A0A096N609_PAPAN Loading...

Transmembrane protein 179B

AlphaFold DB (A0A2K5MN38), UniProt , Accession A0A096N609, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM179B, Length 219 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
1M37.8Very low71.1Confident203 Ų20384.9 Ų84.9100%143%0.427SS*.  092.20-63.6179.3-164.800109.1E91M1-E91 HydrophobicContact CE-CG 4.37Å; M1-E91 WeakPolarHBondContact CE-OE1 3.38Å; M1-E91 HydrophobicContact SD-CG 3.91Å
2A40.3Very low72.9Confident83 Ų8383.2 Ų83.269%0.68644%0.435SS*.  trans-96.3115.9171.200000106.1
3L50.8Low74.4Confident54 Ų5478.7 Ų78.728%0.28341%0.412SS..  trans-44.9120.5160.8-146.290.2000105.9W5 Q7 R8L3-W5 PolarHBondContact O-N 2.78Å; L3-W5 VanDerWaalsContact O-N 3.1Å; L3-Q7 HydrophobicContact CD2-CB 4.02Å; L3-Q7 HydrophobicContact CD2-CG 3.79Å; L3-Q7 HydrophobicContact CG-CB 4.31Å; L3-Q7 HydrophobicContact CG-CG 4.23Å; L3-R8 HydrophobicContact CB-CG 4.14Å; L3-R8 HydrophobicContact CD2-CG 3.71Å
4P72.8Confident75.7Confident69 Ų6973.4 Ų73.445%0.44838%0.384SS..  trans-51.8127.7-173.316.5-28.3000107.4L6 Q7P4-L6 CarbonylContact O-C 3.39Å; P4-L6 PolarHBondContact O-N 3.02Å; P4-Q7 HydrophobicContact CG-CB 4.16Å; P4-Q7 WeakPolarHBondContact O-CB 3.45Å; P4-Q7 PolarHBondContact O-N 2.76Å
5W75.9Confident77Confident197 Ų19770.9 Ų70.975%0.74638%0.379SS*.Hα-helixtrans-43.3-37.2-171.9168.8-104.5000113L3 Q7 R8 V9L3-W5 PolarHBondContact O-N 2.78Å; L3-W5 VanDerWaalsContact O-N 3.1Å; W5-Q7 PolarHBondContact O-N 3.37Å; W5-R8 PolarHBondContact O-N 3.45Å; W5-V9 HydrophobicContact CD2-CG2 4.46Å; W5-V9 HydrophobicContact CZ2-CG2 4.3Å; W5-V9 WeakPolarHBondContact O-CG2 3.38Å; W5-V9 PolarHBondContact O-N 2.96Å
6L78.4Confident78.1Confident59 Ų5968.6 Ų68.631%0.30937%0.373SS..Hα-helixtrans-55.3-42.1173.6-105.792.1000114.9P4 R8 V9 E10 L182 Q186P4-L6 CarbonylContact O-C 3.39Å; P4-L6 PolarHBondContact O-N 3.02Å; L6-R8 VanDerWaalsContact C-N 3.35Å; L6-V9 PolarHBondContact O-N 2.94Å; L6-E10 WeakPolarHBondContact O-CB 3.45Å; L6-E10 PolarHBondContact O-N 3.32Å; L6-L182 HydrophobicContact CD2-CD2 4.27Å; L6-L182 HydrophobicContact CG-CD2 4.37Å; L6-Q186 HydrophobicContact CD2-CG 3.4Å; L6-Q186 VanDerWaalsContact CD2-CG 3.4Å
7Q79Confident79Confident29 Ų2964.7 Ų64.714%0.13635%0.352CS..Hα-helixtrans-68.6-34.7-178.5-172.4177.2-9.200111.6L3 P4 W5 E10 L11L3-Q7 HydrophobicContact CD2-CB 4.02Å; L3-Q7 HydrophobicContact CD2-CG 3.79Å; L3-Q7 HydrophobicContact CG-CB 4.31Å; L3-Q7 HydrophobicContact CG-CG 4.23Å; P4-Q7 HydrophobicContact CG-CB 4.16Å; P4-Q7 WeakPolarHBondContact O-CB 3.45Å; P4-Q7 PolarHBondContact O-N 2.76Å; W5-Q7 PolarHBondContact O-N 3.37Å; Q7-E10 PolarHBondContact O-N 2.96Å; Q7-L11 WeakPolarHBondContact O-CB 3.38Å; Q7-L11 PolarHBondContact O-N 3.19Å
8R82.8Confident79.9Confident138 Ų13864.3 Ų64.352%0.52135%0.346SS..Hα-helixtrans-66.2-41.3172.8-65.9-175.1178.8168.7-0.4111.5L3 W5 L6 L11 A12L3-R8 HydrophobicContact CB-CG 4.14Å; L3-R8 HydrophobicContact CD2-CG 3.71Å; W5-R8 PolarHBondContact O-N 3.45Å; L6-R8 VanDerWaalsContact C-N 3.35Å; R8-L11 PolarHBondContact O-N 3.37Å; R8-A12 PolarHBondContact O-N 2.98Å
9V88.1Confident80.7Confident48 Ų4866.6 Ų66.629%0.29136%0.357SS..Hα-helixtrans-65.1-43.7175.7176.50000110.8W5 L6 L11 A12 L13 L182W5-V9 HydrophobicContact CD2-CG2 4.46Å; W5-V9 HydrophobicContact CZ2-CG2 4.3Å; W5-V9 WeakPolarHBondContact O-CG2 3.38Å; W5-V9 PolarHBondContact O-N 2.96Å; L6-V9 PolarHBondContact O-N 2.94Å; V9-L11 VanDerWaalsContact C-N 3.32Å; V9-L11 PolarHBondContact O-N 3.16Å; V9-A12 PolarHBondContact O-N 3.05Å; V9-L13 HydrophobicContact CG1-CD1 4.12Å; V9-L13 WeakPolarHBondContact O-CG 3.34Å; V9-L13 PolarHBondContact O-N 3.36Å; V9-L182 HydrophobicContact CG1-CD1 3.87Å
10E87.9Confident81.3Confident10 Ų1064.3 Ų64.35%0.04735%0.346CS..Hα-helixtrans-58.8-43.2175.6-173.7175.6-175.800111.4L6 Q7 L13 F14 R95 Q183 Q186L6-E10 WeakPolarHBondContact O-CB 3.45Å; L6-E10 PolarHBondContact O-N 3.32Å; Q7-E10 PolarHBondContact O-N 2.96Å; E10-L13 PolarHBondContact O-N 3.43Å; E10-F14 HydrophobicContact CG-CD2 4.01Å; E10-F14 HydrophobicContact CG-CE2 3.56Å; E10-F14 HydrophobicContact CG-CZ 4.4Å; E10-F14 VanDerWaalsContact O-CD2 3.27Å; E10-F14 WeakPolarHBondContact O-CD2 3.36Å; E10-F14 PolarHBondContact O-N 3.33Å; E10-R95 IonicContact OE1-CZ 3.53Å; E10-R95 IonicContact OE1-NH1 3.27Å; E10-R95 PolarHBondContact OE1-NH1 3.08Å; E10-R95 IonicContact OE1-NH2 2.86Å; E10-R95 PolarHBondContact OE1-NH2 2.84Å; E10-R95 IonicContact OE2-NH2 3.45Å; E10-R95 PolarHBondContact OE2-NH2 3.44Å; E10-Q183 PolarHBondContact OE1-NE2 3.38Å; E10-Q186 PolarHBondContact OE2-NE2 3.06Å
11L88.6Confident81.9Confident44 Ų4461.2 Ų61.223%0.2333%0.33CS..Hα-helixtrans-63.1-44.2176.1-161.976.8000112.2Q7 R8 V9 L13 F14 A15 L81 W84Q7-L11 WeakPolarHBondContact O-CB 3.38Å; Q7-L11 PolarHBondContact O-N 3.19Å; R8-L11 PolarHBondContact O-N 3.37Å; V9-L11 VanDerWaalsContact C-N 3.32Å; V9-L11 PolarHBondContact O-N 3.16Å; L11-L13 VanDerWaalsContact C-N 3.3Å; L11-L13 PolarHBondContact O-N 3.13Å; L11-F14 PolarHBondContact O-N 2.86Å; L11-A15 PolarHBondContact O-N 3.34Å; L11-L81 HydrophobicContact CD1-CD2 3.53Å; L11-L81 HydrophobicContact CG-CD2 3.63Å; L11-L81 WeakPolarHBondContact O-CD2 3.31Å; L11-W84 HydrophobicContact CD1-CB 3.64Å; L11-W84 HydrophobicContact CD1-CG 4.21Å
12A92.2Very high84.5Confident64 Ų6453.2 Ų53.253%0.52930%0.296SS..Hα-helixtrans-62-38.7176.800000111.9R8 V9 A15 A16R8-A12 PolarHBondContact O-N 2.98Å; V9-A12 PolarHBondContact O-N 3.05Å; A12-A15 PolarHBondContact O-N 3.08Å; A12-A16 PolarHBondContact O-N 3.46Å
13L93.2Very high87Confident25 Ų2552.7 Ų52.713%0.13128%0.284CS..Hα-helixtrans-66.2-40.1175.2-69.9167.3000112.1V9 E10 L11 A15 A16 A17 L175 V178 V179 L182V9-L13 HydrophobicContact CG1-CD1 4.12Å; V9-L13 WeakPolarHBondContact O-CG 3.34Å; V9-L13 PolarHBondContact O-N 3.36Å; E10-L13 PolarHBondContact O-N 3.43Å; L11-L13 VanDerWaalsContact C-N 3.3Å; L11-L13 PolarHBondContact O-N 3.13Å; L13-A15 VanDerWaalsContact C-N 3.32Å; L13-A15 PolarHBondContact O-N 2.98Å; L13-A16 PolarHBondContact O-N 2.87Å; L13-A17 VanDerWaalsContact O-CB 3.31Å; L13-A17 WeakPolarHBondContact O-CB 3.22Å; L13-A17 PolarHBondContact O-N 2.98Å; L13-L175 HydrophobicContact CD2-CD2 3.68Å; L13-V178 HydrophobicContact CD1-CB 4.35Å; L13-V178 HydrophobicContact CD1-CG1 3.66Å; L13-V178 HydrophobicContact CD2-CG1 4.21Å; L13-V179 HydrophobicContact CB-CG2 3.61Å; L13-V179 HydrophobicContact CD1-CG2 3.94Å; L13-V179 HydrophobicContact CG-CG2 4.39Å; L13-L182 HydrophobicContact CD1-CD1 3.34Å
14F92.7Very high89Confident4 Ų450.2 Ų50.22%0.01827%0.271CS..Hα-helixtrans-64.4-36.1174-77-52.4000112.6E10 L11 A17 F18 L80 L81 W176 V179E10-F14 HydrophobicContact CG-CD2 4.01Å; E10-F14 HydrophobicContact CG-CE2 3.56Å; E10-F14 HydrophobicContact CG-CZ 4.4Å; E10-F14 VanDerWaalsContact O-CD2 3.27Å; E10-F14 WeakPolarHBondContact O-CD2 3.36Å; E10-F14 PolarHBondContact O-N 3.33Å; L11-F14 PolarHBondContact O-N 2.86Å; F14-A17 PolarHBondContact O-N 2.02Å; F14-F18 WeakPolarHBondContact O-CB 3.34Å; F14-F18 PolarHBondContact O-N 2.92Å; F14-L80 HydrophobicContact CD1-CD1 4.48Å; F14-L80 HydrophobicContact CD2-CD1 4.49Å; F14-L80 HydrophobicContact CE1-CD1 4.1Å; F14-L80 HydrophobicContact CE2-CD1 4.09Å; F14-L80 HydrophobicContact CZ-CD1 3.89Å; F14-L81 HydrophobicContact CB-CD2 4.02Å; F14-L81 HydrophobicContact CB-CG 4.3Å; F14-W176 HydrophobicContact CD1-CH2 4.33Å; F14-W176 AromaticContact CE1-CH2 3.69Å; F14-W176 HydrophobicContact CE1-CH2 3.69Å; F14-W176 HydrophobicContact CE1-CZ2 4.37Å; F14-W176 AromaticContact CE1-CZ3 3.87Å; F14-W176 HydrophobicContact CE1-CZ3 3.87Å; F14-V179 HydrophobicContact CE1-CG1 4.04Å; F14-V179 HydrophobicContact CZ-CG1 3.84Å
15A94.1Very high90Very high37 Ų3747.5 Ų47.531%0.30626%0.255SS..Hα-helixtrans-64.2-44.5173.400000111.9L11 A12 L13 F18 L19 L81L11-A15 PolarHBondContact O-N 3.34Å; A12-A15 PolarHBondContact O-N 3.08Å; L13-A15 VanDerWaalsContact C-N 3.32Å; L13-A15 PolarHBondContact O-N 2.98Å; A15-F18 WeakPolarHBondContact O-CB 3.21Å; A15-F18 PolarHBondContact O-N 3.42Å; A15-L19 WeakPolarHBondContact O-CG 3.13Å; A15-L19 PolarHBondContact O-N 3.09Å; A15-L19 VanDerWaalsContact O-N 3.13Å; A15-L81 HydrophobicContact CB-CD1 4.07Å; A15-L81 HydrophobicContact CB-CD2 4.17Å
16A94.9Very high90.8Very high34 Ų3440.6 Ų40.628%0.28124%0.24SC..Hα-helixtrans-63.1-43.8174.200000111.7A12 L13 F18 L19 C20 L175A12-A16 PolarHBondContact O-N 3.46Å; L13-A16 PolarHBondContact O-N 2.87Å; A16-F18 VanDerWaalsContact C-N 3.32Å; A16-F18 PolarHBondContact O-N 3.48Å; A16-L19 PolarHBondContact O-N 3.11Å; A16-C20 PolarHBondContact O-N 3.07Å; A16-C20 PolarHBondContact O-SG 2.91Å; A16-C20 VanDerWaalsContact O-SG 3.37Å; A16-L175 HydrophobicContact CB-CD1 3.65Å; A16-L175 HydrophobicContact CB-CD2 4.02Å
17A93.9Very high91.4Very high2 Ų238.2 Ų38.22%0.01723%0.228CC..Hα-helixtrans-64.3-37.1178.800000111.9L13 F14 C20 G21 N172 L175L13-A17 VanDerWaalsContact O-CB 3.31Å; L13-A17 WeakPolarHBondContact O-CB 3.22Å; L13-A17 PolarHBondContact O-N 2.98Å; F14-A17 PolarHBondContact O-N 2.02Å; A17-C20 PolarHBondContact O-N 3.39Å; A17-G21 PolarHBondContact O-N 3.43Å; A17-N172 WeakPolarHBondContact CA-OD1 3.29Å; A17-N172 WeakPolarHBondContact CB-OD1 3.34Å; A17-N172 PolarHBondContact O-OD1 2.96Å; A17-L175 HydrophobicContact CB-CB 4.41Å; A17-L175 HydrophobicContact CB-CD1 4.36Å
18F94.4Very high91.8Very high58 Ų5836.9 Ų36.925%0.25422%0.223SC..Hα-helixtrans-58.2-51.5171.3163.6-108.5000111.4F14 A15 A16 C20 G21 A22 A74 C77 L78 L81F14-F18 WeakPolarHBondContact O-CB 3.34Å; F14-F18 PolarHBondContact O-N 2.92Å; A15-F18 WeakPolarHBondContact O-CB 3.21Å; A15-F18 PolarHBondContact O-N 3.42Å; A16-F18 VanDerWaalsContact C-N 3.32Å; A16-F18 PolarHBondContact O-N 3.48Å; F18-C20 VanDerWaalsContact C-N 3.35Å; F18-C20 PolarHBondContact O-N 3.29Å; F18-G21 PolarHBondContact O-N 3.31Å; F18-A22 HydrophobicContact CE2-CB 4.48Å; F18-A22 VanDerWaalsContact O-CB 3.25Å; F18-A22 WeakPolarHBondContact O-CB 3.47Å; F18-A22 PolarHBondContact O-N 3.33Å; F18-A74 HydrophobicContact CD2-CB 4.01Å; F18-A74 WeakPolarHBondContact CD2-O 3.37Å; F18-A74 HydrophobicContact CE2-CB 4.48Å; F18-C77 HydrophobicContact CB-CB 3.87Å; F18-L78 HydrophobicContact CD2-CB 4.02Å; F18-L78 HydrophobicContact CE2-CB 4.05Å; F18-L78 HydrophobicContact CE2-CD1 4.29Å; F18-L78 HydrophobicContact CE2-CD2 4.29Å; F18-L78 HydrophobicContact CE2-CG 4.45Å; F18-L78 HydrophobicContact CZ-CD1 4.24Å; F18-L81 HydrophobicContact CB-CD1 4.5Å
19L95.3Very high92.1Very high107 Ų10734.2 Ų34.256%0.5622%0.221SC*.Hα-helixtrans-60.9-45.2179.9-67.4173000111.2A15 A16 A22 V23A15-L19 WeakPolarHBondContact O-CG 3.13Å; A15-L19 PolarHBondContact O-N 3.09Å; A15-L19 VanDerWaalsContact O-N 3.13Å; A16-L19 PolarHBondContact O-N 3.11Å; L19-A22 PolarHBondContact O-N 3.3Å; L19-V23 WeakPolarHBondContact O-CB 3.36Å; L19-V23 VanDerWaalsContact O-CG2 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 2.86Å; L19-V23 PolarHBondContact O-N 2.91Å
20C93.7Very high92.1Very high20 Ų2040.5 Ų40.514%0.13524%0.24CC..Hα-helixtrans-64-44.2178.4-67.50000112.4A16 A17 F18 V23 A24 S168 N172A16-C20 PolarHBondContact O-N 3.07Å; A16-C20 PolarHBondContact O-SG 2.91Å; A16-C20 VanDerWaalsContact O-SG 3.37Å; A17-C20 PolarHBondContact O-N 3.39Å; F18-C20 VanDerWaalsContact C-N 3.35Å; F18-C20 PolarHBondContact O-N 3.29Å; C20-V23 PolarHBondContact O-N 3.03Å; C20-A24 WeakPolarHBondContact O-CB 3.16Å; C20-A24 PolarHBondContact O-N 3.31Å; C20-S168 VanDerWaalsContact C-OG 3.25Å; C20-S168 WeakPolarHBondContact CA-OG 3.13Å; C20-S168 WeakPolarHBondContact CB-OG 3.39Å; C20-S168 PolarHBondContact O-OG 3.04Å; C20-N172 HydrophobicContact CB-CB 3.83Å
21G92.6Very high92Very high0 Ų040.1 Ų40.10%024%0.238CC..Hα-helixtrans-62.9-43176.100000112.5A17 F18 A24 A25A17-G21 PolarHBondContact O-N 3.43Å; F18-G21 PolarHBondContact O-N 3.31Å; G21-A24 PolarHBondContact O-N 2.84Å; G21-A25 WeakPolarHBondContact O-CB 3.33Å; G21-A25 PolarHBondContact O-N 2.9Å
22A93.6Very high91.9Very high35 Ų3538.6 Ų38.629%0.28923%0.23SC..Hα-helixtrans-64.4-43.2177.800000112.2F18 L19 A25 A26F18-A22 HydrophobicContact CE2-CB 4.48Å; F18-A22 VanDerWaalsContact O-CB 3.25Å; F18-A22 WeakPolarHBondContact O-CB 3.47Å; F18-A22 PolarHBondContact O-N 3.33Å; L19-A22 PolarHBondContact O-N 3.3Å; A22-A25 PolarHBondContact O-N 3.44Å; A22-A26 WeakPolarHBondContact O-CB 2.87Å; A22-A26 PolarHBondContact O-N 3.42Å
23V93.2Very high91.5Very high73 Ų7338.1 Ų38.144%0.44223%0.232SC..Hα-helixtrans-61.9-45.6175.7168.80000110.9L19 C20 A26 A27L19-V23 WeakPolarHBondContact O-CB 3.36Å; L19-V23 VanDerWaalsContact O-CG2 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 2.86Å; L19-V23 PolarHBondContact O-N 2.91Å; C20-V23 PolarHBondContact O-N 3.03Å; V23-A26 PolarHBondContact O-N 2.86Å; V23-A27 WeakPolarHBondContact O-CB 3.38Å; V23-A27 PolarHBondContact O-N 2.86Å
24A92.3Very high91.1Very high1 Ų138.3 Ų38.31%0.00824%0.235CC..Hα-helixtrans-62.3-45.9178.700000111.9C20 G21 L28C20-A24 WeakPolarHBondContact O-CB 3.16Å; C20-A24 PolarHBondContact O-N 3.31Å; G21-A24 PolarHBondContact O-N 2.84Å; A24-L28 WeakPolarHBondContact O-CB 3.49Å; A24-L28 PolarHBondContact O-N 2.91Å; A24-L28 VanDerWaalsContact O-N 3.12Å
25A93.2Very high90.7Very high13 Ų1338.5 Ų38.511%0.10724%0.236CC..Hα-helixtrans-62.7-49.6176.900000111.7G21 A22 A27 L28 T29G21-A25 WeakPolarHBondContact O-CB 3.33Å; G21-A25 PolarHBondContact O-N 2.9Å; A22-A25 PolarHBondContact O-N 3.44Å; A25-A27 PolarHBondContact O-N 3.22Å; A25-L28 PolarHBondContact O-N 3.45Å; A25-T29 WeakPolarHBondContact O-CB 3.28Å; A25-T29 PolarHBondContact O-N 3.48Å; A25-T29 PolarHBondContact O-OG1 3.19Å
26A92.1Very high90.1Very high51 Ų5141.1 Ų41.142%0.42125%0.252SS..Hα-helixtrans-63.7-42.1-178.600000112.5A22 V23 L28 T29 R30A22-A26 WeakPolarHBondContact O-CB 2.87Å; A22-A26 PolarHBondContact O-N 3.42Å; V23-A26 PolarHBondContact O-N 2.86Å; A26-L28 VanDerWaalsContact C-N 3.34Å; A26-L28 PolarHBondContact O-N 2.83Å; A26-T29 PolarHBondContact O-N 2.87Å; A26-R30 WeakPolarHBondContact O-CB 3.16Å; A26-R30 WeakPolarHBondContact O-CG 3.22Å; A26-R30 PolarHBondContact O-N 3.37Å
27A91.1Very high89.5Confident9 Ų941 Ų417%0.07425%0.254CS..Hα-helixtrans-63.4-40.9177.600000111.5V23 A25 T31 N161 A165V23-A27 WeakPolarHBondContact O-CB 3.38Å; V23-A27 PolarHBondContact O-N 2.86Å; A25-A27 PolarHBondContact O-N 3.22Å; A27-T31 WeakPolarHBondContact O-CB 3.45Å; A27-T31 PolarHBondContact O-N 3.44Å; A27-T31 PolarHBondContact O-OG1 2.85Å; A27-N161 HydrophobicContact CB-CB 4.28Å; A27-N161 WeakPolarHBondContact CB-O 3.37Å; A27-A165 HydrophobicContact CB-CB 4.01Å
28L88.6Confident89.1Confident2 Ų247.4 Ų47.41%0.0128%0.278CS..Hα-helixtrans-67.9-46.3174.8-82.4171000113A24 A25 A26 R30 T31 Q32 L41 V66 A67 L121 L162 A165A24-L28 WeakPolarHBondContact O-CB 3.49Å; A24-L28 PolarHBondContact O-N 2.91Å; A24-L28 VanDerWaalsContact O-N 3.12Å; A25-L28 PolarHBondContact O-N 3.45Å; A26-L28 VanDerWaalsContact C-N 3.34Å; A26-L28 PolarHBondContact O-N 2.83Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.28Å; L28-T31 PolarHBondContact O-N 3.16Å; L28-T31 VanDerWaalsContact O-N 3.12Å; L28-Q32 WeakPolarHBondContact O-CG 3.37Å; L28-Q32 PolarHBondContact O-N 2.95Å; L28-L41 HydrophobicContact CD2-CD1 4.32Å; L28-V66 HydrophobicContact CD1-CB 3.74Å; L28-V66 HydrophobicContact CD1-CG1 3.23Å; L28-A67 HydrophobicContact CB-CB 4.33Å; L28-L121 HydrophobicContact CD1-CD2 4.09Å; L28-L121 HydrophobicContact CD2-CD2 3.76Å; L28-L121 HydrophobicContact CG-CD2 4.18Å; L28-L162 HydrophobicContact CD2-CD2 3.97Å; L28-A165 HydrophobicContact CG-CB 4.31Å
29T88.7Confident88.7Confident81 Ų8144.6 Ų44.650%0.49727%0.266SS..Hα-helixtrans-61.3-41.8177.9-58.80000111.3A25 A26 T31 Q32 G33A25-T29 WeakPolarHBondContact O-CB 3.28Å; A25-T29 PolarHBondContact O-N 3.48Å; A25-T29 PolarHBondContact O-OG1 3.19Å; A26-T29 PolarHBondContact O-N 2.87Å; T29-T31 VanDerWaalsContact C-N 3.34Å; T29-T31 PolarHBondContact O-N 3.13Å; T29-Q32 PolarHBondContact O-N 2.84Å; T29-G33 PolarHBondContact O-N 3.49Å
30R87.3Confident88.2Confident181 Ų18139.6 Ų39.668%0.68324%0.239SC*.Hα-helixtrans-61.2-43.6173-79.9-171.1179.3179.31.8111.9A26 L28 G33 S34A26-R30 WeakPolarHBondContact O-CB 3.16Å; A26-R30 WeakPolarHBondContact O-CG 3.22Å; A26-R30 PolarHBondContact O-N 3.37Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.28Å; R30-G33 PolarHBondContact O-N 3.22Å; R30-S34 WeakPolarHBondContact O-CB 3.26Å; R30-S34 PolarHBondContact O-N 2.94Å
31T86.9Confident87.7Confident2 Ų238.6 Ų38.61%0.01223%0.233CC..Hα-helixtrans-63.6-47.6178.9-540000110.6A27 L28 T29 G33 S34 F35 P40 F158 N161 L162A27-T31 WeakPolarHBondContact O-CB 3.45Å; A27-T31 PolarHBondContact O-N 3.44Å; A27-T31 PolarHBondContact O-OG1 2.85Å; L28-T31 PolarHBondContact O-N 3.16Å; L28-T31 VanDerWaalsContact O-N 3.12Å; T29-T31 VanDerWaalsContact C-N 3.34Å; T29-T31 PolarHBondContact O-N 3.13Å; T31-G33 VanDerWaalsContact C-N 3.34Å; T31-G33 PolarHBondContact O-N 2.78Å; T31-S34 WeakPolarHBondContact O-CB 3.32Å; T31-S34 PolarHBondContact O-N 2.98Å; T31-S34 VanDerWaalsContact O-N 3.13Å; T31-F35 HydrophobicContact CG2-CD2 4.02Å; T31-F35 HydrophobicContact CG2-CE2 3.92Å; T31-F35 VanDerWaalsContact O-CD2 3.25Å; T31-F35 WeakPolarHBondContact O-CD2 3.42Å; T31-F35 PolarHBondContact O-N 3.12Å; T31-F35 VanDerWaalsContact O-N 3.13Å; T31-P40 HydrophobicContact CG2-CG 3.79Å; T31-F158 HydrophobicContact CG2-CB 4.33Å; T31-N161 VanDerWaalsContact OG1-CB 3.25Å; T31-N161 WeakPolarHBondContact OG1-CB 3.33Å; T31-L162 HydrophobicContact CG2-CD2 4.37Å; T31-L162 HydrophobicContact CG2-CG 4.25Å
32Q86.6Confident87.4Confident11 Ų1142.6 Ų42.65%0.05125%0.248CC..Hα-helixtrans-59.5-43.1175-72.3-176-74.500112.2L28 T29 S34 F35 S36 G37 C63L28-Q32 WeakPolarHBondContact O-CG 3.37Å; L28-Q32 PolarHBondContact O-N 2.95Å; T29-Q32 PolarHBondContact O-N 2.84Å; Q32-S34 VanDerWaalsContact C-N 3.27Å; Q32-S34 PolarHBondContact O-N 2.6Å; Q32-F35 CarbonylContact O-C 3.57Å; Q32-F35 PolarHBondContact O-N 3.16Å; Q32-S36 PolarHBondContact O-N 3.49Å; Q32-G37 WeakPolarHBondContact O-CA 3.25Å; Q32-G37 PolarHBondContact O-N 3.39Å; Q32-C63 VanDerWaalsContact CD-CB 3.41Å; Q32-C63 HydrophobicContact CG-CB 3.91Å
33G84.1Confident87Confident55 Ų5540.9 Ų40.957%0.56724%0.235SC*.Hα-helixtrans-58.5-40.5175.200000112.1T29 R30 T31 F35 S36T29-G33 PolarHBondContact O-N 3.49Å; R30-G33 PolarHBondContact O-N 3.22Å; T31-G33 VanDerWaalsContact C-N 3.34Å; T31-G33 PolarHBondContact O-N 2.78Å; G33-F35 VanDerWaalsContact C-N 3.26Å; G33-F35 PolarHBondContact O-N 3.07Å; G33-S36 PolarHBondContact O-N 2.89Å
34S84.8Confident86.6Confident28 Ų2840.5 Ų40.520%0.19623%0.232CC..Hα-helixtrans-68.1-22.3176-164.50000113.5R30 T31 Q32 T154 A155R30-S34 WeakPolarHBondContact O-CB 3.26Å; R30-S34 PolarHBondContact O-N 2.94Å; T31-S34 WeakPolarHBondContact O-CB 3.32Å; T31-S34 PolarHBondContact O-N 2.98Å; T31-S34 VanDerWaalsContact O-N 3.13Å; Q32-S34 VanDerWaalsContact C-N 3.27Å; Q32-S34 PolarHBondContact O-N 2.6Å; S34-T154 VanDerWaalsContact O-CA 3.31Å; S34-T154 WeakPolarHBondContact O-CA 3.5Å; S34-T154 WeakPolarHBondContact O-CB 3.35Å; S34-T154 WeakPolarHBondContact O-CG2 3.3Å; S34-A155 PolarHBondContact OG-N 3.38Å
35F83.5Confident86.3Confident9 Ų940.6 Ų40.64%0.03923%0.233CC..THydrogen-bonded Turntrans-101.428.9173.6-72.6-78.9000112.8T31 Q32 G33 G37 R38 P40 L54 W149 A155 F158T31-F35 HydrophobicContact CG2-CD2 4.02Å; T31-F35 HydrophobicContact CG2-CE2 3.92Å; T31-F35 VanDerWaalsContact O-CD2 3.25Å; T31-F35 WeakPolarHBondContact O-CD2 3.42Å; T31-F35 PolarHBondContact O-N 3.12Å; T31-F35 VanDerWaalsContact O-N 3.13Å; Q32-F35 CarbonylContact O-C 3.57Å; Q32-F35 PolarHBondContact O-N 3.16Å; G33-F35 VanDerWaalsContact C-N 3.26Å; G33-F35 PolarHBondContact O-N 3.07Å; F35-G37 PolarHBondContact O-N 3.47Å; F35-R38 HydrophobicContact CB-CB 4.33Å; F35-R38 VanDerWaalsContact O-CB 3.28Å; F35-R38 WeakPolarHBondContact O-CB 3.25Å; F35-R38 WeakPolarHBondContact O-CG 3.4Å; F35-R38 PolarHBondContact O-N 2.89Å; F35-P40 HydrophobicContact CD2-CB 3.81Å; F35-P40 HydrophobicContact CD2-CG 3.72Å; F35-P40 HydrophobicContact CE2-CB 3.69Å; F35-P40 HydrophobicContact CE2-CG 3.81Å; F35-P40 HydrophobicContact CG-CB 4.31Å; F35-P40 HydrophobicContact CZ-CB 4.06Å; F35-L54 HydrophobicContact CD1-CB 4.35Å; F35-L54 HydrophobicContact CD1-CD2 3.82Å; F35-L54 HydrophobicContact CE1-CB 4.36Å; F35-L54 HydrophobicContact CE1-CD2 4.23Å; F35-L54 HydrophobicContact CG-CD2 4.4Å; F35-W149 AromaticContact CE1-CE3 3.97Å; F35-W149 HydrophobicContact CE1-CE3 3.97Å; F35-W149 AromaticContact CE1-CZ3 3.88Å; F35-W149 HydrophobicContact CE1-CZ3 3.88Å; F35-W149 HydrophobicContact CZ-CZ3 4.3Å; F35-A155 HydrophobicContact CE1-CB 3.76Å; F35-A155 HydrophobicContact CE2-CB 4.06Å; F35-A155 HydrophobicContact CZ-CB 3.35Å; F35-F158 HydrophobicContact CE2-CB 3.9Å; F35-F158 HydrophobicContact CZ-CB 4.2Å; F35-F158 HydrophobicContact CZ-CG 4.4Å
36S82.4Confident85.9Confident91 Ų9142.1 Ų42.164%0.63624%0.241SC*.THydrogen-bonded Turntrans55.436.7179-52.80000113.4Q32 G33 R38Q32-S36 PolarHBondContact O-N 3.49Å; G33-S36 PolarHBondContact O-N 2.89Å; S36-R38 VanDerWaalsContact C-N 3.34Å
37G81.3Confident85.5Confident33 Ų3343.3 Ų43.334%0.3424%0.24SC..THydrogen-bonded Turntrans83.91.2-178.700000115Q32 F35Q32-G37 WeakPolarHBondContact O-CA 3.25Å; Q32-G37 PolarHBondContact O-N 3.39Å; F35-G37 PolarHBondContact O-N 3.47Å
38R84.8Confident85.2Confident135 Ų13547 Ų4751%0.50926%0.258SS..  trans-83.6151.3177.7-60.5174.1176.9-1701.7111.2F35 S36 P40 P57F35-R38 HydrophobicContact CB-CB 4.33Å; F35-R38 VanDerWaalsContact O-CB 3.28Å; F35-R38 WeakPolarHBondContact O-CB 3.25Å; F35-R38 WeakPolarHBondContact O-CG 3.4Å; F35-R38 PolarHBondContact O-N 2.89Å; S36-R38 VanDerWaalsContact C-N 3.34Å; R38-P40 WeakPolarHBondContact O-CD 3.3Å; R38-P57 HydrophobicContact CB-CB 3.96Å; R38-P57 HydrophobicContact CG-CB 4.46Å
39C86.6Confident84.9Confident0 Ų049.7 Ų49.70%029%0.287CS..EExtended strand (participates in β ladder)trans-90.3114.3177.2-173.10000110.2L41 S58 C63C39-L41 VanDerWaalsContact C-N 3.33Å; C39-S58 PolarHBondContact O-N 3.39Å; C39-C63 WeakPolarHBondContact CA-SG 3.5Å; C39-C63 HydrophobicContact CB-CB 3.69Å; C39-C63 WeakPolarHBondContact CB-SG 3.43Å; C39-C63 WeakPolarHBondContact SG-CB 3.46Å; C39-C63 PolarHBondContact SG-N 3.12Å; C39-C63 VanDerWaalsContact SG-N 3.42Å; C39-C63 CovalentContact SG-SG 2.03Å; C39-C63 PolarHBondContact SG-SG 2.87Å
40P84.6Confident84.4Confident1 Ų150.5 Ų50.51%0.00630%0.296CS..EExtended strand (participates in β ladder)trans-80.6-14.117933.9-37.2000113T31 F35 R38 Y42 G43 L54 L128T31-P40 HydrophobicContact CG2-CG 3.79Å; F35-P40 HydrophobicContact CD2-CB 3.81Å; F35-P40 HydrophobicContact CD2-CG 3.72Å; F35-P40 HydrophobicContact CE2-CB 3.69Å; F35-P40 HydrophobicContact CE2-CG 3.81Å; F35-P40 HydrophobicContact CG-CB 4.31Å; F35-P40 HydrophobicContact CZ-CB 4.06Å; R38-P40 WeakPolarHBondContact O-CD 3.3Å; P40-Y42 PolarHBondContact O-N 3.14Å; P40-G43 WeakPolarHBondContact O-CA 3.11Å; P40-G43 PolarHBondContact O-N 3Å; P40-L54 HydrophobicContact CB-CD2 4.39Å; P40-L128 HydrophobicContact CB-CD2 4.14Å
41L84.4Confident84.1Confident0 Ų042.2 Ų42.20%027%0.265CS..EExtended strand (participates in β ladder)trans-59134.7175.8-68.2169.3000109.7L28 C39 G43 S58 I120 L121 L162L28-L41 HydrophobicContact CD2-CD1 4.32Å; C39-L41 VanDerWaalsContact C-N 3.33Å; L41-G43 PolarHBondContact O-N 3.41Å; L41-S58 WeakPolarHBondContact O-CB 3.31Å; L41-S58 PolarHBondContact O-OG 3.48Å; L41-I120 HydrophobicContact CD1-CG2 4.02Å; L41-L121 HydrophobicContact CD1-CD2 4.35Å; L41-L121 HydrophobicContact CD2-CD2 4.25Å; L41-L162 HydrophobicContact CD2-CD2 4.02Å
42Y85.8Confident83.8Confident83 Ų8342.1 Ų42.133%0.32527%0.265SS..EExtended strand (participates in β ladder)trans57.112.4-173.7-60-86.7000114.5P40 S58 L62 I120 F123 G124P40-Y42 PolarHBondContact O-N 3.14Å; Y42-S58 VanDerWaalsContact CB-OG 3.23Å; Y42-S58 WeakPolarHBondContact CB-OG 3.34Å; Y42-S58 PolarHBondContact O-OG 2.99Å; Y42-L62 HydrophobicContact CD2-CD1 4.15Å; Y42-I120 HydrophobicContact CE2-CG2 4.29Å; Y42-F123 HydrophobicContact CE1-CB 4.04Å; Y42-F123 VanDerWaalsContact OH-CB 3.23Å; Y42-F123 WeakPolarHBondContact OH-CB 3.37Å; Y42-G124 PolarHBondContact N-O 2.79Å; Y42-G124 VanDerWaalsContact N-O 3.12Å
43G84.6Confident83.6Confident0 Ų042.3 Ų42.30%027%0.269CS..EExtended strand (participates in β ladder)trans-74155.318000000112.5P40 L41 H56 L128P40-G43 WeakPolarHBondContact O-CA 3.11Å; P40-G43 PolarHBondContact O-N 3Å; L41-G43 PolarHBondContact O-N 3.41Å; G43-H56 WeakPolarHBondContact CA-O 3.21Å; G43-L128 VanDerWaalsContact O-CD1 3.3Å; G43-L128 WeakPolarHBondContact O-CD1 3.25Å
44V85.2Confident83.5Confident65 Ų6540.6 Ų40.639%0.39425%0.246SC..EExtended strand (participates in β ladder)trans-103.9123.5173.3-177.50000109S55 H56 S131V44-S55 PolarHBondContact O-N 3.4Å; V44-H56 HydrophobicContact CB-CB 4.17Å; V44-H56 HydrophobicContact CG2-CB 4.37Å; V44-H56 PolarHBondContact N-O 2.86Å; V44-H56 PolarHBondContact O-N 3.39Å; V44-S131 WeakPolarHBondContact CA-OG 3.45Å; V44-S131 WeakPolarHBondContact CG1-OG 3.27Å
45A85.9Confident83.1Confident2 Ų241.8 Ų41.82%0.01726%0.255CS..EExtended strand (participates in β ladder)trans-88.4145.717300000110.1A53 S131 I132 L135 W149A45-A53 WeakPolarHBondContact CA-O 3.37Å; A45-S131 PolarHBondContact N-OG 3.04Å; A45-S131 PolarHBondContact O-OG 3.46Å; A45-I132 HydrophobicContact CB-CD1 4.47Å; A45-I132 HydrophobicContact CB-CG1 3.52Å; A45-L135 HydrophobicContact CB-CD1 4.22Å; A45-W149 HydrophobicContact CB-CH2 4.37Å
46T84.8Confident82.9Confident46 Ų4647.7 Ų47.728%0.28228%0.282SS..EExtended strand (participates in β ladder)trans-129.3156.5170.561.20000110.4A53 S55T46-A53 PolarHBondContact N-O 3.24Å; T46-A53 PolarHBondContact O-N 3.44Å; T46-S55 WeakPolarHBondContact CB-OG 3.41Å; T46-S55 WeakPolarHBondContact CG2-OG 3.46Å; T46-S55 PolarHBondContact OG1-OG 3.42Å
47L83.4Confident82.7Confident76 Ų7645.7 Ų45.740%0.39827%0.267SS..EExtended strand (participates in β ladder)trans-93.2116.5175.2-163.575.4000108.9G49 L52 L135 T137L47-G49 WeakPolarHBondContact CG-O 3.41Å; L47-L52 HydrophobicContact CD1-CD2 3.98Å; L47-L135 HydrophobicContact CB-CD2 4.37Å; L47-T137 HydrophobicContact CD1-CG2 4.3Å
48N84.1Confident82.6Confident85 Ų8545.4 Ų45.446%0.45526%0.26SS..EExtended strand (participates in β ladder)trans-111.590.1173.6-170.4-20.2000108.7S50 S51 A53 R150N48-S50 PolarHBondContact O-N 3.18Å; N48-S51 PolarHBondContact N-O 3.07Å; N48-S51 PolarHBondContact O-N 2.85Å; N48-S51 PolarHBondContact O-OG 2.87Å; N48-A53 HydrophobicContact CB-CB 4.46Å; N48-R150 VanDerWaalsContact CG-NH1 3.27Å; N48-R150 PolarHBondContact OD1-NH1 3.03Å
49G82.3Confident82.6Confident60 Ų6041.5 Ų41.562%0.61926%0.256SS*.THydrogen-bonded Turntrans71.6-120.9-171.100000111.5L47L47-G49 WeakPolarHBondContact CG-O 3.41Å
50S79.8Confident82.4Confident98 Ų9844.6 Ų44.669%0.68528%0.276SS*.THydrogen-bonded Turntrans-94.42.5175.255.50000114N48N48-S50 PolarHBondContact O-N 3.18Å
51S80.2Confident82.5Confident6 Ų648.2 Ų48.24%0.04230%0.301CS..EExtended strand (participates in β ladder)trans-118.1143.5-174.455.90000112.4N48 P148 R150N48-S51 PolarHBondContact N-O 3.07Å; N48-S51 PolarHBondContact O-N 2.85Å; N48-S51 PolarHBondContact O-OG 2.87Å; S51-P148 CarbonylContact C-O 3.53Å; S51-P148 WeakPolarHBondContact CA-O 3.5Å; S51-P148 WeakPolarHBondContact CB-O 3.4Å; S51-R150 WeakPolarHBondContact OG-CD 3.3Å; S51-R150 WeakPolarHBondContact OG-CG 3.22Å; S51-R150 PolarHBondContact OG-NE 3.35Å
52L81.1Confident82.6Confident1 Ų150.8 Ų50.81%0.00532%0.315CS..EExtended strand (participates in β ladder)trans-81.4139.9175.4-70.6169.6000110.4L47 I132 L135 A144 I147 P148 W149 R150L47-L52 HydrophobicContact CD1-CD2 3.98Å; L52-I132 HydrophobicContact CD1-CG2 4.36Å; L52-L135 HydrophobicContact CD2-CD1 3.72Å; L52-A144 HydrophobicContact CD1-CB 4.28Å; L52-I147 HydrophobicContact CD1-CB 4.02Å; L52-I147 HydrophobicContact CD1-CD1 4.23Å; L52-I147 HydrophobicContact CD1-CG2 3.99Å; L52-I147 HydrophobicContact CG-CG2 3.94Å; L52-P148 PolarHBondContact N-O 3.35Å; L52-W149 HydrophobicContact CB-CD2 3.72Å; L52-W149 HydrophobicContact CB-CE3 3.89Å; L52-W149 HydrophobicContact CB-CG 4.22Å; L52-W149 HydrophobicContact CB-CH2 4.26Å; L52-W149 HydrophobicContact CB-CZ2 4.1Å; L52-W149 HydrophobicContact CB-CZ3 4.15Å; L52-W149 HydrophobicContact CD1-CH2 4.44Å; L52-W149 HydrophobicContact CD1-CZ2 3.75Å; L52-W149 CarbonylContact O-C 3.47Å; L52-W149 VanDerWaalsContact O-CA 3.25Å; L52-W149 WeakPolarHBondContact O-CA 3.39Å; L52-R150 PolarHBondContact O-N 2.7Å
53A82.6Confident82.7Confident15 Ų1546.9 Ų46.912%0.12430%0.3CS..EExtended strand (participates in β ladder)trans-128.6142.8173.700000109.9A45 T46 N48 S55 R150A45-A53 WeakPolarHBondContact CA-O 3.37Å; T46-A53 PolarHBondContact N-O 3.24Å; T46-A53 PolarHBondContact O-N 3.44Å; N48-A53 HydrophobicContact CB-CB 4.46Å; A53-S55 PolarHBondContact O-N 2.95Å; A53-R150 HydrophobicContact CB-CB 4.48Å
54L81.4Confident83Confident19 Ų1953.6 Ų53.610%0.09933%0.326CS..EExtended strand (participates in β ladder)trans-83.2100.5171.5-169.169000108.7F35 P40 P57 L128F35-L54 HydrophobicContact CD1-CB 4.35Å; F35-L54 HydrophobicContact CD1-CD2 3.82Å; F35-L54 HydrophobicContact CE1-CB 4.36Å; F35-L54 HydrophobicContact CE1-CD2 4.23Å; F35-L54 HydrophobicContact CG-CD2 4.4Å; P40-L54 HydrophobicContact CB-CD2 4.39Å; L54-P57 HydrophobicContact CD2-CB 3.97Å; L54-L128 HydrophobicContact CD1-CD1 4.11Å
55S77.3Confident83.3Confident53 Ų5354.5 Ų54.537%0.37133%0.325SS..EExtended strand (participates in β ladder)trans-79.3-48.7-176.8-78.50000112.8V44 T46 A53 P57V44-S55 PolarHBondContact O-N 3.4Å; T46-S55 WeakPolarHBondContact CB-OG 3.41Å; T46-S55 WeakPolarHBondContact CG2-OG 3.46Å; T46-S55 PolarHBondContact OG1-OG 3.42Å; A53-S55 PolarHBondContact O-N 2.95Å; S55-P57 WeakPolarHBondContact O-CD 3.38Å
56H77.8Confident83.6Confident133 Ų13354.4 Ų54.462%0.61632%0.324SS*.EExtended strand (participates in β ladder)trans-120.491.1-179-67.791.8000109G43 V44G43-H56 WeakPolarHBondContact CA-O 3.21Å; V44-H56 HydrophobicContact CB-CB 4.17Å; V44-H56 HydrophobicContact CG2-CB 4.37Å; V44-H56 PolarHBondContact N-O 2.86Å; V44-H56 PolarHBondContact O-N 3.39Å
57P78.9Confident84Confident48 Ų4852.8 Ų52.831%0.31232%0.316SS..EExtended strand (participates in β ladder)trans-68.3147.716830.9-34.7000109.6R38 L54 S55R38-P57 HydrophobicContact CB-CB 3.96Å; R38-P57 HydrophobicContact CG-CB 4.46Å; L54-P57 HydrophobicContact CD2-CB 3.97Å; S55-P57 WeakPolarHBondContact O-CD 3.38Å
58S80.3Confident84.4Confident28 Ų2851.1 Ų51.120%0.19632%0.316CS..EExtended strand (participates in β ladder)trans-79.3171.4172.7-71.20000111.8C39 L41 Y42C39-S58 PolarHBondContact O-N 3.39Å; L41-S58 WeakPolarHBondContact O-CB 3.31Å; L41-S58 PolarHBondContact O-OG 3.48Å; Y42-S58 VanDerWaalsContact CB-OG 3.23Å; Y42-S58 WeakPolarHBondContact CB-OG 3.34Å; Y42-S58 PolarHBondContact O-OG 2.99Å
59A83.9Confident84.8Confident53 Ų5347.7 Ų47.744%0.43830%0.3SS..PPolyproline II helixtrans-51.1125.6177.800000110.9S61 L62A59-S61 WeakPolarHBondContact CB-OG 3.39Å; A59-S61 PolarHBondContact O-N 3.05Å; A59-S61 VanDerWaalsContact O-N 3.07Å; A59-L62 PolarHBondContact O-N 3.02Å; A59-L62 VanDerWaalsContact O-N 3.11Å
60P82.4Confident85.3Confident65 Ų6545 Ų4542%0.42227%0.271SS..Hα-helixtrans-57-26.7179.8-25.933.9000113.4L62 C63 Y64P60-L62 PolarHBondContact O-N 2.65Å; P60-C63 PolarHBondContact O-N 2.66Å; P60-Y64 HydrophobicContact CB-CD2 3.99Å; P60-Y64 HydrophobicContact CB-CE2 3.8Å; P60-Y64 WeakPolarHBondContact O-CD2 3.45Å; P60-Y64 PolarHBondContact O-N 3.29Å
61S85.8Confident86Confident76 Ų7641.5 Ų41.553%0.53125%0.251SS..Hα-helixtrans-54.7-31.9176.954.10000113.5A59 F65A59-S61 WeakPolarHBondContact CB-OG 3.39Å; A59-S61 PolarHBondContact O-N 3.05Å; A59-S61 VanDerWaalsContact O-N 3.07Å; S61-F65 WeakPolarHBondContact O-CB 3.14Å; S61-F65 PolarHBondContact O-N 3.47Å
62L86.8Confident86.7Confident55 Ų5546.9 Ų46.929%0.28828%0.279SS..Hα-helixtrans-67.1-51.9178.5-68175.9000111.5Y42 A59 P60 Y64 F65 V66 I120Y42-L62 HydrophobicContact CD2-CD1 4.15Å; A59-L62 PolarHBondContact O-N 3.02Å; A59-L62 VanDerWaalsContact O-N 3.11Å; P60-L62 PolarHBondContact O-N 2.65Å; L62-Y64 VanDerWaalsContact C-N 3.33Å; L62-Y64 PolarHBondContact O-N 2.9Å; L62-F65 WeakPolarHBondContact O-CB 3.15Å; L62-F65 PolarHBondContact O-N 3.37Å; L62-V66 WeakPolarHBondContact O-CG2 3.49Å; L62-V66 PolarHBondContact O-N 3.43Å; L62-I120 HydrophobicContact CD2-CD1 4.48Å
63C88.7Confident87.3Confident0 Ų047.6 Ų47.60%028%0.282CS..Hα-helixtrans-66-37.6178.2-75.40000111.6Q32 C39 P60 V66 A67Q32-C63 VanDerWaalsContact CD-CB 3.41Å; Q32-C63 HydrophobicContact CG-CB 3.91Å; C39-C63 WeakPolarHBondContact CA-SG 3.5Å; C39-C63 HydrophobicContact CB-CB 3.69Å; C39-C63 WeakPolarHBondContact CB-SG 3.43Å; C39-C63 WeakPolarHBondContact SG-CB 3.46Å; C39-C63 PolarHBondContact SG-N 3.12Å; C39-C63 VanDerWaalsContact SG-N 3.42Å; C39-C63 CovalentContact SG-SG 2.03Å; C39-C63 PolarHBondContact SG-SG 2.87Å; P60-C63 PolarHBondContact O-N 2.66Å; C63-V66 PolarHBondContact O-N 2.67Å; C63-A67 VanDerWaalsContact O-CB 3.26Å; C63-A67 WeakPolarHBondContact O-CB 3.3Å; C63-A67 PolarHBondContact O-N 3Å
64Y90.1Very high87.9Confident142 Ų14247.1 Ų47.156%0.55728%0.279SS*.Hα-helixtrans-65.1-37.5174.1-74.3-53000112.8P60 L62 G68P60-Y64 HydrophobicContact CB-CD2 3.99Å; P60-Y64 HydrophobicContact CB-CE2 3.8Å; P60-Y64 WeakPolarHBondContact O-CD2 3.45Å; P60-Y64 PolarHBondContact O-N 3.29Å; L62-Y64 VanDerWaalsContact C-N 3.33Å; L62-Y64 PolarHBondContact O-N 2.9Å; Y64-G68 VanDerWaalsContact O-CA 3.32Å; Y64-G68 WeakPolarHBondContact O-CA 3.08Å; Y64-G68 PolarHBondContact O-N 3.46Å
65F91.6Very high88.5Confident83 Ų8350.7 Ų50.736%0.36430%0.297SS..Hα-helixtrans-61.6-49.4174173.2-94.8000110.7S61 L62 G68 A69 L113 V116 I120S61-F65 WeakPolarHBondContact O-CB 3.14Å; S61-F65 PolarHBondContact O-N 3.47Å; L62-F65 WeakPolarHBondContact O-CB 3.15Å; L62-F65 PolarHBondContact O-N 3.37Å; F65-G68 PolarHBondContact O-N 2.89Å; F65-A69 WeakPolarHBondContact O-CB 3.1Å; F65-A69 PolarHBondContact O-N 3.45Å; F65-L113 HydrophobicContact CE2-CD2 4.3Å; F65-L113 HydrophobicContact CZ-CD2 4.06Å; F65-V116 HydrophobicContact CE1-CB 4.3Å; F65-V116 HydrophobicContact CE1-CG1 3.67Å; F65-V116 HydrophobicContact CZ-CG1 4.08Å; F65-I120 HydrophobicContact CD1-CD1 3.88Å; F65-I120 HydrophobicContact CE1-CD1 4.09Å
66V92.1Very high89.3Confident0 Ų051.3 Ų51.30%029%0.292CS..Hα-helixtrans-67.2-45.7-178-176.20000111.8L28 L62 C63 S70 I120 L121L28-V66 HydrophobicContact CD1-CB 3.74Å; L28-V66 HydrophobicContact CD1-CG1 3.23Å; L62-V66 WeakPolarHBondContact O-CG2 3.49Å; L62-V66 PolarHBondContact O-N 3.43Å; C63-V66 PolarHBondContact O-N 2.67Å; V66-S70 VanDerWaalsContact O-CB 3.29Å; V66-S70 WeakPolarHBondContact O-CB 3.34Å; V66-S70 PolarHBondContact O-N 3.42Å; V66-S70 PolarHBondContact O-OG 3.13Å; V66-I120 HydrophobicContact CG2-CB 3.96Å; V66-I120 HydrophobicContact CG2-CD1 4.13Å; V66-I120 HydrophobicContact CG2-CG2 3.61Å; V66-L121 HydrophobicContact CG1-CD1 3.89Å; V66-L121 HydrophobicContact CG1-CG 4Å
67A92.9Very high90Very high13 Ų1345 Ų4511%0.10726%0.263CS..Hα-helixtrans-66-42177.700000111.6L28 C63 G71L28-A67 HydrophobicContact CB-CB 4.33Å; C63-A67 VanDerWaalsContact O-CB 3.26Å; C63-A67 WeakPolarHBondContact O-CB 3.3Å; C63-A67 PolarHBondContact O-N 3Å; A67-G71 WeakPolarHBondContact O-CA 3.42Å; A67-G71 PolarHBondContact O-N 3.13Å
68G91.9Very high90.6Very high40 Ų4045.6 Ų45.641%0.41226%0.263SS..Hα-helixtrans-67-46.9178.200000112.6Y64 F65 G71 L72Y64-G68 VanDerWaalsContact O-CA 3.32Å; Y64-G68 WeakPolarHBondContact O-CA 3.08Å; Y64-G68 PolarHBondContact O-N 3.46Å; F65-G68 PolarHBondContact O-N 2.89Å; G68-G71 PolarHBondContact O-N 3.49Å; G68-L72 WeakPolarHBondContact O-CB 3.26Å; G68-L72 PolarHBondContact O-N 3.34Å
69A93.9Very high91.2Very high13 Ų1349 Ų4911%0.10728%0.279CS..Hα-helixtrans-62.1-47.517700000111.3F65 L73 L113F65-A69 WeakPolarHBondContact O-CB 3.1Å; F65-A69 PolarHBondContact O-N 3.45Å; A69-L73 WeakPolarHBondContact O-CB 3.47Å; A69-L73 PolarHBondContact O-N 3.5Å; A69-L113 HydrophobicContact CB-CB 4.5Å
70S93Very high91.5Very high3 Ų347.8 Ų47.82%0.02127%0.265CS..Hα-helixtrans-65.6-40.9178.7-55.60000112.1V66 A74V66-S70 VanDerWaalsContact O-CB 3.29Å; V66-S70 WeakPolarHBondContact O-CB 3.34Å; V66-S70 PolarHBondContact O-N 3.42Å; V66-S70 PolarHBondContact O-OG 3.13Å; S70-A74 VanDerWaalsContact O-CB 3.31Å; S70-A74 WeakPolarHBondContact O-CB 3.21Å; S70-A74 PolarHBondContact O-N 3.22Å
71G93.7Very high91.8Very high25 Ų2545.7 Ų45.726%0.25825%0.25SC..Hα-helixtrans-70.8-43.7179.100000113.4A67 G68 L73 A74 L75A67-G71 WeakPolarHBondContact O-CA 3.42Å; A67-G71 PolarHBondContact O-N 3.13Å; G68-G71 PolarHBondContact O-N 3.49Å; G71-L73 VanDerWaalsContact C-N 3.32Å; G71-L73 PolarHBondContact O-N 3.12Å; G71-A74 PolarHBondContact O-N 3.05Å; G71-L75 WeakPolarHBondContact O-CB 3.43Å; G71-L75 PolarHBondContact O-N 3.45Å
72L94.9Very high92Very high120 Ų12046.8 Ų46.863%0.62825%0.249SC*.Hα-helixtrans-61.9-42.7175.5-177.870.6000110.7G68 L75 Y76G68-L72 WeakPolarHBondContact O-CB 3.26Å; G68-L72 PolarHBondContact O-N 3.34Å; L72-L75 PolarHBondContact O-N 3.47Å; L72-Y76 WeakPolarHBondContact O-CB 3.39Å; L72-Y76 PolarHBondContact O-N 3.17Å
73L93.9Very high92Very high15 Ų1549.5 Ų49.58%0.07926%0.259CS..Hα-helixtrans-68.5-38.4178.4-167.359.9000112A69 G71 Y76 C77 A110 V114 W176A69-L73 WeakPolarHBondContact O-CB 3.47Å; A69-L73 PolarHBondContact O-N 3.5Å; G71-L73 VanDerWaalsContact C-N 3.32Å; G71-L73 PolarHBondContact O-N 3.12Å; L73-Y76 HydrophobicContact CD1-CD1 4.34Å; L73-Y76 WeakPolarHBondContact O-CB 3.17Å; L73-Y76 PolarHBondContact O-N 2.94Å; L73-C77 PolarHBondContact O-N 3.37Å; L73-C77 PolarHBondContact O-SG 2.9Å; L73-C77 VanDerWaalsContact O-SG 3.32Å; L73-A110 HydrophobicContact CD1-CB 3.67Å; L73-A110 HydrophobicContact CD2-CB 3.96Å; L73-A110 HydrophobicContact CG-CB 4.45Å; L73-V114 HydrophobicContact CD2-CG2 3.36Å; L73-W176 HydrophobicContact CD1-CH2 3.78Å; L73-W176 HydrophobicContact CD1-CZ2 3.29Å; L73-W176 HydrophobicContact CD2-CZ2 3.9Å; L73-W176 HydrophobicContact CG-CH2 4.5Å; L73-W176 HydrophobicContact CG-CZ2 3.54Å
74A94Very high91.8Very high6 Ų650.7 Ų50.75%0.0526%0.264CS..Hα-helixtrans-62-45.117200000111.3F18 S70 G71 Y76 C77 L78F18-A74 HydrophobicContact CD2-CB 4.01Å; F18-A74 WeakPolarHBondContact CD2-O 3.37Å; F18-A74 HydrophobicContact CE2-CB 4.48Å; S70-A74 VanDerWaalsContact O-CB 3.31Å; S70-A74 WeakPolarHBondContact O-CB 3.21Å; S70-A74 PolarHBondContact O-N 3.22Å; G71-A74 PolarHBondContact O-N 3.05Å; A74-Y76 VanDerWaalsContact C-N 3.31Å; A74-Y76 PolarHBondContact O-N 3.36Å; A74-C77 PolarHBondContact O-N 2.99Å; A74-L78 PolarHBondContact O-N 3.23Å
75L94.9Very high91.5Very high93 Ų9348.3 Ų48.349%0.48726%0.259SS..Hα-helixtrans-60.1-42.9175.6-177.266.4000111.4G71 L72 L78 L79G71-L75 WeakPolarHBondContact O-CB 3.43Å; G71-L75 PolarHBondContact O-N 3.45Å; L72-L75 PolarHBondContact O-N 3.47Å; L75-L78 PolarHBondContact O-N 2.92Å; L75-L79 HydrophobicContact CG-CD1 4.22Å; L75-L79 WeakPolarHBondContact O-CG 3.25Å; L75-L79 PolarHBondContact O-N 3.39Å
76Y93.2Very high91.2Very high66 Ų6651.6 Ų51.626%0.25927%0.27SS..Hα-helixtrans-58.7-48.2174.8174.9-103.5000111.9L72 L73 A74 L78 L79 L80 I106 W176L72-Y76 WeakPolarHBondContact O-CB 3.39Å; L72-Y76 PolarHBondContact O-N 3.17Å; L73-Y76 HydrophobicContact CD1-CD1 4.34Å; L73-Y76 WeakPolarHBondContact O-CB 3.17Å; L73-Y76 PolarHBondContact O-N 2.94Å; A74-Y76 VanDerWaalsContact C-N 3.31Å; A74-Y76 PolarHBondContact O-N 3.36Å; Y76-L78 VanDerWaalsContact C-N 3.32Å; Y76-L78 PolarHBondContact O-N 3.15Å; Y76-L79 PolarHBondContact O-N 2.92Å; Y76-L80 HydrophobicContact CD1-CD1 4.01Å; Y76-L80 HydrophobicContact CE1-CD1 3.29Å; Y76-L80 HydrophobicContact CE1-CG 4.07Å; Y76-L80 HydrophobicContact CE2-CD1 4.14Å; Y76-L80 HydrophobicContact CE2-CD2 4.48Å; Y76-L80 HydrophobicContact CE2-CG 4.1Å; Y76-L80 PolarHBondContact O-N 3.36Å; Y76-L80 WeakPolarHBondContact OH-CD1 3.39Å; Y76-I106 HydrophobicContact CD1-CG2 4.33Å; Y76-I106 HydrophobicContact CE1-CG2 3.58Å; Y76-I106 HydrophobicContact CE2-CD1 4.21Å; Y76-I106 HydrophobicContact CE2-CG2 4.38Å; Y76-I106 VanDerWaalsContact OH-CD1 3.25Å; Y76-I106 WeakPolarHBondContact OH-CD1 3.43Å; Y76-W176 HydrophobicContact CD1-CH2 4.17Å; Y76-W176 HydrophobicContact CE1-CH2 4.11Å
77C92.5Very high90.6Very high1 Ų152.1 Ų52.11%0.00727%0.274CS..Hα-helixtrans-58-44.3174.8-69.20000111.7F18 L73 A74 L80 L81 W176F18-C77 HydrophobicContact CB-CB 3.87Å; L73-C77 PolarHBondContact O-N 3.37Å; L73-C77 PolarHBondContact O-SG 2.9Å; L73-C77 VanDerWaalsContact O-SG 3.32Å; A74-C77 PolarHBondContact O-N 2.99Å; C77-L80 PolarHBondContact O-N 3.49Å; C77-L81 WeakPolarHBondContact O-CG 3.28Å; C77-L81 PolarHBondContact O-N 3.43Å; C77-W176 VanDerWaalsContact SG-CZ2 3.56Å
78L93.3Very high89.7Confident61 Ų6154.6 Ų54.632%0.31929%0.29SS..Hα-helixtrans-61.7-46.2178.9-176.667.1000112F18 A74 L75 Y76 L80 L81 L82F18-L78 HydrophobicContact CD2-CB 4.02Å; F18-L78 HydrophobicContact CE2-CB 4.05Å; F18-L78 HydrophobicContact CE2-CD1 4.29Å; F18-L78 HydrophobicContact CE2-CD2 4.29Å; F18-L78 HydrophobicContact CE2-CG 4.45Å; F18-L78 HydrophobicContact CZ-CD1 4.24Å; A74-L78 PolarHBondContact O-N 3.23Å; L75-L78 PolarHBondContact O-N 2.92Å; Y76-L78 VanDerWaalsContact C-N 3.32Å; Y76-L78 PolarHBondContact O-N 3.15Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 3.27Å; L78-L81 WeakPolarHBondContact O-CB 3.12Å; L78-L81 PolarHBondContact O-N 2.84Å; L78-L82 HydrophobicContact CG-CD1 4.36Å; L78-L82 WeakPolarHBondContact O-CG 3.49Å; L78-L82 PolarHBondContact O-N 2.99Å
79L92.9Very high89.2Confident100 Ų10057.8 Ų57.852%0.52431%0.305SS..Hα-helixtrans-63.6-40.4178.1-69.5174.7000111.6L75 Y76 L82 F83L75-L79 HydrophobicContact CG-CD1 4.22Å; L75-L79 WeakPolarHBondContact O-CG 3.25Å; L75-L79 PolarHBondContact O-N 3.39Å; Y76-L79 PolarHBondContact O-N 2.92Å; L79-L82 PolarHBondContact O-N 3.35Å; L79-F83 VanDerWaalsContact O-CB 3.29Å; L79-F83 WeakPolarHBondContact O-CB 3.38Å; L79-F83 PolarHBondContact O-N 2.94Å
80L88.7Confident88.4Confident27 Ų2761 Ų6114%0.14132%0.32CS..Hα-helixtrans-62.6-44.9173.4-81.1-176.7000112.2F14 Y76 C77 L78 L82 F83 W84F14-L80 HydrophobicContact CD1-CD1 4.48Å; F14-L80 HydrophobicContact CD2-CD1 4.49Å; F14-L80 HydrophobicContact CE1-CD1 4.1Å; F14-L80 HydrophobicContact CE2-CD1 4.09Å; F14-L80 HydrophobicContact CZ-CD1 3.89Å; Y76-L80 HydrophobicContact CD1-CD1 4.01Å; Y76-L80 HydrophobicContact CE1-CD1 3.29Å; Y76-L80 HydrophobicContact CE1-CG 4.07Å; Y76-L80 HydrophobicContact CE2-CD1 4.14Å; Y76-L80 HydrophobicContact CE2-CD2 4.48Å; Y76-L80 HydrophobicContact CE2-CG 4.1Å; Y76-L80 PolarHBondContact O-N 3.36Å; Y76-L80 WeakPolarHBondContact OH-CD1 3.39Å; C77-L80 PolarHBondContact O-N 3.49Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 3.27Å; L80-L82 VanDerWaalsContact C-N 3.33Å; L80-L82 PolarHBondContact O-N 3.26Å; L80-F83 PolarHBondContact O-N 2.96Å; L80-W84 WeakPolarHBondContact O-CB 3.4Å; L80-W84 PolarHBondContact O-N 2.98Å
81L90Very high87Confident20 Ų2068.3 Ų68.311%0.10535%0.354CS..Hα-helixtrans-57.6-48.9177.1-71.7168000110.5L11 F14 A15 F18 C77 L78 W84 I85L11-L81 HydrophobicContact CD1-CD2 3.53Å; L11-L81 HydrophobicContact CG-CD2 3.63Å; L11-L81 WeakPolarHBondContact O-CD2 3.31Å; F14-L81 HydrophobicContact CB-CD2 4.02Å; F14-L81 HydrophobicContact CB-CG 4.3Å; A15-L81 HydrophobicContact CB-CD1 4.07Å; A15-L81 HydrophobicContact CB-CD2 4.17Å; F18-L81 HydrophobicContact CB-CD1 4.5Å; C77-L81 WeakPolarHBondContact O-CG 3.28Å; C77-L81 PolarHBondContact O-N 3.43Å; L78-L81 WeakPolarHBondContact O-CB 3.12Å; L78-L81 PolarHBondContact O-N 2.84Å; L81-W84 PolarHBondContact O-N 3.28Å; L81-I85 WeakPolarHBondContact O-CB 3.32Å; L81-I85 WeakPolarHBondContact O-CD1 3.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.36Å; L81-I85 PolarHBondContact O-N 3.27Å
82L89.2Confident85.2Confident100 Ų10074 Ų7452%0.52438%0.378SS..Hα-helixtrans-62-44.1178.2-69.4174.5000111.9L78 L79 L80 I85 Y86L78-L82 HydrophobicContact CG-CD1 4.36Å; L78-L82 WeakPolarHBondContact O-CG 3.49Å; L78-L82 PolarHBondContact O-N 2.99Å; L79-L82 PolarHBondContact O-N 3.35Å; L80-L82 VanDerWaalsContact C-N 3.33Å; L80-L82 PolarHBondContact O-N 3.26Å; L82-I85 PolarHBondContact O-N 3.3Å; L82-Y86 VanDerWaalsContact O-CB 3.28Å; L82-Y86 WeakPolarHBondContact O-CB 3.49Å; L82-Y86 PolarHBondContact O-N 3.02Å
83F87.2Confident83.5Confident112 Ų11270 Ų7049%0.49136%0.361SS..Hα-helixtrans-58.3-49.8176.5175.2-97.9000111.2L79 L80 Y86 S87L79-F83 VanDerWaalsContact O-CB 3.29Å; L79-F83 WeakPolarHBondContact O-CB 3.38Å; L79-F83 PolarHBondContact O-N 2.94Å; L80-F83 PolarHBondContact O-N 2.96Å; F83-Y86 PolarHBondContact O-N 3.5Å; F83-S87 VanDerWaalsContact O-CB 3.24Å; F83-S87 WeakPolarHBondContact O-CB 3.46Å; F83-S87 PolarHBondContact O-N 3.39Å; F83-S87 PolarHBondContact O-OG 2.85Å
84W83.6Confident82Confident25 Ų2577.9 Ų77.910%0.09540%0.396CS..Hα-helixtrans-69.1-35-179.4-78.8111.2000113.5L11 L80 L81 S88 R95L11-W84 HydrophobicContact CD1-CB 3.64Å; L11-W84 HydrophobicContact CD1-CG 4.21Å; L80-W84 WeakPolarHBondContact O-CB 3.4Å; L80-W84 PolarHBondContact O-N 2.98Å; L81-W84 PolarHBondContact O-N 3.28Å; W84-S88 WeakPolarHBondContact O-CB 3.35Å; W84-S88 PolarHBondContact O-N 3.42Å; W84-S88 PolarHBondContact O-OG 3.3Å; W84-R95 HydrophobicContact CH2-CB 3.93Å; W84-R95 HydrophobicContact CZ2-CB 4.32Å
85I83.9Confident80.8Confident91 Ų9180.1 Ų80.147%0.46740%0.404SS..Hα-helixtrans-63.6-48.6173.1-70.9164.5000109.5L81 L82 S88 C89L81-I85 WeakPolarHBondContact O-CB 3.32Å; L81-I85 WeakPolarHBondContact O-CD1 3.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.36Å; L81-I85 PolarHBondContact O-N 3.27Å; L82-I85 PolarHBondContact O-N 3.3Å; I85-S88 WeakPolarHBondContact O-CB 3.23Å; I85-S88 PolarHBondContact O-N 3.01Å; I85-S88 VanDerWaalsContact O-N 3.1Å; I85-C89 PolarHBondContact O-N 3.42Å; I85-C89 PolarHBondContact O-SG 3.25Å; I85-C89 VanDerWaalsContact O-SG 3.35Å
86Y84.6Confident79.8Confident152 Ų15277.9 Ų77.960%0.59640%0.403SS*.Hα-helixtrans-59.9-48.1177.1176.3-97000111.9L82 F83 S88 C89 I90L82-Y86 VanDerWaalsContact O-CB 3.28Å; L82-Y86 WeakPolarHBondContact O-CB 3.49Å; L82-Y86 PolarHBondContact O-N 3.02Å; F83-Y86 PolarHBondContact O-N 3.5Å; Y86-S88 PolarHBondContact O-N 2.96Å; Y86-C89 VanDerWaalsContact O-CB 3.3Å; Y86-C89 WeakPolarHBondContact O-CB 3.23Å; Y86-C89 PolarHBondContact O-N 3.42Å; Y86-I90 HydrophobicContact CD1-CD1 4.4Å; Y86-I90 HydrophobicContact CE1-CD1 3.6Å; Y86-I90 HydrophobicContact CE2-CD1 4.32Å; Y86-I90 PolarHBondContact O-N 3.31Å; Y86-I90 WeakPolarHBondContact OH-CD1 3.36Å
87S79.9Confident79Confident12 Ų1278 Ų788%0.08441%0.413CS..Hα-helixtrans-63.3-23.8174.2-90.70000113.6F83 C89 S93F83-S87 VanDerWaalsContact O-CB 3.24Å; F83-S87 WeakPolarHBondContact O-CB 3.46Å; F83-S87 PolarHBondContact O-N 3.39Å; F83-S87 PolarHBondContact O-OG 2.85Å; S87-C89 VanDerWaalsContact C-N 3.32Å; S87-S93 WeakPolarHBondContact CB-OG 3.28Å; S87-S93 PolarHBondContact O-OG 2.98Å; S87-S93 PolarHBondContact OG-OG 2.83Å
88S75.5Confident78.4Confident64 Ų6483.8 Ų83.845%0.44844%0.443SS..Hα-helixtrans-78.6-21.3173.6-59.90000111.9W84 I85 Y86 I90W84-S88 WeakPolarHBondContact O-CB 3.35Å; W84-S88 PolarHBondContact O-N 3.42Å; W84-S88 PolarHBondContact O-OG 3.3Å; I85-S88 WeakPolarHBondContact O-CB 3.23Å; I85-S88 PolarHBondContact O-N 3.01Å; I85-S88 VanDerWaalsContact O-N 3.1Å; Y86-S88 PolarHBondContact O-N 2.96Å; S88-I90 VanDerWaalsContact C-N 3.31Å
89C80.2Confident77.9Confident107 Ų10782.2 Ų82.272%0.72344%0.442SS*.Hα-helixtrans-78-18.1173.1-61.40000112.5I85 Y86 S87I85-C89 PolarHBondContact O-N 3.42Å; I85-C89 PolarHBondContact O-SG 3.25Å; I85-C89 VanDerWaalsContact O-SG 3.35Å; Y86-C89 VanDerWaalsContact O-CB 3.3Å; Y86-C89 WeakPolarHBondContact O-CB 3.23Å; Y86-C89 PolarHBondContact O-N 3.42Å; S87-C89 VanDerWaalsContact C-N 3.32Å
90I78.3Confident77.5Confident80 Ų8077.5 Ų77.541%0.4142%0.417SS..SBendtrans-110.4124.1177.4-61.6179.3000107Y86 S88 D92Y86-I90 HydrophobicContact CD1-CD1 4.4Å; Y86-I90 HydrophobicContact CE1-CD1 3.6Å; Y86-I90 HydrophobicContact CE2-CD1 4.32Å; Y86-I90 PolarHBondContact O-N 3.31Å; Y86-I90 WeakPolarHBondContact OH-CD1 3.36Å; S88-I90 VanDerWaalsContact C-N 3.31Å; I90-D92 PolarHBondContact O-N 3.48Å
91E62.2Low77.5Confident158 Ų15883.2 Ų83.274%0.73844%0.437SS*.SBendtrans-66.41.7-163.5-145.4148.9-171.200115.8M1M1-E91 HydrophobicContact CE-CG 4.37Å; M1-E91 WeakPolarHBondContact CE-OE1 3.38Å; M1-E91 HydrophobicContact SD-CG 3.91Å
92D56.4Low77.4Confident144 Ų14486.9 Ų86.977%0.7746%0.455SS*.  trans-122.483.2-173.2-73-47.3000112.9I90I90-D92 PolarHBondContact O-N 3.48Å
93S58.5Low77.4Confident37 Ų3782.4 Ų82.426%0.25943%0.433SS..  trans-147.581.3175-710000113.5S87S87-S93 WeakPolarHBondContact CB-OG 3.28Å; S87-S93 PolarHBondContact O-OG 2.98Å; S87-S93 PolarHBondContact OG-OG 2.83Å
94H63.4Low77.5Confident179 Ų17978.4 Ų78.483%0.82942%0.417SS*.  trans-95.2127.4164.1-80.5-77.1000110.6G96H94-G96 PolarHBondContact O-N 3.01Å
95R67.9Low78Confident53 Ų5379.8 Ų79.820%0.243%0.433CS..  trans-70.3111.7170.4-165.6154.487-174-8.4108.1E10 W84E10-R95 IonicContact OE1-CZ 3.53Å; E10-R95 IonicContact OE1-NH1 3.27Å; E10-R95 PolarHBondContact OE1-NH1 3.08Å; E10-R95 IonicContact OE1-NH2 2.86Å; E10-R95 PolarHBondContact OE1-NH2 2.84Å; E10-R95 IonicContact OE2-NH2 3.45Å; E10-R95 PolarHBondContact OE2-NH2 3.44Å; W84-R95 HydrophobicContact CH2-CB 3.93Å; W84-R95 HydrophobicContact CZ2-CB 4.32Å
96G74.6Confident78.5Confident47 Ų4777.7 Ų77.749%0.48542%0.422SS..  trans-68.3163.6173.300000112.4H94 I98 G99 L100H94-G96 PolarHBondContact O-N 3.01Å; G96-I98 PolarHBondContact O-N 3.33Å; G96-I98 VanDerWaalsContact O-N 3.12Å; G96-G99 WeakPolarHBondContact O-CA 3.36Å; G96-G99 PolarHBondContact O-N 3.31Å; G96-L100 PolarHBondContact O-N 3.38Å; G96-L100 VanDerWaalsContact O-N 3.14Å
97S76.1Confident78.9Confident67 Ų6770.5 Ų70.547%0.46939%0.394SS..Hα-helixtrans-54.9-33.8-178.663.90000113.6L100 R101S97-L100 PolarHBondContact O-N 3.49Å; S97-R101 WeakPolarHBondContact O-CG 3.19Å; S97-R101 PolarHBondContact O-N 3.22Å; S97-R101 VanDerWaalsContact O-N 3.09Å
98I80.2Confident79.6Confident123 Ų12372.3 Ų72.363%0.63141%0.41SS*.Hα-helixtrans-62.7-44.9174.1-63.9171.3000111.1G96 L100 R101 I102G96-I98 PolarHBondContact O-N 3.33Å; G96-I98 VanDerWaalsContact O-N 3.12Å; I98-L100 VanDerWaalsContact C-N 3.28Å; I98-L100 PolarHBondContact O-N 3.45Å; I98-R101 PolarHBondContact O-N 3.43Å; I98-I102 HydrophobicContact CG2-CD1 4.1Å; I98-I102 WeakPolarHBondContact O-CG1 3.32Å; I98-I102 PolarHBondContact O-N 3.34Å; I98-I102 VanDerWaalsContact O-N 3.1Å
99G83Confident80.6Confident28 Ų2874.2 Ų74.229%0.28941%0.414SS..Hα-helixtrans-64-35.2177.900000112.2G96 I102 A103G96-G99 WeakPolarHBondContact O-CA 3.36Å; G96-G99 PolarHBondContact O-N 3.31Å; G99-I102 PolarHBondContact O-N 3.48Å; G99-A103 WeakPolarHBondContact O-CB 3.44Å; G99-A103 PolarHBondContact O-N 2.95Å
100L84.8Confident81.3Confident1 Ų169.2 Ų69.21%0.00538%0.381CS..Hα-helixtrans-67.6-37.1173.8-170.864.1000112.5G96 S97 I98 A103 L104 Q183 Q186 W187G96-L100 PolarHBondContact O-N 3.38Å; G96-L100 VanDerWaalsContact O-N 3.14Å; S97-L100 PolarHBondContact O-N 3.49Å; I98-L100 VanDerWaalsContact C-N 3.28Å; I98-L100 PolarHBondContact O-N 3.45Å; L100-A103 PolarHBondContact O-N 2.87Å; L100-L104 WeakPolarHBondContact O-CG 3.49Å; L100-L104 PolarHBondContact O-N 3.41Å; L100-Q183 HydrophobicContact CD1-CB 4.21Å; L100-Q183 HydrophobicContact CD1-CG 4.39Å; L100-Q186 HydrophobicContact CD1-CB 4.12Å; L100-Q186 HydrophobicContact CD2-CB 4.07Å; L100-W187 HydrophobicContact CD2-CB 3.67Å; L100-W187 HydrophobicContact CD2-CE3 4.27Å; L100-W187 HydrophobicContact CD2-CG 4.41Å; L100-W187 HydrophobicContact CG-CB 4.41Å; L100-W187 HydrophobicContact CG-CE3 4.21Å
101R87.1Confident82.1Confident148 Ų14866.9 Ų66.956%0.55837%0.368SS*.Hα-helixtrans-63.9-43.4174.2-34.3-156.1156.4169.5-4.7112.9S97 I98 A103 L104 A105 W187S97-R101 WeakPolarHBondContact O-CG 3.19Å; S97-R101 PolarHBondContact O-N 3.22Å; S97-R101 VanDerWaalsContact O-N 3.09Å; I98-R101 PolarHBondContact O-N 3.43Å; R101-A103 VanDerWaalsContact C-N 3.32Å; R101-L104 PolarHBondContact O-N 3.39Å; R101-A105 PolarHBondContact O-N 3.13Å; R101-A105 VanDerWaalsContact O-N 3.09Å; R101-W187 HydrophobicContact CB-CH2 4.03Å; R101-W187 HydrophobicContact CB-CZ3 3.55Å; R101-W187 HydrophobicContact CG-CE3 4.24Å; R101-W187 HydrophobicContact CG-CH2 3.45Å; R101-W187 VanDerWaalsContact CG-CH2 3.45Å; R101-W187 HydrophobicContact CG-CZ3 3.22Å
102I88.4Confident83.7Confident96 Ų9665.7 Ų65.749%0.49236%0.361SS..Hα-helixtrans-63.3-43.5177-65167.9000109.5I98 G99 L104 A105 I106I98-I102 HydrophobicContact CG2-CD1 4.1Å; I98-I102 WeakPolarHBondContact O-CG1 3.32Å; I98-I102 PolarHBondContact O-N 3.34Å; I98-I102 VanDerWaalsContact O-N 3.1Å; G99-I102 PolarHBondContact O-N 3.48Å; I102-L104 PolarHBondContact O-N 2.03Å; I102-A105 PolarHBondContact O-N 3.41Å; I102-I106 HydrophobicContact CG2-CD1 3.7Å; I102-I106 HydrophobicContact CG2-CG1 4.4Å; I102-I106 VanDerWaalsContact O-CG1 3.29Å; I102-I106 WeakPolarHBondContact O-CG1 3.08Å; I102-I106 PolarHBondContact O-N 2.85Å
103A89.1Confident85.6Confident6 Ų661 Ų615%0.0534%0.336CS..Hα-helixtrans-60.6-42.5177.700000112.9G99 L100 R101 I106 S107 Q183G99-A103 WeakPolarHBondContact O-CB 3.44Å; G99-A103 PolarHBondContact O-N 2.95Å; L100-A103 PolarHBondContact O-N 2.87Å; R101-A103 VanDerWaalsContact C-N 3.32Å; A103-I106 PolarHBondContact O-N 3.05Å; A103-S107 PolarHBondContact O-N 3.12Å; A103-S107 PolarHBondContact O-OG 2.85Å; A103-S107 VanDerWaalsContact O-OG 3.12Å; A103-Q183 VanDerWaalsContact C-OE1 3.31Å; A103-Q183 PolarHBondContact O-OE1 2.91Å
104L90.4Very high87.3Confident29 Ų2959.4 Ų59.415%0.15233%0.325CS..Hα-helixtrans-61.6-43.2174.7-77.9174.8000112.8L100 R101 I102 I106 S107 A108 L180 Q183 V184 W187L100-L104 WeakPolarHBondContact O-CG 3.49Å; L100-L104 PolarHBondContact O-N 3.41Å; R101-L104 PolarHBondContact O-N 3.39Å; I102-L104 PolarHBondContact O-N 2.03Å; L104-I106 VanDerWaalsContact C-N 3.33Å; L104-S107 WeakPolarHBondContact CA-OG 3.33Å; L104-S107 PolarHBondContact O-N 3.42Å; L104-S107 PolarHBondContact O-OG 2.96Å; L104-A108 WeakPolarHBondContact O-CB 3.31Å; L104-A108 PolarHBondContact O-N 3Å; L104-L180 HydrophobicContact CD2-CD1 3.73Å; L104-Q183 HydrophobicContact CD2-CB 3.43Å; L104-Q183 VanDerWaalsContact CD2-CB 3.43Å; L104-Q183 HydrophobicContact CG-CB 4.08Å; L104-V184 HydrophobicContact CD2-CG2 3.74Å; L104-W187 HydrophobicContact CD1-CB 4.39Å; L104-W187 HydrophobicContact CD1-CD2 4.02Å; L104-W187 HydrophobicContact CD1-CE3 3.28Å; L104-W187 HydrophobicContact CD1-CG 4.47Å; L104-W187 HydrophobicContact CD1-CZ3 3.68Å
105A93.8Very high88.9Confident53 Ų5354.3 Ų54.344%0.43830%0.303SS..Hα-helixtrans-63.2-43.4177.100000110.9R101 I102 A108 I109R101-A105 PolarHBondContact O-N 3.13Å; R101-A105 VanDerWaalsContact O-N 3.09Å; I102-A105 PolarHBondContact O-N 3.41Å; A105-A108 PolarHBondContact O-N 2.86Å; A105-I109 VanDerWaalsContact O-CG1 3.3Å; A105-I109 WeakPolarHBondContact O-CG1 3.45Å; A105-I109 PolarHBondContact O-N 2.81Å
106I93.3Very high90.2Very high48 Ų4854 Ų5425%0.24631%0.307CS..Hα-helixtrans-65.9-42.7178.7-65.4168000111.2Y76 I102 A103 L104 A108 I109 A110Y76-I106 HydrophobicContact CD1-CG2 4.33Å; Y76-I106 HydrophobicContact CE1-CG2 3.58Å; Y76-I106 HydrophobicContact CE2-CD1 4.21Å; Y76-I106 HydrophobicContact CE2-CG2 4.38Å; Y76-I106 VanDerWaalsContact OH-CD1 3.25Å; Y76-I106 WeakPolarHBondContact OH-CD1 3.43Å; I102-I106 HydrophobicContact CG2-CD1 3.7Å; I102-I106 HydrophobicContact CG2-CG1 4.4Å; I102-I106 VanDerWaalsContact O-CG1 3.29Å; I102-I106 WeakPolarHBondContact O-CG1 3.08Å; I102-I106 PolarHBondContact O-N 2.85Å; A103-I106 PolarHBondContact O-N 3.05Å; L104-I106 VanDerWaalsContact C-N 3.33Å; I106-A108 VanDerWaalsContact C-N 3.34Å; I106-A108 PolarHBondContact O-N 3.45Å; I106-I109 PolarHBondContact O-N 3.29Å; I106-A110 VanDerWaalsContact O-CB 3.27Å; I106-A110 WeakPolarHBondContact O-CB 3.43Å; I106-A110 PolarHBondContact O-N 2.87Å
107S93.9Very high91.1Very high0 Ų051.8 Ų51.80%028%0.284CS..Hα-helixtrans-65.1-37.4178.157.40000112.2A103 L104 A110 I111 L180 Q183A103-S107 PolarHBondContact O-N 3.12Å; A103-S107 PolarHBondContact O-OG 2.85Å; A103-S107 VanDerWaalsContact O-OG 3.12Å; L104-S107 WeakPolarHBondContact CA-OG 3.33Å; L104-S107 PolarHBondContact O-N 3.42Å; L104-S107 PolarHBondContact O-OG 2.96Å; S107-A110 PolarHBondContact O-N 2.93Å; S107-I111 VanDerWaalsContact O-CG1 3.26Å; S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 3.4Å; S107-L180 VanDerWaalsContact OG-CD1 3.23Å; S107-L180 WeakPolarHBondContact OG-CD1 3.47Å; S107-Q183 PolarHBondContact OG-OE1 2.73Å
108A94.9Very high91.9Very high51 Ų5148.6 Ų48.642%0.42126%0.261SS..Hα-helixtrans-62.4-45.4172.400000112.6L104 A105 I106 A110 I111 F112L104-A108 WeakPolarHBondContact O-CB 3.31Å; L104-A108 PolarHBondContact O-N 3Å; A105-A108 PolarHBondContact O-N 2.86Å; I106-A108 VanDerWaalsContact C-N 3.34Å; I106-A108 PolarHBondContact O-N 3.45Å; A108-A110 VanDerWaalsContact C-N 3.34Å; A108-I111 PolarHBondContact O-N 3.02Å; A108-F112 PolarHBondContact O-N 2.87Å; A108-F112 VanDerWaalsContact O-N 3.14Å
109I95.8Very high92.6Very high104 Ų10444.7 Ų44.753%0.53325%0.245SC..Hα-helixtrans-62.8-43176-67.1165000110.6A105 I106 F112 L113A105-I109 VanDerWaalsContact O-CG1 3.3Å; A105-I109 WeakPolarHBondContact O-CG1 3.45Å; A105-I109 PolarHBondContact O-N 2.81Å; I106-I109 PolarHBondContact O-N 3.29Å; I109-F112 PolarHBondContact O-N 3.01Å; I109-L113 HydrophobicContact CG2-CD1 3.94Å; I109-L113 HydrophobicContact CG2-CG 4.31Å; I109-L113 WeakPolarHBondContact O-CG 3.4Å; I109-L113 PolarHBondContact O-N 3.38Å
110A94.6Very high93.1Very high2 Ų244.4 Ų44.42%0.01724%0.236CC..Hα-helixtrans-59.9-46.9178.100000111.9L73 I106 S107 A108 F112 L113 V114 W176L73-A110 HydrophobicContact CD1-CB 3.67Å; L73-A110 HydrophobicContact CD2-CB 3.96Å; L73-A110 HydrophobicContact CG-CB 4.45Å; I106-A110 VanDerWaalsContact O-CB 3.27Å; I106-A110 WeakPolarHBondContact O-CB 3.43Å; I106-A110 PolarHBondContact O-N 2.87Å; S107-A110 PolarHBondContact O-N 2.93Å; A108-A110 VanDerWaalsContact C-N 3.34Å; A110-F112 VanDerWaalsContact C-N 3.31Å; A110-F112 PolarHBondContact O-N 3.22Å; A110-L113 PolarHBondContact O-N 3.44Å; A110-V114 WeakPolarHBondContact O-CB 3.46Å; A110-V114 VanDerWaalsContact O-CG2 3.25Å; A110-V114 WeakPolarHBondContact O-CG2 3.02Å; A110-V114 PolarHBondContact O-N 3.28Å; A110-W176 HydrophobicContact CB-CD2 3.58Å; A110-W176 HydrophobicContact CB-CE3 3.51Å; A110-W176 HydrophobicContact CB-CG 4.27Å; A110-W176 HydrophobicContact CB-CH2 3.82Å; A110-W176 HydrophobicContact CB-CZ2 3.93Å; A110-W176 HydrophobicContact CB-CZ3 3.62Å
111I96.1Very high93.4Very high30 Ų3044.3 Ų44.315%0.15424%0.236CC..Hα-helixtrans-56.8-47.1175.6-70.9166.2000110.4S107 A108 V114 L115 L173 W176 L180S107-I111 VanDerWaalsContact O-CG1 3.26Å; S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 3.4Å; A108-I111 PolarHBondContact O-N 3.02Å; I111-V114 PolarHBondContact O-N 3.43Å; I111-L115 WeakPolarHBondContact O-CB 3.4Å; I111-L115 PolarHBondContact O-N 2.94Å; I111-L173 HydrophobicContact CG2-CD1 3.89Å; I111-W176 HydrophobicContact CG1-CB 3.66Å; I111-L180 HydrophobicContact CD1-CB 3.89Å; I111-L180 HydrophobicContact CD1-CD2 3.58Å; I111-L180 HydrophobicContact CD1-CG 4.3Å
112F96.5Very high93.7Very high133 Ų13343.6 Ų43.658%0.58323%0.233SC*.Hα-helixtrans-60.1-49.6179177.8-99.8000111.8A108 I109 A110 V114 L115 V116A108-F112 PolarHBondContact O-N 2.87Å; A108-F112 VanDerWaalsContact O-N 3.14Å; I109-F112 PolarHBondContact O-N 3.01Å; A110-F112 VanDerWaalsContact C-N 3.31Å; A110-F112 PolarHBondContact O-N 3.22Å; F112-V114 PolarHBondContact O-N 2.82Å; F112-L115 PolarHBondContact O-N 3.21Å; F112-V116 HydrophobicContact CD1-CG2 4.49Å; F112-V116 HydrophobicContact CD2-CG2 4.48Å; F112-V116 HydrophobicContact CE1-CG2 4.12Å; F112-V116 HydrophobicContact CE2-CG2 4.1Å; F112-V116 HydrophobicContact CZ-CG2 3.91Å; F112-V116 WeakPolarHBondContact O-CG2 3.06Å; F112-V116 PolarHBondContact O-N 3.32Å
113L95.4Very high93.9Very high47 Ų4744.7 Ų44.725%0.24624%0.235CC..Hα-helixtrans-62.5-42.2179.7-69.4176.1000112.5F65 A69 I109 A110 S117F65-L113 HydrophobicContact CE2-CD2 4.3Å; F65-L113 HydrophobicContact CZ-CD2 4.06Å; A69-L113 HydrophobicContact CB-CB 4.5Å; I109-L113 HydrophobicContact CG2-CD1 3.94Å; I109-L113 HydrophobicContact CG2-CG 4.31Å; I109-L113 WeakPolarHBondContact O-CG 3.4Å; I109-L113 PolarHBondContact O-N 3.38Å; A110-L113 PolarHBondContact O-N 3.44Å; L113-S117 VanDerWaalsContact O-CB 3.23Å; L113-S117 WeakPolarHBondContact O-CB 3.43Å; L113-S117 PolarHBondContact O-N 2.98Å; L113-S117 PolarHBondContact O-OG 3.31Å
114V95Very high93.8Very high3 Ų344.4 Ų44.42%0.01823%0.232CC..Hα-helixtrans-68.3-39.6178.1174.80000111.1L73 A110 I111 F112 S117 A118 S169 N172 L173L73-V114 HydrophobicContact CD2-CG2 3.36Å; A110-V114 WeakPolarHBondContact O-CB 3.46Å; A110-V114 VanDerWaalsContact O-CG2 3.25Å; A110-V114 WeakPolarHBondContact O-CG2 3.02Å; A110-V114 PolarHBondContact O-N 3.28Å; I111-V114 PolarHBondContact O-N 3.43Å; F112-V114 PolarHBondContact O-N 2.82Å; V114-S117 WeakPolarHBondContact O-CB 3.47Å; V114-S117 PolarHBondContact O-N 3.45Å; V114-A118 WeakPolarHBondContact O-CB 3.35Å; V114-A118 PolarHBondContact O-N 3.46Å; V114-S169 WeakPolarHBondContact CG1-O 3.34Å; V114-N172 HydrophobicContact CG1-CB 4.14Å; V114-L173 HydrophobicContact CB-CD1 4.45Å; V114-L173 HydrophobicContact CG1-CB 3.88Å; V114-L173 HydrophobicContact CG1-CD1 4.29Å
115L95.6Very high93.7Very high71 Ų7143.4 Ų43.437%0.37223%0.228SC..Hα-helixtrans-63.3-49176.8179.563.6000111.4I111 F112 S117 A118 C119 L173I111-L115 WeakPolarHBondContact O-CB 3.4Å; I111-L115 PolarHBondContact O-N 2.94Å; F112-L115 PolarHBondContact O-N 3.21Å; L115-S117 VanDerWaalsContact C-N 3.27Å; L115-S117 PolarHBondContact O-N 2.98Å; L115-A118 PolarHBondContact O-N 3.33Å; L115-C119 WeakPolarHBondContact O-CB 3.35Å; L115-C119 PolarHBondContact O-N 3.28Å; L115-C119 PolarHBondContact O-SG 2.95Å; L115-L173 HydrophobicContact CB-CD1 4.03Å; L115-L173 HydrophobicContact CD1-CD2 3.84Å
116V95.6Very high93.6Very high46 Ų4648.9 Ų48.928%0.27924%0.237SC..Hα-helixtrans-58.9-43.4176.3175.80000110.2F65 F112 C119 I120F65-V116 HydrophobicContact CE1-CB 4.3Å; F65-V116 HydrophobicContact CE1-CG1 3.67Å; F65-V116 HydrophobicContact CZ-CG1 4.08Å; F112-V116 HydrophobicContact CD1-CG2 4.49Å; F112-V116 HydrophobicContact CD2-CG2 4.48Å; F112-V116 HydrophobicContact CE1-CG2 4.12Å; F112-V116 HydrophobicContact CE2-CG2 4.1Å; F112-V116 HydrophobicContact CZ-CG2 3.91Å; F112-V116 WeakPolarHBondContact O-CG2 3.06Å; F112-V116 PolarHBondContact O-N 3.32Å; V116-C119 PolarHBondContact O-N 2.98Å; V116-I120 HydrophobicContact CG1-CD1 3.81Å; V116-I120 HydrophobicContact CG1-CG1 4.43Å; V116-I120 VanDerWaalsContact O-CG1 3.29Å; V116-I120 WeakPolarHBondContact O-CG1 3.48Å; V116-I120 PolarHBondContact O-N 3.37Å
117S93.5Very high93.4Very high1 Ų149 Ų491%0.00724%0.242CC..Hα-helixtrans-59-47.8176-68.60000112.9L113 V114 L115 C119 I120 L121L113-S117 VanDerWaalsContact O-CB 3.23Å; L113-S117 WeakPolarHBondContact O-CB 3.43Å; L113-S117 PolarHBondContact O-N 2.98Å; L113-S117 PolarHBondContact O-OG 3.31Å; V114-S117 WeakPolarHBondContact O-CB 3.47Å; V114-S117 PolarHBondContact O-N 3.45Å; L115-S117 VanDerWaalsContact C-N 3.27Å; L115-S117 PolarHBondContact O-N 2.98Å; S117-C119 PolarHBondContact O-N 3.26Å; S117-I120 PolarHBondContact O-N 3.46Å; S117-L121 WeakPolarHBondContact O-CB 3.28Å; S117-L121 WeakPolarHBondContact O-CG 3.38Å; S117-L121 PolarHBondContact O-N 2.92Å
118A94.1Very high93Very high0 Ų049 Ų490%024%0.242CC..Hα-helixtrans-63.8-40.2178.400000111.8V114 L115 L121 R122 W170V114-A118 WeakPolarHBondContact O-CB 3.35Å; V114-A118 PolarHBondContact O-N 3.46Å; L115-A118 PolarHBondContact O-N 3.33Å; A118-L121 PolarHBondContact O-N 2.85Å; A118-R122 WeakPolarHBondContact O-CB 3.25Å; A118-R122 PolarHBondContact O-N 3.33Å; A118-W170 HydrophobicContact CB-CD2 4.28Å; A118-W170 HydrophobicContact CB-CZ2 4.28Å
119C93.9Very high92.7Very high42 Ų4247.5 Ų47.528%0.28423%0.228SC..Hα-helixtrans-62.9-48.6175.2-72.40000111.7L115 V116 S117 L121 R122 F123L115-C119 WeakPolarHBondContact O-CB 3.35Å; L115-C119 PolarHBondContact O-N 3.28Å; L115-C119 PolarHBondContact O-SG 2.95Å; V116-C119 PolarHBondContact O-N 2.98Å; S117-C119 PolarHBondContact O-N 3.26Å; C119-L121 VanDerWaalsContact C-N 3.29Å; C119-L121 PolarHBondContact O-N 3.38Å; C119-R122 PolarHBondContact O-N 2.91Å; C119-F123 HydrophobicContact CB-CD2 4.43Å; C119-F123 WeakPolarHBondContact O-CB 3.41Å; C119-F123 VanDerWaalsContact O-CD2 3.28Å; C119-F123 WeakPolarHBondContact O-CD2 3.45Å; C119-F123 PolarHBondContact O-N 2.82Å
120I93.2Very high92.4Very high21 Ų2146.9 Ų46.911%0.10823%0.226CC..Hα-helixtrans-58.4-43.4177.4-71.3168.7000110.6L41 Y42 L62 F65 V66 V116 S117 G124L41-I120 HydrophobicContact CD1-CG2 4.02Å; Y42-I120 HydrophobicContact CE2-CG2 4.29Å; L62-I120 HydrophobicContact CD2-CD1 4.48Å; F65-I120 HydrophobicContact CD1-CD1 3.88Å; F65-I120 HydrophobicContact CE1-CD1 4.09Å; V66-I120 HydrophobicContact CG2-CB 3.96Å; V66-I120 HydrophobicContact CG2-CD1 4.13Å; V66-I120 HydrophobicContact CG2-CG2 3.61Å; V116-I120 HydrophobicContact CG1-CD1 3.81Å; V116-I120 HydrophobicContact CG1-CG1 4.43Å; V116-I120 VanDerWaalsContact O-CG1 3.29Å; V116-I120 WeakPolarHBondContact O-CG1 3.48Å; V116-I120 PolarHBondContact O-N 3.37Å; S117-I120 PolarHBondContact O-N 3.46Å; I120-G124 VanDerWaalsContact O-CA 3.29Å; I120-G124 WeakPolarHBondContact O-CA 3.46Å; I120-G124 PolarHBondContact O-N 3.39Å
121L91.6Very high92.1Very high0 Ų047.6 Ų47.60%023%0.231CC..Hα-helixtrans-61.8-50.4176.2-80.7167.1000112L28 L41 V66 S117 A118 C119 T125 L162 A165 E166 S169L28-L121 HydrophobicContact CD1-CD2 4.09Å; L28-L121 HydrophobicContact CD2-CD2 3.76Å; L28-L121 HydrophobicContact CG-CD2 4.18Å; L41-L121 HydrophobicContact CD1-CD2 4.35Å; L41-L121 HydrophobicContact CD2-CD2 4.25Å; V66-L121 HydrophobicContact CG1-CD1 3.89Å; V66-L121 HydrophobicContact CG1-CG 4Å; S117-L121 WeakPolarHBondContact O-CB 3.28Å; S117-L121 WeakPolarHBondContact O-CG 3.38Å; S117-L121 PolarHBondContact O-N 2.92Å; A118-L121 PolarHBondContact O-N 2.85Å; C119-L121 VanDerWaalsContact C-N 3.29Å; C119-L121 PolarHBondContact O-N 3.38Å; L121-T125 WeakPolarHBondContact O-CB 3.29Å; L121-T125 PolarHBondContact O-N 2.99Å; L121-T125 PolarHBondContact O-OG1 2.74Å; L121-L162 HydrophobicContact CD2-CD2 4.35Å; L121-A165 HydrophobicContact CD1-CB 4.21Å; L121-A165 HydrophobicContact CD2-CB 4.13Å; L121-E166 HydrophobicContact CB-CB 4.34Å; L121-S169 VanDerWaalsContact CD1-OG 3.32Å; L121-S169 WeakPolarHBondContact CD1-OG 3.48Å
122R93.3Very high91.6Very high132 Ų13246.2 Ų46.250%0.49822%0.224SC..Hα-helixtrans-64.4-51.4-176.5-177.5163.3-174.7-179.60.6112.3A118 C119 R126 E166A118-R122 WeakPolarHBondContact O-CB 3.25Å; A118-R122 PolarHBondContact O-N 3.33Å; C119-R122 PolarHBondContact O-N 2.91Å; R122-R126 VanDerWaalsContact O-CB 3.3Å; R122-R126 WeakPolarHBondContact O-CB 3.45Å; R122-R126 PolarHBondContact O-N 2.88Å; R122-E166 HydrophobicContact CB-CG 4.41Å; R122-E166 WeakPolarHBondContact CB-OE1 3.14Å; R122-E166 WeakPolarHBondContact CD-OE1 3.32Å; R122-E166 WeakPolarHBondContact CG-OE1 3.18Å; R122-E166 IonicContact NE-OE1 2.76Å
123F91.9Very high91.2Very high119 Ų11943 Ų4352%0.52221%0.212SC..Hα-helixtrans-71.6-39.7179.9-74.1-69.9000112Y42 C119 R126 S127Y42-F123 HydrophobicContact CE1-CB 4.04Å; Y42-F123 VanDerWaalsContact OH-CB 3.23Å; Y42-F123 WeakPolarHBondContact OH-CB 3.37Å; C119-F123 HydrophobicContact CB-CD2 4.43Å; C119-F123 WeakPolarHBondContact O-CB 3.41Å; C119-F123 VanDerWaalsContact O-CD2 3.28Å; C119-F123 WeakPolarHBondContact O-CD2 3.45Å; C119-F123 PolarHBondContact O-N 2.82Å; F123-R126 PolarHBondContact O-N 2.88Å; F123-S127 WeakPolarHBondContact O-CB 3.21Å; F123-S127 PolarHBondContact O-N 3.3Å
124G87.9Confident90.8Very high0 Ų045 Ų450%023%0.23CC..Hα-helixtrans-64.4-42.1178.300000112.7Y42 I120 L128Y42-G124 PolarHBondContact N-O 2.79Å; Y42-G124 VanDerWaalsContact N-O 3.12Å; I120-G124 VanDerWaalsContact O-CA 3.29Å; I120-G124 WeakPolarHBondContact O-CA 3.46Å; I120-G124 PolarHBondContact O-N 3.39Å; G124-L128 PolarHBondContact O-N 3.34Å; G124-L128 VanDerWaalsContact O-N 3.14Å
125T89Confident90.2Very high9 Ų947.4 Ų47.46%0.05524%0.242CC..Hα-helixtrans-68.2-42.4176-55.80000111L121 S127 L128 C129 L162L121-T125 WeakPolarHBondContact O-CB 3.29Å; L121-T125 PolarHBondContact O-N 2.99Å; L121-T125 PolarHBondContact O-OG1 2.74Å; T125-S127 PolarHBondContact O-N 3.18Å; T125-L128 PolarHBondContact O-N 3.1Å; T125-C129 VanDerWaalsContact O-CB 3.28Å; T125-C129 WeakPolarHBondContact O-CB 3.4Å; T125-C129 PolarHBondContact O-N 3.29Å; T125-L162 HydrophobicContact CG2-CB 4.15Å; T125-L162 HydrophobicContact CG2-CD1 4.31Å
126R90.3Very high89.4Confident168 Ų16851.3 Ų51.363%0.63426%0.264SS*.Hα-helixtrans-63.5-41.1177.1-171.2176.4-176.4-176.31112.3R122 F123 C129 N130R122-R126 VanDerWaalsContact O-CB 3.3Å; R122-R126 WeakPolarHBondContact O-CB 3.45Å; R122-R126 PolarHBondContact O-N 2.88Å; F123-R126 PolarHBondContact O-N 2.88Å; R126-C129 WeakPolarHBondContact O-CB 3.23Å; R126-C129 PolarHBondContact O-N 2.98Å; R126-N130 WeakPolarHBondContact O-CB 3.45Å; R126-N130 PolarHBondContact O-N 2.86Å
127S89.6Confident88.4Confident50 Ų5052.2 Ų52.235%0.3527%0.269SS..Hα-helixtrans-61.7-50.5177.2-173.10000111.6F123 T125 C129 N130 S131F123-S127 WeakPolarHBondContact O-CB 3.21Å; F123-S127 PolarHBondContact O-N 3.3Å; T125-S127 PolarHBondContact O-N 3.18Å; S127-C129 PolarHBondContact O-N 3.45Å; S127-N130 PolarHBondContact O-N 2.99Å; S127-S131 PolarHBondContact O-N 3.04Å
128L86.4Confident87.7Confident1 Ų153 Ų531%0.00527%0.274CS..Hα-helixtrans-57.2-42.9175.1178.768.2000110.9P40 G43 L54 G124 T125 S131 I132 F158 L162P40-L128 HydrophobicContact CB-CD2 4.14Å; G43-L128 VanDerWaalsContact O-CD1 3.3Å; G43-L128 WeakPolarHBondContact O-CD1 3.25Å; L54-L128 HydrophobicContact CD1-CD1 4.11Å; G124-L128 PolarHBondContact O-N 3.34Å; G124-L128 VanDerWaalsContact O-N 3.14Å; T125-L128 PolarHBondContact O-N 3.1Å; L128-S131 WeakPolarHBondContact O-CB 3.38Å; L128-S131 PolarHBondContact O-N 2.89Å; L128-I132 HydrophobicContact CD1-CD1 4.46Å; L128-I132 HydrophobicContact CG-CD1 4.15Å; L128-I132 WeakPolarHBondContact O-CG1 3.38Å; L128-I132 PolarHBondContact O-N 3.02Å; L128-I132 VanDerWaalsContact O-N 3.07Å; L128-F158 HydrophobicContact CD2-CD2 4.17Å; L128-F158 HydrophobicContact CD2-CE2 3.92Å; L128-L162 HydrophobicContact CD2-CD1 4.32Å
129C88.1Confident86.9Confident18 Ų1861 Ų6112%0.12232%0.315CS..Hα-helixtrans-64.1-46-179.2-159.60000113.3T125 R126 S127 S131 I132 I133 C141T125-C129 VanDerWaalsContact O-CB 3.28Å; T125-C129 WeakPolarHBondContact O-CB 3.4Å; T125-C129 PolarHBondContact O-N 3.29Å; R126-C129 WeakPolarHBondContact O-CB 3.23Å; R126-C129 PolarHBondContact O-N 2.98Å; S127-C129 PolarHBondContact O-N 3.45Å; C129-S131 VanDerWaalsContact C-N 3.26Å; C129-S131 PolarHBondContact O-N 3.39Å; C129-I132 PolarHBondContact O-N 3.27Å; C129-I132 VanDerWaalsContact O-N 3.09Å; C129-I133 WeakPolarHBondContact O-CG1 3.29Å; C129-I133 PolarHBondContact O-N 3.11Å; C129-C141 WeakPolarHBondContact CA-SG 3.41Å; C129-C141 HydrophobicContact CB-CB 4.25Å; C129-C141 WeakPolarHBondContact CB-SG 3.37Å; C129-C141 WeakPolarHBondContact SG-CB 3.39Å; C129-C141 CovalentContact SG-SG 2.02Å; C129-C141 PolarHBondContact SG-SG 3.4Å
130N89.3Confident86.3Confident92 Ų9261 Ų6149%0.49232%0.315SS..Hα-helixtrans-60.5-39.5176.3-70.9-12.7000111.1R126 S127 I132 I133 S134R126-N130 WeakPolarHBondContact O-CB 3.45Å; R126-N130 PolarHBondContact O-N 2.86Å; S127-N130 PolarHBondContact O-N 2.99Å; N130-I132 VanDerWaalsContact C-N 3.29Å; N130-I132 PolarHBondContact O-N 3.26Å; N130-I133 PolarHBondContact O-N 3.07Å; N130-S134 WeakPolarHBondContact O-CB 3.26Å; N130-S134 PolarHBondContact O-N 3.24Å; N130-S134 PolarHBondContact O-OG 2.83Å
131S87.1Confident85.8Confident17 Ų1760.2 Ų60.212%0.11931%0.312CS..Hα-helixtrans-63.2-32.9174.9175.80000113.1V44 A45 S127 L128 C129 S134V44-S131 WeakPolarHBondContact CA-OG 3.45Å; V44-S131 WeakPolarHBondContact CG1-OG 3.27Å; A45-S131 PolarHBondContact N-OG 3.04Å; A45-S131 PolarHBondContact O-OG 3.46Å; S127-S131 PolarHBondContact O-N 3.04Å; L128-S131 WeakPolarHBondContact O-CB 3.38Å; L128-S131 PolarHBondContact O-N 2.89Å; C129-S131 VanDerWaalsContact C-N 3.26Å; C129-S131 PolarHBondContact O-N 3.39Å; S131-S134 PolarHBondContact O-OG 3.35Å
132I86.4Confident85.5Confident1 Ų162.1 Ų62.11%0.00533%0.325CS..Hα-helixtrans-76.4-46.1177-65.6164.2000110.4A45 L52 L128 C129 N130 S134 L135 A144 W149 F158A45-I132 HydrophobicContact CB-CD1 4.47Å; A45-I132 HydrophobicContact CB-CG1 3.52Å; L52-I132 HydrophobicContact CD1-CG2 4.36Å; L128-I132 HydrophobicContact CD1-CD1 4.46Å; L128-I132 HydrophobicContact CG-CD1 4.15Å; L128-I132 WeakPolarHBondContact O-CG1 3.38Å; L128-I132 PolarHBondContact O-N 3.02Å; L128-I132 VanDerWaalsContact O-N 3.07Å; C129-I132 PolarHBondContact O-N 3.27Å; C129-I132 VanDerWaalsContact O-N 3.09Å; N130-I132 VanDerWaalsContact C-N 3.29Å; N130-I132 PolarHBondContact O-N 3.26Å; I132-S134 PolarHBondContact O-N 3.21Å; I132-L135 VanDerWaalsContact O-CB 3.31Å; I132-L135 WeakPolarHBondContact O-CB 3.5Å; I132-L135 PolarHBondContact O-N 3.32Å; I132-A144 HydrophobicContact CD1-CB 4.34Å; I132-A144 HydrophobicContact CG2-CB 3.56Å; I132-W149 HydrophobicContact CD1-CH2 4.08Å; I132-W149 HydrophobicContact CD1-CZ2 4.1Å; I132-F158 HydrophobicContact CD1-CE2 4.29Å; I132-F158 HydrophobicContact CD1-CZ 3.84Å
133I87.6Confident85Confident64 Ų6459.8 Ų59.833%0.32832%0.32SS..Hα-helixtrans-62.2-34.8179.5-66.3168000110.5C129 N130 L135 N136C129-I133 WeakPolarHBondContact O-CG1 3.29Å; C129-I133 PolarHBondContact O-N 3.11Å; N130-I133 PolarHBondContact O-N 3.07Å; I133-L135 PolarHBondContact O-N 3.24Å; I133-L135 VanDerWaalsContact O-N 3.16Å; I133-N136 PolarHBondContact O-N 2.91Å
134S86.9Confident84.4Confident91 Ų9154.1 Ų54.164%0.63630%0.295SS*.THydrogen-bonded Turntrans-64.6-16.8176.666.90000114.1N130 S131 I132 N136N130-S134 WeakPolarHBondContact O-CB 3.26Å; N130-S134 PolarHBondContact O-N 3.24Å; N130-S134 PolarHBondContact O-OG 2.83Å; S131-S134 PolarHBondContact O-OG 3.35Å; I132-S134 PolarHBondContact O-N 3.21Å; S134-N136 PolarHBondContact O-N 2.9Å
135L83.5Confident84.1Confident52 Ų5256.6 Ų56.627%0.27231%0.307SS..THydrogen-bonded Turntrans-77.3-1.2172.5-61.5165.5000112.5A45 L47 L52 I132 I133 T137A45-L135 HydrophobicContact CB-CD1 4.22Å; L47-L135 HydrophobicContact CB-CD2 4.37Å; L52-L135 HydrophobicContact CD2-CD1 3.72Å; I132-L135 VanDerWaalsContact O-CB 3.31Å; I132-L135 WeakPolarHBondContact O-CB 3.5Å; I132-L135 PolarHBondContact O-N 3.32Å; I133-L135 PolarHBondContact O-N 3.24Å; I133-L135 VanDerWaalsContact O-N 3.16Å; L135-T137 PolarHBondContact O-N 2.94Å; L135-T137 PolarHBondContact O-OG1 3.42Å; L135-T137 VanDerWaalsContact O-OG1 3.08Å
136N79Confident83.8Confident154 Ų15463 Ų6382%0.82433%0.334SS*.THydrogen-bonded Turntrans53.522.5177.5-149.921000114.5I133 S134I133-N136 PolarHBondContact O-N 2.91Å; S134-N136 PolarHBondContact O-N 2.9Å
137T74.9Confident83.4Confident64 Ų6456.4 Ų56.439%0.39331%0.311SS..SBendtrans-93.4-26.1-179.9-49.20000111.2L47 L135 I147L47-T137 HydrophobicContact CD1-CG2 4.3Å; L135-T137 PolarHBondContact O-N 2.94Å; L135-T137 PolarHBondContact O-OG1 3.42Å; L135-T137 VanDerWaalsContact O-OG1 3.08Å; T137-I147 HydrophobicContact CG2-CD1 3.73Å
138T78.8Confident83Confident18 Ų1857.9 Ų57.911%0.1132%0.319CS..  trans-139.5150.4174.165.10000111.5S140 E143 A144 I147T138-S140 WeakPolarHBondContact CB-O 3.13Å; T138-S140 PolarHBondContact OG1-O 3.34Å; T138-E143 HydrophobicContact CG2-CB 4.12Å; T138-A144 HydrophobicContact CG2-CB 4.44Å; T138-I147 HydrophobicContact CG2-CD1 3.26Å; T138-I147 HydrophobicContact CG2-CG1 4.26Å
139I76.4Confident82.8Confident168 Ų16858.4 Ų58.486%0.86232%0.321SS*.SBendtrans-82.8-22.6175-59.7163.3000110.8
140S80.9Confident82.3Confident41 Ų4163.4 Ų63.429%0.28734%0.338SS..SBendtrans-137.7154.4179.872.30000113T138 S142 E143 A144T138-S140 WeakPolarHBondContact CB-O 3.13Å; T138-S140 PolarHBondContact OG1-O 3.34Å; S140-S142 VanDerWaalsContact C-N 3.28Å; S140-S142 PolarHBondContact O-N 3.33Å; S140-S142 PolarHBondContact OG-OG 2.87Å; S140-E143 PolarHBondContact O-N 3.48Å; S140-E143 WeakPolarHBondContact OG-CG 3.33Å; S140-A144 PolarHBondContact O-N 3.47Å
141C83.9Confident81.6Confident6 Ų662.6 Ų62.64%0.04134%0.338CS..Hα-helixtrans-61.9-34.5172.5-108.50000113.9C129 E143 A144 Y159C129-C141 WeakPolarHBondContact CA-SG 3.41Å; C129-C141 HydrophobicContact CB-CB 4.25Å; C129-C141 WeakPolarHBondContact CB-SG 3.37Å; C129-C141 WeakPolarHBondContact SG-CB 3.39Å; C129-C141 CovalentContact SG-SG 2.02Å; C129-C141 PolarHBondContact SG-SG 3.4Å; C141-E143 PolarHBondContact O-N 2.85Å; C141-A144 WeakPolarHBondContact O-CB 3.22Å; C141-A144 PolarHBondContact O-N 3.33Å; C141-A144 VanDerWaalsContact O-N 3.08Å; C141-Y159 HydrophobicContact CB-CD2 3.51Å; C141-Y159 HydrophobicContact CB-CE2 3.55Å; C141-Y159 HydrophobicContact CB-CG 4.14Å
142S83.9Confident80.6Confident40 Ų4067.7 Ų67.728%0.2837%0.37SS..Hα-helixtrans-65-28.6-177.762.80000111.4S140 Q145S140-S142 VanDerWaalsContact C-N 3.28Å; S140-S142 PolarHBondContact O-N 3.33Å; S140-S142 PolarHBondContact OG-OG 2.87Å; S142-Q145 WeakPolarHBondContact O-CG 3.33Å; S142-Q145 PolarHBondContact O-NE2 2.95Å
143E83.1Confident79.6Confident82 Ų8270.3 Ų70.338%0.38340%0.397SS..Hα-helixtrans-79.8-27.7174.2-65-54.7120.500111.9T138 S140 C141 Q145 K146T138-E143 HydrophobicContact CG2-CB 4.12Å; S140-E143 PolarHBondContact O-N 3.48Å; S140-E143 WeakPolarHBondContact OG-CG 3.33Å; C141-E143 PolarHBondContact O-N 2.85Å; E143-Q145 PolarHBondContact O-N 3.43Å; E143-K146 WeakPolarHBondContact O-CB 3.47Å; E143-K146 PolarHBondContact O-N 2.89Å; E143-K146 IonicContact OE1-NZ 3.96Å; E143-K146 PolarHBondContact OE1-NZ 3.37Å; E143-K146 WeakPolarHBondContact OE2-CD 3.31Å; E143-K146 WeakPolarHBondContact OE2-CE 3.45Å; E143-K146 IonicContact OE2-NZ 2.78Å; E143-K146 PolarHBondContact OE2-NZ 2.97Å
144A79.9Confident78.6Confident0 Ų068.1 Ų68.10%039%0.387CS..Hα-helixtrans-64.5-22.1178.500000113.9L52 I132 T138 S140 C141 K146 I147 W149 F158L52-A144 HydrophobicContact CD1-CB 4.28Å; I132-A144 HydrophobicContact CD1-CB 4.34Å; I132-A144 HydrophobicContact CG2-CB 3.56Å; T138-A144 HydrophobicContact CG2-CB 4.44Å; S140-A144 PolarHBondContact O-N 3.47Å; C141-A144 WeakPolarHBondContact O-CB 3.22Å; C141-A144 PolarHBondContact O-N 3.33Å; C141-A144 VanDerWaalsContact O-N 3.08Å; A144-K146 PolarHBondContact O-N 3.27Å; A144-I147 PolarHBondContact O-N 3.49Å; A144-W149 PolarHBondContact O-NE1 3.45Å; A144-W149 VanDerWaalsContact O-NE1 3.13Å; A144-F158 HydrophobicContact CB-CZ 4.44Å
145Q81.9Confident77.9Confident52 Ų5263.8 Ų63.824%0.24336%0.357CS..THydrogen-bonded Turntrans-73.1-15.5173.683.4-164.4-39.900113.1S142 E143 F158S142-Q145 WeakPolarHBondContact O-CG 3.33Å; S142-Q145 PolarHBondContact O-NE2 2.95Å; E143-Q145 PolarHBondContact O-N 3.43Å; Q145-F158 HydrophobicContact CB-CD1 3.98Å; Q145-F158 HydrophobicContact CB-CE1 3.85Å
146K82.4Confident77.3Confident143 Ų14367 Ų6762%0.62237%0.373SS*.THydrogen-bonded Turntrans-88.9-15.5177.1-58.1178.1-171.9163.30112.3E143 A144E143-K146 WeakPolarHBondContact O-CB 3.47Å; E143-K146 PolarHBondContact O-N 2.89Å; E143-K146 IonicContact OE1-NZ 3.96Å; E143-K146 PolarHBondContact OE1-NZ 3.37Å; E143-K146 WeakPolarHBondContact OE2-CD 3.31Å; E143-K146 WeakPolarHBondContact OE2-CE 3.45Å; E143-K146 IonicContact OE2-NZ 2.78Å; E143-K146 PolarHBondContact OE2-NZ 2.97Å; A144-K146 PolarHBondContact O-N 3.27Å
147I81.3Confident77.5Confident30 Ų3065.4 Ų65.415%0.15436%0.361CS..SBendtrans-76.8139.1176.9-62.1179.8000108.8L52 T137 T138 A144 W149L52-I147 HydrophobicContact CD1-CB 4.02Å; L52-I147 HydrophobicContact CD1-CD1 4.23Å; L52-I147 HydrophobicContact CD1-CG2 3.99Å; L52-I147 HydrophobicContact CG-CG2 3.94Å; T137-I147 HydrophobicContact CG2-CD1 3.73Å; T138-I147 HydrophobicContact CG2-CD1 3.26Å; T138-I147 HydrophobicContact CG2-CG1 4.26Å; A144-I147 PolarHBondContact O-N 3.49Å; I147-W149 PolarHBondContact O-N 3.24Å
148P80.8Confident77.9Confident82 Ų8262.5 Ų62.553%0.53234%0.343SS..PPolyproline II helixtrans-61.2129.7175.323.8-33.6000111.5S51 L52S51-P148 CarbonylContact C-O 3.53Å; S51-P148 WeakPolarHBondContact CA-O 3.5Å; S51-P148 WeakPolarHBondContact CB-O 3.4Å; L52-P148 PolarHBondContact N-O 3.35Å
149W83.1Confident78.2Confident11 Ų1164.9 Ų64.94%0.04235%0.35CS..EExtended strand (participates in β ladder)trans-97.9151.2173.8-73.473.6000111.4F35 A45 L52 I132 A144 I147 P151 P152 T154 A155 F158F35-W149 AromaticContact CE1-CE3 3.97Å; F35-W149 HydrophobicContact CE1-CE3 3.97Å; F35-W149 AromaticContact CE1-CZ3 3.88Å; F35-W149 HydrophobicContact CE1-CZ3 3.88Å; F35-W149 HydrophobicContact CZ-CZ3 4.3Å; A45-W149 HydrophobicContact CB-CH2 4.37Å; L52-W149 HydrophobicContact CB-CD2 3.72Å; L52-W149 HydrophobicContact CB-CE3 3.89Å; L52-W149 HydrophobicContact CB-CG 4.22Å; L52-W149 HydrophobicContact CB-CH2 4.26Å; L52-W149 HydrophobicContact CB-CZ2 4.1Å; L52-W149 HydrophobicContact CB-CZ3 4.15Å; L52-W149 HydrophobicContact CD1-CH2 4.44Å; L52-W149 HydrophobicContact CD1-CZ2 3.75Å; L52-W149 CarbonylContact O-C 3.47Å; L52-W149 VanDerWaalsContact O-CA 3.25Å; L52-W149 WeakPolarHBondContact O-CA 3.39Å; I132-W149 HydrophobicContact CD1-CH2 4.08Å; I132-W149 HydrophobicContact CD1-CZ2 4.1Å; A144-W149 PolarHBondContact O-NE1 3.45Å; A144-W149 VanDerWaalsContact O-NE1 3.13Å; I147-W149 PolarHBondContact O-N 3.24Å; W149-P151 CarbonylContact C-O 3.54Å; W149-P151 CarbonylContact O-C 3.21Å; W149-P152 WeakPolarHBondContact O-CA 3.16Å; W149-T154 WeakPolarHBondContact CB-O 3.32Å; W149-T154 WeakPolarHBondContact CB-OG1 3.23Å; W149-A155 HydrophobicContact CB-CB 4.09Å; W149-A155 HydrophobicContact CD2-CB 3.4Å; W149-A155 VanDerWaalsContact CD2-CB 3.4Å; W149-A155 HydrophobicContact CE3-CB 3.95Å; W149-A155 HydrophobicContact CG-CB 3.45Å; W149-A155 VanDerWaalsContact CG-CB 3.45Å; W149-A155 HydrophobicContact CZ2-CB 4.3Å; W149-F158 HydrophobicContact CZ2-CD1 4.23Å; W149-F158 AromaticContact CZ2-CE1 3.69Å; W149-F158 HydrophobicContact CZ2-CE1 3.69Å; W149-F158 HydrophobicContact CZ2-CZ 4.03Å
150R78.2Confident78.8Confident123 Ų12359 Ų5946%0.46432%0.324SS..EExtended strand (participates in β ladder)trans-106.7129.6171.9-84.6-175.6-176.9168.97.3110.5N48 S51 L52 A53N48-R150 VanDerWaalsContact CG-NH1 3.27Å; N48-R150 PolarHBondContact OD1-NH1 3.03Å; S51-R150 WeakPolarHBondContact OG-CD 3.3Å; S51-R150 WeakPolarHBondContact OG-CG 3.22Å; S51-R150 PolarHBondContact OG-NE 3.35Å; L52-R150 PolarHBondContact O-N 2.7Å; A53-R150 HydrophobicContact CB-CB 4.48Å
151P74.5Confident79.3Confident76 Ų7658.1 Ų58.149%0.49432%0.316SS..SBendcis-66.5153.8-4.218.8-23.5000113.9W149 G153 T154W149-P151 CarbonylContact C-O 3.54Å; W149-P151 CarbonylContact O-C 3.21Å; P151-G153 PolarHBondContact O-N 3.46Å; P151-T154 HydrophobicContact CB-CG2 4.4Å; P151-T154 HydrophobicContact CG-CG2 3.67Å; P151-T154 VanDerWaalsContact O-CB 3.3Å; P151-T154 WeakPolarHBondContact O-CB 3.33Å; P151-T154 WeakPolarHBondContact O-CG2 3.38Å; P151-T154 PolarHBondContact O-N 2.87Å; P151-T154 VanDerWaalsContact O-N 3.16Å; P151-T154 PolarHBondContact O-OG1 3.25Å
152P65.3Low79.5Confident124 Ų12457.8 Ų57.881%0.80531%0.314SS*.THydrogen-bonded Turntrans-59.1137.6-178.123.3-32.4000111.6W149W149-P152 WeakPolarHBondContact O-CA 3.16Å
153G64.8Low79.8Confident55 Ų5559.7 Ų59.757%0.56732%0.318SS*.THydrogen-bonded Turntrans89.8-1.4-17300000114.7P151P151-G153 PolarHBondContact O-N 3.46Å
154T67.9Low80.1Confident18 Ų1859.4 Ų59.411%0.1132%0.319CS..  trans-85.7158.2172.761.50000112.2S34 W149 P151 L156S34-T154 VanDerWaalsContact O-CA 3.31Å; S34-T154 WeakPolarHBondContact O-CA 3.5Å; S34-T154 WeakPolarHBondContact O-CB 3.35Å; S34-T154 WeakPolarHBondContact O-CG2 3.3Å; W149-T154 WeakPolarHBondContact CB-O 3.32Å; W149-T154 WeakPolarHBondContact CB-OG1 3.23Å; P151-T154 HydrophobicContact CB-CG2 4.4Å; P151-T154 HydrophobicContact CG-CG2 3.67Å; P151-T154 VanDerWaalsContact O-CB 3.3Å; P151-T154 WeakPolarHBondContact O-CB 3.33Å; P151-T154 WeakPolarHBondContact O-CG2 3.38Å; P151-T154 PolarHBondContact O-N 2.87Å; P151-T154 VanDerWaalsContact O-N 3.16Å; P151-T154 PolarHBondContact O-OG1 3.25Å; T154-L156 PolarHBondContact O-N 2.92Å; T154-L156 VanDerWaalsContact O-N 3.12Å
155A70.4Confident80.7Confident1 Ų159.4 Ų59.41%0.00832%0.319CS..SBendtrans57.81917800000117S34 F35 W149 Q157 F158S34-A155 PolarHBondContact OG-N 3.38Å; F35-A155 HydrophobicContact CE1-CB 3.76Å; F35-A155 HydrophobicContact CE2-CB 4.06Å; F35-A155 HydrophobicContact CZ-CB 3.35Å; W149-A155 HydrophobicContact CB-CB 4.09Å; W149-A155 HydrophobicContact CD2-CB 3.4Å; W149-A155 VanDerWaalsContact CD2-CB 3.4Å; W149-A155 HydrophobicContact CE3-CB 3.95Å; W149-A155 HydrophobicContact CG-CB 3.45Å; W149-A155 VanDerWaalsContact CG-CB 3.45Å; W149-A155 HydrophobicContact CZ2-CB 4.3Å; A155-Q157 PolarHBondContact O-N 3.2Å; A155-Q157 VanDerWaalsContact O-N 3.11Å; A155-F158 HydrophobicContact CB-CB 4.14Å; A155-F158 HydrophobicContact CB-CD1 3.9Å; A155-F158 HydrophobicContact CB-CG 4.25Å; A155-F158 WeakPolarHBondContact O-CD1 3.33Å; A155-F158 PolarHBondContact O-N 3.26Å; A155-F158 VanDerWaalsContact O-N 3.13Å
156L72.8Confident81.2Confident118 Ų11858.3 Ų58.362%0.61831%0.314SS*.THydrogen-bonded Turntrans-58.2120.5173.5-84.8157.7000110.1T154 F158T154-L156 PolarHBondContact O-N 2.92Å; T154-L156 VanDerWaalsContact O-N 3.12Å; L156-F158 PolarHBondContact O-N 2.91Å; L156-F158 VanDerWaalsContact O-N 3.16Å
157Q81.8Confident81.7Confident122 Ų12254.6 Ų54.657%0.5730%0.304SS*.THydrogen-bonded Turntrans57.224.9-178.8-56.8176.8-30.900114.4A155 Y159 S160 N161A155-Q157 PolarHBondContact O-N 3.2Å; A155-Q157 VanDerWaalsContact O-N 3.11Å; Q157-Y159 PolarHBondContact O-N 3.23Å; Q157-S160 PolarHBondContact O-N 3.25Å; Q157-N161 PolarHBondContact O-N 3.47Å; Q157-N161 PolarHBondContact O-ND2 2.93Å
158F84.3Confident82.3Confident2 Ų253.8 Ų53.81%0.00930%0.301CS..Hα-helixtrans-54.8-42.3-177.281.9-87.4000112.1T31 F35 L128 I132 A144 Q145 W149 A155 L156 N161 L162T31-F158 HydrophobicContact CG2-CB 4.33Å; F35-F158 HydrophobicContact CE2-CB 3.9Å; F35-F158 HydrophobicContact CZ-CB 4.2Å; F35-F158 HydrophobicContact CZ-CG 4.4Å; L128-F158 HydrophobicContact CD2-CD2 4.17Å; L128-F158 HydrophobicContact CD2-CE2 3.92Å; I132-F158 HydrophobicContact CD1-CE2 4.29Å; I132-F158 HydrophobicContact CD1-CZ 3.84Å; A144-F158 HydrophobicContact CB-CZ 4.44Å; Q145-F158 HydrophobicContact CB-CD1 3.98Å; Q145-F158 HydrophobicContact CB-CE1 3.85Å; W149-F158 HydrophobicContact CZ2-CD1 4.23Å; W149-F158 AromaticContact CZ2-CE1 3.69Å; W149-F158 HydrophobicContact CZ2-CE1 3.69Å; W149-F158 HydrophobicContact CZ2-CZ 4.03Å; A155-F158 HydrophobicContact CB-CB 4.14Å; A155-F158 HydrophobicContact CB-CD1 3.9Å; A155-F158 HydrophobicContact CB-CG 4.25Å; A155-F158 WeakPolarHBondContact O-CD1 3.33Å; A155-F158 PolarHBondContact O-N 3.26Å; A155-F158 VanDerWaalsContact O-N 3.13Å; L156-F158 PolarHBondContact O-N 2.91Å; L156-F158 VanDerWaalsContact O-N 3.16Å; F158-N161 PolarHBondContact O-N 3.26Å; F158-L162 HydrophobicContact CD2-CD1 4.09Å; F158-L162 WeakPolarHBondContact O-CB 3.48Å; F158-L162 VanDerWaalsContact O-CG 3.3Å; F158-L162 WeakPolarHBondContact O-CG 3.26Å; F158-L162 PolarHBondContact O-N 3.46Å
159Y85.3Confident83Confident69 Ų6950 Ų5027%0.27128%0.276SS..Hα-helixtrans-67.8-45.6-179179.2-103.6000111.5C141 Q157 N161 L162 H163C141-Y159 HydrophobicContact CB-CD2 3.51Å; C141-Y159 HydrophobicContact CB-CE2 3.55Å; C141-Y159 HydrophobicContact CB-CG 4.14Å; Q157-Y159 PolarHBondContact O-N 3.23Å; Y159-N161 VanDerWaalsContact C-N 3.34Å; Y159-N161 PolarHBondContact O-N 3.43Å; Y159-L162 PolarHBondContact O-N 3.47Å; Y159-H163 WeakPolarHBondContact O-CB 3.3Å; Y159-H163 PolarHBondContact O-N 3.4Å
160S89Confident83.6Confident44 Ų4453.3 Ų53.331%0.30829%0.289SS..Hα-helixtrans-59.3-45.2176-177.80000111.5Q157 H163 N164Q157-S160 PolarHBondContact O-N 3.25Å; S160-H163 PolarHBondContact O-N 3.25Å; S160-N164 VanDerWaalsContact O-CB 3.26Å; S160-N164 WeakPolarHBondContact O-CB 3.27Å; S160-N164 PolarHBondContact O-N 2.99Å; S160-N164 PolarHBondContact O-ND2 2.83Å
161N90.1Very high84.4Confident22 Ų2250.7 Ų50.712%0.11829%0.286CS..Hα-helixtrans-64.4-45.9178.1-68.8-33.5000112.1A27 T31 Q157 F158 Y159 N164 A165A27-N161 HydrophobicContact CB-CB 4.28Å; A27-N161 WeakPolarHBondContact CB-O 3.37Å; T31-N161 VanDerWaalsContact OG1-CB 3.25Å; T31-N161 WeakPolarHBondContact OG1-CB 3.33Å; Q157-N161 PolarHBondContact O-N 3.47Å; Q157-N161 PolarHBondContact O-ND2 2.93Å; F158-N161 PolarHBondContact O-N 3.26Å; Y159-N161 VanDerWaalsContact C-N 3.34Å; Y159-N161 PolarHBondContact O-N 3.43Å; N161-N164 PolarHBondContact O-N 2.94Å; N161-A165 WeakPolarHBondContact O-CB 3.38Å; N161-A165 PolarHBondContact O-N 3.15Å
162L88Confident85.4Confident0 Ų047.2 Ų47.20%026%0.263CS..Hα-helixtrans-64.6-40.2177.2-73.6174.6000112.2L28 T31 L41 L121 T125 L128 F158 Y159 A165 E166L28-L162 HydrophobicContact CD2-CD2 3.97Å; T31-L162 HydrophobicContact CG2-CD2 4.37Å; T31-L162 HydrophobicContact CG2-CG 4.25Å; L41-L162 HydrophobicContact CD2-CD2 4.02Å; L121-L162 HydrophobicContact CD2-CD2 4.35Å; T125-L162 HydrophobicContact CG2-CB 4.15Å; T125-L162 HydrophobicContact CG2-CD1 4.31Å; L128-L162 HydrophobicContact CD2-CD1 4.32Å; F158-L162 HydrophobicContact CD2-CD1 4.09Å; F158-L162 WeakPolarHBondContact O-CB 3.48Å; F158-L162 VanDerWaalsContact O-CG 3.3Å; F158-L162 WeakPolarHBondContact O-CG 3.26Å; F158-L162 PolarHBondContact O-N 3.46Å; Y159-L162 PolarHBondContact O-N 3.47Å; L162-A165 PolarHBondContact O-N 3.14Å; L162-E166 WeakPolarHBondContact O-CB 3.2Å; L162-E166 PolarHBondContact O-N 3.12Å
163H90Very high86.8Confident80 Ų8042.3 Ų42.337%0.3723%0.23SC..Hα-helixtrans-67.6-41177.7-174.962.3000112.2Y159 S160 E166 T167Y159-H163 WeakPolarHBondContact O-CB 3.3Å; Y159-H163 PolarHBondContact O-N 3.4Å; S160-H163 PolarHBondContact O-N 3.25Å; H163-E166 PolarHBondContact O-N 3.44Å; H163-T167 WeakPolarHBondContact O-CB 3.41Å; H163-T167 PolarHBondContact O-N 3.46Å; H163-T167 PolarHBondContact O-OG1 2.82Å
164N91.1Very high88.4Confident75 Ų7544 Ų4440%0.40123%0.23SC..Hα-helixtrans-64.2-42173-70.6-18.6000111S160 N161 S168S160-N164 VanDerWaalsContact O-CB 3.26Å; S160-N164 WeakPolarHBondContact O-CB 3.27Å; S160-N164 PolarHBondContact O-N 2.99Å; S160-N164 PolarHBondContact O-ND2 2.83Å; N161-N164 PolarHBondContact O-N 2.94Å; N164-S168 WeakPolarHBondContact O-CB 3.46Å; N164-S168 PolarHBondContact O-N 3.45Å
165A91.3Very high89.7Confident0 Ų044.3 Ų44.30%023%0.23CC..Hα-helixtrans-61.7-47.7175.500000111.4A27 L28 L121 N161 L162 S168 S169A27-A165 HydrophobicContact CB-CB 4.01Å; L28-A165 HydrophobicContact CG-CB 4.31Å; L121-A165 HydrophobicContact CD1-CB 4.21Å; L121-A165 HydrophobicContact CD2-CB 4.13Å; N161-A165 WeakPolarHBondContact O-CB 3.38Å; N161-A165 PolarHBondContact O-N 3.15Å; L162-A165 PolarHBondContact O-N 3.14Å; A165-S168 PolarHBondContact O-N 2.86Å; A165-S169 WeakPolarHBondContact O-CB 3.49Å; A165-S169 PolarHBondContact O-N 3.06Å; A165-S169 PolarHBondContact O-OG 3Å; A165-S169 VanDerWaalsContact O-OG 3.07Å
166E93.3Very high90.9Very high30 Ų3044.4 Ų44.414%0.1423%0.23CC..Hα-helixtrans-57.7-53.5176.7179.9-177177.400111.2L121 R122 L162 H163 S168 S169 W170L121-E166 HydrophobicContact CB-CB 4.34Å; R122-E166 HydrophobicContact CB-CG 4.41Å; R122-E166 WeakPolarHBondContact CB-OE1 3.14Å; R122-E166 WeakPolarHBondContact CD-OE1 3.32Å; R122-E166 WeakPolarHBondContact CG-OE1 3.18Å; R122-E166 IonicContact NE-OE1 2.76Å; L162-E166 WeakPolarHBondContact O-CB 3.2Å; L162-E166 PolarHBondContact O-N 3.12Å; H163-E166 PolarHBondContact O-N 3.44Å; E166-S168 VanDerWaalsContact C-N 3.31Å; E166-S168 PolarHBondContact O-N 3.27Å; E166-S169 PolarHBondContact O-N 2.95Å; E166-W170 PolarHBondContact O-N 3.37Å
167T93.4Very high92Very high65 Ų6541.3 Ų41.340%0.39922%0.218SC..Hα-helixtrans-59.5-45.1-179.5-56.30000110.7H163 S169 W170 V171H163-T167 WeakPolarHBondContact O-CB 3.41Å; H163-T167 PolarHBondContact O-N 3.46Å; H163-T167 PolarHBondContact O-OG1 2.82Å; T167-S169 VanDerWaalsContact C-N 3.34Å; T167-S169 PolarHBondContact O-N 3.29Å; T167-W170 PolarHBondContact O-N 2.95Å; T167-V171 WeakPolarHBondContact O-CG2 3.5Å; T167-V171 PolarHBondContact O-N 2.79Å
168S93.8Very high92.6Very high13 Ų1338.5 Ų38.59%0.09121%0.209CC..Hα-helixtrans-62.8-39178-164.40000112.2C20 N164 A165 E166 V171 N172C20-S168 VanDerWaalsContact C-OG 3.25Å; C20-S168 WeakPolarHBondContact CA-OG 3.13Å; C20-S168 WeakPolarHBondContact CB-OG 3.39Å; C20-S168 PolarHBondContact O-OG 3.04Å; N164-S168 WeakPolarHBondContact O-CB 3.46Å; N164-S168 PolarHBondContact O-N 3.45Å; A165-S168 PolarHBondContact O-N 2.86Å; E166-S168 VanDerWaalsContact C-N 3.31Å; E166-S168 PolarHBondContact O-N 3.27Å; S168-V171 PolarHBondContact O-N 3.49Å; S168-N172 VanDerWaalsContact O-CB 3.28Å; S168-N172 WeakPolarHBondContact O-CB 3.24Å; S168-N172 PolarHBondContact O-N 2.81Å
169S94Very high93.1Very high1 Ų138.4 Ų38.41%0.00721%0.208CC..Hα-helixtrans-65.6-38.5175.2-66.30000112.6V114 L121 A165 E166 T167 N172 L173V114-S169 WeakPolarHBondContact CG1-O 3.34Å; L121-S169 VanDerWaalsContact CD1-OG 3.32Å; L121-S169 WeakPolarHBondContact CD1-OG 3.48Å; A165-S169 WeakPolarHBondContact O-CB 3.49Å; A165-S169 PolarHBondContact O-N 3.06Å; A165-S169 PolarHBondContact O-OG 3Å; A165-S169 VanDerWaalsContact O-OG 3.07Å; E166-S169 PolarHBondContact O-N 2.95Å; T167-S169 VanDerWaalsContact C-N 3.34Å; T167-S169 PolarHBondContact O-N 3.29Å; S169-N172 PolarHBondContact O-N 2.78Å; S169-L173 PolarHBondContact O-N 2.8Å
170W95.3Very high93.4Very high82 Ų8237.4 Ų37.431%0.31121%0.208SC..Hα-helixtrans-66-42.8174.2-74.7112.7000112.3A118 E166 T167 N172 L173 V174A118-W170 HydrophobicContact CB-CD2 4.28Å; A118-W170 HydrophobicContact CB-CZ2 4.28Å; E166-W170 PolarHBondContact O-N 3.37Å; T167-W170 PolarHBondContact O-N 2.95Å; W170-N172 VanDerWaalsContact C-N 3.32Å; W170-N172 PolarHBondContact O-N 3.33Å; W170-L173 HydrophobicContact CE3-CD2 3.9Å; W170-L173 HydrophobicContact CZ3-CD2 3.8Å; W170-L173 WeakPolarHBondContact O-CB 3.3Å; W170-L173 PolarHBondContact O-N 2.68Å; W170-V174 PolarHBondContact O-N 3.32Å; W170-V174 VanDerWaalsContact O-N 3.15Å
171V96Very high93.6Very high67 Ų6739.7 Ų39.741%0.40622%0.219SC..Hα-helixtrans-61.9-44.1174.3175.70000110.2T167 S168 L173 V174 L175T167-V171 WeakPolarHBondContact O-CG2 3.5Å; T167-V171 PolarHBondContact O-N 2.79Å; S168-V171 PolarHBondContact O-N 3.49Å; V171-L173 VanDerWaalsContact C-N 3.28Å; V171-L173 PolarHBondContact O-N 2.85Å; V171-V174 PolarHBondContact O-N 3.43Å; V171-L175 HydrophobicContact CG1-CD1 4.12Å; V171-L175 HydrophobicContact CG1-CG 4.44Å; V171-L175 WeakPolarHBondContact O-CG 3.43Å; V171-L175 PolarHBondContact O-N 3.31Å
172N95.3Very high93.6Very high3 Ų340.1 Ų40.12%0.01622%0.222CC..Hα-helixtrans-59-40.6176.7-161.830.6000111.7A17 C20 V114 S168 S169 W170 V174 L175 W176A17-N172 WeakPolarHBondContact CA-OD1 3.29Å; A17-N172 WeakPolarHBondContact CB-OD1 3.34Å; A17-N172 PolarHBondContact O-OD1 2.96Å; C20-N172 HydrophobicContact CB-CB 3.83Å; V114-N172 HydrophobicContact CG1-CB 4.14Å; S168-N172 VanDerWaalsContact O-CB 3.28Å; S168-N172 WeakPolarHBondContact O-CB 3.24Å; S168-N172 PolarHBondContact O-N 2.81Å; S169-N172 PolarHBondContact O-N 2.78Å; W170-N172 VanDerWaalsContact C-N 3.32Å; W170-N172 PolarHBondContact O-N 3.33Å; N172-V174 PolarHBondContact O-N 2.9Å; N172-L175 PolarHBondContact O-N 2.87Å; N172-W176 PolarHBondContact O-N 3.41Å; N172-W176 PolarHBondContact OD1-NE1 2.88Å
173L95.6Very high93.7Very high21 Ų2140.2 Ų40.211%0.1122%0.222CC..Hα-helixtrans-59.4-47.2176.4-176.266.5000111.5I111 V114 L115 S169 W170 V171 L175 W176 C177I111-L173 HydrophobicContact CG2-CD1 3.89Å; V114-L173 HydrophobicContact CB-CD1 4.45Å; V114-L173 HydrophobicContact CG1-CB 3.88Å; V114-L173 HydrophobicContact CG1-CD1 4.29Å; L115-L173 HydrophobicContact CB-CD1 4.03Å; L115-L173 HydrophobicContact CD1-CD2 3.84Å; S169-L173 PolarHBondContact O-N 2.8Å; W170-L173 HydrophobicContact CE3-CD2 3.9Å; W170-L173 HydrophobicContact CZ3-CD2 3.8Å; W170-L173 WeakPolarHBondContact O-CB 3.3Å; W170-L173 PolarHBondContact O-N 2.68Å; V171-L173 VanDerWaalsContact C-N 3.28Å; V171-L173 PolarHBondContact O-N 2.85Å; L173-L175 VanDerWaalsContact C-N 3.32Å; L173-L175 PolarHBondContact O-N 3.3Å; L173-W176 PolarHBondContact O-N 3.1Å; L173-C177 PolarHBondContact O-N 3.41Å; L173-C177 PolarHBondContact O-SG 2.72Å; L173-C177 VanDerWaalsContact O-SG 3.32Å
174V96.7Very high93.6Very high92 Ų9239.1 Ų39.156%0.55822%0.221SC*.Hα-helixtrans-60.6-44.3177.9175.30000110.5W170 V171 N172 W176 C177 V178W170-V174 PolarHBondContact O-N 3.32Å; W170-V174 VanDerWaalsContact O-N 3.15Å; V171-V174 PolarHBondContact O-N 3.43Å; N172-V174 PolarHBondContact O-N 2.9Å; V174-W176 PolarHBondContact O-N 3.35Å; V174-C177 WeakPolarHBondContact O-CB 3.28Å; V174-C177 PolarHBondContact O-N 3.5Å; V174-V178 WeakPolarHBondContact O-CG2 3.44Å; V174-V178 PolarHBondContact O-N 2.82Å
175L95.5Very high93.4Very high24 Ų2439.1 Ų39.113%0.12622%0.224CC..Hα-helixtrans-59.1-46.3177.5-68.2170.6000111.7L13 A16 A17 V171 N172 L173 C177 V178 V179L13-L175 HydrophobicContact CD2-CD2 3.68Å; A16-L175 HydrophobicContact CB-CD1 3.65Å; A16-L175 HydrophobicContact CB-CD2 4.02Å; A17-L175 HydrophobicContact CB-CB 4.41Å; A17-L175 HydrophobicContact CB-CD1 4.36Å; V171-L175 HydrophobicContact CG1-CD1 4.12Å; V171-L175 HydrophobicContact CG1-CG 4.44Å; V171-L175 WeakPolarHBondContact O-CG 3.43Å; V171-L175 PolarHBondContact O-N 3.31Å; N172-L175 PolarHBondContact O-N 2.87Å; L173-L175 VanDerWaalsContact C-N 3.32Å; L173-L175 PolarHBondContact O-N 3.3Å; L175-C177 VanDerWaalsContact C-N 3.34Å; L175-C177 PolarHBondContact O-N 3.03Å; L175-V178 PolarHBondContact O-N 2.67Å; L175-V179 WeakPolarHBondContact O-CG2 3.27Å; L175-V179 PolarHBondContact O-N 2.81Å
176W96.3Very high93.2Very high2 Ų240.3 Ų40.31%0.00823%0.229CC..Hα-helixtrans-64.2-36.4177-82.7103.4000113.3F14 L73 Y76 C77 A110 I111 N172 L173 V174 V179 L180F14-W176 HydrophobicContact CD1-CH2 4.33Å; F14-W176 AromaticContact CE1-CH2 3.69Å; F14-W176 HydrophobicContact CE1-CH2 3.69Å; F14-W176 HydrophobicContact CE1-CZ2 4.37Å; F14-W176 AromaticContact CE1-CZ3 3.87Å; F14-W176 HydrophobicContact CE1-CZ3 3.87Å; L73-W176 HydrophobicContact CD1-CH2 3.78Å; L73-W176 HydrophobicContact CD1-CZ2 3.29Å; L73-W176 HydrophobicContact CD2-CZ2 3.9Å; L73-W176 HydrophobicContact CG-CH2 4.5Å; L73-W176 HydrophobicContact CG-CZ2 3.54Å; Y76-W176 HydrophobicContact CD1-CH2 4.17Å; Y76-W176 HydrophobicContact CE1-CH2 4.11Å; C77-W176 VanDerWaalsContact SG-CZ2 3.56Å; A110-W176 HydrophobicContact CB-CD2 3.58Å; A110-W176 HydrophobicContact CB-CE3 3.51Å; A110-W176 HydrophobicContact CB-CG 4.27Å; A110-W176 HydrophobicContact CB-CH2 3.82Å; A110-W176 HydrophobicContact CB-CZ2 3.93Å; A110-W176 HydrophobicContact CB-CZ3 3.62Å; I111-W176 HydrophobicContact CG1-CB 3.66Å; N172-W176 PolarHBondContact O-N 3.41Å; N172-W176 PolarHBondContact OD1-NE1 2.88Å; L173-W176 PolarHBondContact O-N 3.1Å; V174-W176 PolarHBondContact O-N 3.35Å; W176-V179 HydrophobicContact CE3-CG1 4.48Å; W176-V179 PolarHBondContact O-N 2.95Å; W176-L180 WeakPolarHBondContact O-CB 3.41Å; W176-L180 PolarHBondContact O-N 2.92Å
177C95.9Very high92.7Very high53 Ų5342.9 Ų42.936%0.35824%0.237SC..Hα-helixtrans-62.6-43.3172.4-71.20000111.9L173 V174 L175 L180 V181L173-C177 PolarHBondContact O-N 3.41Å; L173-C177 PolarHBondContact O-SG 2.72Å; L173-C177 VanDerWaalsContact O-SG 3.32Å; V174-C177 WeakPolarHBondContact O-CB 3.28Å; V174-C177 PolarHBondContact O-N 3.5Å; L175-C177 VanDerWaalsContact C-N 3.34Å; L175-C177 PolarHBondContact O-N 3.03Å; C177-L180 PolarHBondContact O-N 3.22Å; C177-V181 WeakPolarHBondContact O-CG2 3.47Å; C177-V181 PolarHBondContact O-N 2.9Å
178V95Very high92.1Very high63 Ų6346.5 Ų46.538%0.38225%0.248SC..Hα-helixtrans-64.9-42.5176.9178.40000110.7L13 V174 L175 L180 V181 L182L13-V178 HydrophobicContact CD1-CB 4.35Å; L13-V178 HydrophobicContact CD1-CG1 3.66Å; L13-V178 HydrophobicContact CD2-CG1 4.21Å; V174-V178 WeakPolarHBondContact O-CG2 3.44Å; V174-V178 PolarHBondContact O-N 2.82Å; L175-V178 PolarHBondContact O-N 2.67Å; V178-L180 VanDerWaalsContact C-N 3.35Å; V178-L180 PolarHBondContact O-N 3.46Å; V178-V181 PolarHBondContact O-N 3.25Å; V178-L182 HydrophobicContact CG1-CD1 4.35Å; V178-L182 WeakPolarHBondContact O-CG 3.3Å; V178-L182 PolarHBondContact O-N 3.45Å
179V93.2Very high91.3Very high0 Ų049.1 Ų49.10%027%0.266CS..Hα-helixtrans-58-46.4174.2169.20000111.1L13 F14 L175 W176 V181 L182 Q183L13-V179 HydrophobicContact CB-CG2 3.61Å; L13-V179 HydrophobicContact CD1-CG2 3.94Å; L13-V179 HydrophobicContact CG-CG2 4.39Å; F14-V179 HydrophobicContact CE1-CG1 4.04Å; F14-V179 HydrophobicContact CZ-CG1 3.84Å; L175-V179 WeakPolarHBondContact O-CG2 3.27Å; L175-V179 PolarHBondContact O-N 2.81Å; W176-V179 HydrophobicContact CE3-CG1 4.48Å; W176-V179 PolarHBondContact O-N 2.95Å; V179-V181 PolarHBondContact O-N 3.45Å; V179-L182 PolarHBondContact O-N 2.95Å; V179-Q183 HydrophobicContact CG1-CG 4.43Å; V179-Q183 VanDerWaalsContact CG1-NE2 3.33Å; V179-Q183 VanDerWaalsContact O-CG 3.3Å; V179-Q183 WeakPolarHBondContact O-CG 3.38Å; V179-Q183 PolarHBondContact O-N 2.89Å
180L93.6Very high90.1Very high49 Ų4953.7 Ų53.726%0.25729%0.288SS..Hα-helixtrans-60-45.9177.1178.969.8000111.3L104 S107 I111 W176 C177 V178 L182 Q183 V184L104-L180 HydrophobicContact CD2-CD1 3.73Å; S107-L180 VanDerWaalsContact OG-CD1 3.23Å; S107-L180 WeakPolarHBondContact OG-CD1 3.47Å; I111-L180 HydrophobicContact CD1-CB 3.89Å; I111-L180 HydrophobicContact CD1-CD2 3.58Å; I111-L180 HydrophobicContact CD1-CG 4.3Å; W176-L180 WeakPolarHBondContact O-CB 3.41Å; W176-L180 PolarHBondContact O-N 2.92Å; C177-L180 PolarHBondContact O-N 3.22Å; V178-L180 VanDerWaalsContact C-N 3.35Å; V178-L180 PolarHBondContact O-N 3.46Å; L180-L182 VanDerWaalsContact C-N 3.34Å; L180-L182 PolarHBondContact O-N 3.47Å; L180-Q183 PolarHBondContact O-N 3.31Å; L180-V184 WeakPolarHBondContact O-CG2 3.29Å; L180-V184 PolarHBondContact O-N 3.34Å
181V92.4Very high88.5Confident91 Ų9152.9 Ų52.955%0.55230%0.298SS*.Hα-helixtrans-59.9-44.9177.5170.60000111C177 V178 V179 Q183 V184 V185C177-V181 WeakPolarHBondContact O-CG2 3.47Å; C177-V181 PolarHBondContact O-N 2.9Å; V178-V181 PolarHBondContact O-N 3.25Å; V179-V181 PolarHBondContact O-N 3.45Å; V181-Q183 PolarHBondContact O-N 2.99Å; V181-V184 PolarHBondContact O-N 2.98Å; V181-V185 HydrophobicContact CG1-CG2 4.49Å; V181-V185 WeakPolarHBondContact O-CG2 3.46Å; V181-V185 PolarHBondContact O-N 3.25Å
182L89.9Confident86.4Confident31 Ų3153.5 Ų53.516%0.16230%0.302CS..Hα-helixtrans-60.8-44.2176.9-71.3175.7000111.8L6 V9 L13 V178 V179 L180 V184 V185 Q186L6-L182 HydrophobicContact CD2-CD2 4.27Å; L6-L182 HydrophobicContact CG-CD2 4.37Å; V9-L182 HydrophobicContact CG1-CD1 3.87Å; L13-L182 HydrophobicContact CD1-CD1 3.34Å; V178-L182 HydrophobicContact CG1-CD1 4.35Å; V178-L182 WeakPolarHBondContact O-CG 3.3Å; V178-L182 PolarHBondContact O-N 3.45Å; V179-L182 PolarHBondContact O-N 2.95Å; L180-L182 VanDerWaalsContact C-N 3.34Å; L180-L182 PolarHBondContact O-N 3.47Å; L182-V184 VanDerWaalsContact C-N 3.33Å; L182-V184 PolarHBondContact O-N 3.09Å; L182-V185 PolarHBondContact O-N 3.03Å; L182-Q186 WeakPolarHBondContact O-CG 3.11Å; L182-Q186 PolarHBondContact O-N 3.33Å
183Q90.2Very high84Confident2 Ų258.4 Ų58.41%0.00933%0.334CS..Hα-helixtrans-64.7-36.6177.4-70.2172.5-0.800112.2E10 L100 A103 L104 S107 V179 L180 V181 Q186 W187E10-Q183 PolarHBondContact OE1-NE2 3.38Å; L100-Q183 HydrophobicContact CD1-CB 4.21Å; L100-Q183 HydrophobicContact CD1-CG 4.39Å; A103-Q183 VanDerWaalsContact C-OE1 3.31Å; A103-Q183 PolarHBondContact O-OE1 2.91Å; L104-Q183 HydrophobicContact CD2-CB 3.43Å; L104-Q183 VanDerWaalsContact CD2-CB 3.43Å; L104-Q183 HydrophobicContact CG-CB 4.08Å; S107-Q183 PolarHBondContact OG-OE1 2.73Å; V179-Q183 HydrophobicContact CG1-CG 4.43Å; V179-Q183 VanDerWaalsContact CG1-NE2 3.33Å; V179-Q183 VanDerWaalsContact O-CG 3.3Å; V179-Q183 WeakPolarHBondContact O-CG 3.38Å; V179-Q183 PolarHBondContact O-N 2.89Å; L180-Q183 PolarHBondContact O-N 3.31Å; V181-Q183 PolarHBondContact O-N 2.99Å; Q183-Q186 PolarHBondContact O-N 3.28Å; Q183-W187 WeakPolarHBondContact O-CB 3.48Å; Q183-W187 PolarHBondContact O-N 3.47Å
184V88.4Confident81.4Confident57 Ų5765.1 Ų65.135%0.34537%0.365SS..Hα-helixtrans-66.9-39.3174.2170.40000111.1L104 L180 V181 L182 W187 K188L104-V184 HydrophobicContact CD2-CG2 3.74Å; L180-V184 WeakPolarHBondContact O-CG2 3.29Å; L180-V184 PolarHBondContact O-N 3.34Å; V181-V184 PolarHBondContact O-N 2.98Å; L182-V184 VanDerWaalsContact C-N 3.33Å; L182-V184 PolarHBondContact O-N 3.09Å; V184-W187 PolarHBondContact O-N 3.42Å; V184-K188 WeakPolarHBondContact O-CG 3.02Å; V184-K188 PolarHBondContact O-N 2.97Å
185V87.4Confident78.4Confident76 Ų7671.5 Ų71.546%0.46138%0.379SS..Hα-helixtrans-64.4-46.7174.9171.30000110.6V181 L182 W187 K188 S189V181-V185 HydrophobicContact CG1-CG2 4.49Å; V181-V185 WeakPolarHBondContact O-CG2 3.46Å; V181-V185 PolarHBondContact O-N 3.25Å; L182-V185 PolarHBondContact O-N 3.03Å; V185-W187 VanDerWaalsContact C-N 3.28Å; V185-W187 PolarHBondContact O-N 3.46Å; V185-K188 PolarHBondContact O-N 3.4Å; V185-S189 PolarHBondContact O-N 3.45Å; V185-S189 PolarHBondContact O-OG 2.87Å
186Q85.1Confident75.7Confident24 Ų2475.5 Ų75.511%0.11241%0.406CS..Hα-helixtrans-55.1-45.7173.9-71.6172-1.700110.9L6 E10 L100 L182 Q183 K188 S189 E190L6-Q186 HydrophobicContact CD2-CG 3.4Å; L6-Q186 VanDerWaalsContact CD2-CG 3.4Å; E10-Q186 PolarHBondContact OE2-NE2 3.06Å; L100-Q186 HydrophobicContact CD1-CB 4.12Å; L100-Q186 HydrophobicContact CD2-CB 4.07Å; L182-Q186 WeakPolarHBondContact O-CG 3.11Å; L182-Q186 PolarHBondContact O-N 3.33Å; Q183-Q186 PolarHBondContact O-N 3.28Å; Q186-K188 PolarHBondContact O-N 2.82Å; Q186-S189 WeakPolarHBondContact CA-OG 3.25Å; Q186-S189 PolarHBondContact O-N 2.95Å; Q186-S189 PolarHBondContact O-OG 2.92Å; Q186-E190 PolarHBondContact O-N 2.75Å
187W82.9Confident73.1Confident84 Ų8481.9 Ų81.932%0.31844%0.44SS..Hα-helixtrans-63-46.7-179.5179.1-65000111.2L100 R101 L104 Q183 V184 V185 S189 E190 A191L100-W187 HydrophobicContact CD2-CB 3.67Å; L100-W187 HydrophobicContact CD2-CE3 4.27Å; L100-W187 HydrophobicContact CD2-CG 4.41Å; L100-W187 HydrophobicContact CG-CB 4.41Å; L100-W187 HydrophobicContact CG-CE3 4.21Å; R101-W187 HydrophobicContact CB-CH2 4.03Å; R101-W187 HydrophobicContact CB-CZ3 3.55Å; R101-W187 HydrophobicContact CG-CE3 4.24Å; R101-W187 HydrophobicContact CG-CH2 3.45Å; R101-W187 VanDerWaalsContact CG-CH2 3.45Å; R101-W187 HydrophobicContact CG-CZ3 3.22Å; L104-W187 HydrophobicContact CD1-CB 4.39Å; L104-W187 HydrophobicContact CD1-CD2 4.02Å; L104-W187 HydrophobicContact CD1-CE3 3.28Å; L104-W187 HydrophobicContact CD1-CG 4.47Å; L104-W187 HydrophobicContact CD1-CZ3 3.68Å; Q183-W187 WeakPolarHBondContact O-CB 3.48Å; Q183-W187 PolarHBondContact O-N 3.47Å; V184-W187 PolarHBondContact O-N 3.42Å; V185-W187 VanDerWaalsContact C-N 3.28Å; V185-W187 PolarHBondContact O-N 3.46Å; W187-S189 VanDerWaalsContact C-N 3.3Å; W187-S189 PolarHBondContact O-N 3.39Å; W187-E190 PolarHBondContact O-N 3.09Å; W187-A191 VanDerWaalsContact O-CB 3.27Å; W187-A191 WeakPolarHBondContact O-CB 3.12Å; W187-A191 PolarHBondContact O-N 2.97Å
188K82.5Confident70.4Confident141 Ų14187.2 Ų87.261%0.61346%0.46SS*.Hα-helixtrans-63.2-38.3178.7-76.9-174.5175-173.50111.4V184 V185 Q186 A191 T192V184-K188 WeakPolarHBondContact O-CG 3.02Å; V184-K188 PolarHBondContact O-N 2.97Å; V185-K188 PolarHBondContact O-N 3.4Å; Q186-K188 PolarHBondContact O-N 2.82Å; K188-A191 PolarHBondContact O-N 3.01Å; K188-T192 WeakPolarHBondContact O-CB 3.04Å; K188-T192 PolarHBondContact O-N 3.27Å; K188-T192 PolarHBondContact O-OG1 3.17Å
189S75.2Confident68Low69 Ų6995.1 Ų95.148%0.48348%0.483SS..Hα-helixtrans-67.5-37.2176.356.40000113V185 Q186 W187 T192V185-S189 PolarHBondContact O-N 3.45Å; V185-S189 PolarHBondContact O-OG 2.87Å; Q186-S189 WeakPolarHBondContact CA-OG 3.25Å; Q186-S189 PolarHBondContact O-N 2.95Å; Q186-S189 PolarHBondContact O-OG 2.92Å; W187-S189 VanDerWaalsContact C-N 3.3Å; W187-S189 PolarHBondContact O-N 3.39Å; S189-T192 VanDerWaalsContact O-O 3.04Å
190E70.4Confident65.7Low97 Ų9798 Ų9845%0.45351%0.512SS..Hα-helixtrans-71.3-36.1174.7-74179-172.100112.2Q186 W187 T192Q186-E190 PolarHBondContact O-N 2.75Å; W187-E190 PolarHBondContact O-N 3.09Å; E190-T192 VanDerWaalsContact C-N 3.29Å
191A60.5Low62.8Low65 Ų65101.8 Ų101.854%0.53753%0.532SS..Hα-helixtrans-75.6-17.417800000113.6W187 K188 P193W187-A191 VanDerWaalsContact O-CB 3.27Å; W187-A191 WeakPolarHBondContact O-CB 3.12Å; W187-A191 PolarHBondContact O-N 2.97Å; K188-A191 PolarHBondContact O-N 3.01Å; A191-P193 VanDerWaalsContact C-CD 3.47Å; A191-P193 WeakPolarHBondContact O-CD 3.45Å
192T51.8Low60.8Low80 Ų80103.1 Ų103.149%0.49154%0.543SS..SBendtrans-98.686.9172.1-41.40000106.8K188 S189 E190 H194K188-T192 WeakPolarHBondContact O-CB 3.04Å; K188-T192 PolarHBondContact O-N 3.27Å; K188-T192 PolarHBondContact O-OG1 3.17Å; S189-T192 VanDerWaalsContact O-O 3.04Å; E190-T192 VanDerWaalsContact C-N 3.29Å; T192-H194 VanDerWaalsContact C-N 3.33Å; T192-H194 PolarHBondContact O-N 3.36Å; T192-H194 PolarHBondContact O-ND1 3.1Å
193P45.5Very low58.4Low106 Ų106109.9 Ų109.969%0.68857%0.574SS**  trans-57.1111.2167.126-31.2000104.8A191 R195A191-P193 VanDerWaalsContact C-CD 3.47Å; A191-P193 WeakPolarHBondContact O-CD 3.45Å; P193-R195 PolarHBondContact O-N 3.49Å
194H40.9Very low56.1Low162 Ų162121 Ų12175%0.7562%0.616SS**  trans-59.595.7156.2-74.748.3000102.9T192 P196T192-H194 VanDerWaalsContact C-N 3.33Å; T192-H194 PolarHBondContact O-N 3.36Å; T192-H194 PolarHBondContact O-ND1 3.1Å; H194-P196 WeakPolarHBondContact O-CD 3.44Å
195R34.3Very low54.3Low225 Ų225123.6 Ų123.685%0.84964%0.636SS**  trans-66.8106.8149.2-121.7-173.8175169.8-0.9102.1P193 L197P193-R195 PolarHBondContact O-N 3.49Å; R195-L197 PolarHBondContact O-N 3.14Å
196P38.8Very low52.5Low109 Ų109125.4 Ų125.471%0.70865%0.652SS**  trans-60.2109150.4-1.922000102.8H194 E198H194-P196 WeakPolarHBondContact O-CD 3.44Å; P196-E198 PolarHBondContact O-N 2.89Å
197L41Very low50.7Low135 Ų135133.1 Ų133.171%0.70769%0.688SS**  trans-59.2101.6154.8-170.680.4000103.1R195 R199R195-L197 PolarHBondContact O-N 3.14Å; L197-R199 PolarHBondContact O-N 3.12Å
198E38.4Very low49.1Very low166 Ų166134.9 Ų134.978%0.77671%0.708SS**  trans-54.790.5166.1-101.4173.6122.800106.5P196 G200P196-E198 PolarHBondContact O-N 2.89Å; E198-G200 VanDerWaalsContact C-N 3.33Å; E198-G200 PolarHBondContact O-N 3.21Å
199R45.9Very low47.4Very low229 Ų229136.4 Ų136.486%0.86472%0.723SS**  trans-84.490.2168.2172.4166.9-93.2143.6-5.3104.8L197L197-R199 PolarHBondContact O-N 3.12Å
200G45.3Very low46.1Very low59 Ų59137.8 Ų137.861%0.60874%0.739SS**  trans117.983.8161.700000114.2E198E198-G200 VanDerWaalsContact C-N 3.33Å; E198-G200 PolarHBondContact O-N 3.21Å
201D32.5Very low45Very low129 Ų129140.4 Ų140.469%0.6976%0.755SS**  trans-130.6117.8135.6-91.3-30.9000108.4E203D201-E203 PolarHBondContact O-N 3.42Å
202P49Very low44.4Very low119 Ų119146.9 Ų146.977%0.77377%0.772SS**  trans-92.569.3174.337.4-29.5000109.2
203E39.5Very low43.8Very low173 Ų173146.3 Ų146.381%0.80878%0.782SS**  trans-131.865.4172.1-81-173.1133.800110.4D201D201-E203 PolarHBondContact O-N 3.42Å
204W42.7Very low43.6Very low237 Ų237147.1 Ų147.190%0.89879%0.787SS**  trans-12669.8154.3-162.4-80000108.8
205S50.8Low43.6Very low111 Ų111151.1 Ų151.178%0.77680%0.796SS**SBendtrans-168.479167.412.80000110.2
206S49.5Very low44Very low114 Ų114148.7 Ų148.780%0.79780%0.799SS**SBendtrans-174.720.214772.90000117.8
207E47Very low43.9Very low185 Ų185148 Ų14886%0.86480%0.797SS**SBendtrans-134.430-179.9-67.8-161.1117.200116.4
208T48.9Very low43.6Very low121 Ų121150.7 Ų150.774%0.74281%0.805SS**SBendtrans-1264.8165.426.40000115.9A210T208-A210 PolarHBondContact O-N 3.43Å
209D47.9Very low43.5Very low173 Ų173151.6 Ų151.693%0.92583%0.83SS**THydrogen-bonded Turntrans-91.820.3177.6-83.2-30.7000115
210A48.6Very low43.4Very low99 Ų99147.8 Ų147.882%0.81883%0.828SS**THydrogen-bonded Turntrans-111.112.5178.700000115.3T208T208-A210 PolarHBondContact O-N 3.43Å
211L47.3Very low43.3Very low151 Ų151152.4 Ų152.479%0.79184%0.84SS**SBendtrans-1271.7-175.6-104.9141.1000116.5
212F46.2Very low43.9Very low201 Ų201153.7 Ų153.788%0.88285%0.848SS**  trans-130.483.4170.5-69.2-76.1000111.2
213G40.2Very low43.6Very low69 Ų69155.8 Ų155.871%0.71185%0.852SS**PPolyproline II helixtrans-64.9155.3164.700000111.8
214P39.9Very low43.8Very low122 Ų122154.7 Ų154.779%0.79286%0.855SS**PPolyproline II helixtrans-72.2141.6-163-10.326000112.5L216P214-L216 PolarHBondContact O-N 3.19Å
215R42.7Very low43.9Very low246 Ų246149.2 Ų149.293%0.92885%0.852SS**PPolyproline II helixtrans-58.2116.7157.6-68.3-173.8-162.4-143.54.2108.6
216L41Very low43.4Very low175 Ų175151.9 Ų151.992%0.91686%0.858SS**  trans-99.8107.1155.9-91.6156.4000107.6P214P214-L216 PolarHBondContact O-N 3.19Å
217S37.1Very low42.9Very low95 Ų95154.8 Ų154.866%0.66486%0.863SS**  trans-95.6134.7167.947.20000110
218H35.5Very low42.6Very low191 Ų191152.3 Ų152.388%0.88486%0.862SS**  trans69.6111.4154.8-86.8-81.1000120.6
219S35.7Very low42Very low185 Ų185155.2 Ų155.2100%1.29487%0.873SS**  -160.60107.91760000110.1

Retrieved 219 of 219 residues in 46 ms (Link to these results)

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