72-F106 HydrophobicContact CB-CD2 4.35Å; C72-F106 HydrophobicContact CB-CE1 3.67Å; C72-F106 HydrophobicContact CB-CE2 3.61Å; C72-F106 HydrophobicContact CB-CZ 3.24Å
73Y87.9Confident91.3Very high1 Ų125 Ų250%0.00413%0.13CC..Hα-helixtrans-62.3-48.7-179.9-172.2-106.8000112.9T69 L71 T75 V76 I77 F103 F106 V107 T277 P281T69-Y73 WeakPolarHBondContact O-CB 3.46Å; T69-Y73 PolarHBondContact O-N 2.96Å; L71-Y73 VanDerWaalsContact C-N 3.33Å; Y73-T75 PolarHBondContact O-N 3.32Å; Y73-V76 PolarHBondContact O-N 2.9Å; Y73-V76 VanDerWaalsContact O-N 3.14Å; Y73-I77 HydrophobicContact CE2-CG1 4.31Å; Y73-I77 WeakPolarHBondContact O-CG1 3.45Å; Y73-I77 PolarHBondContact O-N 2.89Å; Y73-F103 AromaticContact CE2-CD2 3.54Å; Y73-F103 HydrophobicContact CE2-CD2 3.54Å; Y73-F103 HydrophobicContact CE2-CE2 4.07Å; Y73-F103 HydrophobicContact CE2-CG 4.39Å; Y73-F103 AromaticContact CZ-CD2 3.78Å; Y73-F103 AromaticContact CZ-CE2 3.85Å; Y73-F103 WeakPolarHBondContact OH-CD2 3.47Å; Y73-F103 WeakPolarHBondContact OH-CE2 3.43Å; Y73-F106 HydrophobicContact CD2-CB 3.42Å; Y73-F106 VanDerWaalsContact CD2-CB 3.42Å; Y73-F106 HydrophobicContact CD2-CD2 4.05Å; Y73-F106 HydrophobicContact CD2-CG 4.17Å; Y73-F106 HydrophobicContact CE2-CB 4.21Å; Y73-F106 HydrophobicContact CG-CB 4.06Å; Y73-V107 HydrophobicContact CE2-CG2 3.62Å; Y73-V107 WeakPolarHBondContact OH-CG2 3.24Å; Y73-T277 HydrophobicContact CE1-CG2 4.46Å; Y73-T277 WeakPolarHBondContact CE1-O 3.32Å; Y73-T277 WeakPolarHBondContact OH-CB 3.45Å; Y73-T277 WeakPolarHBondContact OH-CG2 3.38Å; Y73-P281 HydrophobicContact CD1-CG 3.97Å; Y73-P281 HydrophobicContact CE1-CG 4.39Å
74S90Very high90.9Very high2 Ų225.6 Ų25.61%0.01414%0.137CC..Hα-helixtrans-57.2-37.6174.6-60.10000111.5S38 D70 T78 P79S38-S74 PolarHBondContact OG-OG 3.36Å; D70-S74 VanDerWaalsContact O-CB 3.27Å; D70-S74 WeakPolarHBondContact O-CB 3.27Å; D70-S74 PolarHBondContact O-N 2.99Å; D70-S74 PolarHBondContact O-OG 3.12Å; S74-T78 VanDerWaalsContact O-CB 3.29Å; S74-T78 WeakPolarHBondContact O-CB 3.43Å; S74-T78 PolarHBondContact O-N 2.85Å; S74-T78 PolarHBondContact O-OG1 2.93Å; S74-T78 VanDerWaalsContact O-OG1 3.13Å; S74-P79 VanDerWaalsContact O-CD 3.25Å; S74-P79 WeakPolarHBondContact O-CD 3.18Å
75T90.8Very high90.5Very high65 Ų6523 Ų2340%0.39913%0.126SC..Hα-helixtrans-72.9-30.2-179.6-54.50000113L71 C72 Y73 P79L71-T75 WeakPolarHBondContact O-CB 3.47Å; L71-T75 PolarHBondContact O-N 3.04Å; L71-T75 VanDerWaalsContact O-N 3.11Å; L71-T75 PolarHBondContact O-OG1 3.4Å; C72-T75 WeakPolarHBondContact O-CB 3.36Å; C72-T75 PolarHBondContact O-N 3Å; Y73-T75 PolarHBondContact O-N 3.32Å; T75-P79 WeakPolarHBondContact O-CD 3.39Å; T75-P79 VanDerWaalsContact O-CG 3.29Å; T75-P79 WeakPolarHBondContact O-CG 3.43Å
76V89.6Confident90.1Very high33 Ų3327 Ų2720%0.215%0.151CC..Hα-helixtrans-75.3-35.1177.3169.20000111.8C72 Y73 Q99 F102 F106C72-V76 WeakPolarHBondContact O-CG2 3.49Å; C72-V76 PolarHBondContact O-N 3.42Å; Y73-V76 PolarHBondContact O-N 2.9Å; Y73-V76 VanDerWaalsContact O-N 3.14Å; V76-Q99 HydrophobicContact CG1-CG 3.86Å; V76-Q99 PolarHBondContact O-NE2 3.18Å; V76-Q99 VanDerWaalsContact O-NE2 3.17Å; V76-F102 HydrophobicContact CG1-CB 4.15Å; V76-F102 HydrophobicContact CG2-CB 4.05Å; V76-F106 HydrophobicContact CG2-CE2 4.29Å
77I88.1Confident89.7Confident0 Ų034 Ų340%018%0.181CC..Hα-helixtrans-98.2-56.4-170.1-59.2-58.6000112.1Y73 R80 M81 Q99 F103 Y176 V177Y73-I77 HydrophobicContact CE2-CG1 4.31Å; Y73-I77 WeakPolarHBondContact O-CG1 3.45Å; Y73-I77 PolarHBondContact O-N 2.89Å; I77-R80 PolarHBondContact O-N 3.3Å; I77-M81 PolarHBondContact O-N 3.48Å; I77-M81 VanDerWaalsContact O-N 3.09Å; I77-Q99 HydrophobicContact CD1-CG 4.46Å; I77-F103 HydrophobicContact CD1-CB 4.23Å; I77-F103 HydrophobicContact CD1-CD2 3.55Å; I77-F103 HydrophobicContact CD1-CE2 4.31Å; I77-F103 HydrophobicContact CD1-CG 4.27Å; I77-F103 HydrophobicContact CG1-CD2 4.18Å; I77-Y176 HydrophobicContact CG2-CE2 4.13Å; I77-V177 HydrophobicContact CB-CG1 4.44Å; I77-V177 HydrophobicContact CD1-CB 4.32Å; I77-V177 HydrophobicContact CD1-CG1 3.8Å; I77-V177 HydrophobicContact CG2-CG1 3.84Å
78T88.8Confident89.2Confident2 Ų239.7 Ų39.71%0.01221%0.208CC..Hα-helixtrans-67.2-43.6-166.3-460000113.7Y35 S74 R80 M81 L82Y35-T78 HydrophobicContact CD2-CG2 4.1Å; Y35-T78 HydrophobicContact CG-CG2 4.16Å; S74-T78 VanDerWaalsContact O-CB 3.29Å; S74-T78 WeakPolarHBondContact O-CB 3.43Å; S74-T78 PolarHBondContact O-N 2.85Å; S74-T78 PolarHBondContact O-OG1 2.93Å; S74-T78 VanDerWaalsContact O-OG1 3.13Å; T78-R80 VanDerWaalsContact C-N 3.27Å; T78-R80 PolarHBondContact O-N 3.24Å; T78-M81 HydrophobicContact CG2-CE 4.13Å; T78-M81 WeakPolarHBondContact O-CB 3.47Å; T78-M81 PolarHBondContact O-N 3.24Å; T78-L82 HydrophobicContact CG2-CD1 4.32Å; T78-L82 HydrophobicContact CG2-CG 4.36Å; T78-L82 WeakPolarHBondContact O-CG 3.42Å; T78-L82 PolarHBondContact O-N 3.13Å
79P88.9Confident88.7Confident42 Ų4235.3 Ų35.327%0.27319%0.188SC..Hα-helixtrans-58.4-38.7176.2-27.436.9000113.1Y35 S74 T75 L82 V83Y35-P79 HydrophobicContact CE2-CG 4.1Å; S74-P79 VanDerWaalsContact O-CD 3.25Å; S74-P79 WeakPolarHBondContact O-CD 3.18Å; T75-P79 WeakPolarHBondContact O-CD 3.39Å; T75-P79 VanDerWaalsContact O-CG 3.29Å; T75-P79 WeakPolarHBondContact O-CG 3.43Å; P79-L82 PolarHBondContact O-N 3.28Å; P79-V83 WeakPolarHBondContact O-CG2 3.41Å; P79-V83 PolarHBondContact O-N 2.9Å; P79-V83 VanDerWaalsContact O-N 3.13Å
80R88.7Confident88.4Confident76 Ų7638.9 Ų38.929%0.28721%0.207SC..Hα-helixtrans-69.1-38.7178.4-73.6-70.4-175.8170.93.2111.7I77 T78 V83 N89 E95I77-R80 PolarHBondContact O-N 3.3Å; T78-R80 VanDerWaalsContact C-N 3.27Å; T78-R80 PolarHBondContact O-N 3.24Å; R80-V83 PolarHBondContact O-N 3.42Å; R80-N89 PolarHBondContact O-ND2 3.01Å; R80-E95 IonicContact CZ-OE1 2.8Å; R80-E95 IonicContact NH2-OE1 2.69Å; R80-E95 PolarHBondContact NH2-OE1 3.49Å
81M88.4Confident88.3Confident1 Ų139 Ų391%0.00521%0.207CC..Hα-helixtrans-62.4-42.8171.8-175.6179.763.300111.9F31 I77 T78 V83 G84 F85 Y176 I278F31-M81 HydrophobicContact CB-CE 3.58Å; F31-M81 HydrophobicContact CD1-CE 3.37Å; F31-M81 HydrophobicContact CD1-SD 4.49Å; F31-M81 HydrophobicContact CD2-CE 3.73Å; F31-M81 HydrophobicContact CD2-SD 4.39Å; F31-M81 HydrophobicContact CE1-CE 3.89Å; F31-M81 HydrophobicContact CE1-SD 4.48Å; F31-M81 HydrophobicContact CE2-CE 4.24Å; F31-M81 HydrophobicContact CE2-SD 4.44Å; F31-M81 HydrophobicContact CG-CE 3.27Å; F31-M81 HydrophobicContact CG-SD 4.43Å; F31-M81 HydrophobicContact CZ-CE 4.3Å; F31-M81 HydrophobicContact CZ-SD 4.46Å; I77-M81 PolarHBondContact O-N 3.48Å; I77-M81 VanDerWaalsContact O-N 3.09Å; T78-M81 HydrophobicContact CG2-CE 4.13Å; T78-M81 WeakPolarHBondContact O-CB 3.47Å; T78-M81 PolarHBondContact O-N 3.24Å; M81-V83 VanDerWaalsContact C-N 3.33Å; M81-V83 PolarHBondContact O-N 2.89Å; M81-G84 PolarHBondContact O-N 3.19Å; M81-F85 HydrophobicContact CG-CE2 3.99Å; M81-F85 HydrophobicContact CG-CZ 4.27Å; M81-Y176 HydrophobicContact CB-CD2 3.91Å; M81-Y176 HydrophobicContact CG-CD2 3.8Å; M81-Y176 HydrophobicContact CG-CG 4.08Å; M81-Y176 HydrophobicContact SD-CD2 3.72Å; M81-Y176 HydrophobicContact SD-CE2 3.97Å; M81-Y176 HydrophobicContact SD-CG 4.14Å; M81-I278 HydrophobicContact CE-CD1 3.54Å; M81-I278 HydrophobicContact SD-CD1 3.81Å
82L89.7Confident88.2Confident14 Ų1439.1 Ų39.17%0.07321%0.211CC..Hα-helixtrans-61.3-38.9-179.7-71.9174.2000112.7F28 F31 L32 T78 P79 G84 F85F28-L82 HydrophobicContact CD2-CB 4.22Å; F28-L82 HydrophobicContact CD2-CD2 3.8Å; F28-L82 HydrophobicContact CE2-CB 3.97Å; F28-L82 HydrophobicContact CE2-CD2 4.09Å; F28-L82 HydrophobicContact CG-CD2 4.34Å; F28-L82 WeakPolarHBondContact O-CD2 3.25Å; F31-L82 HydrophobicContact CB-CD2 3.86Å; L32-L82 HydrophobicContact CB-CD1 4.36Å; L32-L82 HydrophobicContact CB-CD2 4.26Å; L32-L82 HydrophobicContact CD1-CD1 4.02Å; T78-L82 HydrophobicContact CG2-CD1 4.32Å; T78-L82 HydrophobicContact CG2-CG 4.36Å; T78-L82 WeakPolarHBondContact O-CG 3.42Å; T78-L82 PolarHBondContact O-N 3.13Å; P79-L82 PolarHBondContact O-N 3.28Å; L82-G84 PolarHBondContact O-N 2.97Å; L82-F85 HydrophobicContact CD2-CD2 4.33Å; L82-F85 PolarHBondContact O-N 3.48Å; L82-F85 VanDerWaalsContact O-N 3.16Å
83V88.4Confident87.9Confident48 Ų4839.7 Ų39.729%0.29121%0.21SC..Hα-helixtrans-57.4-38.3174.31710000111.3P79 R80 M81 F85 V86 K87P79-V83 WeakPolarHBondContact O-CG2 3.41Å; P79-V83 PolarHBondContact O-N 2.9Å; P79-V83 VanDerWaalsContact O-N 3.13Å; R80-V83 PolarHBondContact O-N 3.42Å; M81-V83 VanDerWaalsContact C-N 3.33Å; M81-V83 PolarHBondContact O-N 2.89Å; V83-F85 PolarHBondContact O-N 3.31Å; V83-V86 PolarHBondContact O-N 3.05Å; V83-V86 VanDerWaalsContact O-N 3.08Å; V83-K87 HydrophobicContact CG1-CD 4.42Å; V83-K87 HydrophobicContact CG1-CG 3.87Å; V83-K87 PolarHBondContact O-N 2.92Å
84G85.1Confident87.9Confident15 Ų1542.7 Ų42.716%0.15524%0.235CC..Hα-helixtrans-65.6-17.2179.900000115.4M81 L82M81-G84 PolarHBondContact O-N 3.19Å; L82-G84 PolarHBondContact O-N 2.97Å
85F85.9Confident87.9Confident7 Ų746.3 Ų46.33%0.03125%0.252CS..Hα-helixtrans-85.8-20172.8-62.1-59.7000113.3L17 T18 Q24 L27 F28 F31 M81 L82 V83L17-F85 HydrophobicContact CB-CE1 3.93Å; L17-F85 HydrophobicContact CB-CZ 3.86Å; L17-F85 HydrophobicContact CD2-CE1 4.41Å; L17-F85 HydrophobicContact CD2-CZ 3.92Å; T18-F85 HydrophobicContact CG2-CE1 4.25Å; Q24-F85 HydrophobicContact CB-CB 4.38Å; Q24-F85 HydrophobicContact CB-CD1 4.3Å; Q24-F85 HydrophobicContact CG-CD1 4.28Å; L27-F85 HydrophobicContact CB-CD1 4.39Å; L27-F85 HydrophobicContact CB-CE1 3.81Å; L27-F85 HydrophobicContact CB-CE2 4.38Å; L27-F85 HydrophobicContact CB-CZ 3.81Å; L27-F85 HydrophobicContact CD1-CE1 4.1Å; F28-F85 HydrophobicContact CB-CB 3.95Å; F28-F85 HydrophobicContact CB-CD2 4.1Å; F28-F85 HydrophobicContact CB-CG 4.25Å; F28-F85 HydrophobicContact CD2-CB 4.11Å; F28-F85 HydrophobicContact CD2-CD2 4.33Å; F31-F85 AromaticContact CD2-CE2 3.78Å; F31-F85 HydrophobicContact CD2-CE2 3.78Å; F31-F85 AromaticContact CD2-CZ 3.84Å; F31-F85 HydrophobicContact CD2-CZ 3.84Å; F31-F85 HydrophobicContact CE2-CE2 4.47Å; F31-F85 HydrophobicContact CE2-CZ 4.09Å; M81-F85 HydrophobicContact CG-CE2 3.99Å; M81-F85 HydrophobicContact CG-CZ 4.27Å; L82-F85 HydrophobicContact CD2-CD2 4.33Å; L82-F85 PolarHBondContact O-N 3.48Å; L82-F85 VanDerWaalsContact O-N 3.16Å; V83-F85 PolarHBondContact O-N 3.31Å
86V86.3Confident87.9Confident98 Ų9843.2 Ų43.259%0.59423%0.233SC*.Hα-helixtrans-102.1-39.8-173.9-178.10000111.5F28 V83F28-V86 HydrophobicContact CD2-CG2 3.72Å; F28-V86 HydrophobicContact CE2-CG2 3.55Å; F28-V86 HydrophobicContact CZ-CG2 4.29Å; V83-V86 PolarHBondContact O-N 3.05Å; V83-V86 VanDerWaalsContact O-N 3.08Å
87K85.8Confident88Confident145 Ų14542.1 Ų42.163%0.6323%0.226SC*.SBendtrans-150170.6-176.165176.8-176.8177.50111.3V83 N89V83-K87 HydrophobicContact CG1-CD 4.42Å; V83-K87 HydrophobicContact CG1-CG 3.87Å; V83-K87 PolarHBondContact O-N 2.92Å; K87-N89 PolarHBondContact O-N 3.1Å
88Q83Confident88.2Confident122 Ų12245.6 Ų45.657%0.5725%0.247SC*.  trans-56.8126.3172.5-167.2175.112.400110.6I13 I90I13-Q88 HydrophobicContact CG2-CG 4.04Å; Q88-I90 HydrophobicContact CG-CD1 4.47Å; Q88-I90 HydrophobicContact CG-CG1 4.01Å; Q88-I90 PolarHBondContact O-N 3.03Å
89N85.6Confident88.4Confident2 Ų246 Ų461%0.01125%0.249CC..EExtended strand (participates in β ladder)trans-95.785.2-174.9-168.12.7000110L14 R80 K87L14-N89 HydrophobicContact CB-CB 4.02Å; L14-N89 PolarHBondContact N-O 3.46Å; R80-N89 PolarHBondContact O-ND2 3.01Å; K87-N89 PolarHBondContact O-N 3.1Å
90I88.1Confident88.4Confident76 Ų7644.1 Ų44.139%0.3924%0.236SC..EExtended strand (participates in β ladder)trans-89.9130.3177-51.5177.1000108.3E11 F12 I13 Q88E11-I90 HydrophobicContact CB-CG2 4.11Å; E11-I90 HydrophobicContact CG-CG2 4.48Å; F12-I90 CarbonylContact O-C 3.47Å; F12-I90 WeakPolarHBondContact O-CA 3.28Å; I13-I90 HydrophobicContact CG1-CG1 4.49Å; Q88-I90 HydrophobicContact CG-CD1 4.47Å; Q88-I90 HydrophobicContact CG-CG1 4.01Å; Q88-I90 PolarHBondContact O-N 3.03Å
91I89.9Confident88.7Confident2 Ų242.3 Ų42.31%0.0123%0.231CC..EExtended strand (participates in β ladder)trans-130.7133.4179.4-169.8167.7000109.5E11 F12 L14 E95 C96E11-I91 CarbonylContact C-O 3.17Å; E11-I91 WeakPolarHBondContact CA-O 3.49Å; F12-I91 HydrophobicContact CB-CG2 3.86Å; F12-I91 PolarHBondContact N-O 3.22Å; F12-I91 PolarHBondContact O-N 3.47Å; L14-I91 HydrophobicContact CD1-CB 4.37Å; L14-I91 HydrophobicContact CD1-CG2 3.94Å; L14-I91 HydrophobicContact CG-CG2 4.16Å; I91-E95 HydrophobicContact CD1-CB 3.94Å; I91-E95 HydrophobicContact CG1-CB 3.49Å; I91-E95 VanDerWaalsContact CG1-CB 3.49Å; I91-C96 HydrophobicContact CD1-CB 4.19Å; I91-C96 HydrophobicContact CG1-CB 4.29Å; I91-C96 HydrophobicContact CG2-CB 4.28Å
92S90.3Very high88.9Confident37 Ų3746 Ų4626%0.25925%0.247SC..EExtended strand (participates in β ladder)trans-68.6156.3174.864.30000111A94 E95 C96S92-A94 PolarHBondContact O-N 2.71Å; S92-E95 WeakPolarHBondContact CB-OE2 3.11Å; S92-E95 PolarHBondContact N-OE2 3.32Å; S92-E95 PolarHBondContact O-N 2.93Å; S92-E95 WeakPolarHBondContact OG-CB 3.11Å; S92-E95 WeakPolarHBondContact OG-CG 3.49Å; S92-E95 PolarHBondContact OG-N 2.87Å; S92-E95 PolarHBondContact OG-OE2 2.63Å; S92-C96 WeakPolarHBondContact O-CB 3.5Å; S92-C96 PolarHBondContact O-N 3.32Å
93H86.4Confident88.9Confident45 Ų4545.9 Ų45.921%0.20825%0.246CC..Hα-helixtrans-54.5-42.5175.5175.8-85.5000112K10 F12 C96 M97 F167K10-H93 PolarHBondContact O-N 3.01Å; F12-H93 HydrophobicContact CE2-CB 4.03Å; F12-H93 AromaticContact CE2-CD2 3.67Å; H93-C96 WeakPolarHBondContact O-CB 3.41Å; H93-C96 PolarHBondContact O-N 3Å; H93-M97 WeakPolarHBondContact O-CG 3.41Å; H93-M97 PolarHBondContact O-N 3.36Å; H93-F167 AromaticContact CD2-CE2 3.95Å; H93-F167 AromaticContact NE2-CE2 3.61Å
94A88.6Confident88.9Confident64 Ų6444.1 Ų44.153%0.52924%0.236SC..Hα-helixtrans-65-42.9179.200000112.8S92 C96 T98S92-A94 PolarHBondContact O-N 2.71Å; A94-C96 VanDerWaalsContact C-N 3.33Å; A94-T98 WeakPolarHBondContact O-CB 3.31Å; A94-T98 PolarHBondContact O-N 3.4Å; A94-T98 PolarHBondContact O-OG1 3.45Å
95E89.8Confident89.4Confident78 Ų7845 Ų4536%0.36424%0.236SC..Hα-helixtrans-65-38.3174.6-73.4171123.400111.7R80 I91 S92 T98 Q99R80-E95 IonicContact CZ-OE1 2.8Å; R80-E95 IonicContact NH2-OE1 2.69Å; R80-E95 PolarHBondContact NH2-OE1 3.49Å; I91-E95 HydrophobicContact CD1-CB 3.94Å; I91-E95 HydrophobicContact CG1-CB 3.49Å; I91-E95 VanDerWaalsContact CG1-CB 3.49Å; S92-E95 WeakPolarHBondContact CB-OE2 3.11Å; S92-E95 PolarHBondContact N-OE2 3.32Å; S92-E95 PolarHBondContact O-N 2.93Å; S92-E95 WeakPolarHBondContact OG-CB 3.11Å; S92-E95 WeakPolarHBondContact OG-CG 3.49Å; S92-E95 PolarHBondContact OG-N 2.87Å; S92-E95 PolarHBondContact OG-OE2 2.63Å; E95-T98 PolarHBondContact O-N 3.23Å; E95-Q99 WeakPolarHBondContact O-CB 3.38Å; E95-Q99 PolarHBondContact O-N 2.96Å
96C90.3Very high89.7Confident0 Ų045.2 Ų45.20%024%0.237CC..Hα-helixtrans-63.7-46178.2-172.80000111.6F12 I91 S92 H93 A94 T98 Q99 L100 C178F12-C96 HydrophobicContact CD2-CB 4.08Å; F12-C96 HydrophobicContact CE2-CB 4.43Å; I91-C96 HydrophobicContact CD1-CB 4.19Å; I91-C96 HydrophobicContact CG1-CB 4.29Å; I91-C96 HydrophobicContact CG2-CB 4.28Å; S92-C96 WeakPolarHBondContact O-CB 3.5Å; S92-C96 PolarHBondContact O-N 3.32Å; H93-C96 WeakPolarHBondContact O-CB 3.41Å; H93-C96 PolarHBondContact O-N 3Å; A94-C96 VanDerWaalsContact C-N 3.33Å; C96-T98 VanDerWaalsContact C-N 3.33Å; C96-T98 PolarHBondContact O-N 3.48Å; C96-Q99 PolarHBondContact O-N 3.37Å; C96-L100 WeakPolarHBondContact O-CB 3.31Å; C96-L100 PolarHBondContact O-N 3.26Å; C96-C178 WeakPolarHBondContact CA-SG 3.47Å; C96-C178 HydrophobicContact CB-CB 4.08Å; C96-C178 WeakPolarHBondContact CB-SG 3.29Å; C96-C178 WeakPolarHBondContact SG-CB 3.41Å; C96-C178 CovalentContact SG-SG 2.03Å; C96-C178 PolarHBondContact SG-SG 3.02Å
97M91.6Very high89.7Confident11 Ų1142 Ų425%0.05422%0.217CC..Hα-helixtrans-65.6-37.3175-65-58.5145.800112H93 L100 F101 I159 M162 L163 F167 L183H93-M97 WeakPolarHBondContact O-CG 3.41Å; H93-M97 PolarHBondContact O-N 3.36Å; M97-L100 PolarHBondContact O-N 3.25Å; M97-F101 PolarHBondContact O-N 3.13Å; M97-I159 HydrophobicContact CB-CD1 4.46Å; M97-I159 WeakPolarHBondContact O-CD1 3.44Å; M97-M162 HydrophobicContact CE-CB 4.41Å; M97-M162 HydrophobicContact SD-CB 3.88Å; M97-L163 HydrophobicContact CG-CD2 4.09Å; M97-F167 HydrophobicContact CE-CE2 4.11Å; M97-F167 HydrophobicContact CE-CZ 3.95Å; M97-L183 HydrophobicContact CE-CD1 4.25Å
98T91.9Very high90Very high72 Ų7235.5 Ų35.544%0.44219%0.189SC..Hα-helixtrans-66.6-43.8175.9-56.70000111.3A94 E95 C96 L100 F101 F102A94-T98 WeakPolarHBondContact O-CB 3.31Å; A94-T98 PolarHBondContact O-N 3.4Å; A94-T98 PolarHBondContact O-OG1 3.45Å; E95-T98 PolarHBondContact O-N 3.23Å; C96-T98 VanDerWaalsContact C-N 3.33Å; C96-T98 PolarHBondContact O-N 3.48Å; T98-L100 VanDerWaalsContact C-N 3.34Å; T98-L100 PolarHBondContact O-N 3.32Å; T98-F101 PolarHBondContact O-N 3.07Å; T98-F102 HydrophobicContact CG2-CD2 3.78Å; T98-F102 HydrophobicContact CG2-CE2 3.58Å; T98-F102 VanDerWaalsContact O-CD2 3.23Å; T98-F102 WeakPolarHBondContact O-CD2 3.46Å; T98-F102 PolarHBondContact O-N 2.75Å; T98-F102 VanDerWaalsContact O-N 3.16Å
99Q92.7Very high90.5Very high12 Ų1229.7 Ų29.76%0.05616%0.162CC..Hα-helixtrans-60-46175178.8177.476.600110.8V76 I77 E95 C96 F101 F102 F103V76-Q99 HydrophobicContact CG1-CG 3.86Å; V76-Q99 PolarHBondContact O-NE2 3.18Å; V76-Q99 VanDerWaalsContact O-NE2 3.17Å; I77-Q99 HydrophobicContact CD1-CG 4.46Å; E95-Q99 WeakPolarHBondContact O-CB 3.38Å; E95-Q99 PolarHBondContact O-N 2.96Å; C96-Q99 PolarHBondContact O-N 3.37Å; Q99-F101 VanDerWaalsContact C-N 3.32Å; Q99-F101 PolarHBondContact O-N 3.48Å; Q99-F102 PolarHBondContact O-N 2.93Å; Q99-F103 WeakPolarHBondContact O-CB 3.3Å; Q99-F103 PolarHBondContact O-N 3Å
100L90.9Very high90.8Very high1 Ų129.7 Ų29.71%0.00516%0.162CC..Hα-helixtrans-60.8-40.9178.7179.362.5000112.2C96 M97 T98 F103 A104 I159 M162 V180 L183C96-L100 WeakPolarHBondContact O-CB 3.31Å; C96-L100 PolarHBondContact O-N 3.26Å; M97-L100 PolarHBondContact O-N 3.25Å; T98-L100 VanDerWaalsContact C-N 3.34Å; T98-L100 PolarHBondContact O-N 3.32Å; L100-F103 HydrophobicContact CD1-CD1 4.42Å; L100-F103 PolarHBondContact O-N 3.27Å; L100-A104 WeakPolarHBondContact O-CB 3.38Å; L100-A104 PolarHBondContact O-N 2.86Å; L100-I159 HydrophobicContact CB-CD1 4.08Å; L100-I159 HydrophobicContact CD2-CD1 4Å; L100-I159 HydrophobicContact CG-CD1 4.01Å; L100-M162 HydrophobicContact CD2-CE 3.76Å; L100-M162 HydrophobicContact CD2-CG 3.9Å; L100-V180 HydrophobicContact CD1-CG2 3.75Å; L100-V180 HydrophobicContact CD2-CG2 4.39Å; L100-L183 HydrophobicContact CD2-CD1 4.11Å
101F93.6Very high90.9Very high38 Ų3826.5 Ų26.517%0.16715%0.147CC..Hα-helixtrans-59.8-53.6177.9176.5-96.6000111.3M97 T98 Q99 F103 A104 F105 F152 S155 M156 I159M97-F101 PolarHBondContact O-N 3.13Å; T98-F101 PolarHBondContact O-N 3.07Å; Q99-F101 VanDerWaalsContact C-N 3.32Å; Q99-F101 PolarHBondContact O-N 3.48Å; F101-F103 VanDerWaalsContact C-N 3.32Å; F101-F103 PolarHBondContact O-N 3.17Å; F101-A104 PolarHBondContact O-N 3.46Å; F101-F105 VanDerWaalsContact O-CB 3.24Å; F101-F105 WeakPolarHBondContact O-CB 3.19Å; F101-F105 PolarHBondContact O-N 3.35Å; F101-F152 HydrophobicContact CE2-CD2 4.36Å; F101-F152 HydrophobicContact CE2-CE2 4.42Å; F101-F152 AromaticContact CZ-CD2 3.81Å; F101-F152 HydrophobicContact CZ-CD2 3.81Å; F101-F152 AromaticContact CZ-CE2 4Å; F101-F152 HydrophobicContact CZ-CE2 4Å; F101-S155 PolarHBondContact O-OG 3.44Å; F101-M156 HydrophobicContact CE2-CE 4.3Å; F101-I159 HydrophobicContact CB-CD1 3.96Å; F101-I159 HydrophobicContact CB-CG1 3.76Å; F101-I159 HydrophobicContact CD2-CG1 3.84Å; F101-I159 HydrophobicContact CG-CG1 4.29Å
102F93.4Very high91.1Very high79 Ų7927.8 Ų27.835%0.34615%0.151SC..Hα-helixtrans-65.9-37.9-179.4-77.2-63000111.7V76 T98 Q99 F105 F106V76-F102 HydrophobicContact CG1-CB 4.15Å; V76-F102 HydrophobicContact CG2-CB 4.05Å; T98-F102 HydrophobicContact CG2-CD2 3.78Å; T98-F102 HydrophobicContact CG2-CE2 3.58Å; T98-F102 VanDerWaalsContact O-CD2 3.23Å; T98-F102 WeakPolarHBondContact O-CD2 3.46Å; T98-F102 PolarHBondContact O-N 2.75Å; T98-F102 VanDerWaalsContact O-N 3.16Å; Q99-F102 PolarHBondContact O-N 2.93Å; F102-F105 PolarHBondContact O-N 3.41Å; F102-F106 HydrophobicContact CB-CD2 4.19Å; F102-F106 HydrophobicContact CB-CE2 3.89Å; F102-F106 AromaticContact CD1-CE2 3.8Å; F102-F106 HydrophobicContact CD1-CE2 3.8Å; F102-F106 HydrophobicContact CD1-CZ 4.03Å; F102-F106 HydrophobicContact CG-CE2 4.22Å; F102-F106 WeakPolarHBondContact O-CD2 3.43Å; F102-F106 WeakPolarHBondContact O-CG 3Å; F102-F106 PolarHBondContact O-N 2.68Å
103F88.8Confident91.3Very high12 Ų1226 Ų265%0.05314%0.139CC..Hα-helixtrans-56.8-54.5174.4173.4-106.1000111.6Y73 I77 Q99 L100 F101 F105 V107 Y276 T277Y73-F103 AromaticContact CE2-CD2 3.54Å; Y73-F103 HydrophobicContact CE2-CD2 3.54Å; Y73-F103 HydrophobicContact CE2-CE2 4.07Å; Y73-F103 HydrophobicContact CE2-CG 4.39Å; Y73-F103 AromaticContact CZ-CD2 3.78Å; Y73-F103 AromaticContact CZ-CE2 3.85Å; Y73-F103 WeakPolarHBondContact OH-CD2 3.47Å; Y73-F103 WeakPolarHBondContact OH-CE2 3.43Å; I77-F103 HydrophobicContact CD1-CB 4.23Å; I77-F103 HydrophobicContact CD1-CD2 3.55Å; I77-F103 HydrophobicContact CD1-CE2 4.31Å; I77-F103 HydrophobicContact CD1-CG 4.27Å; I77-F103 HydrophobicContact CG1-CD2 4.18Å; Q99-F103 WeakPolarHBondContact O-CB 3.3Å; Q99-F103 PolarHBondContact O-N 3Å; L100-F103 HydrophobicContact CD1-CD1 4.42Å; L100-F103 PolarHBondContact O-N 3.27Å; F101-F103 VanDerWaalsContact C-N 3.32Å; F101-F103 PolarHBondContact O-N 3.17Å; F103-F105 VanDerWaalsContact C-N 3.28Å; F103-F105 PolarHBondContact O-N 2.95Å; F103-V107 HydrophobicContact CD2-CG2 4.47Å; F103-V107 HydrophobicContact CE2-CG2 4.29Å; F103-V107 HydrophobicContact CZ-CG2 4.45Å; F103-V107 VanDerWaalsContact O-CG2 3.28Å; F103-V107 WeakPolarHBondContact O-CG2 3.45Å; F103-V107 PolarHBondContact O-N 3.17Å; F103-Y276 HydrophobicContact CZ-CE2 4.16Å; F103-T277 HydrophobicContact CE2-CG2 3.69Å; F103-T277 HydrophobicContact CZ-CG2 4.19Å
104A89.8Confident91.5Very high10 Ų1024 Ų248%0.08313%0.13CC..Hα-helixtrans-62.4-37.817800000111.8L100 F101 I108 S155L100-A104 WeakPolarHBondContact O-CB 3.38Å; L100-A104 PolarHBondContact O-N 2.86Å; F101-A104 PolarHBondContact O-N 3.46Å; A104-I108 WeakPolarHBondContact O-CB 3.37Å; A104-I108 WeakPolarHBondContact O-CD1 3.4Å; A104-I108 WeakPolarHBondContact O-CG1 3.21Å; A104-I108 PolarHBondContact O-N 3.47Å; A104-I108 VanDerWaalsContact O-N 3.1Å; A104-S155 WeakPolarHBondContact CB-OG 3.44Å
105F94.1Very high91.7Very high33 Ų3321.5 Ų21.515%0.14511%0.108CC..Hα-helixtrans-63.9-52.3-174.9174.9-101.4000110.5F101 F102 F103 I108 D109 Y148 F152 S155F101-F105 VanDerWaalsContact O-CB 3.24Å; F101-F105 WeakPolarHBondContact O-CB 3.19Å; F101-F105 PolarHBondContact O-N 3.35Å; F102-F105 PolarHBondContact O-N 3.41Å; F103-F105 VanDerWaalsContact C-N 3.28Å; F103-F105 PolarHBondContact O-N 2.95Å; F105-I108 PolarHBondContact O-N 3.04Å; F105-D109 WeakPolarHBondContact CE1-OD2 3.47Å; F105-D109 WeakPolarHBondContact CZ-OD2 3.38Å; F105-D109 WeakPolarHBondContact O-CB 3.06Å; F105-D109 PolarHBondContact O-N 3Å; F105-Y148 HydrophobicContact CZ-CD1 4.1Å; F105-Y148 HydrophobicContact CZ-CG 4.5Å; F105-F152 HydrophobicContact CD2-CB 4.42Å; F105-F152 HydrophobicContact CE2-CB 4.18Å; F105-S155 WeakPolarHBondContact CA-OG 3.46Å; F105-S155 WeakPolarHBondContact CB-OG 3.06Å; F105-S155 PolarHBondContact N-OG 3.47Å
106F92.2Very high92Very high13 Ų1318 Ų186%0.0579%0.093CC..Hα-helixtrans-70.3-35-177.9-67.9-48.5000113.3T69 C72 Y73 V76 F102 D109 E110T69-F106 HydrophobicContact CG2-CB 3.9Å; T69-F106 HydrophobicContact CG2-CD1 3.85Å; T69-F106 HydrophobicContact CG2-CG 4.26Å; T69-F106 WeakPolarHBondContact CG2-O 3.48Å; C72-F106 HydrophobicContact CB-CD1 4.41Å; C72-F106 HydrophobicContact CB-CD2 4.35Å; C72-F106 HydrophobicContact CB-CE1 3.67Å; C72-F106 HydrophobicContact CB-CE2 3.61Å; C72-F106 HydrophobicContact CB-CZ 3.24Å; Y73-F106 HydrophobicContact CD2-CB 3.42Å; Y73-F106 VanDerWaalsContact CD2-CB 3.42Å; Y73-F106 HydrophobicContact CD2-CD2 4.05Å; Y73-F106 HydrophobicContact CD2-CG 4.17Å; Y73-F106 HydrophobicContact CE2-CB 4.21Å; Y73-F106 HydrophobicContact CG-CB 4.06Å; V76-F106 HydrophobicContact CG2-CE2 4.29Å; F102-F106 HydrophobicContact CB-CD2 4.19Å; F102-F106 HydrophobicContact CB-CE2 3.89Å; F102-F106 AromaticContact CD1-CE2 3.8Å; F102-F106 HydrophobicContact CD1-CE2 3.8Å; F102-F106 HydrophobicContact CD1-CZ 4.03Å; F102-F106 HydrophobicContact CG-CE2 4.22Å; F102-F106 WeakPolarHBondContact O-CD2 3.43Å; F102-F106 WeakPolarHBondContact O-CG 3Å; F102-F106 PolarHBondContact O-N 2.68Å; F106-D109 PolarHBondContact O-N 3.19Å; F106-E110 WeakPolarHBondContact O-CB 3.46Å; F106-E110 PolarHBondContact O-N 3.31Å
107V87.8Confident92.1Very high29 Ų2918 Ų1818%0.1769%0.093CC..Hα-helixtrans-62.7-44.9174.7170.30000110.6Y73 F103 E110 C111 Y276Y73-V107 HydrophobicContact CE2-CG2 3.62Å; Y73-V107 WeakPolarHBondContact OH-CG2 3.24Å; F103-V107 HydrophobicContact CD2-CG2 4.47Å; F103-V107 HydrophobicContact CE2-CG2 4.29Å; F103-V107 HydrophobicContact CZ-CG2 4.45Å; F103-V107 VanDerWaalsContact O-CG2 3.28Å; F103-V107 WeakPolarHBondContact O-CG2 3.45Å; F103-V107 PolarHBondContact O-N 3.17Å; V107-E110 PolarHBondContact O-N 3.34Å; V107-C111 PolarHBondContact O-N 3.37Å; V107-C111 PolarHBondContact O-SG 3.38Å; V107-Y276 HydrophobicContact CG2-CE2 4.35Å
108I91.2Very high92.1Very high9 Ų917.5 Ų17.55%0.0469%0.09CC..Hα-helixtrans-65.9-43178.4-65.7169.2000110.2A104 F105 E110 C111 Y112 V201A104-I108 WeakPolarHBondContact O-CB 3.37Å; A104-I108 WeakPolarHBondContact O-CD1 3.4Å; A104-I108 WeakPolarHBondContact O-CG1 3.21Å; A104-I108 PolarHBondContact O-N 3.47Å; A104-I108 VanDerWaalsContact O-N 3.1Å; F105-I108 PolarHBondContact O-N 3.04Å; I108-E110 PolarHBondContact O-N 2.9Å; I108-C111 WeakPolarHBondContact O-CB 3.49Å; I108-C111 PolarHBondContact O-N 3.28Å; I108-Y112 HydrophobicContact CG2-CD2 3.66Å; I108-Y112 HydrophobicContact CG2-CE2 3.52Å; I108-Y112 VanDerWaalsContact O-CD2 3.22Å; I108-Y112 WeakPolarHBondContact O-CD2 3.22Å; I108-Y112 PolarHBondContact O-N 3.16Å; I108-V201 HydrophobicContact CD1-CG1 4.35Å
109D93.6Very high92.2Very high0 Ų018.1 Ų18.10%09%0.085CC..Hα-helixtrans-61.2-43.9177.5-73.8-12.9000112.3T69 F105 F106 C111 Y112 I113 V147 Y148T69-D109 HydrophobicContact CG2-CB 4.31Å; F105-D109 WeakPolarHBondContact CE1-OD2 3.47Å; F105-D109 WeakPolarHBondContact CZ-OD2 3.38Å; F105-D109 WeakPolarHBondContact O-CB 3.06Å; F105-D109 PolarHBondContact O-N 3Å; F106-D109 PolarHBondContact O-N 3.19Å; D109-C111 VanDerWaalsContact C-N 3.34Å; D109-C111 PolarHBondContact O-N 2.91Å; D109-Y112 PolarHBondContact O-N 3.18Å; D109-I113 HydrophobicContact CB-CD1 4.45Å; D109-I113 WeakPolarHBondContact O-CB 3.38Å; D109-I113 WeakPolarHBondContact O-CG1 3.49Å; D109-I113 PolarHBondContact O-N 3.49Å; D109-V147 HydrophobicContact CB-CG1 3.99Å; D109-Y148 HydrophobicContact CB-CD1 4.46Å; D109-Y148 HydrophobicContact CB-CE1 4.46Å; D109-Y148 WeakPolarHBondContact OD2-CD1 3.37Å; D109-Y148 WeakPolarHBondContact OD2-CE1 3.32Å
110E91Very high92.2Very high2 Ų217.6 Ų17.61%0.0098%0.082CC..Hα-helixtrans-56.4-47.8176.7-175.6174.1-177.200111L66 T69 F106 V107 I108 Y112 I113 L114 F250 N284L66-E110 HydrophobicContact CD1-CG 3.86Å; T69-E110 HydrophobicContact CG2-CB 4.46Å; F106-E110 WeakPolarHBondContact O-CB 3.46Å; F106-E110 PolarHBondContact O-N 3.31Å; V107-E110 PolarHBondContact O-N 3.34Å; I108-E110 PolarHBondContact O-N 2.9Å; E110-Y112 PolarHBondContact O-N 3.38Å; E110-I113 PolarHBondContact O-N 2.86Å; E110-L114 HydrophobicContact CG-CD1 4.22Å; E110-L114 WeakPolarHBondContact O-CB 3.35Å; E110-L114 VanDerWaalsContact O-CG 3.31Å; E110-L114 WeakPolarHBondContact O-CG 3.26Å; E110-L114 PolarHBondContact O-N 3.47Å; E110-F250 HydrophobicContact CB-CE2 4.25Å; E110-F250 HydrophobicContact CG-CD2 4.08Å; E110-F250 HydrophobicContact CG-CE2 3.75Å; E110-F250 HydrophobicContact CG-CZ 4.36Å; E110-F250 WeakPolarHBondContact OE1-CD2 3.4Å; E110-F250 VanDerWaalsContact OE2-CE2 3.32Å; E110-F250 WeakPolarHBondContact OE2-CE2 3.44Å; E110-N284 PolarHBondContact OE1-ND2 3.32Å
111C90.6Very high92.2Very high10 Ų1019.1 Ų19.17%0.0689%0.088CC..Hα-helixtrans-53.5-49.7175.9-66.80000112.5V107 I108 D109 T115 P209 F250V107-C111 PolarHBondContact O-N 3.37Å; V107-C111 PolarHBondContact O-SG 3.38Å; I108-C111 WeakPolarHBondContact O-CB 3.49Å; I108-C111 PolarHBondContact O-N 3.28Å; D109-C111 VanDerWaalsContact C-N 3.34Å; D109-C111 PolarHBondContact O-N 2.91Å; C111-T115 PolarHBondContact O-N 3.48Å; C111-T115 PolarHBondContact O-OG1 2.82Å; C111-P209 HydrophobicContact CB-CG 4.32Å; C111-F250 HydrophobicContact CB-CE1 4.4Å; C111-F250 WeakPolarHBondContact SG-CE1 3.17Å; C111-F250 WeakPolarHBondContact SG-CZ 3.48Å
112Y93.7Very high92.1Very high28 Ų2819 Ų1911%0.119%0.087CC..Hα-helixtrans-78.8-29.5-175-73.8-68.4000112.8I108 D109 E110 T115 A116 M150 N205 V208 P209I108-Y112 HydrophobicContact CG2-CD2 3.66Å; I108-Y112 HydrophobicContact CG2-CE2 3.52Å; I108-Y112 VanDerWaalsContact O-CD2 3.22Å; I108-Y112 WeakPolarHBondContact O-CD2 3.22Å; I108-Y112 PolarHBondContact O-N 3.16Å; D109-Y112 PolarHBondContact O-N 3.18Å; E110-Y112 PolarHBondContact O-N 3.38Å; Y112-T115 WeakPolarHBondContact O-CB 3.45Å; Y112-T115 PolarHBondContact O-N 2.92Å; Y112-A116 WeakPolarHBondContact O-CB 3.32Å; Y112-A116 PolarHBondContact O-N 3Å; Y112-M150 HydrophobicContact CD2-CB 4.13Å; Y112-M150 HydrophobicContact CE2-CB 3.82Å; Y112-M150 HydrophobicContact CE2-CG 4.47Å; Y112-N205 WeakPolarHBondContact CE2-OD1 3.4Å; Y112-N205 VanDerWaalsContact CZ-OD1 3.31Å; Y112-N205 PolarHBondContact OH-OD1 2.86Å; Y112-V208 HydrophobicContact CE1-CG1 4.37Å; Y112-P209 HydrophobicContact CD1-CG 4.26Å; Y112-P209 HydrophobicContact CE1-CG 4.03Å
113I94.7Very high92Very high1 Ų115.3 Ų15.31%0.0057%0.071CC..Hα-helixtrans-63.9-47171-68.9165.4000109.7F62 N65 L66 D109 E110 T115 A116 M117 V147F62-I113 HydrophobicContact CB-CG2 4.32Å; N65-I113 HydrophobicContact CB-CD1 4.09Å; L66-I113 HydrophobicContact CB-CG2 3.84Å; L66-I113 HydrophobicContact CD1-CB 4.49Å; L66-I113 HydrophobicContact CD1-CG2 4.2Å; D109-I113 HydrophobicContact CB-CD1 4.45Å; D109-I113 WeakPolarHBondContact O-CB 3.38Å; D109-I113 WeakPolarHBondContact O-CG1 3.49Å; D109-I113 PolarHBondContact O-N 3.49Å; E110-I113 PolarHBondContact O-N 2.86Å; I113-T115 PolarHBondContact O-N 3.24Å; I113-A116 WeakPolarHBondContact O-CB 3.28Å; I113-A116 PolarHBondContact O-N 3.22Å; I113-A116 VanDerWaalsContact O-N 3.13Å; I113-M117 HydrophobicContact CG2-CG 4.43Å; I113-M117 HydrophobicContact CG2-SD 3.87Å; I113-M117 VanDerWaalsContact O-CG 3.29Å; I113-M117 WeakPolarHBondContact O-CG 3.44Å; I113-M117 PolarHBondContact O-N 3.38Å; I113-V147 HydrophobicContact CG1-CG1 4.01Å
114L91.8Very high92Very high1 Ų116.3 Ų16.31%0.0058%0.082CC..Hα-helixtrans-59.4-37.6174.1-69.6173.8000111.6L66 E110 M117 A118 H243 A246 F250 Y288L66-L114 HydrophobicContact CD2-CD2 4.15Å; E110-L114 HydrophobicContact CG-CD1 4.22Å; E110-L114 WeakPolarHBondContact O-CB 3.35Å; E110-L114 VanDerWaalsContact O-CG 3.31Å; E110-L114 WeakPolarHBondContact O-CG 3.26Å; E110-L114 PolarHBondContact O-N 3.47Å; L114-M117 HydrophobicContact CD2-SD 4.45Å; L114-M117 PolarHBondContact O-N 3.27Å; L114-A118 PolarHBondContact O-N 3.08Å; L114-H243 PolarHBondContact O-CE1 3.27Å; L114-H243 PolarHBondContact O-NE2 3.18Å; L114-A246 HydrophobicContact CD2-CB 4.38Å; L114-F250 HydrophobicContact CD1-CB 4.05Å; L114-F250 HydrophobicContact CD1-CD1 4.19Å; L114-F250 HydrophobicContact CD1-CD2 4.39Å; L114-F250 HydrophobicContact CD1-CG 3.93Å; L114-Y288 WeakPolarHBondContact CD2-OH 3.41Å
115T92.7Very high91.9Very high13 Ų1317.5 Ų17.58%0.089%0.086CC..Hα-helixtrans-65.4-43.2175-56.80000112C111 Y112 I113 M117 A118 Y119 P209 T212C111-T115 PolarHBondContact O-N 3.48Å; C111-T115 PolarHBondContact O-OG1 2.82Å; Y112-T115 WeakPolarHBondContact O-CB 3.45Å; Y112-T115 PolarHBondContact O-N 2.92Å; I113-T115 PolarHBondContact O-N 3.24Å; T115-M117 VanDerWaalsContact C-N 3.33Å; T115-M117 PolarHBondContact O-N 3.16Å; T115-A118 WeakPolarHBondContact O-CB 3.44Å; T115-A118 PolarHBondContact O-N 3.47Å; T115-Y119 PolarHBondContact O-N 2.93Å; T115-P209 VanDerWaalsContact OG1-CB 3.3Å; T115-P209 WeakPolarHBondContact OG1-CB 3.44Å; T115-T212 HydrophobicContact CG2-CG2 3.47Å; T115-T212 VanDerWaalsContact CG2-CG2 3.47Å
116A94.8Very high91.5Very high5 Ų517.2 Ų17.24%0.0419%0.088CC..Hα-helixtrans-63.6-39.5176.500000111.9F62 Y112 I113 Y119 D120 M143F62-A116 HydrophobicContact CD1-CB 4Å; F62-A116 HydrophobicContact CE1-CB 3.76Å; F62-A116 HydrophobicContact CE2-CB 4.38Å; F62-A116 HydrophobicContact CG-CB 4.43Å; F62-A116 HydrophobicContact CZ-CB 3.96Å; Y112-A116 WeakPolarHBondContact O-CB 3.32Å; Y112-A116 PolarHBondContact O-N 3Å; I113-A116 WeakPolarHBondContact O-CB 3.28Å; I113-A116 PolarHBondContact O-N 3.22Å; I113-A116 VanDerWaalsContact O-N 3.13Å; A116-Y119 PolarHBondContact O-N 3.41Å; A116-D120 PolarHBondContact O-N 2.87Å; A116-M143 HydrophobicContact CB-CE 3.66Å
117M93.8Very high91.3Very high0 Ų021.1 Ų21.10%011%0.105CC..Hα-helixtrans-63.5-39.8173.7-69.7168.778.100111.7M59 F62 L63 L66 I113 L114 T115 Y119 D120 R121 H243 Y288M59-M117 HydrophobicContact CE-CB 4.42Å; M59-M117 HydrophobicContact CE-CE 3.27Å; M59-M117 HydrophobicContact SD-CB 4.17Å; M59-M117 HydrophobicContact SD-CE 4.04Å; M59-M117 HydrophobicContact SD-CG 4.26Å; F62-M117 HydrophobicContact CB-CG 3.42Å; F62-M117 VanDerWaalsContact CB-CG 3.42Å; F62-M117 HydrophobicContact CB-SD 4.14Å; F62-M117 HydrophobicContact CD2-CG 4.43Å; F62-M117 HydrophobicContact CG-CG 4.15Å; L63-M117 HydrophobicContact CB-CE 4.41Å; L63-M117 HydrophobicContact CD1-CE 4.23Å; L66-M117 HydrophobicContact CD2-CE 4.42Å; L66-M117 HydrophobicContact CD2-SD 4.11Å; I113-M117 HydrophobicContact CG2-CG 4.43Å; I113-M117 HydrophobicContact CG2-SD 3.87Å; I113-M117 VanDerWaalsContact O-CG 3.29Å; I113-M117 WeakPolarHBondContact O-CG 3.44Å; I113-M117 PolarHBondContact O-N 3.38Å; L114-M117 HydrophobicContact CD2-SD 4.45Å; L114-M117 PolarHBondContact O-N 3.27Å; T115-M117 VanDerWaalsContact C-N 3.33Å; T115-M117 PolarHBondContact O-N 3.16Å; M117-Y119 VanDerWaalsContact C-N 3.33Å; M117-Y119 PolarHBondContact O-N 3.41Å; M117-D120 WeakPolarHBondContact O-CB 3.18Å; M117-D120 PolarHBondContact O-N 3.5Å; M117-R121 WeakPolarHBondContact O-CG 3.31Å; M117-R121 PolarHBondContact O-N 3.46Å; M117-H243 VanDerWaalsContact CB-NE2 3.29Å; M117-H243 WeakPolarHBondContact CB-NE2 3.41Å; M117-Y288 HydrophobicContact CE-CD1 4.29Å; M117-Y288 HydrophobicContact CE-CE1 3.54Å; M117-Y288 HydrophobicContact CE-CE2 4.23Å; M117-Y288 WeakPolarHBondContact CE-OH 3.3Å
118A92.2Very high91.2Very high0 Ų024 Ų240%012%0.124CC..Hα-helixtrans-62.4-41.1172.900000112.4L114 T115 R121 Y122 L213 Y217L114-A118 PolarHBondContact O-N 3.08Å; T115-A118 WeakPolarHBondContact O-CB 3.44Å; T115-A118 PolarHBondContact O-N 3.47Å; A118-R121 PolarHBondContact O-N 3.01Å; A118-Y122 PolarHBondContact O-N 3.42Å; A118-L213 HydrophobicContact CB-CD2 3.45Å; A118-L213 VanDerWaalsContact CB-CD2 3.45Å; A118-Y217 HydrophobicContact CB-CE2 4.05Å
119Y92.4Very high91.1Very high85 Ų8531.8 Ų31.833%0.33317%0.165SC..Hα-helixtrans-65.4-37.7175.8-176.7-108.2000112.1T115 A116 M117 Y122 A123 M135 M143T115-Y119 PolarHBondContact O-N 2.93Å; A116-Y119 PolarHBondContact O-N 3.41Å; M117-Y119 VanDerWaalsContact C-N 3.33Å; M117-Y119 PolarHBondContact O-N 3.41Å; Y119-Y122 AromaticContact CD2-CD1 3.98Å; Y119-Y122 HydrophobicContact CD2-CD1 3.98Å; Y119-Y122 AromaticContact CE2-CD1 3.93Å; Y119-Y122 HydrophobicContact CE2-CD1 3.93Å; Y119-Y122 HydrophobicContact CE2-CE1 4.2Å; Y119-Y122 WeakPolarHBondContact O-CB 3.07Å; Y119-Y122 PolarHBondContact O-N 3.46Å; Y119-A123 WeakPolarHBondContact O-CB 3.5Å; Y119-A123 PolarHBondContact O-N 3.42Å; Y119-M135 HydrophobicContact CD1-CE 3.27Å; Y119-M135 HydrophobicContact CD1-SD 4.43Å; Y119-M135 HydrophobicContact CE1-CE 3.79Å; Y119-M135 HydrophobicContact CE1-SD 4.46Å; Y119-M135 HydrophobicContact CG-CE 4.22Å; Y119-M143 HydrophobicContact CD1-CE 3.73Å; Y119-M143 HydrophobicContact CD1-SD 4.25Å; Y119-M143 HydrophobicContact CG-CE 4.41Å
120D92.8Very high91Very high0 Ų036.3 Ų36.30%019%0.188CC..Hα-helixtrans-56.7-50.2170.6175.973.2000111.8P58 M59 A116 M117 Y122 A123 A124 Y131 M135P58-D120 WeakPolarHBondContact CB-OD1 3.41Å; M59-D120 WeakPolarHBondContact CB-OD2 3.21Å; A116-D120 PolarHBondContact O-N 2.87Å; M117-D120 WeakPolarHBondContact O-CB 3.18Å; M117-D120 PolarHBondContact O-N 3.5Å; D120-Y122 VanDerWaalsContact C-N 3.3Å; D120-Y122 PolarHBondContact O-N 3.5Å; D120-A123 PolarHBondContact O-N 2.95Å; D120-A124 WeakPolarHBondContact O-CB 3.14Å; D120-A124 PolarHBondContact O-N 3.45Å; D120-Y131 WeakPolarHBondContact OD1-CE2 3.3Å; D120-Y131 PolarHBondContact OD1-OH 3.16Å; D120-M135 HydrophobicContact CB-CE 3.68Å; D120-M135 VanDerWaalsContact N-CE 3.3Å
121R90.9Very high90.9Very high33 Ų3338.6 Ų38.613%0.12520%0.197CC..Hα-helixtrans-61.5-40.9178.6-64.7-53.9-175.3-168.39.2112M59 M117 A118 I125 I220M59-R121 VanDerWaalsContact CG-NH2 3.33Å; M59-R121 HydrophobicContact SD-CG 4.45Å; M59-R121 VanDerWaalsContact SD-CZ 3.54Å; M59-R121 PolarHBondContact SD-NE 3.36Å; M59-R121 VanDerWaalsContact SD-NE 3.35Å; M117-R121 WeakPolarHBondContact O-CG 3.31Å; M117-R121 PolarHBondContact O-N 3.46Å; A118-R121 PolarHBondContact O-N 3.01Å; R121-I125 WeakPolarHBondContact O-CB 3.35Å; R121-I125 WeakPolarHBondContact O-CG1 3.38Å; R121-I125 PolarHBondContact O-N 3.23Å; R121-I125 VanDerWaalsContact O-N 3.07Å; R121-I220 HydrophobicContact CB-CD1 4.2Å
122Y91.4Very high90.8Very high36 Ų3646.3 Ų46.314%0.14123%0.233CC..Hα-helixtrans-60.2-51173.3163.5-98.7000111.5A118 Y119 D120 A124 I125 C126 K127 L219A118-Y122 PolarHBondContact O-N 3.42Å; Y119-Y122 AromaticContact CD2-CD1 3.98Å; Y119-Y122 HydrophobicContact CD2-CD1 3.98Å; Y119-Y122 AromaticContact CE2-CD1 3.93Å; Y119-Y122 HydrophobicContact CE2-CD1 3.93Å; Y119-Y122 HydrophobicContact CE2-CE1 4.2Å; Y119-Y122 WeakPolarHBondContact O-CB 3.07Å; Y119-Y122 PolarHBondContact O-N 3.46Å; D120-Y122 VanDerWaalsContact C-N 3.3Å; D120-Y122 PolarHBondContact O-N 3.5Å; Y122-A124 VanDerWaalsContact C-N 3.32Å; Y122-A124 PolarHBondContact O-N 2.81Å; Y122-I125 PolarHBondContact O-N 3.32Å; Y122-C126 HydrophobicContact CD2-CB 3.78Å; Y122-C126 HydrophobicContact CE2-CB 3.55Å; Y122-C126 WeakPolarHBondContact O-CA 3.19Å; Y122-C126 VanDerWaalsContact O-CB 3.23Å; Y122-C126 WeakPolarHBondContact O-CB 3.33Å; Y122-C126 PolarHBondContact O-N 3.19Å; Y122-K127 WeakPolarHBondContact OH-CE 3.3Å; Y122-L219 HydrophobicContact CD2-CB 4Å; Y122-L219 HydrophobicContact CD2-CD1 4.24Å; Y122-L219 HydrophobicContact CE2-CB 3.78Å; Y122-L219 HydrophobicContact CE2-CD1 3.53Å; Y122-L219 HydrophobicContact CE2-CG 4.3Å
123A91.3Very high90.6Very high1 Ų150.3 Ų50.31%0.00826%0.259CS..Hα-helixtrans-62.5-41.2-178.500000111.6Y119 D120 K127 Y131 M135Y119-A123 WeakPolarHBondContact O-CB 3.5Å; Y119-A123 PolarHBondContact O-N 3.42Å; D120-A123 PolarHBondContact O-N 2.95Å; A123-K127 CarbonylContact O-C 3.59Å; A123-K127 WeakPolarHBondContact O-CA 3.49Å; A123-K127 PolarHBondContact O-N 3.33Å; A123-Y131 HydrophobicContact CB-CD2 3.95Å; A123-Y131 HydrophobicContact CB-CE2 4.38Å; A123-M135 HydrophobicContact CB-CG 4.16Å
124A89.6Confident90.3Very high34 Ų3452 Ų5228%0.28127%0.27SS..Hα-helixtrans-65-40.6-179.900000112.9D120 Y122 Y131D120-A124 WeakPolarHBondContact O-CB 3.14Å; D120-A124 PolarHBondContact O-N 3.45Å; Y122-A124 VanDerWaalsContact C-N 3.32Å; Y122-A124 PolarHBondContact O-N 2.81Å; A124-Y131 VanDerWaalsContact CA-CD2 3.49Å; A124-Y131 HydrophobicContact CB-CD2 3.9Å; A124-Y131 HydrophobicContact CB-CE2 3.69Å
125I86.6Confident90.3Very high35 Ų3552.3 Ų52.318%0.17927%0.272CS..Hα-helixtrans-87.9-46.9-176.1-64171.5000111.1R121 Y122 I220 C240R121-I125 WeakPolarHBondContact O-CB 3.35Å; R121-I125 WeakPolarHBondContact O-CG1 3.38Å; R121-I125 PolarHBondContact O-N 3.23Å; R121-I125 VanDerWaalsContact O-N 3.07Å; Y122-I125 PolarHBondContact O-N 3.32Å; I125-I220 HydrophobicContact CD1-CG2 3.93Å; I125-C240 WeakPolarHBondContact CD1-SG 3.48Å
126C86.9Confident90.4Very high26 Ų2653.4 Ų53.418%0.17628%0.28CS..Hα-helixtrans-88.6-22-170.5-63.30000114.2Y122 N223Y122-C126 HydrophobicContact CD2-CB 3.78Å; Y122-C126 HydrophobicContact CE2-CB 3.55Å; Y122-C126 WeakPolarHBondContact O-CA 3.19Å; Y122-C126 VanDerWaalsContact O-CB 3.23Å; Y122-C126 WeakPolarHBondContact O-CB 3.33Å; Y122-C126 PolarHBondContact O-N 3.19Å; C126-N223 WeakPolarHBondContact CA-ND2 3.24Å
127K87.9Confident90.2Very high95 Ų9563.2 Ų63.241%0.41332%0.316SS..  trans-13655.6-178.8-63.5-169175.3-178.40112.2Y122 A123 L129 L130 Y131Y122-K127 WeakPolarHBondContact OH-CE 3.3Å; A123-K127 CarbonylContact O-C 3.59Å; A123-K127 WeakPolarHBondContact O-CA 3.49Å; A123-K127 PolarHBondContact O-N 3.33Å; K127-L129 VanDerWaalsContact C-N 3.28Å; K127-L129 PolarHBondContact O-N 2.98Å; K127-L129 VanDerWaalsContact O-N 3.17Å; K127-L130 HydrophobicContact CB-CB 4.4Å; K127-L130 HydrophobicContact CD-CD1 4.42Å; K127-L130 PolarHBondContact O-N 3.37Å; K127-Y131 PolarHBondContact O-N 3.36Å
128P85.7Confident90.2Very high89 Ų8970.7 Ų70.758%0.57835%0.351SS*.THydrogen-bonded Turntrans-58.5-35.8-172.823.8-34.5000113.5L130 Y131P128-L130 VanDerWaalsContact C-N 3.3Å; P128-L130 PolarHBondContact O-N 3.04Å; P128-Y131 WeakPolarHBondContact O-CB 3.37Å; P128-Y131 PolarHBondContact O-N 2.8Å
129L89.1Confident90.3Very high174 Ų17473 Ų7391%0.91137%0.365SS*.THydrogen-bonded Turntrans-68.3-27.4178.8-64.1176.2000113.6K127K127-L129 VanDerWaalsContact C-N 3.28Å; K127-L129 PolarHBondContact O-N 2.98Å; K127-L129 VanDerWaalsContact O-N 3.17Å
130L90.8Very high90.4Very high94 Ų9469.2 Ų69.249%0.49235%0.35SS..THydrogen-bonded Turntrans-99.6-8.7-179.1-65.3171.5000112.4K127 P128 Q132 V133 T134K127-L130 HydrophobicContact CB-CB 4.4Å; K127-L130 HydrophobicContact CD-CD1 4.42Å; K127-L130 PolarHBondContact O-N 3.37Å; P128-L130 VanDerWaalsContact C-N 3.3Å; P128-L130 PolarHBondContact O-N 3.04Å; L130-Q132 VanDerWaalsContact C-N 3.3Å; L130-Q132 PolarHBondContact O-N 2.72Å; L130-V133 PolarHBondContact O-N 2.96Å; L130-T134 HydrophobicContact CB-CG2 4.1Å; L130-T134 PolarHBondContact O-N 3Å; L130-T134 PolarHBondContact O-OG1 2.98Å; L130-T134 VanDerWaalsContact O-OG1 3.08Å
131Y90.4Very high90.5Very high51 Ų5173.3 Ų73.320%0.237%0.372CS..Hα-helixtrans-52.2-44.5-172-179.9-107.9000113.2P58 D120 A123 A124 K127 P128 V133 T134 M135P58-Y131 WeakPolarHBondContact CG-OH 3.44Å; D120-Y131 WeakPolarHBondContact OD1-CE2 3.3Å; D120-Y131 PolarHBondContact OD1-OH 3.16Å; A123-Y131 HydrophobicContact CB-CD2 3.95Å; A123-Y131 HydrophobicContact CB-CE2 4.38Å; A124-Y131 VanDerWaalsContact CA-CD2 3.49Å; A124-Y131 HydrophobicContact CB-CD2 3.9Å; A124-Y131 HydrophobicContact CB-CE2 3.69Å; K127-Y131 PolarHBondContact O-N 3.36Å; P128-Y131 WeakPolarHBondContact O-CB 3.37Å; P128-Y131 PolarHBondContact O-N 2.8Å; Y131-V133 PolarHBondContact O-N 2.98Å; Y131-T134 WeakPolarHBondContact CA-OG1 3.48Å; Y131-T134 PolarHBondContact O-N 3.43Å; Y131-T134 PolarHBondContact O-OG1 2.98Å; Y131-M135 HydrophobicContact CD2-CB 4.07Å; Y131-M135 HydrophobicContact CD2-CG 4.12Å; Y131-M135 HydrophobicContact CE2-CB 3.68Å; Y131-M135 HydrophobicContact CE2-CG 3.7Å; Y131-M135 WeakPolarHBondContact O-CA 3.41Å; Y131-M135 WeakPolarHBondContact O-CB 3.3Å; Y131-M135 PolarHBondContact O-N 2.79Å
132Q87.3Confident90.8Very high172 Ų17277.5 Ų77.580%0.80440%0.396SS*.Hα-helixtrans-62.9-31-178.7-71-164.5-17.500113.5L130 S136L130-Q132 VanDerWaalsContact C-N 3.3Å; L130-Q132 PolarHBondContact O-N 2.72Å; Q132-S136 PolarHBondContact O-N 2.95Å
133V89.2Confident91Very high111 Ų11178.1 Ų78.167%0.67340%0.401SS*.Hα-helixtrans-85.3-44.5178.4-177.30000110.1L130 Y131 M135L130-V133 PolarHBondContact O-N 2.96Å; Y131-V133 PolarHBondContact O-N 2.98Å; V133-M135 PolarHBondContact O-N 3.31Å
134T88.5Confident91.2Very high38 Ų3878.3 Ų78.323%0.23340%0.402CS..Hα-helixtrans-73.5-25.9-176.955.90000113.6L130 Y131 V139L130-T134 HydrophobicContact CB-CG2 4.1Å; L130-T134 PolarHBondContact O-N 3Å; L130-T134 PolarHBondContact O-OG1 2.98Å; L130-T134 VanDerWaalsContact O-OG1 3.08Å; Y131-T134 WeakPolarHBondContact CA-OG1 3.48Å; Y131-T134 PolarHBondContact O-N 3.43Å; Y131-T134 PolarHBondContact O-OG1 2.98Å; T134-V139 WeakPolarHBondContact O-CG1 3.49Å
135M93Very high91.5Very high7 Ų782.7 Ų82.73%0.03442%0.418CS..THydrogen-bonded Turntrans-120.944.9174.5-73.8-55-158.600111.4P58 F62 Y119 D120 A123 Y131 V133 M143P58-M135 HydrophobicContact CB-CB 4.24Å; P58-M135 HydrophobicContact CG-CB 4.01Å; P58-M135 WeakPolarHBondContact CG-O 3.46Å; F62-M135 HydrophobicContact CE2-CE 4.37Å; Y119-M135 HydrophobicContact CD1-CE 3.27Å; Y119-M135 HydrophobicContact CD1-SD 4.43Å; Y119-M135 HydrophobicContact CE1-CE 3.79Å; Y119-M135 HydrophobicContact CE1-SD 4.46Å; Y119-M135 HydrophobicContact CG-CE 4.22Å; D120-M135 HydrophobicContact CB-CE 3.68Å; D120-M135 VanDerWaalsContact N-CE 3.3Å; A123-M135 HydrophobicContact CB-CG 4.16Å; Y131-M135 HydrophobicContact CD2-CB 4.07Å; Y131-M135 HydrophobicContact CD2-CG 4.12Å; Y131-M135 HydrophobicContact CE2-CB 3.68Å; Y131-M135 HydrophobicContact CE2-CG 3.7Å; Y131-M135 WeakPolarHBondContact O-CA 3.41Å; Y131-M135 WeakPolarHBondContact O-CB 3.3Å; Y131-M135 PolarHBondContact O-N 2.79Å; V133-M135 PolarHBondContact O-N 3.31Å; M135-M143 HydrophobicContact CE-CE 4.33Å; M135-M143 HydrophobicContact CE-SD 4.02Å; M135-M143 HydrophobicContact SD-SD 4.14Å
136S93.3Very high92Very high36 Ų3682.7 Ų82.725%0.25243%0.427SS..  trans-68.7158.4168.972.90000110.8Q132 Q138 V139 C140Q132-S136 PolarHBondContact O-N 2.95Å; S136-Q138 PolarHBondContact O-N 3.21Å; S136-Q138 VanDerWaalsContact O-N 3.16Å; S136-V139 PolarHBondContact O-N 2.82Å; S136-V139 WeakPolarHBondContact OG-CG2 3.36Å; S136-C140 PolarHBondContact O-N 3.48Å; S136-C140 PolarHBondContact O-SG 3.5Å; S136-C140 VanDerWaalsContact O-SG 3.39Å
137R90.9Very high92.4Very high210 Ų21081.9 Ų81.979%0.79242%0.421SS*.Hα-helixtrans-54.1-37.6178.4-174.5176.8179.5-174.1-0.2112.9C140 L141R137-C140 PolarHBondContact O-N 3.43Å; R137-L141 HydrophobicContact CG-CD1 4.26Å; R137-L141 VanDerWaalsContact O-CG 3.25Å; R137-L141 WeakPolarHBondContact O-CG 3.23Å; R137-L141 PolarHBondContact O-N 3.41Å
138Q93.8Very high92.8Very high158 Ų15880.3 Ų80.374%0.73841%0.413SS*.Hα-helixtrans-65.8-41.9178.3-69.1177.8-7.700111.6S136 L141 L142S136-Q138 PolarHBondContact O-N 3.21Å; S136-Q138 VanDerWaalsContact O-N 3.16Å; Q138-L141 PolarHBondContact O-N 3.36Å; Q138-L142 WeakPolarHBondContact O-CB 3.33Å; Q138-L142 PolarHBondContact O-N 3.43Å
139V94.3Very high93.3Very high49 Ų4979.5 Ų79.530%0.29741%0.406SS..Hα-helixtrans-65.7-44.6176.5177.10000110.5T134 S136 L141 L142 M143T134-V139 WeakPolarHBondContact O-CG1 3.49Å; S136-V139 PolarHBondContact O-N 2.82Å; S136-V139 WeakPolarHBondContact OG-CG2 3.36Å; V139-L141 VanDerWaalsContact C-N 3.32Å; V139-L141 PolarHBondContact O-N 2.85Å; V139-L142 PolarHBondContact O-N 3.35Å; V139-L142 VanDerWaalsContact O-N 3.16Å; V139-M143 HydrophobicContact CG1-CG 4.23Å; V139-M143 HydrophobicContact CG1-SD 4.06Å; V139-M143 VanDerWaalsContact O-CG 3.31Å; V139-M143 WeakPolarHBondContact O-CG 3.37Å; V139-M143 PolarHBondContact O-N 2.9Å
140C94.9Very high93.5Very high4 Ų474.8 Ų74.83%0.02738%0.38CS..Hα-helixtrans-59.2-42.2176.4-600000112.3Y61 F62 S136 R137 M143 T144Y61-C140 HydrophobicContact CD1-CB 3.79Å; Y61-C140 HydrophobicContact CE1-CB 3.82Å; F62-C140 HydrophobicContact CZ-CB 4.14Å; S136-C140 PolarHBondContact O-N 3.48Å; S136-C140 PolarHBondContact O-SG 3.5Å; S136-C140 VanDerWaalsContact O-SG 3.39Å; R137-C140 PolarHBondContact O-N 3.43Å; C140-M143 PolarHBondContact O-N 3.45Å; C140-T144 PolarHBondContact O-N 3.35Å; C140-T144 PolarHBondContact O-OG1 2.88Å; C140-T144 VanDerWaalsContact O-OG1 3.14Å
141L94.8Very high93.7Very high86 Ų8670.3 Ų70.345%0.4536%0.357SS..Hα-helixtrans-62.2-44.7175-72.8167.9000111.7Y61 R137 Q138 V139 M143 T144 M145Y61-L141 HydrophobicContact CE2-CD2 4.47Å; R137-L141 HydrophobicContact CG-CD1 4.26Å; R137-L141 VanDerWaalsContact O-CG 3.25Å; R137-L141 WeakPolarHBondContact O-CG 3.23Å; R137-L141 PolarHBondContact O-N 3.41Å; Q138-L141 PolarHBondContact O-N 3.36Å; V139-L141 VanDerWaalsContact C-N 3.32Å; V139-L141 PolarHBondContact O-N 2.85Å; L141-M143 VanDerWaalsContact C-N 3.35Å; L141-T144 PolarHBondContact O-N 3.29Å; L141-M145 WeakPolarHBondContact O-CB 3.28Å; L141-M145 PolarHBondContact O-N 2.9Å
142L96.4Very high93.9Very high122 Ų12272.4 Ų72.464%0.63937%0.367SS*.Hα-helixtrans-64.2-40.5178.2-17268.4000111.7Q138 V139 M145 G146Q138-L142 WeakPolarHBondContact O-CB 3.33Å; Q138-L142 PolarHBondContact O-N 3.43Å; V139-L142 PolarHBondContact O-N 3.35Å; V139-L142 VanDerWaalsContact O-N 3.16Å; L142-M145 PolarHBondContact O-N 2.93Å; L142-G146 PolarHBondContact O-N 2.95Å
143M95.8Very high94.3Very high48 Ų4869 Ų6924%0.23635%0.354CS..Hα-helixtrans-61.4-49.5174.6-71.4179.280.200110.9F62 A116 Y119 M135 V139 C140 L141 M145 G146 V147F62-M143 HydrophobicContact CE1-CB 4.14Å; F62-M143 HydrophobicContact CZ-CB 4.12Å; F62-M143 HydrophobicContact CZ-CE 4.38Å; F62-M143 HydrophobicContact CZ-SD 3.96Å; A116-M143 HydrophobicContact CB-CE 3.66Å; Y119-M143 HydrophobicContact CD1-CE 3.73Å; Y119-M143 HydrophobicContact CD1-SD 4.25Å; Y119-M143 HydrophobicContact CG-CE 4.41Å; M135-M143 HydrophobicContact CE-CE 4.33Å; M135-M143 HydrophobicContact CE-SD 4.02Å; M135-M143 HydrophobicContact SD-SD 4.14Å; V139-M143 HydrophobicContact CG1-CG 4.23Å; V139-M143 HydrophobicContact CG1-SD 4.06Å; V139-M143 VanDerWaalsContact O-CG 3.31Å; V139-M143 WeakPolarHBondContact O-CG 3.37Å; V139-M143 PolarHBondContact O-N 2.9Å; C140-M143 PolarHBondContact O-N 3.45Å; L141-M143 VanDerWaalsContact C-N 3.35Å; M143-M145 VanDerWaalsContact C-N 3.33Å; M143-M145 PolarHBondContact O-N 2.92Å; M143-G146 PolarHBondContact O-N 2.87Å; M143-G146 VanDerWaalsContact O-N 3.15Å; M143-V147 VanDerWaalsContact O-CG2 3.3Å; M143-V147 WeakPolarHBondContact O-CG2 3.49Å; M143-V147 PolarHBondContact O-N 2.84Å
144T95.9Very high94.4Very high6 Ų664.2 Ų64.24%0.03733%0.327CS..Hα-helixtrans-60.4-42.1176.6-61.50000112.2Y61 C140 L141 G146 V147 Y148Y61-T144 WeakPolarHBondContact CE1-OG1 3.49Å; Y61-T144 WeakPolarHBondContact OH-CB 3.31Å; Y61-T144 PolarHBondContact OH-OG1 3.37Å; Y61-T144 VanDerWaalsContact OH-OG1 3.09Å; C140-T144 PolarHBondContact O-N 3.35Å; C140-T144 PolarHBondContact O-OG1 2.88Å; C140-T144 VanDerWaalsContact O-OG1 3.14Å; L141-T144 PolarHBondContact O-N 3.29Å; T144-G146 VanDerWaalsContact C-N 3.31Å; T144-G146 PolarHBondContact O-N 2.77Å; T144-V147 WeakPolarHBondContact O-CB 3.49Å; T144-V147 PolarHBondContact O-N 3.06Å; T144-Y148 HydrophobicContact CG2-CD2 3.88Å; T144-Y148 HydrophobicContact CG2-CE2 3.45Å; T144-Y148 VanDerWaalsContact CG2-CE2 3.45Å; T144-Y148 PolarHBondContact O-N 3Å
145M96.6Very high94.6Very high125 Ų12562.4 Ų62.462%0.61632%0.316SS*.Hα-helixtrans-60.7-43.9175.2-171-176.6-152.300111L141 L142 M143 V147 Y148 V149L141-M145 WeakPolarHBondContact O-CB 3.28Å; L141-M145 PolarHBondContact O-N 2.9Å; L142-M145 PolarHBondContact O-N 2.93Å; M143-M145 VanDerWaalsContact C-N 3.33Å; M143-M145 PolarHBondContact O-N 2.92Å; M145-V147 VanDerWaalsContact C-N 3.33Å; M145-V147 PolarHBondContact O-N 3.41Å; M145-Y148 PolarHBondContact O-N 3.04Å; M145-V149 HydrophobicContact CG-CG2 4.49Å; M145-V149 WeakPolarHBondContact O-CB 3.42Å; M145-V149 VanDerWaalsContact O-CG2 3.25Å; M145-V149 WeakPolarHBondContact O-CG2 3.32Å; M145-V149 PolarHBondContact O-N 3.47Å
146G96.3Very high94.6Very high35 Ų3565.3 Ų65.336%0.36133%0.33SS..Hα-helixtrans-58.7-43.4174.400000112.4L142 M143 T144 V149 M150L142-G146 PolarHBondContact O-N 2.95Å; M143-G146 PolarHBondContact O-N 2.87Å; M143-G146 VanDerWaalsContact O-N 3.15Å; T144-G146 VanDerWaalsContact C-N 3.31Å; T144-G146 PolarHBondContact O-N 2.77Å; G146-V149 PolarHBondContact O-N 3.48Å; G146-M150 WeakPolarHBondContact O-CB 3.38Å; G146-M150 VanDerWaalsContact O-CG 3.27Å; G146-M150 WeakPolarHBondContact O-CG 3.27Å; G146-M150 PolarHBondContact O-N 2.74Å
147V95.9Very high94.4Very high10 Ų1065.2 Ų65.26%0.06133%0.331CS..Hα-helixtrans-56.3-55.9174.9175.10000110.9D109 I113 M143 T144 M145 V149 M150 G151D109-V147 HydrophobicContact CB-CG1 3.99Å; I113-V147 HydrophobicContact CG1-CG1 4.01Å; M143-V147 VanDerWaalsContact O-CG2 3.3Å; M143-V147 WeakPolarHBondContact O-CG2 3.49Å; M143-V147 PolarHBondContact O-N 2.84Å; T144-V147 WeakPolarHBondContact O-CB 3.49Å; T144-V147 PolarHBondContact O-N 3.06Å; M145-V147 VanDerWaalsContact C-N 3.33Å; M145-V147 PolarHBondContact O-N 3.41Å; V147-V149 VanDerWaalsContact C-N 3.3Å; V147-V149 PolarHBondContact O-N 2.91Å; V147-M150 WeakPolarHBondContact O-CB 3.35Å; V147-M150 PolarHBondContact O-N 3Å; V147-M150 VanDerWaalsContact O-N 3.07Å; V147-G151 PolarHBondContact O-N 3.06Å
148Y96.2Very high94.2Very high62 Ų6256 Ų5624%0.24330%0.297CS..Hα-helixtrans-64.8-32.9-177.5-64.9-29.2000113.5N65 F105 D109 T144 M145 F152N65-Y148 PolarHBondContact OD1-OH 2.85Å; F105-Y148 HydrophobicContact CZ-CD1 4.1Å; F105-Y148 HydrophobicContact CZ-CG 4.5Å; D109-Y148 HydrophobicContact CB-CD1 4.46Å; D109-Y148 HydrophobicContact CB-CE1 4.46Å; D109-Y148 WeakPolarHBondContact OD2-CD1 3.37Å; D109-Y148 WeakPolarHBondContact OD2-CE1 3.32Å; T144-Y148 HydrophobicContact CG2-CD2 3.88Å; T144-Y148 HydrophobicContact CG2-CE2 3.45Å; T144-Y148 VanDerWaalsContact CG2-CE2 3.45Å; T144-Y148 PolarHBondContact O-N 3Å; M145-Y148 PolarHBondContact O-N 3.04Å; Y148-F152 VanDerWaalsContact O-CB 3.25Å; Y148-F152 WeakPolarHBondContact O-CB 3.38Å; Y148-F152 PolarHBondContact O-N 2.87Å
149V96.5Very high94Very high71 Ų7149.3 Ų49.343%0.4327%0.266SS..Hα-helixtrans-65.9-43.5173168.90000110.7M145 G146 V147 F152 L153M145-V149 HydrophobicContact CG-CG2 4.49Å; M145-V149 WeakPolarHBondContact O-CB 3.42Å; M145-V149 VanDerWaalsContact O-CG2 3.25Å; M145-V149 WeakPolarHBondContact O-CG2 3.32Å; M145-V149 PolarHBondContact O-N 3.47Å; G146-V149 PolarHBondContact O-N 3.48Å; V147-V149 VanDerWaalsContact C-N 3.3Å; V147-V149 PolarHBondContact O-N 2.91Å; V149-F152 PolarHBondContact O-N 3.45Å; V149-L153 HydrophobicContact CG1-CD1 3.89Å; V149-L153 HydrophobicContact CG1-CG 4.34Å; V149-L153 WeakPolarHBondContact O-CB 3.2Å; V149-L153 VanDerWaalsContact O-CG 3.27Å; V149-L153 WeakPolarHBondContact O-CG 2.95Å; V149-L153 PolarHBondContact O-N 2.91Å
150M93.4Very high93.7Very high75 Ų7550.3 Ų50.337%0.36927%0.272SS..Hα-helixtrans-64.6-43.4177.2-70.6-57.6-60.900111.9Y112 G146 V147 L153 G154Y112-M150 HydrophobicContact CD2-CB 4.13Å; Y112-M150 HydrophobicContact CE2-CB 3.82Å; Y112-M150 HydrophobicContact CE2-CG 4.47Å; G146-M150 WeakPolarHBondContact O-CB 3.38Å; G146-M150 VanDerWaalsContact O-CG 3.27Å; G146-M150 WeakPolarHBondContact O-CG 3.27Å; G146-M150 PolarHBondContact O-N 2.74Å; V147-M150 WeakPolarHBondContact O-CB 3.35Å; V147-M150 PolarHBondContact O-N 3Å; V147-M150 VanDerWaalsContact O-N 3.07Å; M150-L153 PolarHBondContact O-N 3.03Å; M150-G154 PolarHBondContact O-N 3.35Å
151G94Very high93.2Very high0 Ų051.1 Ų51.10%028%0.278CS..Hα-helixtrans-56.2-51.1172.100000111.6V147 L153 G154 S155V147-G151 PolarHBondContact O-N 3.06Å; G151-L153 PolarHBondContact O-N 3.11Å; G151-G154 PolarHBondContact O-N 3.18Å; G151-S155 WeakPolarHBondContact O-CB 3.23Å; G151-S155 PolarHBondContact O-N 3.3Å; G151-S155 PolarHBondContact O-OG 3.28Å
152F95.4Very high92.8Very high96 Ų9647 Ų4742%0.42126%0.257SS..Hα-helixtrans-59.9-47.5180-179.8-94.7000112.6F101 F105 Y148 V149 S155 M156F101-F152 HydrophobicContact CE2-CD2 4.36Å; F101-F152 HydrophobicContact CE2-CE2 4.42Å; F101-F152 AromaticContact CZ-CD2 3.81Å; F101-F152 HydrophobicContact CZ-CD2 3.81Å; F101-F152 AromaticContact CZ-CE2 4Å; F101-F152 HydrophobicContact CZ-CE2 4Å; F105-F152 HydrophobicContact CD2-CB 4.42Å; F105-F152 HydrophobicContact CE2-CB 4.18Å; Y148-F152 VanDerWaalsContact O-CB 3.25Å; Y148-F152 WeakPolarHBondContact O-CB 3.38Å; Y148-F152 PolarHBondContact O-N 2.87Å; V149-F152 PolarHBondContact O-N 3.45Å; F152-S155 PolarHBondContact O-N 2.75Å; F152-M156 HydrophobicContact CE1-CE 4.09Å; F152-M156 HydrophobicContact CE2-CE 3.82Å; F152-M156 HydrophobicContact CZ-CE 3.4Å; F152-M156 WeakPolarHBondContact O-CB 3.13Å; F152-M156 PolarHBondContact O-N 3.46Å
153L94.3Very high92.2Very high101 Ų10146 Ų4653%0.52925%0.251SS..Hα-helixtrans-64-42.7180-70.7174.1000111.8V149 M150 G151 A157V149-L153 HydrophobicContact CG1-CD1 3.89Å; V149-L153 HydrophobicContact CG1-CG 4.34Å; V149-L153 WeakPolarHBondContact O-CB 3.2Å; V149-L153 VanDerWaalsContact O-CG 3.27Å; V149-L153 WeakPolarHBondContact O-CG 2.95Å; V149-L153 PolarHBondContact O-N 2.91Å; M150-L153 PolarHBondContact O-N 3.03Å; G151-L153 PolarHBondContact O-N 3.11Å; L153-A157 WeakPolarHBondContact O-CB 2.99Å; L153-A157 PolarHBondContact O-N 2.98Å
154G91.7Very high91.6Very high9 Ų953.4 Ų53.49%0.09328%0.276CS..Hα-helixtrans-62.7-48.7177.100000112.2M150 G151 M156 A157 H158M150-G154 PolarHBondContact O-N 3.35Å; G151-G154 PolarHBondContact O-N 3.18Å; G154-M156 PolarHBondContact O-N 3.11Å; G154-A157 WeakPolarHBondContact O-CB 3.02Å; G154-A157 PolarHBondContact O-N 3.23Å; G154-H158 PolarHBondContact O-CD2 2.86Å; G154-H158 PolarHBondContact O-N 2.91Å
155S92.8Very high90.9Very high0 Ų053.6 Ų53.60%028%0.277CS..Hα-helixtrans-64.9-41178-56.90000112.8F101 A104 F105 G151 F152 A157 H158 I159F101-S155 PolarHBondContact O-OG 3.44Å; A104-S155 WeakPolarHBondContact CB-OG 3.44Å; F105-S155 WeakPolarHBondContact CA-OG 3.46Å; F105-S155 WeakPolarHBondContact CB-OG 3.06Å; F105-S155 PolarHBondContact N-OG 3.47Å; G151-S155 WeakPolarHBondContact O-CB 3.23Å; G151-S155 PolarHBondContact O-N 3.3Å; G151-S155 PolarHBondContact O-OG 3.28Å; F152-S155 PolarHBondContact O-N 2.75Å; S155-A157 VanDerWaalsContact C-N 3.31Å; S155-A157 PolarHBondContact O-N 2.92Å; S155-H158 PolarHBondContact O-N 2.98Å; S155-I159 WeakPolarHBondContact O-CG1 3.17Å; S155-I159 PolarHBondContact O-N 3.41Å
156M92.6Very high90.1Very high68 Ų6853 Ų5334%0.33528%0.276SS..Hα-helixtrans-62.7-40.7177.3-171.56269.300111.2F101 F152 G154 H158 I159 V160F101-M156 HydrophobicContact CE2-CE 4.3Å; F152-M156 HydrophobicContact CE1-CE 4.09Å; F152-M156 HydrophobicContact CE2-CE 3.82Å; F152-M156 HydrophobicContact CZ-CE 3.4Å; F152-M156 WeakPolarHBondContact O-CB 3.13Å; F152-M156 PolarHBondContact O-N 3.46Å; G154-M156 PolarHBondContact O-N 3.11Å; M156-H158 VanDerWaalsContact C-N 3.32Å; M156-H158 PolarHBondContact O-N 2.95Å; M156-I159 PolarHBondContact O-N 2.8Å; M156-V160 HydrophobicContact CG-CG2 4.08Å; M156-V160 WeakPolarHBondContact O-CB 3.26Å; M156-V160 VanDerWaalsContact O-CG2 3.28Å; M156-V160 WeakPolarHBondContact O-CG2 3.48Å; M156-V160 PolarHBondContact O-N 3.32Å; M156-V160 HydrophobicContact SD-CG2 3.98Å
157A90.1Very high89.4Confident34 Ų3452 Ų5228%0.28126%0.262SS..Hα-helixtrans-58.6-44.8175.700000111.6L153 G154 S155 C161 V197 V201L153-A157 WeakPolarHBondContact O-CB 2.99Å; L153-A157 PolarHBondContact O-N 2.98Å; G154-A157 WeakPolarHBondContact O-CB 3.02Å; G154-A157 PolarHBondContact O-N 3.23Å; S155-A157 VanDerWaalsContact C-N 3.31Å; S155-A157 PolarHBondContact O-N 2.92Å; A157-C161 PolarHBondContact O-N 2.78Å; A157-C161 PolarHBondContact O-SG 3.47Å; A157-V197 HydrophobicContact CB-CG1 4.16Å; A157-V201 HydrophobicContact CB-CG2 4.41Å
158H86.9Confident88.5Confident16 Ų1655.5 Ų55.57%0.07429%0.286CS..Hα-helixtrans-61.2-50.8174.2-74-68000112G154 S155 M156 V160 C161 M162 V201G154-H158 PolarHBondContact O-CD2 2.86Å; G154-H158 PolarHBondContact O-N 2.91Å; S155-H158 PolarHBondContact O-N 2.98Å; M156-H158 VanDerWaalsContact C-N 3.32Å; M156-H158 PolarHBondContact O-N 2.95Å; H158-V160 PolarHBondContact O-N 2.83Å; H158-C161 PolarHBondContact O-N 3.43Å; H158-M162 WeakPolarHBondContact O-CG 3.32Å; H158-M162 PolarHBondContact O-N 3.42Å; H158-V201 WeakPolarHBondContact NE2-CG1 3.23Å
159I89.5Confident87.4Confident18 Ų1857.4 Ų57.49%0.09230%0.301CS..Hα-helixtrans-63-44.8-177.1-67.4-56.2000112.5M97 L100 F101 S155 M156 C161 M162 L163M97-I159 HydrophobicContact CB-CD1 4.46Å; M97-I159 WeakPolarHBondContact O-CD1 3.44Å; L100-I159 HydrophobicContact CB-CD1 4.08Å; L100-I159 HydrophobicContact CD2-CD1 4Å; L100-I159 HydrophobicContact CG-CD1 4.01Å; F101-I159 HydrophobicContact CB-CD1 3.96Å; F101-I159 HydrophobicContact CB-CG1 3.76Å; F101-I159 HydrophobicContact CD2-CG1 3.84Å; F101-I159 HydrophobicContact CG-CG1 4.29Å; S155-I159 WeakPolarHBondContact O-CG1 3.17Å; S155-I159 PolarHBondContact O-N 3.41Å; M156-I159 PolarHBondContact O-N 2.8Å; I159-C161 PolarHBondContact O-N 2.76Å; I159-M162 PolarHBondContact O-N 3.48Å; I159-M162 VanDerWaalsContact O-N 3.15Å; I159-L163 HydrophobicContact CG2-CD1 3.76Å; I159-L163 HydrophobicContact CG2-CG 4.08Å; I159-L163 VanDerWaalsContact O-CG 3.31Å; I159-L163 WeakPolarHBondContact O-CG 3.37Å; I159-L163 PolarHBondContact O-N 3.16Å
160V88.3Confident86.4Confident70 Ų7056 Ų5642%0.42430%0.301SS..Hα-helixtrans-60.1-39.1179.1170.40000110.7M156 H158 R164M156-V160 HydrophobicContact CG-CG2 4.08Å; M156-V160 WeakPolarHBondContact O-CB 3.26Å; M156-V160 VanDerWaalsContact O-CG2 3.28Å; M156-V160 WeakPolarHBondContact O-CG2 3.48Å; M156-V160 PolarHBondContact O-N 3.32Å; M156-V160 HydrophobicContact SD-CG2 3.98Å; H158-V160 PolarHBondContact O-N 2.83Å; V160-R164 VanDerWaalsContact O-CG 3.26Å; V160-R164 WeakPolarHBondContact O-CG 3.35Å
161C84.9Confident85.9Confident22 Ų2255.2 Ų55.215%0.14930%0.298CS..Hα-helixtrans-71.5-36.8177.5-61.40000112.2A157 H158 I159 R164 N194A157-C161 PolarHBondContact O-N 2.78Å; A157-C161 PolarHBondContact O-SG 3.47Å; H158-C161 PolarHBondContact O-N 3.43Å; I159-C161 PolarHBondContact O-N 2.76Å; C161-R164 WeakPolarHBondContact O-CB 3.31Å; C161-R164 PolarHBondContact O-N 2.9Å; C161-N194 WeakPolarHBondContact CB-OD1 2.99Å; C161-N194 PolarHBondContact O-ND2 3.22Å; C161-N194 PolarHBondContact O-OD1 3.46Å
162M85.6Confident85.4Confident0 Ų059.6 Ų59.60%032%0.32CS..Hα-helixtrans-68.8-38.1178-68.6-62.9-116.200113.1M97 L100 H158 I159 R164 L165 V180 L183 L184 N194M97-M162 HydrophobicContact CE-CB 4.41Å; M97-M162 HydrophobicContact SD-CB 3.88Å; L100-M162 HydrophobicContact CD2-CE 3.76Å; L100-M162 HydrophobicContact CD2-CG 3.9Å; H158-M162 WeakPolarHBondContact O-CG 3.32Å; H158-M162 PolarHBondContact O-N 3.42Å; I159-M162 PolarHBondContact O-N 3.48Å; I159-M162 VanDerWaalsContact O-N 3.15Å; M162-R164 PolarHBondContact O-N 3.26Å; M162-L165 WeakPolarHBondContact O-CB 3.28Å; M162-L165 PolarHBondContact O-N 3Å; M162-L165 VanDerWaalsContact O-N 3.12Å; M162-L165 HydrophobicContact SD-CD1 3.7Å; M162-V180 HydrophobicContact CE-CB 4.21Å; M162-V180 HydrophobicContact CE-CG1 3.89Å; M162-V180 HydrophobicContact SD-CG1 4.38Å; M162-L183 HydrophobicContact CE-CB 3.33Å; M162-L183 HydrophobicContact CE-CD1 3.56Å; M162-L183 HydrophobicContact CE-CG 4.08Å; M162-L184 HydrophobicContact SD-CD2 4.07Å; M162-N194 PolarHBondContact N-OD1 3.01Å
163L84.4Confident84.8Confident101 Ų10155 Ų5553%0.52930%0.301SS..THydrogen-bonded Turntrans-67-13.4176.4-69.6175.7000113.5M97 I159M97-L163 HydrophobicContact CG-CD2 4.09Å; I159-L163 HydrophobicContact CG2-CD1 3.76Å; I159-L163 HydrophobicContact CG2-CG 4.08Å; I159-L163 VanDerWaalsContact O-CG 3.31Å; I159-L163 WeakPolarHBondContact O-CG 3.37Å; I159-L163 PolarHBondContact O-N 3.16Å
164R82.9Confident84.2Confident202 Ų20253.2 Ų53.276%0.76229%0.291SS*.THydrogen-bonded Turntrans-88.5-7.3175.9-64.2-73.3-174.9177.11.7113V160 C161 M162V160-R164 VanDerWaalsContact O-CG 3.26Å; V160-R164 WeakPolarHBondContact O-CG 3.35Å; C161-R164 WeakPolarHBondContact O-CB 3.31Å; C161-R164 PolarHBondContact O-N 2.9Å; M162-R164 PolarHBondContact O-N 3.26Å
165L81.6Confident83.8Confident11 Ų1153 Ų536%0.05829%0.288CS..PPolyproline II helixtrans-86.9138.6-177.5-63.1175.8000111.3M162 F167 L184 T189 N194M162-L165 WeakPolarHBondContact O-CB 3.28Å; M162-L165 PolarHBondContact O-N 3Å; M162-L165 VanDerWaalsContact O-N 3.12Å; M162-L165 HydrophobicContact SD-CD1 3.7Å; L165-F167 HydrophobicContact CB-CE1 4.43Å; L165-F167 HydrophobicContact CB-CZ 4.16Å; L165-L184 HydrophobicContact CD1-CD2 3.58Å; L165-T189 WeakPolarHBondContact CA-OG1 3.44Å; L165-T189 WeakPolarHBondContact CD2-OG1 3.42Å; L165-N194 WeakPolarHBondContact CD2-ND2 3.43Å
166D80Confident83.2Confident111 Ų11153 Ų5359%0.59429%0.288SS*.PPolyproline II helixtrans-94.5117.7167-67.2-45.8000109.4S187 C188 T189D166-S187 WeakPolarHBondContact O-CA 3.23Å; D166-C188 PolarHBondContact O-N 3.49Å; D166-T189 HydrophobicContact CB-CG2 3.99Å; D166-T189 PolarHBondContact N-OG1 3.46Å; D166-T189 VanDerWaalsContact N-OG1 3.12Å
167F81.4Confident82.8Confident15 Ų1549.9 Ų49.97%0.06627%0.272CS..BIsolated β-bridgetrans-87117.6175.8-57-75.8000109.6V9 F12 H93 M97 L165 L183 L186V9-F167 HydrophobicContact CB-CB 4.2Å; V9-F167 HydrophobicContact CG2-CB 3.9Å; V9-F167 WeakPolarHBondContact CG2-O 3.46Å; F12-F167 HydrophobicContact CE1-CD1 4.48Å; F12-F167 HydrophobicContact CE1-CG 4.33Å; F12-F167 HydrophobicContact CZ-CD1 4.37Å; F12-F167 AromaticContact CZ-CD2 4Å; F12-F167 HydrophobicContact CZ-CD2 4Å; F12-F167 HydrophobicContact CZ-CE2 4.26Å; F12-F167 HydrophobicContact CZ-CG 4.06Å; H93-F167 AromaticContact CD2-CE2 3.95Å; H93-F167 AromaticContact NE2-CE2 3.61Å; M97-F167 HydrophobicContact CE-CE2 4.11Å; M97-F167 HydrophobicContact CE-CZ 3.95Å; L165-F167 HydrophobicContact CB-CE1 4.43Å; L165-F167 HydrophobicContact CB-CZ 4.16Å; F167-L183 HydrophobicContact CE1-CB 4.41Å; F167-L183 HydrophobicContact CE1-CD2 4.19Å; F167-L183 HydrophobicContact CZ-CD2 4.45Å; F167-L186 HydrophobicContact CD1-CB 4.01Å
168C76.8Confident82.5Confident84 Ų8448.2 Ų48.257%0.56826%0.259SS*.  trans-134.2-11.7177.694.40000114.5G170 L186 C188C168-G170 PolarHBondContact O-N 3.45Å; C168-L186 PolarHBondContact N-O 3.43Å; C168-C188 VanDerWaalsContact C-SG 3.59Å; C168-C188 WeakPolarHBondContact CA-SG 3.31Å; C168-C188 HydrophobicContact CB-CB 3.85Å; C168-C188 WeakPolarHBondContact CB-SG 3.4Å; C168-C188 PolarHBondContact N-SG 2.97Å; C168-C188 VanDerWaalsContact N-SG 3.4Å; C168-C188 WeakPolarHBondContact SG-CB 3.3Å; C168-C188 CovalentContact SG-SG 1.99Å; C168-C188 PolarHBondContact SG-SG 3.15Å
169N71.7Confident82.3Confident101 Ų10148.6 Ų48.654%0.5426%0.261SS..SBendtrans-86.152.6178.5-72.8-30.2000112.3L186N169-L186 PolarHBondContact N-O 3.48Å; N169-L186 VanDerWaalsContact O-CD2 3.3Å; N169-L186 WeakPolarHBondContact O-CD2 3.32Å
170G76.8Confident81.8Confident42 Ų4248.3 Ų48.343%0.43326%0.261SS..  trans76.4-168.9-178.600000113.9C168C168-G170 PolarHBondContact O-N 3.45Å
171N82.6Confident81.3Confident59 Ų5949.7 Ų49.732%0.31627%0.265SS..SBendtrans-127.214.2-173.768.5-19.8000114V9 E11 F12 I13V9-N171 HydrophobicContact CG1-CB 3.88Å; E11-N171 VanDerWaalsContact O-CB 3.26Å; E11-N171 WeakPolarHBondContact O-CB 3.25Å; E11-N171 PolarHBondContact O-ND2 2.86Å; F12-N171 CarbonylContact C-O 3.6Å; F12-N171 VanDerWaalsContact CA-O 3.24Å; F12-N171 WeakPolarHBondContact CA-O 3.37Å; F12-N171 HydrophobicContact CD1-CB 4.47Å; I13-N171 PolarHBondContact N-O 3.37Å
172I82.7Confident81.1Confident91 Ų9149.7 Ų49.747%0.46727%0.265SS..EExtended strand (participates in β ladder)trans-98.2118.7-176-57.5176.1000109.9I13 L15I13-I172 CarbonylContact O-C 3.58Å; I13-I172 WeakPolarHBondContact O-CA 3.47Å; L15-I172 HydrophobicContact CD1-CG2 3.62Å; L15-I172 HydrophobicContact CD2-CG2 4.22Å; L15-I172 HydrophobicContact CG-CG2 3.63Å
173I83.1Confident80.9Confident1 Ų149.7 Ų49.71%0.00527%0.265CS..EExtended strand (participates in β ladder)trans-98.4116.8175.4-62.2173.8000108.2F12 I13 L14 L15 H175 P182 L183 L186F12-I173 HydrophobicContact CB-CD1 3.68Å; F12-I173 HydrophobicContact CB-CG1 4.21Å; F12-I173 HydrophobicContact CD1-CD1 3.93Å; F12-I173 HydrophobicContact CD1-CG1 4.13Å; F12-I173 HydrophobicContact CD2-CD1 4.36Å; F12-I173 HydrophobicContact CG-CD1 3.75Å; F12-I173 HydrophobicContact CG-CG1 4.36Å; I13-I173 PolarHBondContact O-N 3.4Å; L14-I173 HydrophobicContact CD2-CB 3.98Å; L14-I173 HydrophobicContact CD2-CD1 4.29Å; L14-I173 HydrophobicContact CD2-CG2 3.85Å; L15-I173 PolarHBondContact N-O 3.39Å; I173-H175 HydrophobicContact CG2-CB 3.91Å; I173-H175 PolarHBondContact O-N 3.41Å; I173-P182 HydrophobicContact CG2-CB 3.75Å; I173-L183 HydrophobicContact CD1-CD2 3.7Å; I173-L183 HydrophobicContact CD1-CG 4.38Å; I173-L183 HydrophobicContact CG1-CD2 4.38Å; I173-L186 HydrophobicContact CG1-CD1 3.66Å
174N82.7Confident80.6Confident62 Ų6245.5 Ų45.533%0.33224%0.243SC..SBendtrans-78.556.4176.5-16714.3000112.8L15 V266 K270L15-N174 HydrophobicContact CD1-CB 3.82Å; L15-N174 WeakPolarHBondContact CD1-OD1 3.31Å; N174-V266 WeakPolarHBondContact ND2-CG1 3.42Å; N174-K270 WeakPolarHBondContact O-CE 3.38Å; N174-K270 VanDerWaalsContact OD1-CE 3.26Å; N174-K270 WeakPolarHBondContact OD1-CE 3.18Å; N174-K270 PolarHBondContact OD1-NZ 3.31Å
175H82Confident80.5Confident6 Ų642.6 Ų42.63%0.02824%0.236CC..SBendtrans-156.7162.5-179.7-156.2-101.1000109.9L14 G16 I173 V177 P182L14-H175 WeakPolarHBondContact CD2-O 3.38Å; G16-H175 PolarHBondContact N-O 2.92Å; I173-H175 HydrophobicContact CG2-CB 3.91Å; I173-H175 PolarHBondContact O-N 3.41Å; H175-V177 WeakPolarHBondContact CB-O 3.26Å; H175-V177 WeakPolarHBondContact CE1-CG2 3.32Å; H175-V177 VanDerWaalsContact ND1-CG2 3.28Å; H175-V177 WeakPolarHBondContact ND1-CG2 3.45Å; H175-V177 PolarHBondContact ND1-N 2.97Å; H175-V177 PolarHBondContact ND1-O 3.17Å; H175-P182 HydrophobicContact CB-CB 4.32Å; H175-P182 HydrophobicContact CB-CG 3.89Å
176Y81.1Confident80.4Confident0 Ų042.8 Ų42.80%024%0.237CC..SBendtrans-89-9.3178.161.3-90.5000113.8L17 I77 M81 K270 T273 I274 T277 I278L17-Y176 HydrophobicContact CD1-CD1 4.17Å; L17-Y176 HydrophobicContact CD1-CE1 4.34Å; I77-Y176 HydrophobicContact CG2-CE2 4.13Å; M81-Y176 HydrophobicContact CB-CD2 3.91Å; M81-Y176 HydrophobicContact CG-CD2 3.8Å; M81-Y176 HydrophobicContact CG-CG 4.08Å; M81-Y176 HydrophobicContact SD-CD2 3.72Å; M81-Y176 HydrophobicContact SD-CE2 3.97Å; M81-Y176 HydrophobicContact SD-CG 4.14Å; Y176-K270 HydrophobicContact CD1-CB 4.39Å; Y176-K270 HydrophobicContact CE1-CB 4.23Å; Y176-T273 WeakPolarHBondContact OH-CB 3.38Å; Y176-T273 VanDerWaalsContact OH-CG2 3.23Å; Y176-T273 WeakPolarHBondContact OH-CG2 3.3Å; Y176-I274 HydrophobicContact CE1-CG1 4.26Å; Y176-I274 PolarHBondContact OH-N 3.41Å; Y176-T277 PolarHBondContact OH-OG1 3.43Å; Y176-I278 HydrophobicContact CE2-CD1 4.45Å
177V83.3Confident80.5Confident1 Ų138.1 Ų38.11%0.00621%0.213CC..SBendtrans-138159.6171.8-690000111.3I77 H175 D179I77-V177 HydrophobicContact CB-CG1 4.44Å; I77-V177 HydrophobicContact CD1-CB 4.32Å; I77-V177 HydrophobicContact CD1-CG1 3.8Å; I77-V177 HydrophobicContact CG2-CG1 3.84Å; H175-V177 WeakPolarHBondContact CB-O 3.26Å; H175-V177 WeakPolarHBondContact CE1-CG2 3.32Å; H175-V177 VanDerWaalsContact ND1-CG2 3.28Å; H175-V177 WeakPolarHBondContact ND1-CG2 3.45Å; H175-V177 PolarHBondContact ND1-N 2.97Å; H175-V177 PolarHBondContact ND1-O 3.17Å; V177-D179 PolarHBondContact O-N 3.38Å
178C84.5Confident80.5Confident0 Ų040.2 Ų40.20%023%0.229CC..  trans-68.8106.4168.4-73.30000110.2C96 L183C96-C178 WeakPolarHBondContact CA-SG 3.47Å; C96-C178 HydrophobicContact CB-CB 4.08Å; C96-C178 WeakPolarHBondContact CB-SG 3.29Å; C96-C178 WeakPolarHBondContact SG-CB 3.41Å; C96-C178 CovalentContact SG-SG 2.03Å; C96-C178 PolarHBondContact SG-SG 3.02Å; C178-L183 HydrophobicContact CB-CD1 4.38Å
179D82.3Confident80.8Confident23 Ų2338.4 Ų38.412%0.12322%0.215CC..  trans-123160178.6-172.315.3000110V177 P182 L183V177-D179 PolarHBondContact O-N 3.38Å; D179-P182 HydrophobicContact CB-CG 4.17Å; D179-P182 WeakPolarHBondContact O-CD 3.26Å; D179-L183 WeakPolarHBondContact O-CB 3.24Å; D179-L183 WeakPolarHBondContact O-CD1 3.49Å; D179-L183 WeakPolarHBondContact O-CG 3.41Å; D179-L183 PolarHBondContact O-N 3.38Å
180V79.3Confident81.3Confident13 Ų1338.5 Ų38.58%0.07922%0.223CC..Hα-helixtrans-63.3-52.9-172.4-174.10000111.5L100 M162 L183 L184 V198L100-V180 HydrophobicContact CD1-CG2 3.75Å; L100-V180 HydrophobicContact CD2-CG2 4.39Å; M162-V180 HydrophobicContact CE-CB 4.21Å; M162-V180 HydrophobicContact CE-CG1 3.89Å; M162-V180 HydrophobicContact SD-CG1 4.38Å; V180-L183 PolarHBondContact O-N 2.98Å; V180-L184 HydrophobicContact CG1-CD1 3.88Å; V180-L184 HydrophobicContact CG1-CG 4.14Å; V180-L184 VanDerWaalsContact O-CG 3.32Å; V180-L184 WeakPolarHBondContact O-CG 3.02Å; V180-L184 PolarHBondContact O-N 3.28Å; V180-V198 HydrophobicContact CB-CG2 4.4Å; V180-V198 HydrophobicContact CG1-CG2 3.5Å; V180-V198 VanDerWaalsContact CG1-CG2 3.5Å
181L78.4Confident81.6Confident99 Ų9938 Ų3852%0.51821%0.212SC..Hα-helixtrans-62.8-45.1-174.5-59.9175.4000113.1L183 L184 K185L181-L183 VanDerWaalsContact C-N 3.33Å; L181-L183 PolarHBondContact O-N 3.29Å; L181-L184 PolarHBondContact O-N 3.08Å; L181-K185 PolarHBondContact O-N 3.16Å
182P79.5Confident81.7Confident22 Ų2241.5 Ų41.514%0.14323%0.225CC..Hα-helixtrans-61-37.8174.3-25.836000113.9I173 H175 D179 K185I173-P182 HydrophobicContact CG2-CB 3.75Å; H175-P182 HydrophobicContact CB-CB 4.32Å; H175-P182 HydrophobicContact CB-CG 3.89Å; D179-P182 HydrophobicContact CB-CG 4.17Å; D179-P182 WeakPolarHBondContact O-CD 3.26Å; P182-K185 PolarHBondContact O-N 2.79Å
183L81.8Confident81.8Confident0 Ų042.6 Ų42.60%023%0.23CC..Hα-helixtrans-70.3-37.8179-78.8169.1000112F12 M97 L100 M162 F167 I173 C178 D179 V180 L181 K185 L186F12-L183 HydrophobicContact CE1-CD2 4.36Å; F12-L183 HydrophobicContact CE2-CD2 4.47Å; F12-L183 HydrophobicContact CZ-CD2 4.19Å; M97-L183 HydrophobicContact CE-CD1 4.25Å; L100-L183 HydrophobicContact CD2-CD1 4.11Å; M162-L183 HydrophobicContact CE-CB 3.33Å; M162-L183 HydrophobicContact CE-CD1 3.56Å; M162-L183 HydrophobicContact CE-CG 4.08Å; F167-L183 HydrophobicContact CE1-CB 4.41Å; F167-L183 HydrophobicContact CE1-CD2 4.19Å; F167-L183 HydrophobicContact CZ-CD2 4.45Å; I173-L183 HydrophobicContact CD1-CD2 3.7Å; I173-L183 HydrophobicContact CD1-CG 4.38Å; I173-L183 HydrophobicContact CG1-CD2 4.38Å; C178-L183 HydrophobicContact CB-CD1 4.38Å; D179-L183 WeakPolarHBondContact O-CB 3.24Å; D179-L183 WeakPolarHBondContact O-CD1 3.49Å; D179-L183 WeakPolarHBondContact O-CG 3.41Å; D179-L183 PolarHBondContact O-N 3.38Å; V180-L183 PolarHBondContact O-N 2.98Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L181-L183 PolarHBondContact O-N 3.29Å; L183-K185 VanDerWaalsContact C-N 3.26Å; L183-K185 PolarHBondContact O-N 3.27Å; L183-L186 PolarHBondContact O-N 3.44Å; L183-L186 VanDerWaalsContact O-N 3.08Å
184L78.8Confident81.8Confident12 Ų1243 Ų436%0.06323%0.233CC..Hα-helixtrans-60.4-35.1175.7-68.9177.2000112.5M162 L165 V180 L181 L186 S187 T191 N194 E195M162-L184 HydrophobicContact SD-CD2 4.07Å; L165-L184 HydrophobicContact CD1-CD2 3.58Å; V180-L184 HydrophobicContact CG1-CD1 3.88Å; V180-L184 HydrophobicContact CG1-CG 4.14Å; V180-L184 VanDerWaalsContact O-CG 3.32Å; V180-L184 WeakPolarHBondContact O-CG 3.02Å; V180-L184 PolarHBondContact O-N 3.28Å; L181-L184 PolarHBondContact O-N 3.08Å; L184-L186 PolarHBondContact O-N 3.31Å; L184-S187 WeakPolarHBondContact O-CB 3.33Å; L184-S187 PolarHBondContact O-N 3.5Å; L184-T191 HydrophobicContact CB-CG2 4.02Å; L184-T191 HydrophobicContact CD2-CG2 3.88Å; L184-T191 WeakPolarHBondContact O-CG2 3.32Å; L184-N194 HydrophobicContact CD1-CB 4.23Å; L184-N194 HydrophobicContact CD2-CB 3.38Å; L184-N194 HydrophobicContact CG-CB 4.45Å; L184-E195 HydrophobicContact CD1-CG 4.09Å
185K80.1Confident81.8Confident141 Ų14144.7 Ų44.761%0.61324%0.239SC*.THydrogen-bonded Turntrans-64.5-21176.8-68.8178.4-178.7177.10113.8L181 P182 L183L181-K185 PolarHBondContact O-N 3.16Å; P182-K185 PolarHBondContact O-N 2.79Å; L183-K185 VanDerWaalsContact C-N 3.26Å; L183-K185 PolarHBondContact O-N 3.27Å
186L79.4Confident81.9Confident16 Ų1648.3 Ų48.38%0.08426%0.258CS..THydrogen-bonded Turntrans-90.8-11.2-179.9-63172.9000113.2F12 F167 C168 N169 I173 L183 L184F12-L186 HydrophobicContact CD1-CD1 4.33Å; F12-L186 HydrophobicContact CE1-CD1 4.25Å; F167-L186 HydrophobicContact CD1-CB 4.01Å; C168-L186 PolarHBondContact N-O 3.43Å; N169-L186 PolarHBondContact N-O 3.48Å; N169-L186 VanDerWaalsContact O-CD2 3.3Å; N169-L186 WeakPolarHBondContact O-CD2 3.32Å; I173-L186 HydrophobicContact CG1-CD1 3.66Å; L183-L186 PolarHBondContact O-N 3.44Å; L183-L186 VanDerWaalsContact O-N 3.08Å; L184-L186 PolarHBondContact O-N 3.31Å
187S82.4Confident82.2Confident12 Ų1249.7 Ų49.78%0.08427%0.266CS..BIsolated β-bridgetrans-70.8144.8-179.8175.10000111.9D166 L184 T189D166-S187 WeakPolarHBondContact O-CA 3.23Å; L184-S187 WeakPolarHBondContact O-CB 3.33Å; L184-S187 PolarHBondContact O-N 3.5Å; S187-T189 PolarHBondContact OG-N 3.31Å; S187-T189 VanDerWaalsContact OG-N 3.16Å; S187-T189 PolarHBondContact OG-O 2.89Å; S187-T189 PolarHBondContact OG-OG1 2.87Å
188C81.9Confident82.3Confident59 Ų5950.8 Ų50.840%0.39927%0.272SS..SBendtrans-107.7-13170.9-61.20000112.9D166 C168D166-C188 PolarHBondContact O-N 3.49Å; C168-C188 VanDerWaalsContact C-SG 3.59Å; C168-C188 WeakPolarHBondContact CA-SG 3.31Å; C168-C188 HydrophobicContact CB-CB 3.85Å; C168-C188 WeakPolarHBondContact CB-SG 3.4Å; C168-C188 PolarHBondContact N-SG 2.97Å; C168-C188 VanDerWaalsContact N-SG 3.4Å; C168-C188 WeakPolarHBondContact SG-CB 3.3Å; C168-C188 CovalentContact SG-SG 1.99Å; C168-C188 PolarHBondContact SG-SG 3.15Å
189T81.9Confident82.1Confident47 Ų4758.2 Ų58.229%0.28831%0.305SS..SBendtrans-81.7153.7165.641.90000110.9L165 D166 S187 T191L165-T189 WeakPolarHBondContact CA-OG1 3.44Å; L165-T189 WeakPolarHBondContact CD2-OG1 3.42Å; D166-T189 HydrophobicContact CB-CG2 3.99Å; D166-T189 PolarHBondContact N-OG1 3.46Å; D166-T189 VanDerWaalsContact N-OG1 3.12Å; S187-T189 PolarHBondContact OG-N 3.31Å; S187-T189 VanDerWaalsContact OG-N 3.16Å; S187-T189 PolarHBondContact OG-O 2.89Å; S187-T189 PolarHBondContact OG-OG1 2.87Å; T189-T191 PolarHBondContact O-N 3.28Å
190S82.2Confident82.3Confident102 Ų10261.4 Ų61.471%0.71332%0.321SS*.  trans-56.2125.5177.2179.70000111.5F192S190-F192 VanDerWaalsContact C-N 3.34Å
191T84.7Confident82.6Confident31 Ų3161.9 Ų61.919%0.1932%0.324CS..  trans-86-4179.752.60000113.2L184 T189 I193 N194 E195L184-T191 HydrophobicContact CB-CG2 4.02Å; L184-T191 HydrophobicContact CD2-CG2 3.88Å; L184-T191 WeakPolarHBondContact O-CG2 3.32Å; T189-T191 PolarHBondContact O-N 3.28Å; T191-I193 VanDerWaalsContact C-N 3.35Å; T191-I193 PolarHBondContact O-N 2.94Å; T191-N194 WeakPolarHBondContact O-CA 3.22Å; T191-N194 WeakPolarHBondContact O-CB 3.37Å; T191-N194 PolarHBondContact O-N 3.1Å; T191-E195 WeakPolarHBondContact CB-OE1 3.28Å; T191-E195 PolarHBondContact O-N 3.45Å; T191-E195 PolarHBondContact OG1-OE1 3Å
192F84Confident82.9Confident133 Ų13358.8 Ų58.858%0.58331%0.309SS*.Hα-helixtrans-53.9-45.4-171.9179.1-100.3000113.7S190 N194 E195 L196S190-F192 VanDerWaalsContact C-N 3.34Å; F192-N194 VanDerWaalsContact C-N 3.32Å; F192-N194 PolarHBondContact O-N 3.26Å; F192-E195 PolarHBondContact O-N 2.9Å; F192-L196 WeakPolarHBondContact O-CB 3.15Å; F192-L196 PolarHBondContact O-N 2.85Å
193I83.9Confident83.1Confident114 Ų11458.7 Ų58.759%0.58531%0.313SS*.Hα-helixtrans-64.7-39.3178.1-64.1179.8000110.9T191 L196 V197T191-I193 VanDerWaalsContact C-N 3.35Å; T191-I193 PolarHBondContact O-N 2.94Å; I193-L196 PolarHBondContact O-N 3.26Å; I193-V197 HydrophobicContact CG2-CG2 4.48Å; I193-V197 VanDerWaalsContact O-CG2 3.3Å; I193-V197 WeakPolarHBondContact O-CG2 3.37Å; I193-V197 PolarHBondContact O-N 3.46Å
194N84.1Confident83.3Confident10 Ų1061.8 Ų61.85%0.05333%0.331CS..Hα-helixtrans-66.6-44.4178.3-78.9-93.8000111.1C161 M162 L165 L184 T191 F192 L196 V197 V198C161-N194 WeakPolarHBondContact CB-OD1 2.99Å; C161-N194 PolarHBondContact O-ND2 3.22Å; C161-N194 PolarHBondContact O-OD1 3.46Å; M162-N194 PolarHBondContact N-OD1 3.01Å; L165-N194 WeakPolarHBondContact CD2-ND2 3.43Å; L184-N194 HydrophobicContact CD1-CB 4.23Å; L184-N194 HydrophobicContact CD2-CB 3.38Å; L184-N194 HydrophobicContact CG-CB 4.45Å; T191-N194 WeakPolarHBondContact O-CA 3.22Å; T191-N194 WeakPolarHBondContact O-CB 3.37Å; T191-N194 PolarHBondContact O-N 3.1Å; F192-N194 VanDerWaalsContact C-N 3.32Å; F192-N194 PolarHBondContact O-N 3.26Å; N194-L196 VanDerWaalsContact C-N 3.32Å; N194-L196 PolarHBondContact O-N 3.24Å; N194-V197 PolarHBondContact O-N 3.14Å; N194-V198 WeakPolarHBondContact O-CG2 3.29Å; N194-V198 PolarHBondContact O-N 2.83Å
195E82.8Confident83.7Confident98 Ų9862 Ų6246%0.45833%0.332SS..Hα-helixtrans-61.4-41.5175.9-71.7170.8-155.600111.6L184 T191 F192 V198 F199L184-E195 HydrophobicContact CD1-CG 4.09Å; T191-E195 WeakPolarHBondContact CB-OE1 3.28Å; T191-E195 PolarHBondContact O-N 3.45Å; T191-E195 PolarHBondContact OG1-OE1 3Å; F192-E195 PolarHBondContact O-N 2.9Å; E195-V198 PolarHBondContact O-N 3.49Å; E195-F199 WeakPolarHBondContact O-CB 3.11Å; E195-F199 PolarHBondContact O-N 3.01Å
196L84.6Confident83.9Confident82 Ų8257.8 Ų57.843%0.42932%0.319SS..Hα-helixtrans-63.6-44175.4-177.363.6000111.8F192 I193 N194 F199 I200F192-L196 WeakPolarHBondContact O-CB 3.15Å; F192-L196 PolarHBondContact O-N 2.85Å; I193-L196 PolarHBondContact O-N 3.26Å; N194-L196 VanDerWaalsContact C-N 3.32Å; N194-L196 PolarHBondContact O-N 3.24Å; L196-F199 PolarHBondContact O-N 3.49Å; L196-I200 HydrophobicContact CD1-CD1 4.09Å; L196-I200 HydrophobicContact CD1-CG1 4.42Å; L196-I200 HydrophobicContact CG-CD1 3.93Å; L196-I200 VanDerWaalsContact O-CG1 3.28Å; L196-I200 WeakPolarHBondContact O-CG1 3.28Å; L196-I200 PolarHBondContact O-N 3.25Å
197V86.6Confident84.2Confident29 Ų2961.7 Ų61.718%0.17634%0.339CS..Hα-helixtrans-63.3-43.7176168.50000110.8A157 I193 N194 F199 I200 V201A157-V197 HydrophobicContact CB-CG1 4.16Å; I193-V197 HydrophobicContact CG2-CG2 4.48Å; I193-V197 VanDerWaalsContact O-CG2 3.3Å; I193-V197 WeakPolarHBondContact O-CG2 3.37Å; I193-V197 PolarHBondContact O-N 3.46Å; N194-V197 PolarHBondContact O-N 3.14Å; V197-F199 VanDerWaalsContact C-N 3.33Å; V197-F199 PolarHBondContact O-N 2.95Å; V197-I200 PolarHBondContact O-N 3.22Å; V197-V201 HydrophobicContact CG1-CG2 4.01Å; V197-V201 WeakPolarHBondContact O-CB 3.49Å; V197-V201 VanDerWaalsContact O-CG2 3.24Å; V197-V201 WeakPolarHBondContact O-CG2 3.49Å; V197-V201 PolarHBondContact O-N 3.19Å
198V84.3Confident84.5Confident23 Ų2364.3 Ų64.314%0.13935%0.354CS..Hα-helixtrans-57.1-49.2174.1171.10000110.6V180 N194 E195 I200 V201 V202V180-V198 HydrophobicContact CB-CG2 4.4Å; V180-V198 HydrophobicContact CG1-CG2 3.5Å; V180-V198 VanDerWaalsContact CG1-CG2 3.5Å; N194-V198 WeakPolarHBondContact O-CG2 3.29Å; N194-V198 PolarHBondContact O-N 2.83Å; E195-V198 PolarHBondContact O-N 3.49Å; V198-I200 PolarHBondContact O-N 3.3Å; V198-V201 PolarHBondContact O-N 2.86Å; V198-V202 HydrophobicContact CG1-CG2 4.03Å; V198-V202 WeakPolarHBondContact O-CB 3.17Å; V198-V202 WeakPolarHBondContact O-CG2 3.25Å; V198-V202 PolarHBondContact O-N 3.38Å
199F81.9Confident84.9Confident156 Ų15661.5 Ų61.568%0.68434%0.335SS*.Hα-helixtrans-59.7-44.9179.9-177.6-98.3000112.3E195 L196 V197 G203E195-F199 WeakPolarHBondContact O-CB 3.11Å; E195-F199 PolarHBondContact O-N 3.01Å; L196-F199 PolarHBondContact O-N 3.49Å; V197-F199 VanDerWaalsContact C-N 3.33Å; V197-F199 PolarHBondContact O-N 2.95Å; F199-G203 WeakPolarHBondContact O-CA 3.29Å; F199-G203 PolarHBondContact O-N 2.86Å
200I85.7Confident85.1Confident91 Ų9161.4 Ų61.447%0.46734%0.336SS..Hα-helixtrans-66.8-50.3179.1-67.3167.5000110.9L196 V197 V198 G203 V204L196-I200 HydrophobicContact CD1-CD1 4.09Å; L196-I200 HydrophobicContact CD1-CG1 4.42Å; L196-I200 HydrophobicContact CG-CD1 3.93Å; L196-I200 VanDerWaalsContact O-CG1 3.28Å; L196-I200 WeakPolarHBondContact O-CG1 3.28Å; L196-I200 PolarHBondContact O-N 3.25Å; V197-I200 PolarHBondContact O-N 3.22Å; V198-I200 PolarHBondContact O-N 3.3Å; I200-G203 PolarHBondContact O-N 2.86Å; I200-V204 WeakPolarHBondContact O-CB 3.2Å; I200-V204 VanDerWaalsContact O-CG2 3.3Å; I200-V204 WeakPolarHBondContact O-CG2 3.37Å; I200-V204 PolarHBondContact O-N 3.38Å
201V86.4Confident85.4Confident22 Ų2261.4 Ų61.413%0.13333%0.328CS..Hα-helixtrans-65-50-176.3173.90000110.4I108 A157 H158 V197 V198 G203 V204 N205I108-V201 HydrophobicContact CD1-CG1 4.35Å; A157-V201 HydrophobicContact CB-CG2 4.41Å; H158-V201 WeakPolarHBondContact NE2-CG1 3.23Å; V197-V201 HydrophobicContact CG1-CG2 4.01Å; V197-V201 WeakPolarHBondContact O-CB 3.49Å; V197-V201 VanDerWaalsContact O-CG2 3.24Å; V197-V201 WeakPolarHBondContact O-CG2 3.49Å; V197-V201 PolarHBondContact O-N 3.19Å; V198-V201 PolarHBondContact O-N 2.86Å; V201-G203 PolarHBondContact O-N 3.45Å; V201-V204 PolarHBondContact O-N 3.33Å; V201-N205 VanDerWaalsContact CG1-ND2 3.32Å; V201-N205 WeakPolarHBondContact CG1-ND2 3.38Å; V201-N205 WeakPolarHBondContact O-CB 3.3Å; V201-N205 VanDerWaalsContact O-CG 3.28Å; V201-N205 PolarHBondContact O-N 2.84Å; V201-N205 PolarHBondContact O-ND2 3.41Å
202V83.1Confident85.7Confident34 Ų3462.2 Ų62.221%0.20633%0.333CS..Hα-helixtrans-61-46.6175.7171.80000110.2V198 V204 N205 V206 Y258V198-V202 HydrophobicContact CG1-CG2 4.03Å; V198-V202 WeakPolarHBondContact O-CB 3.17Å; V198-V202 WeakPolarHBondContact O-CG2 3.25Å; V198-V202 PolarHBondContact O-N 3.38Å; V202-V204 PolarHBondContact O-N 2.91Å; V202-N205 CarbonylContact O-C 3.58Å; V202-N205 PolarHBondContact O-N 3.48Å; V202-V206 HydrophobicContact CG1-CG2 4.11Å; V202-V206 WeakPolarHBondContact O-CB 3.22Å; V202-V206 VanDerWaalsContact O-CG2 3.3Å; V202-V206 WeakPolarHBondContact O-CG2 3.39Å; V202-V206 PolarHBondContact O-N 2.65Å; V202-Y258 HydrophobicContact CG1-CE1 3.97Å; V202-Y258 HydrophobicContact CG1-CE2 3.98Å; V202-Y258 VanDerWaalsContact CG1-CZ 3.45Å; V202-Y258 WeakPolarHBondContact CG1-OH 3.32Å
203G84.1Confident85.9Confident21 Ų2156.4 Ų56.422%0.21631%0.307CS..Hα-helixtrans-56.7-49-179.600000112.4F199 I200 V201 V206 I207F199-G203 WeakPolarHBondContact O-CA 3.29Å; F199-G203 PolarHBondContact O-N 2.86Å; I200-G203 PolarHBondContact O-N 2.86Å; V201-G203 PolarHBondContact O-N 3.45Å; G203-V206 PolarHBondContact O-N 3.36Å; G203-I207 WeakPolarHBondContact O-CB 3.36Å; G203-I207 WeakPolarHBondContact O-CD1 3.36Å; G203-I207 WeakPolarHBondContact O-CG1 3.41Å; G203-I207 PolarHBondContact O-N 3.44Å
204V87.1Confident86.2Confident65 Ų6557.9 Ų57.939%0.39431%0.31SS..Hα-helixtrans-62.4-47.1176.8171.60000111.1I200 V201 V202 V206 I207 V208I200-V204 WeakPolarHBondContact O-CB 3.2Å; I200-V204 VanDerWaalsContact O-CG2 3.3Å; I200-V204 WeakPolarHBondContact O-CG2 3.37Å; I200-V204 PolarHBondContact O-N 3.38Å; V201-V204 PolarHBondContact O-N 3.33Å; V202-V204 PolarHBondContact O-N 2.91Å; V204-V206 PolarHBondContact O-N 2.98Å; V204-I207 PolarHBondContact O-N 3.23Å; V204-V208 HydrophobicContact CG1-CG2 4.2Å; V204-V208 WeakPolarHBondContact O-CB 3.14Å; V204-V208 PolarHBondContact O-N 2.98Å
205N86.1Confident86.4Confident15 Ų1561.1 Ų61.18%0.0833%0.33CS..Hα-helixtrans-70.7-15.9-178-71-45.4000114Y112 V201 V202 P209Y112-N205 WeakPolarHBondContact CE2-OD1 3.4Å; Y112-N205 VanDerWaalsContact CZ-OD1 3.31Å; Y112-N205 PolarHBondContact OH-OD1 2.86Å; V201-N205 VanDerWaalsContact CG1-ND2 3.32Å; V201-N205 WeakPolarHBondContact CG1-ND2 3.38Å; V201-N205 WeakPolarHBondContact O-CB 3.3Å; V201-N205 VanDerWaalsContact O-CG 3.28Å; V201-N205 PolarHBondContact O-N 2.84Å; V201-N205 PolarHBondContact O-ND2 3.41Å; V202-N205 CarbonylContact O-C 3.58Å; V202-N205 PolarHBondContact O-N 3.48Å; N205-P209 WeakPolarHBondContact O-CD 3.49Å; N205-P209 WeakPolarHBondContact O-CG 3.34Å
206V84.1Confident86.8Confident54 Ų5456.8 Ų56.833%0.32731%0.311SS..Hα-helixtrans-92.8-50.3171.5172.50000110.3V202 G203 V204 S210V202-V206 HydrophobicContact CG1-CG2 4.11Å; V202-V206 WeakPolarHBondContact O-CB 3.22Å; V202-V206 VanDerWaalsContact O-CG2 3.3Å; V202-V206 WeakPolarHBondContact O-CG2 3.39Å; V202-V206 PolarHBondContact O-N 2.65Å; G203-V206 PolarHBondContact O-N 3.36Å; V204-V206 PolarHBondContact O-N 2.98Å; V206-S210 WeakPolarHBondContact O-CB 3.4Å; V206-S210 PolarHBondContact O-N 2.87Å; V206-S210 PolarHBondContact O-OG 3.36Å
207I85.8Confident87Confident98 Ų9854.3 Ų54.350%0.50330%0.296SS..Hα-helixtrans-66.1-48.5-172.6-67.8167.1000111G203 V204 S210 L211G203-I207 WeakPolarHBondContact O-CB 3.36Å; G203-I207 WeakPolarHBondContact O-CD1 3.36Å; G203-I207 WeakPolarHBondContact O-CG1 3.41Å; G203-I207 PolarHBondContact O-N 3.44Å; V204-I207 PolarHBondContact O-N 3.23Å; I207-S210 PolarHBondContact O-N 2.97Å; I207-L211 HydrophobicContact CG2-CD1 3.58Å; I207-L211 HydrophobicContact CG2-CG 4.15Å; I207-L211 WeakPolarHBondContact O-CB 2.95Å; I207-L211 VanDerWaalsContact O-CG 3.28Å; I207-L211 WeakPolarHBondContact O-CG 3.47Å; I207-L211 PolarHBondContact O-N 2.89Å
208V89.4Confident87Confident66 Ų6655.8 Ų55.840%0.431%0.305SS..Hα-helixtrans-64.5-51.2-174.8170.90000111.4Y112 V204 T212Y112-V208 HydrophobicContact CE1-CG1 4.37Å; V204-V208 HydrophobicContact CG1-CG2 4.2Å; V204-V208 WeakPolarHBondContact O-CB 3.14Å; V204-V208 PolarHBondContact O-N 2.98Å; V208-T212 WeakPolarHBondContact O-CB 3.26Å; V208-T212 PolarHBondContact O-N 3.33Å; V208-T212 PolarHBondContact O-OG1 2.8Å
209P89.4Confident87.3Confident0 Ų058.2 Ų58.20%032%0.317CS..Hα-helixtrans-57.9-46.5171.7-3444000113.6C111 Y112 T115 N205 L211 T212 L213 F251C111-P209 HydrophobicContact CB-CG 4.32Å; Y112-P209 HydrophobicContact CD1-CG 4.26Å; Y112-P209 HydrophobicContact CE1-CG 4.03Å; T115-P209 VanDerWaalsContact OG1-CB 3.3Å; T115-P209 WeakPolarHBondContact OG1-CB 3.44Å; N205-P209 WeakPolarHBondContact O-CD 3.49Å; N205-P209 WeakPolarHBondContact O-CG 3.34Å; P209-L211 PolarHBondContact O-N 3.25Å; P209-T212 PolarHBondContact O-N 3.41Å; P209-L213 VanDerWaalsContact O-CB 3.31Å; P209-L213 WeakPolarHBondContact O-CB 3.12Å; P209-L213 WeakPolarHBondContact O-CD1 3.3Å; P209-L213 WeakPolarHBondContact O-CG 3.41Å; P209-L213 PolarHBondContact O-N 2.94Å; P209-F251 HydrophobicContact CB-CE1 3.92Å; P209-F251 HydrophobicContact CB-CZ 3.56Å
210S87.3Confident87.6Confident45 Ų4550.9 Ų50.932%0.31528%0.284SS..Hα-helixtrans-62.1-44.3-177.5-61.70000112.4V206 I207 L213 F214V206-S210 WeakPolarHBondContact O-CB 3.4Å; V206-S210 PolarHBondContact O-N 2.87Å; V206-S210 PolarHBondContact O-OG 3.36Å; I207-S210 PolarHBondContact O-N 2.97Å; S210-L213 PolarHBondContact O-N 3.14Å; S210-F214 VanDerWaalsContact O-CB 3.28Å; S210-F214 WeakPolarHBondContact O-CB 3.19Å; S210-F214 PolarHBondContact O-N 2.9Å
211L89.1Confident87.6Confident103 Ų10350.3 Ų50.354%0.53928%0.282SS..Hα-helixtrans-63.3-43.9175.7-73174000111.4I207 P209 L213 F214 V215I207-L211 HydrophobicContact CG2-CD1 3.58Å; I207-L211 HydrophobicContact CG2-CG 4.15Å; I207-L211 WeakPolarHBondContact O-CB 2.95Å; I207-L211 VanDerWaalsContact O-CG 3.28Å; I207-L211 WeakPolarHBondContact O-CG 3.47Å; I207-L211 PolarHBondContact O-N 2.89Å; P209-L211 PolarHBondContact O-N 3.25Å; L211-L213 PolarHBondContact O-N 3.24Å; L211-F214 PolarHBondContact O-N 3.25Å; L211-V215 WeakPolarHBondContact O-CB 3.34Å; L211-V215 VanDerWaalsContact O-CG2 3.3Å; L211-V215 WeakPolarHBondContact O-CG2 3.16Å; L211-V215 PolarHBondContact O-N 2.95Å
212T89.9Confident87.6Confident48 Ų4852.6 Ų52.629%0.29430%0.299SS..Hα-helixtrans-64.4-42.6179.9-55.30000111.4T115 V208 P209 S216T115-T212 HydrophobicContact CG2-CG2 3.47Å; T115-T212 VanDerWaalsContact CG2-CG2 3.47Å; V208-T212 WeakPolarHBondContact O-CB 3.26Å; V208-T212 PolarHBondContact O-N 3.33Å; V208-T212 PolarHBondContact O-OG1 2.8Å; P209-T212 PolarHBondContact O-N 3.41Å; T212-S216 WeakPolarHBondContact O-CB 3.45Å; T212-S216 PolarHBondContact O-N 2.81Å; T212-S216 PolarHBondContact O-OG 3.3Å
213L89.1Confident87.7Confident11 Ų1153.4 Ų53.46%0.05830%0.302CS..Hα-helixtrans-61.9-50.1174.9-75.2166.6000111.1A118 P209 S210 L211 S216 Y217 V247 F251A118-L213 HydrophobicContact CB-CD2 3.45Å; A118-L213 VanDerWaalsContact CB-CD2 3.45Å; P209-L213 VanDerWaalsContact O-CB 3.31Å; P209-L213 WeakPolarHBondContact O-CB 3.12Å; P209-L213 WeakPolarHBondContact O-CD1 3.3Å; P209-L213 WeakPolarHBondContact O-CG 3.41Å; P209-L213 PolarHBondContact O-N 2.94Å; S210-L213 PolarHBondContact O-N 3.14Å; L211-L213 PolarHBondContact O-N 3.24Å; L213-S216 PolarHBondContact O-N 3.13Å; L213-Y217 HydrophobicContact CD2-CD2 4.42Å; L213-Y217 HydrophobicContact CD2-CE2 4.15Å; L213-Y217 WeakPolarHBondContact O-CB 3.45Å; L213-Y217 WeakPolarHBondContact O-CD2 3.19Å; L213-Y217 PolarHBondContact O-N 3.32Å; L213-V247 HydrophobicContact CD1-CG1 3.64Å; L213-V247 HydrophobicContact CD1-CG2 4.4Å; L213-V247 HydrophobicContact CD2-CG1 4.09Å; L213-V247 HydrophobicContact CD2-CG2 3.83Å; L213-V247 HydrophobicContact CG-CG1 4.4Å; L213-F251 HydrophobicContact CD1-CD2 3.84Å; L213-F251 HydrophobicContact CD1-CE1 4.4Å; L213-F251 HydrophobicContact CD1-CE2 3.33Å; L213-F251 HydrophobicContact CD1-CZ 3.66Å
214F88.6Confident87.7Confident144 Ų14452.5 Ų52.563%0.63229%0.292SS*.Hα-helixtrans-56.8-54.2178.9-178.4-101.1000111.1S210 L211 S216 Y217 T218S210-F214 VanDerWaalsContact O-CB 3.28Å; S210-F214 WeakPolarHBondContact O-CB 3.19Å; S210-F214 PolarHBondContact O-N 2.9Å; L211-F214 PolarHBondContact O-N 3.25Å; F214-S216 PolarHBondContact O-N 2.8Å; F214-Y217 PolarHBondContact O-N 3.17Å; F214-T218 WeakPolarHBondContact O-CB 3.32Å; F214-T218 PolarHBondContact O-N 3.22Å; F214-T218 PolarHBondContact O-OG1 2.97Å
215V90.1Very high87.5Confident78 Ų7854.9 Ų54.947%0.47330%0.302SS..Hα-helixtrans-59.1-47.5179.3172.40000111.4L211 Y217 T218 L219L211-V215 WeakPolarHBondContact O-CB 3.34Å; L211-V215 VanDerWaalsContact O-CG2 3.3Å; L211-V215 WeakPolarHBondContact O-CG2 3.16Å; L211-V215 PolarHBondContact O-N 2.95Å; V215-Y217 PolarHBondContact O-N 3.18Å; V215-T218 PolarHBondContact O-N 3.27Å; V215-L219 HydrophobicContact CG1-CD1 3.95Å; V215-L219 WeakPolarHBondContact O-CB 3.46Å; V215-L219 VanDerWaalsContact O-CG 3.28Å; V215-L219 WeakPolarHBondContact O-CG 3.39Å; V215-L219 PolarHBondContact O-N 2.9Å
216S90.8Very high87.4Confident8 Ų857.7 Ų57.76%0.05632%0.323CS..Hα-helixtrans-60-47.7-179.1-61.80000111.4T212 L213 F214 L219 I220T212-S216 WeakPolarHBondContact O-CB 3.45Å; T212-S216 PolarHBondContact O-N 2.81Å; T212-S216 PolarHBondContact O-OG 3.3Å; L213-S216 PolarHBondContact O-N 3.13Å; F214-S216 PolarHBondContact O-N 2.8Å; S216-L219 PolarHBondContact O-N 3.37Å; S216-I220 WeakPolarHBondContact O-CB 3.41Å; S216-I220 WeakPolarHBondContact O-CD1 3.22Å; S216-I220 WeakPolarHBondContact O-CG1 3.48Å; S216-I220 PolarHBondContact O-N 3.1Å
217Y88.1Confident87.3Confident30 Ų3057.4 Ų57.412%0.11832%0.319CS..Hα-helixtrans-73.8-34.1-178-86.1-77.3000113.7A118 L213 F214 V215 L219 I220 L221 C240 H243 V244A118-Y217 HydrophobicContact CB-CE2 4.05Å; L213-Y217 HydrophobicContact CD2-CD2 4.42Å; L213-Y217 HydrophobicContact CD2-CE2 4.15Å; L213-Y217 WeakPolarHBondContact O-CB 3.45Å; L213-Y217 WeakPolarHBondContact O-CD2 3.19Å; L213-Y217 PolarHBondContact O-N 3.32Å; F214-Y217 PolarHBondContact O-N 3.17Å; V215-Y217 PolarHBondContact O-N 3.18Å; Y217-L219 VanDerWaalsContact C-N 3.34Å; Y217-I220 HydrophobicContact CD1-CD1 4.25Å; Y217-I220 HydrophobicContact CE1-CD1 4.38Å; Y217-I220 PolarHBondContact O-N 2.97Å; Y217-L221 WeakPolarHBondContact O-CB 3.21Å; Y217-L221 VanDerWaalsContact O-CG 3.24Å; Y217-L221 WeakPolarHBondContact O-CG 3.18Å; Y217-L221 PolarHBondContact O-N 2.93Å; Y217-C240 HydrophobicContact CE1-CB 4.14Å; Y217-H243 AromaticContact CE2-ND1 3.78Å; Y217-H243 AromaticContact CZ-ND1 3.66Å; Y217-H243 WeakPolarHBondContact OH-CB 3.49Å; Y217-H243 PolarHBondContact OH-ND1 3.29Å; Y217-V244 HydrophobicContact CD1-CG2 3.94Å; Y217-V244 HydrophobicContact CE1-CG2 3.25Å
218T87.5Confident87Confident59 Ų5961.7 Ų61.736%0.36234%0.336SS..Hα-helixtrans-60.3-46.9170.9-61.70000110.4F214 V215 L221 S222F214-T218 WeakPolarHBondContact O-CB 3.32Å; F214-T218 PolarHBondContact O-N 3.22Å; F214-T218 PolarHBondContact O-OG1 2.97Å; V215-T218 PolarHBondContact O-N 3.27Å; T218-L221 PolarHBondContact O-N 2.95Å; T218-S222 WeakPolarHBondContact O-CB 3.21Å; T218-S222 PolarHBondContact O-N 3.16Å; T218-S222 PolarHBondContact O-OG 3.41Å; T218-S222 VanDerWaalsContact O-OG 3.06Å
219L89Confident86.8Confident75 Ų7561.6 Ų61.639%0.39334%0.339SS..Hα-helixtrans-65.4-40.5178.1-67.7174000112.4Y122 V215 S216 Y217 S222 N223Y122-L219 HydrophobicContact CD2-CB 4Å; Y122-L219 HydrophobicContact CD2-CD1 4.24Å; Y122-L219 HydrophobicContact CE2-CB 3.78Å; Y122-L219 HydrophobicContact CE2-CD1 3.53Å; Y122-L219 HydrophobicContact CE2-CG 4.3Å; V215-L219 HydrophobicContact CG1-CD1 3.95Å; V215-L219 WeakPolarHBondContact O-CB 3.46Å; V215-L219 VanDerWaalsContact O-CG 3.28Å; V215-L219 WeakPolarHBondContact O-CG 3.39Å; V215-L219 PolarHBondContact O-N 2.9Å; S216-L219 PolarHBondContact O-N 3.37Å; Y217-L219 VanDerWaalsContact C-N 3.34Å; L219-S222 PolarHBondContact O-N 3.43Å; L219-N223 WeakPolarHBondContact O-CB 3.2Å; L219-N223 PolarHBondContact O-N 2.97Å
220I88.3Confident86.2Confident1 Ų165.3 Ų65.31%0.00537%0.37CS..Hα-helixtrans-59-49.1173.5-71.4163.4000110.1R121 I125 S216 Y217 N223 I224R121-I220 HydrophobicContact CB-CD1 4.2Å; I125-I220 HydrophobicContact CD1-CG2 3.93Å; S216-I220 WeakPolarHBondContact O-CB 3.41Å; S216-I220 WeakPolarHBondContact O-CD1 3.22Å; S216-I220 WeakPolarHBondContact O-CG1 3.48Å; S216-I220 PolarHBondContact O-N 3.1Å; Y217-I220 HydrophobicContact CD1-CD1 4.25Å; Y217-I220 HydrophobicContact CE1-CD1 4.38Å; Y217-I220 PolarHBondContact O-N 2.97Å; I220-N223 PolarHBondContact O-N 2.98Å; I220-I224 HydrophobicContact CG2-CD1 3.64Å; I220-I224 HydrophobicContact CG2-CG1 4.31Å; I220-I224 VanDerWaalsContact O-CG1 3.25Å; I220-I224 WeakPolarHBondContact O-CG1 3.44Å; I220-I224 PolarHBondContact O-N 3.45Å
221L86.4Confident85.7Confident80 Ų8070.9 Ų70.942%0.41939%0.391SS..Hα-helixtrans-61.7-46.3179.3-75.4168.4000111.5Y217 T218 N223 I224 L225 F237Y217-L221 WeakPolarHBondContact O-CB 3.21Å; Y217-L221 VanDerWaalsContact O-CG 3.24Å; Y217-L221 WeakPolarHBondContact O-CG 3.18Å; Y217-L221 PolarHBondContact O-N 2.93Å; T218-L221 PolarHBondContact O-N 2.95Å; L221-N223 VanDerWaalsContact C-N 3.29Å; L221-N223 PolarHBondContact O-N 3.49Å; L221-I224 PolarHBondContact O-N 2.93Å; L221-L225 VanDerWaalsContact O-CG 3.28Å; L221-L225 WeakPolarHBondContact O-CG 3.21Å; L221-L225 PolarHBondContact O-N 3.37Å; L221-F237 HydrophobicContact CD2-CE1 3.95Å; L221-F237 HydrophobicContact CD2-CZ 4.14Å
222S86.5Confident84.9Confident69 Ų6967.3 Ų67.348%0.48338%0.378SS..Hα-helixtrans-57.2-43175.6-63.80000111.9T218 L219 L225 S226T218-S222 WeakPolarHBondContact O-CB 3.21Å; T218-S222 PolarHBondContact O-N 3.16Å; T218-S222 PolarHBondContact O-OG 3.41Å; T218-S222 VanDerWaalsContact O-OG 3.06Å; L219-S222 PolarHBondContact O-N 3.43Å; S222-L225 PolarHBondContact O-N 3.06Å; S222-S226 PolarHBondContact O-N 3.32Å
223N85.9Confident84.4Confident51 Ų5169.6 Ų69.627%0.27338%0.382SS..Hα-helixtrans-67.7-43.9177.6-161.4-33.1000111.6C126 L219 I220 L221 L225 S226 I227C126-N223 WeakPolarHBondContact CA-ND2 3.24Å; L219-N223 WeakPolarHBondContact O-CB 3.2Å; L219-N223 PolarHBondContact O-N 2.97Å; I220-N223 PolarHBondContact O-N 2.98Å; L221-N223 VanDerWaalsContact C-N 3.29Å; L221-N223 PolarHBondContact O-N 3.49Å; N223-L225 VanDerWaalsContact C-N 3.29Å; N223-L225 PolarHBondContact O-N 2.95Å; N223-S226 WeakPolarHBondContact O-CA 3.3Å; N223-S226 WeakPolarHBondContact O-CB 3.32Å; N223-S226 PolarHBondContact O-N 3.39Å; N223-S226 PolarHBondContact O-OG 3.12Å; N223-S226 PolarHBondContact OD1-OG 3.15Å; N223-I227 PolarHBondContact O-N 3.18Å
224I83.9Confident83.7Confident3 Ų372.9 Ų72.92%0.01541%0.405CS..Hα-helixtrans-58.3-41.9175.6-68.7171.8000111.4I220 L221 S226 I227 R233 A236 F237I220-I224 HydrophobicContact CG2-CD1 3.64Å; I220-I224 HydrophobicContact CG2-CG1 4.31Å; I220-I224 VanDerWaalsContact O-CG1 3.25Å; I220-I224 WeakPolarHBondContact O-CG1 3.44Å; I220-I224 PolarHBondContact O-N 3.45Å; L221-I224 PolarHBondContact O-N 2.93Å; I224-S226 PolarHBondContact O-N 2.88Å; I224-I227 WeakPolarHBondContact O-CB 3.35Å; I224-I227 PolarHBondContact O-N 3.46Å; I224-I227 VanDerWaalsContact O-N 3.13Å; I224-R233 HydrophobicContact CG2-CB 4.29Å; I224-R233 HydrophobicContact CG2-CG 4.13Å; I224-R233 WeakPolarHBondContact O-CG 3.44Å; I224-A236 HydrophobicContact CD1-CB 3.65Å; I224-A236 HydrophobicContact CG1-CB 3.62Å; I224-F237 HydrophobicContact CG2-CD2 3.99Å; I224-F237 HydrophobicContact CG2-CE2 3.58Å; I224-F237 HydrophobicContact CG2-CZ 4.18Å
225L82.4Confident83.1Confident115 Ų11573.6 Ų73.660%0.60241%0.408SS*.Hα-helixtrans-63-31.9176.7-69.9172.3000112L221 S222 N223 I227 R233L221-L225 VanDerWaalsContact O-CG 3.28Å; L221-L225 WeakPolarHBondContact O-CG 3.21Å; L221-L225 PolarHBondContact O-N 3.37Å; S222-L225 PolarHBondContact O-N 3.06Å; N223-L225 VanDerWaalsContact C-N 3.29Å; N223-L225 PolarHBondContact O-N 2.95Å; L225-I227 VanDerWaalsContact C-N 3.32Å; L225-I227 PolarHBondContact O-N 3.46Å; L225-R233 PolarHBondContact O-NH2 3.31Å
226S83.9Confident82.3Confident73 Ų7370.4 Ų70.451%0.5139%0.39SS..Hα-helixtrans-72.6-19175.581.60000114.3S222 N223 I224 H228S222-S226 PolarHBondContact O-N 3.32Å; N223-S226 WeakPolarHBondContact O-CA 3.3Å; N223-S226 WeakPolarHBondContact O-CB 3.32Å; N223-S226 PolarHBondContact O-N 3.39Å; N223-S226 PolarHBondContact O-OG 3.12Å; N223-S226 PolarHBondContact OD1-OG 3.15Å; I224-S226 PolarHBondContact O-N 2.88Å; S226-H228 PolarHBondContact O-N 3.27Å
227I82.9Confident81.5Confident48 Ų4875.3 Ų75.325%0.24641%0.411CS..  trans-69.1122.8176.1-60.8172.6000109.1N223 I224 L225 R233N223-I227 PolarHBondContact O-N 3.18Å; I224-I227 WeakPolarHBondContact O-CB 3.35Å; I224-I227 PolarHBondContact O-N 3.46Å; I224-I227 VanDerWaalsContact O-N 3.13Å; L225-I227 VanDerWaalsContact C-N 3.32Å; L225-I227 PolarHBondContact O-N 3.46Å; I227-R233 HydrophobicContact CB-CG 4.14Å; I227-R233 HydrophobicContact CG2-CG 4.33Å; I227-R233 PolarHBondContact O-NE 3.29Å; I227-R233 PolarHBondContact O-NH2 3.48Å
228H79.1Confident80.6Confident188 Ų18878.2 Ų78.287%0.8744%0.436SS*.  trans-78.4-22.4-178.7-72.6-77.5000114.3S226S226-H228 PolarHBondContact O-N 3.27Å
229S83.9Confident79.9Confident64 Ų6477.9 Ų77.945%0.44843%0.434SS..  trans-87.3128.1179.7172.90000112.5E231 G232 R233S229-E231 VanDerWaalsContact C-N 3.25Å; S229-E231 PolarHBondContact O-N 2.87Å; S229-E231 PolarHBondContact OG-N 2.89Å; S229-G232 PolarHBondContact O-N 3.46Å; S229-G232 PolarHBondContact OG-N 2.92Å; S229-R233 PolarHBondContact O-N 3.43Å
230A77.7Confident79.3Confident79 Ų7974.7 Ų74.765%0.65342%0.417SS*.Hα-helixtrans-60.6-34.3174.800000112.7R233 S234A230-R233 PolarHBondContact O-N 3.22Å; A230-S234 WeakPolarHBondContact O-CB 3.28Å; A230-S234 PolarHBondContact O-N 2.87Å
231E76.3Confident78.9Confident162 Ų16275.6 Ų75.676%0.75743%0.427SS*.Hα-helixtrans-69.2-41177-168.5175.2-173.500111.4S229 S234 K235S229-E231 VanDerWaalsContact C-N 3.25Å; S229-E231 PolarHBondContact O-N 2.87Å; S229-E231 PolarHBondContact OG-N 2.89Å; E231-S234 PolarHBondContact O-N 3.4Å; E231-K235 WeakPolarHBondContact O-CB 3.39Å; E231-K235 PolarHBondContact O-N 2.93Å
232G73.6Confident78.6Confident27 Ų2772.4 Ų72.428%0.27841%0.411SS..Hα-helixtrans-62.2-42173.900000112.6S229 A236S229-G232 PolarHBondContact O-N 3.46Å; S229-G232 PolarHBondContact OG-N 2.92Å; G232-A236 PolarHBondContact O-N 2.93Å; G232-A236 VanDerWaalsContact O-N 3.1Å
233R78Confident78.6Confident96 Ų9669.1 Ų69.136%0.36239%0.388SS..Hα-helixtrans-62.4-49.9174.6-71.8179.8177.2167.30.8112.2I224 L225 I227 S229 A230 K235 A236 F237I224-R233 HydrophobicContact CG2-CB 4.29Å; I224-R233 HydrophobicContact CG2-CG 4.13Å; I224-R233 WeakPolarHBondContact O-CG 3.44Å; L225-R233 PolarHBondContact O-NH2 3.31Å; I227-R233 HydrophobicContact CB-CG 4.14Å; I227-R233 HydrophobicContact CG2-CG 4.33Å; I227-R233 PolarHBondContact O-NE 3.29Å; I227-R233 PolarHBondContact O-NH2 3.48Å; S229-R233 PolarHBondContact O-N 3.43Å; A230-R233 PolarHBondContact O-N 3.22Å; R233-K235 VanDerWaalsContact C-N 3.32Å; R233-K235 PolarHBondContact O-N 3.27Å; R233-A236 PolarHBondContact O-N 3.47Å; R233-F237 WeakPolarHBondContact O-CD2 3.38Å; R233-F237 PolarHBondContact O-N 2.93Å
234S75Confident78.5Confident80 Ų8069.3 Ų69.356%0.55939%0.392SS*.Hα-helixtrans-59.6-42.8-180-177.70000111.9A230 E231 A236 F237 S238A230-S234 WeakPolarHBondContact O-CB 3.28Å; A230-S234 PolarHBondContact O-N 2.87Å; E231-S234 PolarHBondContact O-N 3.4Å; S234-A236 PolarHBondContact O-N 3.37Å; S234-F237 PolarHBondContact O-N 2.84Å; S234-S238 WeakPolarHBondContact O-CB 3.44Å; S234-S238 PolarHBondContact O-N 3.42Å
235K74.8Confident78.5Confident159 Ų15972.2 Ų72.269%0.69141%0.406SS*.Hα-helixtrans-61.7-42.5175.9-171.3175.6-178.2179.30112.3E231 R233 S238 T239E231-K235 WeakPolarHBondContact O-CB 3.39Å; E231-K235 PolarHBondContact O-N 2.93Å; R233-K235 VanDerWaalsContact C-N 3.32Å; R233-K235 PolarHBondContact O-N 3.27Å; K235-S238 PolarHBondContact O-N 3.13Å; K235-T239 PolarHBondContact O-N 3.31Å; K235-T239 VanDerWaalsContact O-N 3.16Å; K235-T239 PolarHBondContact O-OG1 2.89Å
236A73.3Confident78.5Confident12 Ų1266.9 Ų66.910%0.09938%0.379CS..Hα-helixtrans-66.6-45.1177.900000112.1I224 G232 R233 S234 S238 T239 C240I224-A236 HydrophobicContact CD1-CB 3.65Å; I224-A236 HydrophobicContact CG1-CB 3.62Å; G232-A236 PolarHBondContact O-N 2.93Å; G232-A236 VanDerWaalsContact O-N 3.1Å; R233-A236 PolarHBondContact O-N 3.47Å; S234-A236 PolarHBondContact O-N 3.37Å; A236-S238 VanDerWaalsContact C-N 3.34Å; A236-S238 PolarHBondContact O-N 3.32Å; A236-T239 WeakPolarHBondContact O-CB 3.34Å; A236-T239 PolarHBondContact O-N 2.88Å; A236-T239 VanDerWaalsContact O-N 3.08Å; A236-C240 PolarHBondContact O-N 3.48Å
237F74.4Confident78.5Confident111 Ų11164.2 Ų64.249%0.48736%0.359SS..Hα-helixtrans-59.8-42.5174.5-86.5-69.2000112.6L221 I224 R233 S234 T239 C240 G241L221-F237 HydrophobicContact CD2-CE1 3.95Å; L221-F237 HydrophobicContact CD2-CZ 4.14Å; I224-F237 HydrophobicContact CG2-CD2 3.99Å; I224-F237 HydrophobicContact CG2-CE2 3.58Å; I224-F237 HydrophobicContact CG2-CZ 4.18Å; R233-F237 WeakPolarHBondContact O-CD2 3.38Å; R233-F237 PolarHBondContact O-N 2.93Å; S234-F237 PolarHBondContact O-N 2.84Å; F237-T239 PolarHBondContact O-N 3.43Å; F237-C240 PolarHBondContact O-N 3.43Å; F237-G241 PolarHBondContact O-N 3.23Å
238S70.1Confident78.5Confident91 Ų9165.4 Ų65.464%0.63637%0.372SS*.Hα-helixtrans-63.1-27175.9-176.80000113S234 K235 A236S234-S238 WeakPolarHBondContact O-CB 3.44Å; S234-S238 PolarHBondContact O-N 3.42Å; K235-S238 PolarHBondContact O-N 3.13Å; A236-S238 VanDerWaalsContact C-N 3.34Å; A236-S238 PolarHBondContact O-N 3.32Å
239T71.9Confident78.5Confident52 Ų5260.2 Ų60.232%0.31935%0.35SS..Hα-helixtrans-80-35.1-178.3-54.70000111.7K235 A236 F237K235-T239 PolarHBondContact O-N 3.31Å; K235-T239 VanDerWaalsContact O-N 3.16Å; K235-T239 PolarHBondContact O-OG1 2.89Å; A236-T239 WeakPolarHBondContact O-CB 3.34Å; A236-T239 PolarHBondContact O-N 2.88Å; A236-T239 VanDerWaalsContact O-N 3.08Å; F237-T239 PolarHBondContact O-N 3.43Å
240C77.1Confident78.1Confident7 Ų757.8 Ų57.85%0.04733%0.332CS..Hα-helixtrans-88.4-21.9-179.6-71.70000114I125 Y217 A236 F237 S242 H243 V244I125-C240 WeakPolarHBondContact CD1-SG 3.48Å; Y217-C240 HydrophobicContact CE1-CB 4.14Å; A236-C240 PolarHBondContact O-N 3.48Å; F237-C240 PolarHBondContact O-N 3.43Å; C240-S242 PolarHBondContact O-N 2.87Å; C240-H243 PolarHBondContact O-N 2.87Å; C240-H243 VanDerWaalsContact O-N 3.16Å; C240-V244 WeakPolarHBondContact O-CG2 3.47Å; C240-V244 PolarHBondContact O-N 3Å
241G80.1Confident78Confident21 Ų2155.5 Ų55.522%0.21631%0.307CS..Hα-helixtrans-57.9-41.9-169.200000114.8F237 V244 I245F237-G241 PolarHBondContact O-N 3.23Å; G241-V244 PolarHBondContact O-N 2.96Å; G241-I245 WeakPolarHBondContact O-CD1 3.17Å; G241-I245 VanDerWaalsContact O-CG1 3.23Å; G241-I245 WeakPolarHBondContact O-CG1 3.36Å; G241-I245 PolarHBondContact O-N 2.95Å; G241-I245 VanDerWaalsContact O-N 3.08Å
242S80.3Confident78Confident12 Ų1249.7 Ų49.78%0.08429%0.29CS..Hα-helixtrans-63.4-45.1177.249.70000111.9C240 I245 A246 I287C240-S242 PolarHBondContact O-N 2.87Å; S242-I245 PolarHBondContact O-N 2.77Å; S242-A246 PolarHBondContact O-N 3.46Å; S242-I287 VanDerWaalsContact CB-O 3.23Å; S242-I287 WeakPolarHBondContact CB-O 3.44Å; S242-I287 WeakPolarHBondContact O-CG2 3.38Å
243H85.5Confident77.9Confident0 Ų049.3 Ų49.30%029%0.285CS..Hα-helixtrans-67.5-38.9179.7-169.1-88000112.3L114 M117 Y217 C240 I245 A246 V247 Y288L114-H243 PolarHBondContact O-CE1 3.27Å; L114-H243 PolarHBondContact O-NE2 3.18Å; M117-H243 VanDerWaalsContact CB-NE2 3.29Å; M117-H243 WeakPolarHBondContact CB-NE2 3.41Å; Y217-H243 AromaticContact CE2-ND1 3.78Å; Y217-H243 AromaticContact CZ-ND1 3.66Å; Y217-H243 WeakPolarHBondContact OH-CB 3.49Å; Y217-H243 PolarHBondContact OH-ND1 3.29Å; C240-H243 PolarHBondContact O-N 2.87Å; C240-H243 VanDerWaalsContact O-N 3.16Å; H243-I245 VanDerWaalsContact C-N 3.31Å; H243-I245 PolarHBondContact O-N 3.25Å; H243-A246 PolarHBondContact O-N 3.13Å; H243-V247 WeakPolarHBondContact CE1-CG2 3.45Å; H243-V247 WeakPolarHBondContact O-CB 3.35Å; H243-V247 VanDerWaalsContact O-CG2 3.32Å; H243-V247 WeakPolarHBondContact O-CG2 2.98Å; H243-V247 PolarHBondContact O-N 3.2Å; H243-Y288 HydrophobicContact CB-CE1 4.5Å; H243-Y288 PolarHBondContact CD2-OH 3.29Å; H243-Y288 VanDerWaalsContact CD2-OH 3.24Å
244V84.4Confident77.5Confident56 Ų5645.8 Ų45.834%0.33928%0.276SS..Hα-helixtrans-59.5-44.5173.3173.20000110.6Y217 C240 G241 V247 S248Y217-V244 HydrophobicContact CD1-CG2 3.94Å; Y217-V244 HydrophobicContact CE1-CG2 3.25Å; C240-V244 WeakPolarHBondContact O-CG2 3.47Å; C240-V244 PolarHBondContact O-N 3Å; G241-V244 PolarHBondContact O-N 2.96Å; V244-V247 PolarHBondContact O-N 2.97Å; V244-S248 VanDerWaalsContact O-CB 3.29Å; V244-S248 WeakPolarHBondContact O-CB 3.34Å; V244-S248 PolarHBondContact O-N 3.09Å; V244-S248 PolarHBondContact O-OG 2.92Å
245I83.4Confident77.3Confident64 Ų6444 Ų4433%0.32827%0.267SS..Hα-helixtrans-61.6-46.9177.6-67.7164.7000110.8G241 S242 H243 S248 L249 I287G241-I245 WeakPolarHBondContact O-CD1 3.17Å; G241-I245 VanDerWaalsContact O-CG1 3.23Å; G241-I245 WeakPolarHBondContact O-CG1 3.36Å; G241-I245 PolarHBondContact O-N 2.95Å; G241-I245 VanDerWaalsContact O-N 3.08Å; S242-I245 PolarHBondContact O-N 2.77Å; H243-I245 VanDerWaalsContact C-N 3.31Å; H243-I245 PolarHBondContact O-N 3.25Å; I245-S248 PolarHBondContact O-N 2.92Å; I245-L249 HydrophobicContact CG2-CD1 3.84Å; I245-L249 HydrophobicContact CG2-CG 4.46Å; I245-L249 WeakPolarHBondContact O-CB 3.23Å; I245-L249 VanDerWaalsContact O-CG 3.32Å; I245-L249 WeakPolarHBondContact O-CG 3.28Å; I245-L249 PolarHBondContact O-N 3.11Å; I245-I287 HydrophobicContact CB-CG2 4.43Å; I245-I287 HydrophobicContact CG2-CD1 4.18Å; I245-I287 HydrophobicContact CG2-CG1 4.22Å; I245-I287 HydrophobicContact CG2-CG2 4.45Å
246A83.1Confident76.8Confident2 Ų243.4 Ų43.42%0.01726%0.264CS..Hα-helixtrans-59.5-49.2178.300000111.9L114 S242 H243 S248 L249 F250 I287 Y288L114-A246 HydrophobicContact CD2-CB 4.38Å; S242-A246 PolarHBondContact O-N 3.46Å; H243-A246 PolarHBondContact O-N 3.13Å; A246-S248 PolarHBondContact O-N 3.03Å; A246-L249 PolarHBondContact O-N 3.17Å; A246-F250 WeakPolarHBondContact O-CB 3.47Å; A246-F250 PolarHBondContact O-N 2.03Å; A246-I287 HydrophobicContact CB-CD1 4.38Å; A246-I287 HydrophobicContact CB-CG2 4.13Å; A246-Y288 HydrophobicContact CB-CE2 4.09Å; A246-Y288 WeakPolarHBondContact CB-OH 2.95Å
247V83.6Confident76.3Confident18 Ų1844.7 Ų44.711%0.10927%0.269CS..Hα-helixtrans-61.9-451781680000111.6L213 H243 V244 L249 F250 F251L213-V247 HydrophobicContact CD1-CG1 3.64Å; L213-V247 HydrophobicContact CD1-CG2 4.4Å; L213-V247 HydrophobicContact CD2-CG1 4.09Å; L213-V247 HydrophobicContact CD2-CG2 3.83Å; L213-V247 HydrophobicContact CG-CG1 4.4Å; H243-V247 WeakPolarHBondContact CE1-CG2 3.45Å; H243-V247 WeakPolarHBondContact O-CB 3.35Å; H243-V247 VanDerWaalsContact O-CG2 3.32Å; H243-V247 WeakPolarHBondContact O-CG2 2.98Å; H243-V247 PolarHBondContact O-N 3.2Å; V244-V247 PolarHBondContact O-N 2.97Å; V247-L249 VanDerWaalsContact C-N 3.33Å; V247-L249 PolarHBondContact O-N 2.95Å; V247-F250 PolarHBondContact O-N 3.33Å; V247-F251 HydrophobicContact CG1-CD2 3.79Å; V247-F251 HydrophobicContact CG1-CE2 4.33Å; V247-F251 WeakPolarHBondContact O-CB 3.02Å; V247-F251 WeakPolarHBondContact O-CD2 3.11Å; V247-F251 PolarHBondContact O-N 3.23Å
248S82Confident75.5Confident73 Ų7345.6 Ų45.651%0.5127%0.27SS..Hα-helixtrans-64-37.8178.9-66.70000112.3V244 I245 A246 G252V244-S248 VanDerWaalsContact O-CB 3.29Å; V244-S248 WeakPolarHBondContact O-CB 3.34Å; V244-S248 PolarHBondContact O-N 3.09Å; V244-S248 PolarHBondContact O-OG 2.92Å; I245-S248 PolarHBondContact O-N 2.92Å; A246-S248 PolarHBondContact O-N 3.03Å; S248-G252 WeakPolarHBondContact O-CA 3.46Å; S248-G252 PolarHBondContact O-N 3.21Å
249L80.2Confident75Confident78 Ų7848.3 Ų48.341%0.40828%0.276SS..Hα-helixtrans-66.6-47.4175.1-74.8168.2000111.2I245 A246 V247 A253 L283 I287I245-L249 HydrophobicContact CG2-CD1 3.84Å; I245-L249 HydrophobicContact CG2-CG 4.46Å; I245-L249 WeakPolarHBondContact O-CB 3.23Å; I245-L249 VanDerWaalsContact O-CG 3.32Å; I245-L249 WeakPolarHBondContact O-CG 3.28Å; I245-L249 PolarHBondContact O-N 3.11Å; A246-L249 PolarHBondContact O-N 3.17Å; V247-L249 VanDerWaalsContact C-N 3.33Å; V247-L249 PolarHBondContact O-N 2.95Å; L249-A253 WeakPolarHBondContact O-CB 3.37Å; L249-A253 PolarHBondContact O-N 3.33Å; L249-L283 HydrophobicContact CD1-CD1 3.93Å; L249-I287 HydrophobicContact CD1-CD1 3.63Å
250F75.9Confident74.5Confident14 Ų1447.9 Ų47.96%0.06127%0.27CS..Hα-helixtrans-66.3-58.2-177.6-175.5-89.2000112.3E110 C111 L114 A246 V247 A253 A254E110-F250 HydrophobicContact CB-CE2 4.25Å; E110-F250 HydrophobicContact CG-CD2 4.08Å; E110-F250 HydrophobicContact CG-CE2 3.75Å; E110-F250 HydrophobicContact CG-CZ 4.36Å; E110-F250 WeakPolarHBondContact OE1-CD2 3.4Å; E110-F250 VanDerWaalsContact OE2-CE2 3.32Å; E110-F250 WeakPolarHBondContact OE2-CE2 3.44Å; C111-F250 HydrophobicContact CB-CE1 4.4Å; C111-F250 WeakPolarHBondContact SG-CE1 3.17Å; C111-F250 WeakPolarHBondContact SG-CZ 3.48Å; L114-F250 HydrophobicContact CD1-CB 4.05Å; L114-F250 HydrophobicContact CD1-CD1 4.19Å; L114-F250 HydrophobicContact CD1-CD2 4.39Å; L114-F250 HydrophobicContact CD1-CG 3.93Å; A246-F250 WeakPolarHBondContact O-CB 3.47Å; A246-F250 PolarHBondContact O-N 2.03Å; V247-F250 PolarHBondContact O-N 3.33Å; F250-A253 PolarHBondContact O-N 2.62Å; F250-A254 PolarHBondContact O-N 2.97Å; F250-A254 VanDerWaalsContact O-N 3.15Å
251F75.9Confident73.4Confident30 Ų3051.7 Ų51.713%0.13230%0.295CS..Hα-helixtrans-72.5-30.8-178.6-74.5-90.1000112.6P209 L213 V247 A254 A255P209-F251 HydrophobicContact CB-CE1 3.92Å; P209-F251 HydrophobicContact CB-CZ 3.56Å; L213-F251 HydrophobicContact CD1-CD2 3.84Å; L213-F251 HydrophobicContact CD1-CE1 4.4Å; L213-F251 HydrophobicContact CD1-CE2 3.33Å; L213-F251 HydrophobicContact CD1-CZ 3.66Å; V247-F251 HydrophobicContact CG1-CD2 3.79Å; V247-F251 HydrophobicContact CG1-CE2 4.33Å; V247-F251 WeakPolarHBondContact O-CB 3.02Å; V247-F251 WeakPolarHBondContact O-CD2 3.11Å; V247-F251 PolarHBondContact O-N 3.23Å; F251-A254 PolarHBondContact O-N 3.29Å; F251-A255 VanDerWaalsContact O-CB 3.32Å; F251-A255 WeakPolarHBondContact O-CB 3.44Å; F251-A255 PolarHBondContact O-N 3.37Å
252G75.9Confident72.2Confident40 Ų4057.4 Ų57.441%0.41233%0.331SS..Hα-helixtrans-65.9-42.1175.100000112.2S248 A255 F256S248-G252 WeakPolarHBondContact O-CA 3.46Å; S248-G252 PolarHBondContact O-N 3.21Å; G252-A255 PolarHBondContact O-N 3.32Å; G252-F256 PolarHBondContact O-N 3.08Å
253A71.8Confident70.9Confident20 Ų2062 Ų6217%0.16536%0.363CS..Hα-helixtrans-63.9-42.7174.100000111.7L249 F250 F256 M257 F275L249-A253 WeakPolarHBondContact O-CB 3.37Å; L249-A253 PolarHBondContact O-N 3.33Å; F250-A253 PolarHBondContact O-N 2.62Å; A253-F256 PolarHBondContact O-N 3.22Å; A253-M257 PolarHBondContact O-N 3.44Å; A253-F275 HydrophobicContact CB-CB 4.13Å
254A68.4Low69.6Low21 Ų2163.8 Ų63.817%0.17438%0.378CS..Hα-helixtrans-62.9-44.6175.800000112.2F250 F251 F256 M257 Y258F250-A254 PolarHBondContact O-N 2.97Å; F250-A254 VanDerWaalsContact O-N 3.15Å; F251-A254 PolarHBondContact O-N 3.29Å; A254-F256 VanDerWaalsContact C-N 3.33Å; A254-F256 PolarHBondContact O-N 3.42Å; A254-M257 WeakPolarHBondContact O-CB 3.35Å; A254-M257 PolarHBondContact O-N 2.96Å; A254-Y258 WeakPolarHBondContact O-CD2 3.43Å; A254-Y258 PolarHBondContact O-N 3.05Å
255A70.5Confident68.5Low44 Ų4463.6 Ų63.636%0.36438%0.38SS..Hα-helixtrans-62.4-39.2178.300000112.4F251 G252 M257 Y258 L259F251-A255 VanDerWaalsContact O-CB 3.32Å; F251-A255 WeakPolarHBondContact O-CB 3.44Å; F251-A255 PolarHBondContact O-N 3.37Å; G252-A255 PolarHBondContact O-N 3.32Å; A255-M257 PolarHBondContact O-N 3.44Å; A255-Y258 PolarHBondContact O-N 3.44Å; A255-L259 HydrophobicContact CB-CD1 4.35Å; A255-L259 VanDerWaalsContact O-CB 3.3Å; A255-L259 WeakPolarHBondContact O-CB 3.24Å; A255-L259 WeakPolarHBondContact O-CG 3.43Å; A255-L259 PolarHBondContact O-N 3.33Å
256F66Low67.4Low145 Ų14563.3 Ų63.364%0.63638%0.38SS*.Hα-helixtrans-60.2-35.7175.9-176.2-97000112.4G252 A253 A254G252-F256 PolarHBondContact O-N 3.08Å; A253-F256 PolarHBondContact O-N 3.22Å; A254-F256 VanDerWaalsContact C-N 3.33Å; A254-F256 PolarHBondContact O-N 3.42Å
257M61.4Low66.4Low40 Ų4067.5 Ų67.520%0.19740%0.403CS..Hα-helixtrans-69.2-45.5177.3-171.2-176.572.700112.2A253 A254 A255 K260 Y276A253-M257 PolarHBondContact O-N 3.44Å; A254-M257 WeakPolarHBondContact O-CB 3.35Å; A254-M257 PolarHBondContact O-N 2.96Å; A255-M257 PolarHBondContact O-N 3.44Å; M257-K260 WeakPolarHBondContact O-CB 3.43Å; M257-Y276 HydrophobicContact SD-CE1 3.82Å
258Y57.6Low65.3Low130 Ų13070.3 Ų70.351%0.5142%0.417SS..Hα-helixtrans-81.3-28.3-175-71.8-69.4000114.5V202 A254 A255 K260V202-Y258 HydrophobicContact CG1-CE1 3.97Å; V202-Y258 HydrophobicContact CG1-CE2 3.98Å; V202-Y258 VanDerWaalsContact CG1-CZ 3.45Å; V202-Y258 WeakPolarHBondContact CG1-OH 3.32Å; A254-Y258 WeakPolarHBondContact O-CD2 3.43Å; A254-Y258 PolarHBondContact O-N 3.05Å; A255-Y258 PolarHBondContact O-N 3.44Å; Y258-K260 PolarHBondContact O-N 3.12Å
259L61.1Low64.5Low147 Ų14769.7 Ų69.777%0.7741%0.408SS*.THydrogen-bonded Turntrans-85.17.2178.9-64.9173.3000113.1A255A255-L259 HydrophobicContact CB-CD1 4.35Å; A255-L259 VanDerWaalsContact O-CB 3.3Å; A255-L259 WeakPolarHBondContact O-CB 3.24Å; A255-L259 WeakPolarHBondContact O-CG 3.43Å; A255-L259 PolarHBondContact O-N 3.33Å
260K61Low64.1Low43 Ų4366.4 Ų66.419%0.18739%0.391CS..  trans-71.9139.8-175.4-159.5-178.2-175.3-161.50111M257 Y258 A264 D268 D269M257-K260 WeakPolarHBondContact O-CB 3.43Å; Y258-K260 PolarHBondContact O-N 3.12Å; K260-A264 HydrophobicContact CD-CB 3.54Å; K260-A264 HydrophobicContact CG-CB 3.68Å; K260-D268 VanDerWaalsContact CE-CB 3.45Å; K260-D268 PolarHBondContact NZ-O 3.35Å; K260-D269 IonicContact NZ-OD1 2.82Å; K260-D269 PolarHBondContact NZ-OD1 3.26Å
261P54.4Low63.7Low87 Ų8769.2 Ų69.257%0.56541%0.409SS*.  trans-60.2144.9177.1-21.432000111.6S263 A264P261-S263 PolarHBondContact O-N 2.93Å; P261-A264 VanDerWaalsContact O-CB 3.27Å; P261-A264 WeakPolarHBondContact O-CB 3.37Å; P261-A264 PolarHBondContact O-N 3.16Å
262S53.9Low63.1Low141 Ų14168.1 Ų68.199%0.98640%0.404SS*.THydrogen-bonded Turntrans-60.7-8175.247.50000114.5
263S53.4Low62.9Low108 Ų10866.3 Ų66.376%0.75539%0.386SS*.THydrogen-bonded Turntrans-88.52.5173.462.40000114.4P261P261-S263 PolarHBondContact O-N 2.93Å
264A58.1Low63.1Low38 Ų3866.3 Ų66.331%0.31438%0.382SS..  trans-70.6147.1-179.800000113.7K260 P261K260-A264 HydrophobicContact CD-CB 3.54Å; K260-A264 HydrophobicContact CG-CB 3.68Å; P261-A264 VanDerWaalsContact O-CB 3.27Å; P261-A264 WeakPolarHBondContact O-CB 3.37Å; P261-A264 PolarHBondContact O-N 3.16Å
265S60.7Low63.1Low53 Ų5370.8 Ų70.837%0.37140%0.398SS..  trans-79156.7179.576.40000112.2D267 D268 D269S265-D267 PolarHBondContact O-N 3.33Å; S265-D268 WeakPolarHBondContact CB-OD2 3.5Å; S265-D268 PolarHBondContact N-OD2 2.95Å; S265-D268 VanDerWaalsContact N-OD2 3.14Å; S265-D268 WeakPolarHBondContact O-CB 3.38Å; S265-D268 PolarHBondContact O-N 2.88Å; S265-D268 PolarHBondContact OG-N 3.42Å; S265-D268 PolarHBondContact OG-OD2 3.17Å; S265-D269 PolarHBondContact O-N 2.74Å
266V60.5Low62.9Low57 Ų5769.8 Ų69.835%0.34539%0.385SS..Hα-helixtrans-63.6-28.4175.8-179.40000111.8N174 D269 K270N174-V266 WeakPolarHBondContact ND2-CG1 3.42Å; V266-D269 PolarHBondContact O-N 3.41Å; V266-K270 PolarHBondContact O-N 2.72Å
267D62.4Low63.2Low91 Ų9162.9 Ų62.949%0.48736%0.355SS..Hα-helixtrans-72.9-32177.2-72.4-29000111.9S265 D269 K270 V271S265-D267 PolarHBondContact O-N 3.33Å; D267-D269 PolarHBondContact O-N 3.22Å; D267-K270 PolarHBondContact O-N 2.98Å; D267-K270 IonicContact OD1-NZ 3.83Å; D267-K270 PolarHBondContact OD1-NZ 3.08Å; D267-V271 WeakPolarHBondContact O-CG2 3.42Å; D267-V271 PolarHBondContact O-N 3.24Å
268D59.8Low64Low77 Ų7761.2 Ų61.241%0.41235%0.347SS..Hα-helixtrans-65.3-28.7172.6-62.2-44000111.6K260 S265 S272K260-D268 VanDerWaalsContact CE-CB 3.45Å; K260-D268 PolarHBondContact NZ-O 3.35Å; S265-D268 WeakPolarHBondContact CB-OD2 3.5Å; S265-D268 PolarHBondContact N-OD2 2.95Å; S265-D268 VanDerWaalsContact N-OD2 3.14Å; S265-D268 WeakPolarHBondContact O-CB 3.38Å; S265-D268 PolarHBondContact O-N 2.88Å; S265-D268 PolarHBondContact OG-N 3.42Å; S265-D268 PolarHBondContact OG-OD2 3.17Å; D268-S272 PolarHBondContact O-N 3.39Å; D268-S272 VanDerWaalsContact O-N 3.07Å; D268-S272 PolarHBondContact O-OG 2.89Å
269D64.8Low64.9Low60 Ų6057 Ų5732%0.32133%0.334SS..Hα-helixtrans-69.6-41.1176.1-69-12.7000111.3K260 S265 V266 D267 V271 S272 T273K260-D269 IonicContact NZ-OD1 2.82Å; K260-D269 PolarHBondContact NZ-OD1 3.26Å; S265-D269 PolarHBondContact O-N 2.74Å; V266-D269 PolarHBondContact O-N 3.41Å; D267-D269 PolarHBondContact O-N 3.22Å; D269-V271 VanDerWaalsContact C-N 3.3Å; D269-V271 PolarHBondContact O-N 3.5Å; D269-S272 PolarHBondContact O-N 3.16Å; D269-T273 PolarHBondContact O-N 3.48Å; D269-T273 PolarHBondContact O-OG1 3.3Å
270K72.1Confident65.8Low9 Ų950.4 Ų50.44%0.03930%0.303CS..Hα-helixtrans-59.8-42175-62.9172.2-172.7162.40111.5L17 N174 Y176 V266 D267 T273 I274L17-K270 HydrophobicContact CD1-CB 3.98Å; N174-K270 WeakPolarHBondContact O-CE 3.38Å; N174-K270 VanDerWaalsContact OD1-CE 3.26Å; N174-K270 WeakPolarHBondContact OD1-CE 3.18Å; N174-K270 PolarHBondContact OD1-NZ 3.31Å; Y176-K270 HydrophobicContact CD1-CB 4.39Å; Y176-K270 HydrophobicContact CE1-CB 4.23Å; V266-K270 PolarHBondContact O-N 2.72Å; D267-K270 PolarHBondContact O-N 2.98Å; D267-K270 IonicContact OD1-NZ 3.83Å; D267-K270 PolarHBondContact OD1-NZ 3.08Å; K270-T273 PolarHBondContact O-N 3.42Å; K270-I274 WeakPolarHBondContact O-CG1 3.45Å; K270-I274 PolarHBondContact O-N 3.03Å
271V67.8Low66.6Low73 Ų7348.4 Ų48.444%0.44229%0.294SS..Hα-helixtrans-66.4-44.5178.8175.70000111D267 D269 T273 I274 F275D267-V271 WeakPolarHBondContact O-CG2 3.42Å; D267-V271 PolarHBondContact O-N 3.24Å; D269-V271 VanDerWaalsContact C-N 3.3Å; D269-V271 PolarHBondContact O-N 3.5Å; V271-T273 VanDerWaalsContact C-N 3.29Å; V271-T273 PolarHBondContact O-N 3.18Å; V271-I274 WeakPolarHBondContact O-CB 3.32Å; V271-I274 PolarHBondContact O-N 3.33Å; V271-F275 HydrophobicContact CG1-CE2 4.03Å; V271-F275 VanDerWaalsContact O-CD2 3.28Å; V271-F275 WeakPolarHBondContact O-CD2 3.21Å
272S64.4Low68Low6 Ų646 Ų464%0.04228%0.276CS..Hα-helixtrans-60.1-39.3174-64.40000112.3D268 D269 I274 F275D268-S272 PolarHBondContact O-N 3.39Å; D268-S272 VanDerWaalsContact O-N 3.07Å; D268-S272 PolarHBondContact O-OG 2.89Å; D269-S272 PolarHBondContact O-N 3.16Å; S272-I274 VanDerWaalsContact C-N 3.31Å; S272-I274 PolarHBondContact O-N 3.3Å; S272-F275 PolarHBondContact O-N 3.48Å
273T70.8Confident69.3Low3 Ų341.7 Ų41.72%0.01824%0.241CC..Hα-helixtrans-61.5-36.8176.3-55.40000112.2Y176 D269 K270 V271 F275 Y276 T277Y176-T273 WeakPolarHBondContact OH-CB 3.38Å; Y176-T273 VanDerWaalsContact OH-CG2 3.23Å; Y176-T273 WeakPolarHBondContact OH-CG2 3.3Å; D269-T273 PolarHBondContact O-N 3.48Å; D269-T273 PolarHBondContact O-OG1 3.3Å; K270-T273 PolarHBondContact O-N 3.42Å; V271-T273 VanDerWaalsContact C-N 3.29Å; V271-T273 PolarHBondContact O-N 3.18Å; T273-F275 VanDerWaalsContact C-N 3.26Å; T273-F275 PolarHBondContact O-N 3.47Å; T273-Y276 VanDerWaalsContact CA-CE1 3.47Å; T273-Y276 HydrophobicContact CG2-CE1 4Å; T273-T277 HydrophobicContact CG2-CG2 3.45Å; T273-T277 VanDerWaalsContact CG2-CG2 3.45Å; T273-T277 VanDerWaalsContact O-CB 3.24Å; T273-T277 WeakPolarHBondContact O-CB 3.4Å; T273-T277 WeakPolarHBondContact O-CG2 3.47Å; T273-T277 PolarHBondContact O-N 2.88Å; T273-T277 PolarHBondContact O-OG1 3.05Å
274I76Confident70.7Confident19 Ų1936.9 Ų36.910%0.09721%0.207CC..Hα-helixtrans-58.7-36.8177.3-68.3159.2000112.5L17 F31 Y176 K270 V271 S272 I278 V279L17-I274 HydrophobicContact CD1-CD1 3.4Å; L17-I274 VanDerWaalsContact CD1-CD1 3.4Å; L17-I274 HydrophobicContact CD1-CG1 4.36Å; L17-I274 HydrophobicContact CD2-CD1 3.75Å; L17-I274 HydrophobicContact CG-CD1 4.23Å; F31-I274 HydrophobicContact CE1-CG2 3.85Å; F31-I274 HydrophobicContact CZ-CD1 3.95Å; F31-I274 HydrophobicContact CZ-CG1 4.35Å; F31-I274 HydrophobicContact CZ-CG2 4.15Å; Y176-I274 HydrophobicContact CE1-CG1 4.26Å; Y176-I274 PolarHBondContact OH-N 3.41Å; K270-I274 WeakPolarHBondContact O-CG1 3.45Å; K270-I274 PolarHBondContact O-N 3.03Å; V271-I274 WeakPolarHBondContact O-CB 3.32Å; V271-I274 PolarHBondContact O-N 3.33Å; S272-I274 VanDerWaalsContact C-N 3.31Å; S272-I274 PolarHBondContact O-N 3.3Å; I274-I278 HydrophobicContact CG1-CD1 4.31Å; I274-I278 HydrophobicContact CG2-CB 4.24Å; I274-I278 HydrophobicContact CG2-CD1 4.31Å; I274-I278 WeakPolarHBondContact O-CA 3.16Å; I274-I278 WeakPolarHBondContact O-CB 3.5Å; I274-I278 PolarHBondContact O-N 3.5Å; I274-V279 HydrophobicContact CG2-CG2 4.29Å; I274-V279 PolarHBondContact O-N 2.78Å; I274-V279 VanDerWaalsContact O-N 3.11Å
275F68.4Low71.7Confident115 Ų11535.2 Ų35.250%0.50419%0.193SC..Iπ-helixtrans-65.8-47.7-174.6-79.3-81.1000112.9A253 V271 S272 T273 V279 G280A253-F275 HydrophobicContact CB-CB 4.13Å; V271-F275 HydrophobicContact CG1-CE2 4.03Å; V271-F275 VanDerWaalsContact O-CD2 3.28Å; V271-F275 WeakPolarHBondContact O-CD2 3.21Å; S272-F275 PolarHBondContact O-N 3.48Å; T273-F275 VanDerWaalsContact C-N 3.26Å; T273-F275 PolarHBondContact O-N 3.47Å; F275-V279 HydrophobicContact CD1-CG2 4.34Å; F275-V279 WeakPolarHBondContact O-CB 3.37Å; F275-V279 PolarHBondContact O-N 3.24Å; F275-G280 PolarHBondContact O-N 3.27Å; F275-G280 VanDerWaalsContact O-N 3.1Å
276Y66.7Low72.6Confident23 Ų2336.5 Ų36.59%0.0919%0.192CC..Iπ-helixtrans-82.2-30.2178.275.2-93.1000112F103 V107 M257 T273F103-Y276 HydrophobicContact CZ-CE2 4.16Å; V107-Y276 HydrophobicContact CG2-CE2 4.35Å; M257-Y276 HydrophobicContact SD-CE1 3.82Å; T273-Y276 VanDerWaalsContact CA-CE1 3.47Å; T273-Y276 HydrophobicContact CG2-CE1 4Å
277T72.9Confident73.7Confident1 Ų134.7 Ų34.71%0.00618%0.18CC..Iπ-helixtrans-87.7-22.6-173.266.40000115Y73 F103 Y176 T273Y73-T277 HydrophobicContact CE1-CG2 4.46Å; Y73-T277 WeakPolarHBondContact CE1-O 3.32Å; Y73-T277 WeakPolarHBondContact OH-CB 3.45Å; Y73-T277 WeakPolarHBondContact OH-CG2 3.38Å; F103-T277 HydrophobicContact CE2-CG2 3.69Å; F103-T277 HydrophobicContact CZ-CG2 4.19Å; Y176-T277 PolarHBondContact OH-OG1 3.43Å; T273-T277 HydrophobicContact CG2-CG2 3.45Å; T273-T277 VanDerWaalsContact CG2-CG2 3.45Å; T273-T277 VanDerWaalsContact O-CB 3.24Å; T273-T277 WeakPolarHBondContact O-CB 3.4Å; T273-T277 WeakPolarHBondContact O-CG2 3.47Å; T273-T277 PolarHBondContact O-N 2.88Å; T273-T277 PolarHBondContact O-OG1 3.05Å
278I77.8Confident74.4Confident4 Ų430.5 Ų30.52%0.02116%0.158CC..Iπ-helixtrans-126.6-45.5-172.4-66.8169.9000110.6F31 I34 M81 Y176 I274 M282F31-I278 HydrophobicContact CD1-CD1 4.23Å; F31-I278 HydrophobicContact CD1-CG2 4.14Å; F31-I278 HydrophobicContact CE1-CD1 4.02Å; F31-I278 HydrophobicContact CE1-CG2 4.21Å; I34-I278 HydrophobicContact CG2-CG2 3.51Å; M81-I278 HydrophobicContact CE-CD1 3.54Å; M81-I278 HydrophobicContact SD-CD1 3.81Å; Y176-I278 HydrophobicContact CE2-CD1 4.45Å; I274-I278 HydrophobicContact CG1-CD1 4.31Å; I274-I278 HydrophobicContact CG2-CB 4.24Å; I274-I278 HydrophobicContact CG2-CD1 4.31Å; I274-I278 WeakPolarHBondContact O-CA 3.16Å; I274-I278 WeakPolarHBondContact O-CB 3.5Å; I274-I278 PolarHBondContact O-N 3.5Å; I278-M282 WeakPolarHBondContact O-CB 3.24Å; I278-M282 PolarHBondContact O-N 3.44Å
279V76.9Confident75Confident41 Ų4127.8 Ų27.825%0.24815%0.145CC..Iπ-helixtrans-74.5-40.1-176.5-179.70000111.4I274 F275 M282 L283I274-V279 HydrophobicContact CG2-CG2 4.29Å; I274-V279 PolarHBondContact O-N 2.78Å; I274-V279 VanDerWaalsContact O-N 3.11Å; F275-V279 HydrophobicContact CD1-CG2 4.34Å; F275-V279 WeakPolarHBondContact O-CB 3.37Å; F275-V279 PolarHBondContact O-N 3.24Å; V279-M282 PolarHBondContact O-N 3.31Å; V279-L283 HydrophobicContact CG1-CD1 3.56Å; V279-L283 HydrophobicContact CG1-CG 4.04Å; V279-L283 WeakPolarHBondContact O-CB 3.44Å; V279-L283 VanDerWaalsContact O-CG 3.26Å; V279-L283 WeakPolarHBondContact O-CG 3.36Å; V279-L283 PolarHBondContact O-N 2.82Å
280G78.1Confident74.9Confident10 Ų1030 Ų3010%0.10316%0.156CC..Hα-helixtrans-54.2-64.1176.300000113.4F275 M282 L283 N284F275-G280 PolarHBondContact O-N 3.27Å; F275-G280 VanDerWaalsContact O-N 3.1Å; G280-M282 PolarHBondContact O-N 3.2Å; G280-M282 VanDerWaalsContact O-N 3.16Å; G280-L283 PolarHBondContact O-N 2.87Å; G280-N284 PolarHBondContact O-N 3.19Å; G280-N284 PolarHBondContact O-OD1 3.23Å
281P78.1Confident74.4Confident0 Ų038.1 Ų38.10%019%0.186CC..Hα-helixtrans-55.5-34.1178.9-29.836.4000114.1N42 D70 Y73 P285N42-P281 PolarHBondContact ND2-O 3.47Å; N42-P281 VanDerWaalsContact ND2-O 3.11Å; D70-P281 HydrophobicContact CB-CB 3.9Å; Y73-P281 HydrophobicContact CD1-CG 3.97Å; Y73-P281 HydrophobicContact CE1-CG 4.39Å; P281-P285 WeakPolarHBondContact O-CD 3.19Å
282M84.4Confident74.5Confident38 Ų3836 Ų3619%0.18717%0.172CC..Hα-helixtrans-70.3-38176.3178.7-112125.500112.3I34 V37 I278 V279 G280 F286I34-M282 HydrophobicContact CG2-CB 3.97Å; I34-M282 HydrophobicContact CG2-CG 3.95Å; V37-M282 HydrophobicContact CB-CG 4.45Å; V37-M282 HydrophobicContact CG1-CE 4.05Å; V37-M282 HydrophobicContact CG1-CG 3.98Å; I278-M282 WeakPolarHBondContact O-CB 3.24Å; I278-M282 PolarHBondContact O-N 3.44Å; V279-M282 PolarHBondContact O-N 3.31Å; G280-M282 PolarHBondContact O-N 3.2Å; G280-M282 VanDerWaalsContact O-N 3.16Å; M282-F286 HydrophobicContact CE-CD2 3.61Å; M282-F286 HydrophobicContact CE-CE2 3.3Å; M282-F286 HydrophobicContact CE-CZ 4.26Å; M282-F286 WeakPolarHBondContact O-CD2 3.46Å; M282-F286 WeakPolarHBondContact O-CE2 3.42Å
283L81.6Confident74.9Confident50 Ų5044.1 Ų44.126%0.26221%0.207SC..Hα-helixtrans-78.7-27.1-179.7-69.6176.9000113L249 V279 G280 F286 I287L249-L283 HydrophobicContact CD1-CD1 3.93Å; V279-L283 HydrophobicContact CG1-CD1 3.56Å; V279-L283 HydrophobicContact CG1-CG 4.04Å; V279-L283 WeakPolarHBondContact O-CB 3.44Å; V279-L283 VanDerWaalsContact O-CG 3.26Å; V279-L283 WeakPolarHBondContact O-CG 3.36Å; V279-L283 PolarHBondContact O-N 2.82Å; G280-L283 PolarHBondContact O-N 2.87Å; L283-F286 PolarHBondContact O-N 3.39Å; L283-I287 HydrophobicContact CB-CD1 3.81Å; L283-I287 HydrophobicContact CB-CG1 4.38Å; L283-I287 VanDerWaalsContact O-CG1 3.3Å; L283-I287 WeakPolarHBondContact O-CG1 3.26Å; L283-I287 PolarHBondContact O-N 2.82Å
284N83.2Confident74.9Confident6 Ų647 Ų473%0.03222%0.222CC..Hα-helixtrans-50.7-51.6-176.8-78.3-16000113.2D70 E110 G280 F286 I287 Y288D70-N284 PolarHBondContact OD1-ND2 2.96Å; D70-N284 VanDerWaalsContact OD2-CB 3.26Å; D70-N284 WeakPolarHBondContact OD2-CB 3.49Å; D70-N284 PolarHBondContact OD2-ND2 3.07Å; E110-N284 PolarHBondContact OE1-ND2 3.32Å; G280-N284 PolarHBondContact O-N 3.19Å; G280-N284 PolarHBondContact O-OD1 3.23Å; N284-F286 VanDerWaalsContact C-N 3.28Å; N284-F286 PolarHBondContact O-N 3.44Å; N284-I287 PolarHBondContact O-N 3.4Å; N284-Y288 WeakPolarHBondContact O-CD2 2.99Å; N284-Y288 PolarHBondContact O-N 3.36Å
285P78.4Confident74.7Confident4 Ų446 Ų463%0.02622%0.217CC..Hα-helixtrans-54.6-40.8175.1-28.534.5000113.6N42 P281 S289N42-P285 HydrophobicContact CB-CG 4.4Å; N42-P285 WeakPolarHBondContact OD1-CG 3.33Å; P281-P285 WeakPolarHBondContact O-CD 3.19Å; P285-S289 WeakPolarHBondContact O-CA 3.42Å; P285-S289 WeakPolarHBondContact O-CB 3.37Å; P285-S289 PolarHBondContact O-N 3.4Å; P285-S289 PolarHBondContact O-OG 3.16Å
286F80.1Confident75.1Confident79 Ų7944.4 Ų44.435%0.34621%0.211SC..Hα-helixtrans-73.3-41.9-178.6-61.5-75.2000112.1V37 M282 L283 N284 Y288 S289 I290V37-F286 HydrophobicContact CG1-CE2 3.46Å; V37-F286 VanDerWaalsContact CG1-CE2 3.46Å; V37-F286 HydrophobicContact CG1-CZ 3.53Å; M282-F286 HydrophobicContact CE-CD2 3.61Å; M282-F286 HydrophobicContact CE-CE2 3.3Å; M282-F286 HydrophobicContact CE-CZ 4.26Å; M282-F286 WeakPolarHBondContact O-CD2 3.46Å; M282-F286 WeakPolarHBondContact O-CE2 3.42Å; L283-F286 PolarHBondContact O-N 3.39Å; N284-F286 VanDerWaalsContact C-N 3.28Å; N284-F286 PolarHBondContact O-N 3.44Å; F286-Y288 VanDerWaalsContact C-N 3.29Å; F286-Y288 PolarHBondContact O-N 3.02Å; F286-S289 PolarHBondContact O-N 3.33Å; F286-I290 HydrophobicContact CB-CD1 3.94Å; F286-I290 HydrophobicContact CB-CG1 4.29Å; F286-I290 HydrophobicContact CD1-CD1 3.67Å; F286-I290 HydrophobicContact CD1-CG1 4.15Å; F286-I290 HydrophobicContact CG-CD1 4.25Å; F286-I290 VanDerWaalsContact O-CB 3.32Å; F286-I290 WeakPolarHBondContact O-CB 3.39Å; F286-I290 PolarHBondContact O-N 2.69Å
287I83Confident75.6Confident20 Ų2048.3 Ų48.310%0.10323%0.233CC..Hα-helixtrans-58.9-44.1177.6-67.4164.8000110.2S242 I245 A246 L249 L283 N284S242-I287 VanDerWaalsContact CB-O 3.23Å; S242-I287 WeakPolarHBondContact CB-O 3.44Å; S242-I287 WeakPolarHBondContact O-CG2 3.38Å; I245-I287 HydrophobicContact CB-CG2 4.43Å; I245-I287 HydrophobicContact CG2-CD1 4.18Å; I245-I287 HydrophobicContact CG2-CG1 4.22Å; I245-I287 HydrophobicContact CG2-CG2 4.45Å; A246-I287 HydrophobicContact CB-CD1 4.38Å; A246-I287 HydrophobicContact CB-CG2 4.13Å; L249-I287 HydrophobicContact CD1-CD1 3.63Å; L283-I287 HydrophobicContact CB-CD1 3.81Å; L283-I287 HydrophobicContact CB-CG1 4.38Å; L283-I287 VanDerWaalsContact O-CG1 3.3Å; L283-I287 WeakPolarHBondContact O-CG1 3.26Å; L283-I287 PolarHBondContact O-N 2.82Å; N284-I287 PolarHBondContact O-N 3.4Å
288Y77.9Confident75.5Confident2 Ų248.5 Ų48.51%0.00823%0.234CC..Hα-helixtrans-87.3-19.8-178-67.6-68.6000114.6M59 L63 L66 L114 M117 H243 A246 N284 F286 N292M59-Y288 HydrophobicContact CE-CD1 4.32Å; M59-Y288 HydrophobicContact CE-CE1 3.87Å; L63-Y288 HydrophobicContact CD1-CD1 4.1Å; L63-Y288 HydrophobicContact CD1-CD2 3.4Å; L63-Y288 HydrophobicContact CD1-CE2 3.99Å; L63-Y288 HydrophobicContact CD1-CG 3.48Å; L63-Y288 VanDerWaalsContact CD1-CG 3.48Å; L63-Y288 HydrophobicContact CD2-CG 4.29Å; L66-Y288 HydrophobicContact CD2-CD2 4.39Å; L66-Y288 HydrophobicContact CD2-CE2 3.68Å; L114-Y288 WeakPolarHBondContact CD2-OH 3.41Å; M117-Y288 HydrophobicContact CE-CD1 4.29Å; M117-Y288 HydrophobicContact CE-CE1 3.54Å; M117-Y288 HydrophobicContact CE-CE2 4.23Å; M117-Y288 WeakPolarHBondContact CE-OH 3.3Å; H243-Y288 HydrophobicContact CB-CE1 4.5Å; H243-Y288 PolarHBondContact CD2-OH 3.29Å; H243-Y288 VanDerWaalsContact CD2-OH 3.24Å; A246-Y288 HydrophobicContact CB-CE2 4.09Å; A246-Y288 WeakPolarHBondContact CB-OH 2.95Å; N284-Y288 WeakPolarHBondContact O-CD2 2.99Å; N284-Y288 PolarHBondContact O-N 3.36Å; F286-Y288 VanDerWaalsContact C-N 3.29Å; F286-Y288 PolarHBondContact O-N 3.02Å; Y288-N292 WeakPolarHBondContact O-CB 3.28Å
289S71.1Confident75.4Confident21 Ų2151.4 Ų51.415%0.14725%0.249CC..Hα-helixtrans-101.4-47.2-178-53.20000114.3P285 F286 R291 N292 H296P285-S289 WeakPolarHBondContact O-CA 3.42Å; P285-S289 WeakPolarHBondContact O-CB 3.37Å; P285-S289 PolarHBondContact O-N 3.4Å; P285-S289 PolarHBondContact O-OG 3.16Å; F286-S289 PolarHBondContact O-N 3.33Å; S289-R291 VanDerWaalsContact C-N 3.3Å; S289-R291 PolarHBondContact O-N 3.22Å; S289-N292 PolarHBondContact O-N 2.97Å; S289-N292 VanDerWaalsContact O-N 3.17Å; S289-H296 PolarHBondContact O-NE2 3.46Å
290I62.9Low75.5Confident106 Ų10657.5 Ų57.554%0.54427%0.268SS..THydrogen-bonded Turntrans-63.3-37.7-171-70.3-176.4000111.5F286 H296F286-I290 HydrophobicContact CB-CD1 3.94Å; F286-I290 HydrophobicContact CB-CG1 4.29Å; F286-I290 HydrophobicContact CD1-CD1 3.67Å; F286-I290 HydrophobicContact CD1-CG1 4.15Å; F286-I290 HydrophobicContact CG-CD1 4.25Å; F286-I290 VanDerWaalsContact O-CB 3.32Å; F286-I290 WeakPolarHBondContact O-CB 3.39Å; F286-I290 PolarHBondContact O-N 2.69Å; I290-H296 PolarHBondContact O-NE2 2.87Å
291R62.7Low75.5Confident179 Ų17961.6 Ų61.668%0.67528%0.283SS*.THydrogen-bonded Turntrans-90.8-6.1-178.4-73.4-175.1163.1-166.5-4.1113.7S289S289-R291 VanDerWaalsContact C-N 3.3Å; S289-R291 PolarHBondContact O-N 3.22Å
292N69.8Low75.4Confident28 Ų2863.1 Ų63.115%0.1529%0.292CS..  trans-102.7109.6-170-165.2-29.2000112.1Y60 Y288 S289 D294 V295 H296Y60-N292 VanDerWaalsContact OH-CG 3.27Å; Y60-N292 PolarHBondContact OH-ND2 3.43Å; Y60-N292 PolarHBondContact OH-OD1 3.44Å; Y60-N292 VanDerWaalsContact OH-OD1 3.12Å; Y288-N292 WeakPolarHBondContact O-CB 3.28Å; S289-N292 PolarHBondContact O-N 2.97Å; S289-N292 VanDerWaalsContact O-N 3.17Å; N292-D294 PolarHBondContact O-N 1.99Å; N292-D294 WeakPolarHBondContact OD1-CB 3.18Å; N292-D294 PolarHBondContact OD1-N 3.2Å; N292-V295 HydrophobicContact CB-CB 4.26Å; N292-V295 HydrophobicContact CB-CG2 3.91Å; N292-V295 PolarHBondContact O-N 3.39Å; N292-V295 VanDerWaalsContact O-N 3.14Å; N292-H296 PolarHBondContact O-CD2 3.48Å; N292-H296 PolarHBondContact O-N 3.39Å; N292-H296 VanDerWaalsContact O-N 3.17Å
293K71.9Confident75Confident178 Ų17866.1 Ų66.177%0.77431%0.307SS*.Hα-helixtrans-58.6-32.5-178.8-66.9-176.7180178.80112.7H296 L297K293-H296 PolarHBondContact O-N 3.25Å; K293-L297 WeakPolarHBondContact O-CB 3.28Å; K293-L297 PolarHBondContact O-N 3.49Å
294D71.8Confident74.8Confident62 Ų6271.3 Ų71.333%0.33233%0.327SS..Hα-helixtrans-70-37.7-179.8-54.3-30.8000111.1L55 Y60 N292 L297 A298L55-D294 HydrophobicContact CD2-CB 3.82Å; Y60-D294 VanDerWaalsContact OH-CB 3.25Å; Y60-D294 WeakPolarHBondContact OH-CB 3.17Å; Y60-D294 PolarHBondContact OH-OD2 2.99Å; N292-D294 PolarHBondContact O-N 1.99Å; N292-D294 WeakPolarHBondContact OD1-CB 3.18Å; N292-D294 PolarHBondContact OD1-N 3.2Å; D294-L297 PolarHBondContact O-N 3.3Å; D294-A298 WeakPolarHBondContact O-CB 3.49Å; D294-A298 PolarHBondContact O-N 3Å
295V70.5Confident74.4Confident0 Ų077.8 Ų77.80%035%0.351CS..Hα-helixtrans-67.6-42.8176.9-179.60000110.2L45 L48 Y60 N292 L297 A298 L299L45-V295 HydrophobicContact CD1-CG1 4.39Å; L48-V295 HydrophobicContact CD1-CG1 4.21Å; Y60-V295 HydrophobicContact CE1-CG2 3.96Å; N292-V295 HydrophobicContact CB-CB 4.26Å; N292-V295 HydrophobicContact CB-CG2 3.91Å; N292-V295 PolarHBondContact O-N 3.39Å; N292-V295 VanDerWaalsContact O-N 3.14Å; V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 PolarHBondContact O-N 3.44Å; V295-A298 PolarHBondContact O-N 3.47Å; V295-L299 HydrophobicContact CG1-CD1 4.02Å; V295-L299 WeakPolarHBondContact O-CB 3.26Å; V295-L299 WeakPolarHBondContact O-CG 3.45Å; V295-L299 PolarHBondContact O-N 2.92Å
296H76.7Confident73.6Confident81 Ų8182.1 Ų82.138%0.37538%0.382SS..Hα-helixtrans-59.7-40.5172.9-75.8-70000112.8S289 I290 N292 K293 R300S289-H296 PolarHBondContact O-NE2 3.46Å; I290-H296 PolarHBondContact O-NE2 2.87Å; N292-H296 PolarHBondContact O-CD2 3.48Å; N292-H296 PolarHBondContact O-N 3.39Å; N292-H296 VanDerWaalsContact O-N 3.17Å; K293-H296 PolarHBondContact O-N 3.25Å; H296-R300 WeakPolarHBondContact O-CG 3.13Å; H296-R300 PolarHBondContact O-N 2.82Å
297L77.4Confident72.5Confident104 Ų10486.8 Ų86.855%0.54540%0.402SS..Hα-helixtrans-66.3-43.9176.9-174.867.3000111.3K293 D294 V295 R300 K301K293-L297 WeakPolarHBondContact O-CB 3.28Å; K293-L297 PolarHBondContact O-N 3.49Å; D294-L297 PolarHBondContact O-N 3.3Å; V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 PolarHBondContact O-N 3.44Å; L297-R300 PolarHBondContact O-N 3.36Å; L297-K301 WeakPolarHBondContact O-CB 3.47Å; L297-K301 PolarHBondContact O-N 3.02Å
298A71.4Confident70.6Confident5 Ų594 Ų944%0.04145%0.448CS..Hα-helixtrans-62.4-43.2176.100000112L48 N52 L55 D294 V295 K301 T302L48-A298 HydrophobicContact CD2-CB 4.41Å; N52-A298 HydrophobicContact CB-CB 4.17Å; L55-A298 HydrophobicContact CD1-CB 3.63Å; L55-A298 HydrophobicContact CG-CB 4.24Å; D294-A298 WeakPolarHBondContact O-CB 3.49Å; D294-A298 PolarHBondContact O-N 3Å; V295-A298 PolarHBondContact O-N 3.47Å; A298-K301 PolarHBondContact O-N 2.66Å; A298-T302 WeakPolarHBondContact O-CB 3.41Å; A298-T302 PolarHBondContact O-N 3.33Å; A298-T302 PolarHBondContact O-OG1 3.19Å
299L76.1Confident70.2Confident65 Ų6598.6 Ų98.634%0.3447%0.47SS..Hα-helixtrans-56.2-52.4172.9-84.8157.8000111.3L48 V295 K301 T302 M303L48-L299 HydrophobicContact CD1-CD1 4.29Å; L48-L299 HydrophobicContact CD1-CD2 3.73Å; L48-L299 HydrophobicContact CD1-CG 3.64Å; L48-L299 HydrophobicContact CD2-CB 4.49Å; L48-L299 HydrophobicContact CD2-CD2 4.02Å; L48-L299 HydrophobicContact CD2-CG 3.96Å; L48-L299 HydrophobicContact CG-CD2 4.42Å; L48-L299 HydrophobicContact CG-CG 4.46Å; V295-L299 HydrophobicContact CG1-CD1 4.02Å; V295-L299 WeakPolarHBondContact O-CB 3.26Å; V295-L299 WeakPolarHBondContact O-CG 3.45Å; V295-L299 PolarHBondContact O-N 2.92Å; L299-K301 VanDerWaalsContact C-N 3.32Å; L299-K301 PolarHBondContact O-N 2.76Å; L299-T302 PolarHBondContact O-N 3.3Å; L299-M303 WeakPolarHBondContact O-CG 3.27Å; L299-M303 PolarHBondContact O-N 3.45Å
300R79Confident70.2Confident169 Ų169102.7 Ų102.764%0.63849%0.487SS*.Hα-helixtrans-59-42.2178.2-74.4178.4-176.5-170.71112.3H296 L297 K304H296-R300 WeakPolarHBondContact O-CG 3.13Å; H296-R300 PolarHBondContact O-N 2.82Å; L297-R300 PolarHBondContact O-N 3.36Å; R300-K304 WeakPolarHBondContact O-CB 3.27Å; R300-K304 VanDerWaalsContact O-CG 3.3Å; R300-K304 WeakPolarHBondContact O-CG 3.43Å; R300-K304 PolarHBondContact O-N 3.28Å; R300-K304 VanDerWaalsContact O-N 3.07Å
301K76.9Confident70.6Confident97 Ų97102.5 Ų102.542%0.42248%0.484SS..Hα-helixtrans-67.5-40.8-179.9-169178.1-177.21800111.9L297 A298 L299 R305L297-K301 WeakPolarHBondContact O-CB 3.47Å; L297-K301 PolarHBondContact O-N 3.02Å; A298-K301 PolarHBondContact O-N 2.66Å; L299-K301 VanDerWaalsContact C-N 3.32Å; L299-K301 PolarHBondContact O-N 2.76Å; K301-R305 WeakPolarHBondContact O-CG 3.46Å; K301-R305 PolarHBondContact O-N 3.35Å; K301-R305 VanDerWaalsContact O-N 3.15Å
302T76.3Confident71.1Confident31 Ų3198 Ų9819%0.1947%0.472CS..Hα-helixtrans-69.1-45179.7-51.40000111L51 N52 A298 L299 K304 R305 S306L51-T302 HydrophobicContact CD1-CG2 3.83Å; N52-T302 PolarHBondContact ND2-OG1 3.48Å; A298-T302 WeakPolarHBondContact O-CB 3.41Å; A298-T302 PolarHBondContact O-N 3.33Å; A298-T302 PolarHBondContact O-OG1 3.19Å; L299-T302 PolarHBondContact O-N 3.3Å; T302-K304 PolarHBondContact O-N 2.95Å; T302-R305 PolarHBondContact O-N 3.31Å; T302-S306 PolarHBondContact O-N 3.31Å
303M77.3Confident71.1Confident102 Ų102102.4 Ų102.450%0.50249%0.493SS..Hα-helixtrans-59-46.9173.9-71.6-168.8-56.500111.4L299 R305 S306 F307L299-M303 WeakPolarHBondContact O-CG 3.27Å; L299-M303 PolarHBondContact O-N 3.45Å; M303-R305 VanDerWaalsContact C-N 3.29Å; M303-R305 PolarHBondContact O-N 3.33Å; M303-S306 PolarHBondContact O-N 3.01Å; M303-F307 HydrophobicContact CB-CD2 4.48Å; M303-F307 HydrophobicContact CB-CE2 4.42Å; M303-F307 WeakPolarHBondContact O-CD2 3.48Å; M303-F307 PolarHBondContact O-N 2.68Å; M303-F307 VanDerWaalsContact O-N 3.16Å
304K76.1Confident71.1Confident158 Ų15897.3 Ų97.369%0.68747%0.474SS*.Hα-helixtrans-55-44.4177-77.5-179.9178.8-168.70112.3R300 T302 S306 F307 T308R300-K304 WeakPolarHBondContact O-CB 3.27Å; R300-K304 VanDerWaalsContact O-CG 3.3Å; R300-K304 WeakPolarHBondContact O-CG 3.43Å; R300-K304 PolarHBondContact O-N 3.28Å; R300-K304 VanDerWaalsContact O-N 3.07Å; T302-K304 PolarHBondContact O-N 2.95Å; K304-S306 VanDerWaalsContact C-N 3.33Å; K304-S306 PolarHBondContact O-N 3.16Å; K304-F307 PolarHBondContact O-N 3.14Å; K304-T308 PolarHBondContact O-N 2.99Å; K304-T308 PolarHBondContact O-OG1 3.16Å
305R74.5Confident71Confident142 Ų14299.9 Ų99.954%0.53648%0.484SS..Hα-helixtrans-68.9-26.1177.7-72.8173.7171.5-177.8-8.9114.2K301 T302 M303K301-R305 WeakPolarHBondContact O-CG 3.46Å; K301-R305 PolarHBondContact O-N 3.35Å; K301-R305 VanDerWaalsContact O-N 3.15Å; T302-R305 PolarHBondContact O-N 3.31Å; M303-R305 VanDerWaalsContact C-N 3.29Å; M303-R305 PolarHBondContact O-N 3.33Å
306S62.9Low71.1Confident96 Ų96107.5 Ų107.567%0.67152%0.521SS*.Hα-helixtrans-80.6-19.6177.3-175.10000113.3T302 M303 K304T302-S306 PolarHBondContact O-N 3.31Å; M303-S306 PolarHBondContact O-N 3.01Å; K304-S306 VanDerWaalsContact C-N 3.33Å; K304-S306 PolarHBondContact O-N 3.16Å
307F55.4Low70.6Confident176 Ų176109.8 Ų109.877%0.77253%0.533SS*.  trans-102.710.3177.2-69.4-69.7000112.9M303 K304M303-F307 HydrophobicContact CB-CD2 4.48Å; M303-F307 HydrophobicContact CB-CE2 4.42Å; M303-F307 WeakPolarHBondContact O-CD2 3.48Å; M303-F307 PolarHBondContact O-N 2.68Å; M303-F307 VanDerWaalsContact O-N 3.16Å; K304-F307 PolarHBondContact O-N 3.14Å
308T44.2Very low70Confident172 Ų172110.3 Ų110.3100%1.05553%0.532SS*.  trans-114.70172.1-29.70000108.8K304K304-T308 PolarHBondContact O-N 2.99Å; K304-T308 PolarHBondContact O-OG1 3.16Å

Retrieved 308 of 308 residues in 139.2 ms (Link to these results)

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