A0A096MN96_PAPAN Loading...

Metaxin

AlphaFold DB , UniProt , Accession A0A096MN96, Species PAPAN (Papio anubis, Olive baboon), Gene MTX3, Length 312 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M49.3Very low81.7Confident244 Ų24448.9 Ų48.9100%1.20230%0.295SS*.  0135.10-67.9177.2-169.200106.5
2A60.4Low82.4Confident96 Ų9648.1 Ų48.179%0.79330%0.304SS*.PPolyproline II helixtrans-64.8138.2174.400000109.2
3A67Low83Confident37 Ų3745.6 Ų45.631%0.30629%0.294SS..PPolyproline II helixtrans-51.9138177.200000111L5 E59A3-L5 PolarHBondContact O-N 3.04Å; A3-E59 HydrophobicContact CB-CB 4.44Å; A3-E59 HydrophobicContact CB-CG 3.75Å; A3-E59 WeakPolarHBondContact CB-OE1 3.33Å
4P81.1Confident83.7Confident75 Ų7548.1 Ų48.149%0.48730%0.295SS..PPolyproline II helixtrans-65.1128.9178.726.7-32.5000110.4E6P4-E6 PolarHBondContact O-N 2.89Å
5L91Very high84.1Confident17 Ų1749.7 Ų49.79%0.08932%0.324CS..EExtended strand (participates in β ladder)trans-83.3110.3172.4-64.7174.2000108.3A3 L37 K38 L56 T58 F72 L73 Y78A3-L5 PolarHBondContact O-N 3.04Å; L5-L37 HydrophobicContact CB-CD1 3.92Å; L5-K38 PolarHBondContact O-N 3.11Å; L5-L56 HydrophobicContact CB-CD1 4.34Å; L5-T58 HydrophobicContact CD2-CG2 3.58Å; L5-F72 HydrophobicContact CD2-CE1 3.93Å; L5-L73 HydrophobicContact CD1-CD2 3.8Å; L5-Y78 HydrophobicContact CD1-CE2 4.28Å
6E92.8Very high84.7Confident50 Ų5047.1 Ų47.123%0.23431%0.306CS..EExtended strand (participates in β ladder)trans-106.2121.1-177.9-60.1-158155.300111.5P4 K38 N40 L56 T57P4-E6 PolarHBondContact O-N 2.89Å; E6-K38 CarbonylContact C-O 3.55Å; E6-K38 WeakPolarHBondContact CA-O 3.36Å; E6-K38 HydrophobicContact CG-CB 4.42Å; E6-K38 HydrophobicContact CG-CD 4.34Å; E6-K38 IonicContact OE1-NZ 2.79Å; E6-K38 PolarHBondContact OE1-NZ 3.14Å; E6-N40 PolarHBondContact OE2-ND2 3.17Å; E6-L56 CarbonylContact O-C 3.27Å; E6-L56 WeakPolarHBondContact O-CA 3.46Å; E6-T57 PolarHBondContact N-O 3.33Å; E6-T57 PolarHBondContact O-N 2.87Å
7L93.3Very high85.2Confident0 Ų046.4 Ų46.40%030%0.301CS..EExtended strand (participates in β ladder)trans-101.5115.4175.9-176.971.8000110.2C9 V26 M27 L37 K38 N40 P54L7-C9 HydrophobicContact CD2-CB 4.3Å; L7-C9 HydrophobicContact CG-CB 4.37Å; L7-V26 HydrophobicContact CD1-CG1 3.78Å; L7-V26 HydrophobicContact CD2-CB 4.41Å; L7-V26 HydrophobicContact CD2-CG1 3.98Å; L7-M27 HydrophobicContact CD2-CG 3.62Å; L7-L37 HydrophobicContact CB-CD1 3.89Å; L7-L37 HydrophobicContact CB-CD2 3.76Å; L7-L37 HydrophobicContact CB-CG 3.82Å; L7-L37 HydrophobicContact CD2-CD2 3.73Å; L7-L37 HydrophobicContact CG-CD2 4.26Å; L7-K38 PolarHBondContact N-O 3.36Å; L7-N40 PolarHBondContact O-N 3.25Å; L7-P54 HydrophobicContact CD1-CB 3.72Å
8S92.4Very high85.6Confident17 Ų1743.8 Ų43.812%0.11929%0.285CS..EExtended strand (participates in β ladder)trans-84.6121.5166.7-58.60000110.2N40 P54 I55S8-N40 VanDerWaalsContact CA-O 3.31Å; S8-N40 WeakPolarHBondContact CA-O 3.31Å; S8-P54 WeakPolarHBondContact O-CA 3.35Å; S8-I55 PolarHBondContact N-O 3.39Å; S8-I55 PolarHBondContact O-N 2.82Å; S8-I55 VanDerWaalsContact O-N 3.08Å
9C92.5Very high86Confident0 Ų041.6 Ų41.60%027%0.271CS..EExtended strand (participates in β ladder)trans-148.6167.8-17967.10000114.1L7 S23 V39 N40 V41 I42L7-C9 HydrophobicContact CD2-CB 4.3Å; L7-C9 HydrophobicContact CG-CB 4.37Å; C9-S23 WeakPolarHBondContact CB-OG 3.19Å; C9-V39 WeakPolarHBondContact SG-CG1 3.24Å; C9-N40 PolarHBondContact N-O 3.49Å; C9-N40 VanDerWaalsContact N-O 3.13Å; C9-V41 WeakPolarHBondContact O-CA 3.47Å; C9-I42 WeakPolarHBondContact O-CG1 3.31Å; C9-I42 PolarHBondContact O-N 3.06Å
10W90.6Very high86.3Confident0 Ų041.4 Ų41.40%027%0.266CS..PPolyproline II helixtrans-66145.5171.4-68.4109.4000111.4S18 H20 I42 V53 W125 F126 Q129 I130 L138 M142W10-S18 WeakPolarHBondContact O-CB 3.34Å; W10-S18 PolarHBondContact O-OG 3.39Å; W10-H20 HydrophobicContact CB-CB 3.99Å; W10-H20 VanDerWaalsContact CD1-CB 3.47Å; W10-H20 AromaticContact CD1-CG 3.58Å; W10-H20 HydrophobicContact CG-CB 4.05Å; W10-I42 HydrophobicContact CD2-CD1 3.97Å; W10-I42 HydrophobicContact CE3-CB 4.33Å; W10-I42 HydrophobicContact CE3-CD1 3.98Å; W10-I42 HydrophobicContact CE3-CG2 4.2Å; W10-I42 HydrophobicContact CH2-CD1 4.28Å; W10-I42 HydrophobicContact CZ2-CD1 4.29Å; W10-I42 HydrophobicContact CZ3-CB 4.49Å; W10-I42 HydrophobicContact CZ3-CD1 4.14Å; W10-I42 HydrophobicContact CZ3-CG2 3.88Å; W10-V53 HydrophobicContact CD2-CG2 4.25Å; W10-V53 HydrophobicContact CG-CG2 3.96Å; W10-W125 HydrophobicContact CB-CH2 4.41Å; W10-F126 AromaticContact CD2-CD1 3.87Å; W10-F126 HydrophobicContact CD2-CD1 3.87Å; W10-F126 AromaticContact CD2-CE1 3.7Å; W10-F126 HydrophobicContact CD2-CE1 3.7Å; W10-F126 AromaticContact CE2-CD1 3.98Å; W10-F126 AromaticContact CE2-CE1 3.83Å; W10-F126 AromaticContact CE3-CD1 3.93Å; W10-F126 HydrophobicContact CE3-CD1 3.93Å; W10-F126 HydrophobicContact CE3-CE1 4.19Å; W10-F126 HydrophobicContact CG-CD1 4.47Å; W10-F126 AromaticContact CG-CE1 3.83Å; W10-F126 HydrophobicContact CG-CE1 3.83Å; W10-F126 HydrophobicContact CH2-CD1 4.27Å; W10-F126 HydrophobicContact CZ2-CD1 4.19Å; W10-F126 HydrophobicContact CZ2-CE1 4.44Å; W10-F126 HydrophobicContact CZ3-CD1 4.14Å; W10-F126 AromaticContact NE1-CE1 3.96Å; W10-Q129 HydrophobicContact CE3-CB 4.47Å; W10-Q129 HydrophobicContact CZ3-CB 4.33Å; W10-I130 HydrophobicContact CH2-CD1 3.7Å; W10-I130 HydrophobicContact CH2-CG1 3.75Å; W10-I130 HydrophobicContact CZ3-CD1 4.01Å; W10-I130 HydrophobicContact CZ3-CG1 3.69Å; W10-L138 HydrophobicContact CH2-CD2 4.09Å; W10-L138 HydrophobicContact CZ2-CD2 4.42Å; W10-M142 HydrophobicContact CZ2-CE 4.22Å; W10-M142 HydrophobicContact CZ2-SD 4.16Å
11G87.8Confident86.7Confident2 Ų240 Ų402%0.02126%0.258CS..PPolyproline II helixtrans-64170.2-179.800000115S18 V19 W125G11-S18 WeakPolarHBondContact O-CA 3.48Å; G11-V19 PolarHBondContact O-N 3.09Å; G11-V19 VanDerWaalsContact O-N 3.14Å; G11-W125 WeakPolarHBondContact O-CH2 3.43Å; G11-W125 WeakPolarHBondContact O-CZ2 3.4Å
12G90.2Very high88.8Confident39 Ų3931.6 Ų31.640%0.40222%0.215SC..PPolyproline II helixtrans-80.3161177.400000113.7L16 P17G12-L16 CarbonylContact C-O 3.59Å; G12-L16 WeakPolarHBondContact CA-O 3.41Å; G12-P17 WeakPolarHBondContact CA-O 3.3Å; G12-P17 PolarHBondContact N-O 2.92Å
13G90.1Very high90.4Very high16 Ų1627 Ų2717%0.16518%0.177CC..BIsolated β-bridgetrans-174.7152.9179.900000110.9G15 L16G13-G15 PolarHBondContact O-N 2.79Å; G13-G15 VanDerWaalsContact O-N 3.14Å; G13-L16 PolarHBondContact N-O 3.26Å; G13-L16 VanDerWaalsContact N-O 3.08Å; G13-L16 VanDerWaalsContact O-CB 3.29Å; G13-L16 WeakPolarHBondContact O-CB 3.48Å; G13-L16 PolarHBondContact O-N 2.91Å
14W92.8Very high91.8Very high81 Ų8125.3 Ų25.331%0.30716%0.163SC..THydrogen-bonded Turntrans54.232179.2-56.7-87.5000115L16 V19 V121 W125 K211 V212W14-L16 VanDerWaalsContact C-N 3.29Å; W14-V19 HydrophobicContact CE3-CG1 4.37Å; W14-V19 HydrophobicContact CE3-CG2 3.75Å; W14-V19 HydrophobicContact CZ3-CB 4.47Å; W14-V19 HydrophobicContact CZ3-CG1 3.93Å; W14-V19 HydrophobicContact CZ3-CG2 3.67Å; W14-V121 HydrophobicContact CH2-CG1 3.92Å; W14-V121 HydrophobicContact CZ2-CG1 3.67Å; W14-W125 HydrophobicContact CH2-CB 3.8Å; W14-W125 AromaticContact CH2-CD1 3.34Å; W14-W125 HydrophobicContact CH2-CD2 4.14Å; W14-W125 AromaticContact CH2-CG 3.46Å; W14-W125 HydrophobicContact CH2-CG 3.46Å; W14-W125 VanDerWaalsContact CH2-CG 3.46Å; W14-W125 AromaticContact CH2-NE1 3.94Å; W14-W125 AromaticContact CZ3-CD1 3.57Å; W14-W125 AromaticContact CZ3-CD2 3.95Å; W14-W125 HydrophobicContact CZ3-CD2 3.95Å; W14-W125 AromaticContact CZ3-CE2 3.96Å; W14-W125 AromaticContact CZ3-CG 3.75Å; W14-W125 HydrophobicContact CZ3-CG 3.75Å; W14-W125 AromaticContact CZ3-NE1 3.67Å; W14-K211 HydrophobicContact CB-CB 4.41Å; W14-V212 HydrophobicContact CD2-CB 4.49Å; W14-V212 HydrophobicContact CD2-CG1 4.31Å; W14-V212 HydrophobicContact CD2-CG2 4.16Å; W14-V212 HydrophobicContact CE3-CG1 4.45Å; W14-V212 HydrophobicContact CE3-CG2 3.86Å; W14-V212 HydrophobicContact CH2-CG1 4.46Å; W14-V212 HydrophobicContact CZ2-CG1 4.34Å; W14-V212 HydrophobicContact CZ3-CG2 4.32Å
15G90.4Very high92.6Very high71 Ų7121.7 Ų21.773%0.73214%0.14SC*.THydrogen-bonded Turntrans79.28.1-177.100000114.5G13G13-G15 PolarHBondContact O-N 2.79Å; G13-G15 VanDerWaalsContact O-N 3.14Å
16L94.1Very high92.9Very high8 Ų820.9 Ų20.94%0.04214%0.135CC..BIsolated β-bridgetrans-96.6146.4172.8-58.2171.7000111G12 G13 W14 S18 A207 P208 K211 L237G12-L16 CarbonylContact C-O 3.59Å; G12-L16 WeakPolarHBondContact CA-O 3.41Å; G13-L16 PolarHBondContact N-O 3.26Å; G13-L16 VanDerWaalsContact N-O 3.08Å; G13-L16 VanDerWaalsContact O-CB 3.29Å; G13-L16 WeakPolarHBondContact O-CB 3.48Å; G13-L16 PolarHBondContact O-N 2.91Å; W14-L16 VanDerWaalsContact C-N 3.29Å; L16-S18 VanDerWaalsContact C-N 3.29Å; L16-S18 WeakPolarHBondContact CB-O 3.37Å; L16-S18 PolarHBondContact O-N 3.23Å; L16-A207 HydrophobicContact CD2-CB 3.73Å; L16-P208 HydrophobicContact CD1-CB 4.31Å; L16-P208 HydrophobicContact CD1-CG 4.33Å; L16-K211 HydrophobicContact CD1-CB 4.02Å; L16-K211 HydrophobicContact CD2-CB 4.08Å; L16-K211 HydrophobicContact CD2-CG 3.72Å; L16-K211 HydrophobicContact CG-CB 3.95Å; L16-K211 HydrophobicContact CG-CG 4.14Å; L16-L237 HydrophobicContact CD2-CD1 4.11Å; L16-L237 HydrophobicContact CD2-CD2 4.05Å
17P92.8Very high93Very high35 Ų3519.3 Ų19.323%0.22713%0.128CC..SBendtrans-73.6-22.6175.131.7-35.7000112.7G12 L24 M27 F241G12-P17 WeakPolarHBondContact CA-O 3.3Å; G12-P17 PolarHBondContact N-O 2.92Å; P17-L24 HydrophobicContact CG-CD2 3.51Å; P17-M27 HydrophobicContact CB-CE 3.67Å; P17-M27 HydrophobicContact CG-CE 4.21Å; P17-F241 HydrophobicContact CB-CD1 4.03Å; P17-F241 HydrophobicContact CB-CE1 4.36Å; P17-F241 HydrophobicContact CG-CD1 3.67Å; P17-F241 HydrophobicContact CG-CE1 3.82Å; P17-F241 HydrophobicContact CG-CG 4.05Å; P17-F241 HydrophobicContact CG-CZ 4.32Å
18S93Very high93.2Very high0 Ų019.3 Ų19.30%013%0.128CC..  trans-146.7145.4167.2-172.70000109.6W10 G11 L16 H20 S23 L24W10-S18 WeakPolarHBondContact O-CB 3.34Å; W10-S18 PolarHBondContact O-OG 3.39Å; G11-S18 WeakPolarHBondContact O-CA 3.48Å; L16-S18 VanDerWaalsContact C-N 3.29Å; L16-S18 WeakPolarHBondContact CB-O 3.37Å; L16-S18 PolarHBondContact O-N 3.23Å; S18-H20 VanDerWaalsContact C-N 3.34Å; S18-H20 PolarHBondContact OG-N 2.94Å; S18-S23 WeakPolarHBondContact OG-CB 3.41Å; S18-L24 WeakPolarHBondContact O-CD1 3.5Å; S18-L24 WeakPolarHBondContact O-CD2 3.49Å; S18-L24 VanDerWaalsContact O-CG 3.28Å; S18-L24 WeakPolarHBondContact O-CG 3.44Å
19V91.9Very high93.5Very high3 Ų318.5 Ų18.52%0.01812%0.123CC..SBendtrans-83.7-16.2175.9179.70000111.8G11 W14 F111 W125 F126 V212G11-V19 PolarHBondContact O-N 3.09Å; G11-V19 VanDerWaalsContact O-N 3.14Å; W14-V19 HydrophobicContact CE3-CG1 4.37Å; W14-V19 HydrophobicContact CE3-CG2 3.75Å; W14-V19 HydrophobicContact CZ3-CB 4.47Å; W14-V19 HydrophobicContact CZ3-CG1 3.93Å; W14-V19 HydrophobicContact CZ3-CG2 3.67Å; V19-F111 HydrophobicContact CG1-CE1 4.18Å; V19-W125 HydrophobicContact CB-CE3 4.34Å; V19-W125 HydrophobicContact CB-CH2 3.59Å; V19-W125 HydrophobicContact CB-CZ2 3.94Å; V19-W125 HydrophobicContact CB-CZ3 3.8Å; V19-W125 HydrophobicContact CG1-CE3 4.36Å; V19-W125 HydrophobicContact CG1-CH2 4.45Å; V19-W125 HydrophobicContact CG1-CZ3 4.22Å; V19-W125 HydrophobicContact CG2-CD2 4.33Å; V19-W125 HydrophobicContact CG2-CE3 4.46Å; V19-W125 HydrophobicContact CG2-CH2 3.53Å; V19-W125 HydrophobicContact CG2-CZ2 3.31Å; V19-W125 HydrophobicContact CG2-CZ3 4.1Å; V19-F126 HydrophobicContact CG1-CE2 4.41Å; V19-F126 HydrophobicContact CG1-CZ 4.48Å; V19-V212 HydrophobicContact CG1-CG2 4.3Å
20H92.3Very high93.6Very high36 Ų3618.6 Ų18.617%0.16712%0.123CC..SBendtrans-89.8126.6-177.3-172.4-114.2000111.9W10 S18 E22 S23 L24 V53W10-H20 HydrophobicContact CB-CB 3.99Å; W10-H20 VanDerWaalsContact CD1-CB 3.47Å; W10-H20 AromaticContact CD1-CG 3.58Å; W10-H20 HydrophobicContact CG-CB 4.05Å; S18-H20 VanDerWaalsContact C-N 3.34Å; S18-H20 PolarHBondContact OG-N 2.94Å; H20-E22 PolarHBondContact O-N 3.26Å; H20-S23 PolarHBondContact ND1-OG 3.37Å; H20-S23 WeakPolarHBondContact O-CB 3.36Å; H20-S23 PolarHBondContact O-N 3.06Å; H20-L24 PolarHBondContact O-N 3.38Å; H20-V53 PolarHBondContact CE1-O 3.14Å; H20-V53 PolarHBondContact ND1-O 3.48Å
21S94.1Very high93.9Very high14 Ų1424.2 Ų24.210%0.09815%0.148CC..Hα-helixtrans-57.4-50.2-174.1-630000113.5S23 L24 V25 G204S21-S23 VanDerWaalsContact C-N 3.26Å; S21-S23 PolarHBondContact O-N 3.46Å; S21-L24 WeakPolarHBondContact O-CB 3.33Å; S21-L24 PolarHBondContact O-N 3.02Å; S21-L24 VanDerWaalsContact O-N 3.13Å; S21-V25 WeakPolarHBondContact O-CG2 3.47Å; S21-V25 PolarHBondContact O-N 2.94Å; S21-G204 WeakPolarHBondContact CA-O 3.05Å; S21-G204 WeakPolarHBondContact CB-O 3.24Å; S21-G204 PolarHBondContact OG-O 2.94Å; S21-G204 VanDerWaalsContact OG-O 3.11Å
22E94.4Very high94.3Very high67 Ų6725.3 Ų25.331%0.31315%0.152SC..Hα-helixtrans-62.2-35.6-178.5-67.8-167.6174.300112.4H20 V25 V26 P54 P66H20-E22 PolarHBondContact O-N 3.26Å; E22-V25 PolarHBondContact O-N 3.49Å; E22-V26 PolarHBondContact O-N 3.03Å; E22-P54 HydrophobicContact CB-CG 4.17Å; E22-P66 HydrophobicContact CB-CG 3.43Å; E22-P66 VanDerWaalsContact CB-CG 3.43Å; E22-P66 HydrophobicContact CG-CG 3.77Å; E22-P66 WeakPolarHBondContact OE2-CD 3.43Å
23S94.8Very high94.5Very high0 Ų024.7 Ų24.70%014%0.141CC..Hα-helixtrans-67-42.3176.3-60.70000111.1C9 S18 H20 S21 V25 V26 M27C9-S23 WeakPolarHBondContact CB-OG 3.19Å; S18-S23 WeakPolarHBondContact OG-CB 3.41Å; H20-S23 PolarHBondContact ND1-OG 3.37Å; H20-S23 WeakPolarHBondContact O-CB 3.36Å; H20-S23 PolarHBondContact O-N 3.06Å; S21-S23 VanDerWaalsContact C-N 3.26Å; S21-S23 PolarHBondContact O-N 3.46Å; S23-V25 VanDerWaalsContact C-N 3.35Å; S23-V25 PolarHBondContact O-N 3.49Å; S23-V26 PolarHBondContact O-N 3.43Å; S23-M27 WeakPolarHBondContact O-CB 3.5Å; S23-M27 WeakPolarHBondContact O-CG 3.32Å; S23-M27 PolarHBondContact O-N 2.92Å
24L95.9Very high94.6Very high0 Ų026.6 Ų26.60%016%0.161CC..Hα-helixtrans-62-39.3174.1-74.2-178.8000112.9P17 S18 H20 S21 V26 M27 A28 F203 A207 P208P17-L24 HydrophobicContact CG-CD2 3.51Å; S18-L24 WeakPolarHBondContact O-CD1 3.5Å; S18-L24 WeakPolarHBondContact O-CD2 3.49Å; S18-L24 VanDerWaalsContact O-CG 3.28Å; S18-L24 WeakPolarHBondContact O-CG 3.44Å; H20-L24 PolarHBondContact O-N 3.38Å; S21-L24 WeakPolarHBondContact O-CB 3.33Å; S21-L24 PolarHBondContact O-N 3.02Å; S21-L24 VanDerWaalsContact O-N 3.13Å; L24-V26 VanDerWaalsContact C-N 3.32Å; L24-V26 PolarHBondContact O-N 3.37Å; L24-M27 PolarHBondContact O-N 2.92Å; L24-A28 VanDerWaalsContact O-CB 3.24Å; L24-A28 WeakPolarHBondContact O-CB 3.41Å; L24-A28 PolarHBondContact O-N 3.46Å; L24-F203 HydrophobicContact CB-CE1 4.37Å; L24-F203 HydrophobicContact CD2-CE1 4.26Å; L24-A207 HydrophobicContact CD1-CB 4.21Å; L24-P208 HydrophobicContact CD1-CG 3.48Å; L24-P208 VanDerWaalsContact CD1-CG 3.48Å
25V97.6Very high94.6Very high0 Ų023.2 Ų23.20%015%0.15CC..Hα-helixtrans-56.4-49.7175.7175.90000110.3S21 E22 S23 Y29 P66 L70 A200 Y201 F205S21-V25 WeakPolarHBondContact O-CG2 3.47Å; S21-V25 PolarHBondContact O-N 2.94Å; E22-V25 PolarHBondContact O-N 3.49Å; S23-V25 VanDerWaalsContact C-N 3.35Å; S23-V25 PolarHBondContact O-N 3.49Å; V25-Y29 VanDerWaalsContact O-CB 3.31Å; V25-Y29 WeakPolarHBondContact O-CB 3.3Å; V25-Y29 PolarHBondContact O-N 3.23Å; V25-P66 HydrophobicContact CG1-CB 4.33Å; V25-L70 HydrophobicContact CG1-CD2 4.43Å; V25-A200 HydrophobicContact CG1-CB 4.48Å; V25-Y201 HydrophobicContact CG1-CD1 4.16Å; V25-Y201 HydrophobicContact CG1-CD2 3.64Å; V25-Y201 HydrophobicContact CG1-CE1 4.22Å; V25-Y201 HydrophobicContact CG1-CE2 3.7Å; V25-Y201 HydrophobicContact CG1-CG 3.89Å; V25-Y201 HydrophobicContact CG2-CD1 4.3Å; V25-Y201 HydrophobicContact CG2-CG 4.42Å; V25-F205 HydrophobicContact CG2-CD2 4.31Å; V25-F205 HydrophobicContact CG2-CE2 4.24Å
26V97.1Very high94.6Very high0 Ų023.7 Ų23.70%014%0.141CC..Hα-helixtrans-64.6-44.2180176.80000111.5L7 E22 S23 L24 Y29 A30 L37 P54 P66 I69 L70L7-V26 HydrophobicContact CD1-CG1 3.78Å; L7-V26 HydrophobicContact CD2-CB 4.41Å; L7-V26 HydrophobicContact CD2-CG1 3.98Å; E22-V26 PolarHBondContact O-N 3.03Å; S23-V26 PolarHBondContact O-N 3.43Å; L24-V26 VanDerWaalsContact C-N 3.32Å; L24-V26 PolarHBondContact O-N 3.37Å; V26-Y29 PolarHBondContact O-N 2.91Å; V26-A30 VanDerWaalsContact O-CB 3.32Å; V26-A30 WeakPolarHBondContact O-CB 3.22Å; V26-A30 PolarHBondContact O-N 2.99Å; V26-L37 HydrophobicContact CG1-CD2 4.43Å; V26-P54 HydrophobicContact CG2-CB 4.32Å; V26-P54 HydrophobicContact CG2-CG 3.83Å; V26-P66 HydrophobicContact CG2-CB 4.01Å; V26-P66 HydrophobicContact CG2-CG 4.33Å; V26-I69 HydrophobicContact CG1-CG2 3.6Å; V26-I69 HydrophobicContact CG2-CB 4.27Å; V26-I69 HydrophobicContact CG2-CD1 4.15Å; V26-I69 HydrophobicContact CG2-CG2 4.11Å; V26-L70 HydrophobicContact CB-CD1 4.46Å; V26-L70 HydrophobicContact CG2-CD1 3.99Å
27M96Very high94.5Very high17 Ų1724.9 Ų24.98%0.08415%0.147CC..Hα-helixtrans-64.4-44-179.8-691757400112.1L7 P17 S23 L24 A30 K31 V39 F241L7-M27 HydrophobicContact CD2-CG 3.62Å; P17-M27 HydrophobicContact CB-CE 3.67Å; P17-M27 HydrophobicContact CG-CE 4.21Å; S23-M27 WeakPolarHBondContact O-CB 3.5Å; S23-M27 WeakPolarHBondContact O-CG 3.32Å; S23-M27 PolarHBondContact O-N 2.92Å; L24-M27 PolarHBondContact O-N 2.92Å; M27-A30 PolarHBondContact O-N 3.21Å; M27-K31 WeakPolarHBondContact O-CG 2.92Å; M27-K31 PolarHBondContact O-N 2.88Å; M27-V39 HydrophobicContact CE-CG1 4.19Å; M27-V39 HydrophobicContact CE-CG2 4.07Å; M27-F241 HydrophobicContact CB-CE1 4.24Å; M27-F241 HydrophobicContact CB-CZ 4.33Å
28A97.1Very high94.4Very high0 Ų028.7 Ų28.70%016%0.16CC..Hα-helixtrans-64.5-47.8177.100000110.9L24 A30 K31 F32 A200 F203 F241L24-A28 VanDerWaalsContact O-CB 3.24Å; L24-A28 WeakPolarHBondContact O-CB 3.41Å; L24-A28 PolarHBondContact O-N 3.46Å; A28-A30 VanDerWaalsContact C-N 3.33Å; A28-A30 PolarHBondContact O-N 3.35Å; A28-K31 WeakPolarHBondContact O-CB 2.94Å; A28-K31 PolarHBondContact O-N 3.49Å; A28-K31 VanDerWaalsContact O-N 3.09Å; A28-F32 HydrophobicContact CB-CE2 4.25Å; A28-F32 HydrophobicContact CB-CZ 4.08Å; A28-F32 VanDerWaalsContact O-CD1 3.28Å; A28-F32 WeakPolarHBondContact O-CD1 3.32Å; A28-F32 WeakPolarHBondContact O-CG 3.2Å; A28-F32 PolarHBondContact O-N 3.01Å; A28-A200 HydrophobicContact CB-CB 4.11Å; A28-F203 HydrophobicContact CB-CD1 3.67Å; A28-F203 HydrophobicContact CB-CE1 4.13Å; A28-F241 HydrophobicContact CB-CE2 4.42Å; A28-F241 HydrophobicContact CB-CZ 4.25Å
29Y97.5Very high94.3Very high0 Ų031.5 Ų31.50%018%0.177CC..Hα-helixtrans-56.5-47.8176.8-174.2-98.4000112.1V25 V26 K31 F32 C33 L70 L73 R74 N79 A80 T197 A200V25-Y29 VanDerWaalsContact O-CB 3.31Å; V25-Y29 WeakPolarHBondContact O-CB 3.3Å; V25-Y29 PolarHBondContact O-N 3.23Å; V26-Y29 PolarHBondContact O-N 2.91Å; Y29-K31 VanDerWaalsContact C-N 3.28Å; Y29-K31 PolarHBondContact O-N 3.01Å; Y29-F32 PolarHBondContact O-N 3.22Å; Y29-F32 VanDerWaalsContact O-N 3.14Å; Y29-C33 PolarHBondContact O-N 3.45Å; Y29-C33 PolarHBondContact O-SG 3.1Å; Y29-L70 HydrophobicContact CD1-CB 4.45Å; Y29-L70 HydrophobicContact CD1-CD1 4.03Å; Y29-L70 HydrophobicContact CD1-CD2 4.37Å; Y29-L70 HydrophobicContact CD1-CG 3.57Å; Y29-L70 HydrophobicContact CD2-CD2 3.91Å; Y29-L70 HydrophobicContact CD2-CG 4.01Å; Y29-L70 HydrophobicContact CE1-CB 4.35Å; Y29-L70 HydrophobicContact CE1-CG 3.91Å; Y29-L70 HydrophobicContact CE2-CD2 4.32Å; Y29-L70 HydrophobicContact CE2-CG 4.35Å; Y29-L70 HydrophobicContact CG-CD1 4.03Å; Y29-L70 HydrophobicContact CG-CD2 3.91Å; Y29-L70 HydrophobicContact CG-CG 3.59Å; Y29-L73 HydrophobicContact CD1-CD1 3.92Å; Y29-L73 HydrophobicContact CE1-CB 4.19Å; Y29-L73 HydrophobicContact CE1-CD1 4.28Å; Y29-R74 WeakPolarHBondContact OH-CG 3.19Å; Y29-R74 PolarHBondContact OH-NE 3.35Å; Y29-N79 WeakPolarHBondContact OH-CA 3.38Å; Y29-N79 PolarHBondContact OH-OD1 3.09Å; Y29-N79 VanDerWaalsContact OH-OD1 3.14Å; Y29-A80 HydrophobicContact CD2-CB 4.02Å; Y29-A80 HydrophobicContact CE2-CB 3.55Å; Y29-A80 PolarHBondContact OH-N 3.33Å; Y29-T197 WeakPolarHBondContact CE2-OG1 3.36Å; Y29-A200 HydrophobicContact CD2-CB 4.46Å
30A96.1Very high94.3Very high2 Ų233.7 Ų33.72%0.01719%0.189CC..Hα-helixtrans-59.7-38.6177.700000112.3V26 M27 A28 G34 A35 L37V26-A30 VanDerWaalsContact O-CB 3.32Å; V26-A30 WeakPolarHBondContact O-CB 3.22Å; V26-A30 PolarHBondContact O-N 2.99Å; M27-A30 PolarHBondContact O-N 3.21Å; A28-A30 VanDerWaalsContact C-N 3.33Å; A28-A30 PolarHBondContact O-N 3.35Å; A30-G34 CarbonylContact O-C 3.56Å; A30-G34 PolarHBondContact O-N 3.15Å; A30-G34 VanDerWaalsContact O-N 3.1Å; A30-A35 HydrophobicContact CB-CB 4.11Å; A30-A35 PolarHBondContact O-N 3.45Å; A30-L37 HydrophobicContact CB-CB 4.14Å; A30-L37 HydrophobicContact CB-CD2 3.75Å
31K95.5Very high94.2Very high118 Ų11835.5 Ų35.551%0.51320%0.202SC..Hα-helixtrans-67.7-39.2174.4-72.5-64.7-172.5-178.40112.6M27 A28 Y29 G34 Y240 F241M27-K31 WeakPolarHBondContact O-CG 2.92Å; M27-K31 PolarHBondContact O-N 2.88Å; A28-K31 WeakPolarHBondContact O-CB 2.94Å; A28-K31 PolarHBondContact O-N 3.49Å; A28-K31 VanDerWaalsContact O-N 3.09Å; Y29-K31 VanDerWaalsContact C-N 3.28Å; Y29-K31 PolarHBondContact O-N 3.01Å; K31-G34 PolarHBondContact O-N 3.29Å; K31-Y240 HydrophobicContact CB-CD1 3.97Å; K31-Y240 HydrophobicContact CB-CG 4.33Å; K31-F241 HydrophobicContact CG-CE1 3.92Å; K31-F241 HydrophobicContact CG-CZ 4.08Å
32F96.1Very high93.7Very high25 Ų2535 Ų3511%0.1120%0.198CC..Hα-helixtrans-64.7-41.3179.8-62.7-15.5000112.5A28 Y29 A80 P195 D199 A200 I236 Y240A28-F32 HydrophobicContact CB-CE2 4.25Å; A28-F32 HydrophobicContact CB-CZ 4.08Å; A28-F32 VanDerWaalsContact O-CD1 3.28Å; A28-F32 WeakPolarHBondContact O-CD1 3.32Å; A28-F32 WeakPolarHBondContact O-CG 3.2Å; A28-F32 PolarHBondContact O-N 3.01Å; Y29-F32 PolarHBondContact O-N 3.22Å; Y29-F32 VanDerWaalsContact O-N 3.14Å; F32-A80 HydrophobicContact CB-CB 4.07Å; F32-P195 HydrophobicContact CB-CB 4.07Å; F32-P195 HydrophobicContact CB-CG 3.81Å; F32-P195 HydrophobicContact CD1-CB 3.72Å; F32-P195 HydrophobicContact CD1-CG 3.86Å; F32-P195 HydrophobicContact CD2-CB 3.63Å; F32-P195 HydrophobicContact CD2-CG 4.32Å; F32-P195 HydrophobicContact CE1-CB 3.98Å; F32-P195 HydrophobicContact CE2-CB 3.86Å; F32-P195 HydrophobicContact CG-CB 3.55Å; F32-P195 HydrophobicContact CG-CG 3.76Å; F32-P195 HydrophobicContact CZ-CB 4.04Å; F32-D199 HydrophobicContact CE2-CB 3.89Å; F32-D199 HydrophobicContact CZ-CB 4.43Å; F32-A200 HydrophobicContact CD2-CB 4.02Å; F32-A200 HydrophobicContact CE2-CB 3.76Å; F32-I236 HydrophobicContact CE1-CG2 4.2Å; F32-I236 HydrophobicContact CZ-CD1 4.04Å; F32-I236 HydrophobicContact CZ-CG1 4.3Å; F32-I236 HydrophobicContact CZ-CG2 4.17Å; F32-Y240 AromaticContact CD1-CD1 3.9Å; F32-Y240 HydrophobicContact CD1-CD1 3.9Å; F32-Y240 HydrophobicContact CD1-CD2 4.12Å; F32-Y240 AromaticContact CD1-CE1 3.73Å; F32-Y240 HydrophobicContact CD1-CE1 3.73Å; F32-Y240 AromaticContact CD1-CE2 3.97Å; F32-Y240 HydrophobicContact CD1-CE2 3.97Å; F32-Y240 HydrophobicContact CD1-CG 4.09Å; F32-Y240 AromaticContact CD1-CZ 3.78Å; F32-Y240 HydrophobicContact CE1-CD1 4.22Å; F32-Y240 AromaticContact CE1-CD2 3.62Å; F32-Y240 HydrophobicContact CE1-CD2 3.62Å; F32-Y240 HydrophobicContact CE1-CE1 4.22Å; F32-Y240 AromaticContact CE1-CE2 3.62Å; F32-Y240 HydrophobicContact CE1-CE2 3.62Å; F32-Y240 AromaticContact CE1-CG 3.93Å; F32-Y240 HydrophobicContact CE1-CG 3.93Å; F32-Y240 AromaticContact CE1-CZ 3.94Å
33C94.1Very high93Very high25 Ų2535.5 Ų35.517%0.16920%0.203CC..THydrogen-bonded Turntrans-92.55.3178.664.40000114.3Y29 A35 A80Y29-C33 PolarHBondContact O-N 3.45Å; Y29-C33 PolarHBondContact O-SG 3.1Å; C33-A35 VanDerWaalsContact C-N 3.3Å; C33-A35 PolarHBondContact O-N 2.93Å; C33-A80 HydrophobicContact CB-CB 4.28Å
34G92.8Very high91.8Very high57 Ų5740.9 Ų40.959%0.58823%0.231SC*.THydrogen-bonded Turntrans67.523.7178.300000114.8A30 K31A30-G34 CarbonylContact O-C 3.56Å; A30-G34 PolarHBondContact O-N 3.15Å; A30-G34 VanDerWaalsContact O-N 3.1Å; K31-G34 PolarHBondContact O-N 3.29Å
35A92.8Very high90.7Very high10 Ų1045.7 Ų45.78%0.08326%0.261CS..  trans-67.1131.617900000111.4A30 C33 L37 L73 Y78A30-A35 HydrophobicContact CB-CB 4.11Å; A30-A35 PolarHBondContact O-N 3.45Å; C33-A35 VanDerWaalsContact C-N 3.3Å; C33-A35 PolarHBondContact O-N 2.93Å; A35-L37 VanDerWaalsContact C-N 3.26Å; A35-L37 PolarHBondContact O-N 2.88Å; A35-L73 HydrophobicContact CB-CD2 4.38Å; A35-Y78 HydrophobicContact CB-CD1 3.76Å; A35-Y78 HydrophobicContact CB-CD2 4.13Å; A35-Y78 HydrophobicContact CB-CE1 4.26Å; A35-Y78 HydrophobicContact CB-CG 3.7Å
36P90.6Very high89.6Confident81 Ų8148.1 Ų48.153%0.52627%0.27SS..  trans-77.377.6179.632.6-34.9000110.2Y78P36-Y78 WeakPolarHBondContact CD-OH 3.29Å
37L91.3Very high88.2Confident33 Ų3358.8 Ų58.817%0.17331%0.31CS..EExtended strand (participates in β ladder)trans-93118.7-178.2-16568.5000110.8L5 L7 V26 A30 A35 L56L5-L37 HydrophobicContact CB-CD1 3.92Å; L7-L37 HydrophobicContact CB-CD1 3.89Å; L7-L37 HydrophobicContact CB-CD2 3.76Å; L7-L37 HydrophobicContact CB-CG 3.82Å; L7-L37 HydrophobicContact CD2-CD2 3.73Å; L7-L37 HydrophobicContact CG-CD2 4.26Å; V26-L37 HydrophobicContact CG1-CD2 4.43Å; A30-L37 HydrophobicContact CB-CB 4.14Å; A30-L37 HydrophobicContact CB-CD2 3.75Å; A35-L37 VanDerWaalsContact C-N 3.26Å; A35-L37 PolarHBondContact O-N 2.88Å; L37-L56 HydrophobicContact CD1-CD1 3.55Å
38K92.1Very high86.9Confident114 Ų11459 Ų5950%0.49632%0.318SS..EExtended strand (participates in β ladder)trans-86.1118.8169.3-178.9179165-157.80108.9L5 E6 L7L5-K38 PolarHBondContact O-N 3.11Å; E6-K38 CarbonylContact C-O 3.55Å; E6-K38 WeakPolarHBondContact CA-O 3.36Å; E6-K38 HydrophobicContact CG-CB 4.42Å; E6-K38 HydrophobicContact CG-CD 4.34Å; E6-K38 IonicContact OE1-NZ 2.79Å; E6-K38 PolarHBondContact OE1-NZ 3.14Å; L7-K38 PolarHBondContact N-O 3.36Å
39V91.4Very high85.1Confident59 Ų5962.8 Ų62.836%0.35834%0.344SS..EExtended strand (participates in β ladder)trans-92.5116.9-176.9-1780000109.4C9 M27 V41C9-V39 WeakPolarHBondContact SG-CG1 3.24Å; M27-V39 HydrophobicContact CE-CG1 4.19Å; M27-V39 HydrophobicContact CE-CG2 4.07Å; V39-V41 HydrophobicContact CG1-CG2 4.31Å
40N90.3Very high83.6Confident50 Ų5071.3 Ų71.327%0.26738%0.376SS..EExtended strand (participates in β ladder)trans-101.5102.9173.4-65.5-19.2000108.1E6 L7 S8 C9E6-N40 PolarHBondContact OE2-ND2 3.17Å; L7-N40 PolarHBondContact O-N 3.25Å; S8-N40 VanDerWaalsContact CA-O 3.31Å; S8-N40 WeakPolarHBondContact CA-O 3.31Å; C9-N40 PolarHBondContact N-O 3.49Å; C9-N40 VanDerWaalsContact N-O 3.13Å
41V89.9Confident82.4Confident73 Ų7371.5 Ų71.544%0.44238%0.378SS..EExtended strand (participates in β ladder)trans-72.1133.1177.8173.70000109.4C9 V39 D43C9-V41 WeakPolarHBondContact O-CA 3.47Å; V39-V41 HydrophobicContact CG1-CG2 4.31Å; V41-D43 PolarHBondContact O-N 2.95Å
42I85.1Confident81.6Confident5 Ų570.2 Ų70.23%0.02638%0.377CS..  trans-55.8127.2170.2-71.9174000109C9 W10 W46 V53C9-I42 WeakPolarHBondContact O-CG1 3.31Å; C9-I42 PolarHBondContact O-N 3.06Å; W10-I42 HydrophobicContact CD2-CD1 3.97Å; W10-I42 HydrophobicContact CE3-CB 4.33Å; W10-I42 HydrophobicContact CE3-CD1 3.98Å; W10-I42 HydrophobicContact CE3-CG2 4.2Å; W10-I42 HydrophobicContact CH2-CD1 4.28Å; W10-I42 HydrophobicContact CZ2-CD1 4.29Å; W10-I42 HydrophobicContact CZ3-CB 4.49Å; W10-I42 HydrophobicContact CZ3-CD1 4.14Å; W10-I42 HydrophobicContact CZ3-CG2 3.88Å; I42-W46 HydrophobicContact CD1-CD2 4.34Å; I42-W46 HydrophobicContact CD1-CZ2 4.39Å; I42-W46 HydrophobicContact CG1-CD2 3.98Å; I42-W46 HydrophobicContact CG1-CE3 4.25Å; I42-W46 HydrophobicContact CG1-CG 4.25Å; I42-W46 HydrophobicContact CG2-CB 3.72Å; I42-W46 HydrophobicContact CG2-CD2 4.32Å; I42-W46 HydrophobicContact CG2-CG 3.7Å; I42-V53 HydrophobicContact CD1-CB 4.27Å; I42-V53 HydrophobicContact CD1-CG1 3.74Å; I42-V53 HydrophobicContact CD1-CG2 3.68Å
43D78.4Confident81.1Confident77 Ų7769.2 Ų69.241%0.41237%0.373SS..  trans-130.1-168.4177.772.10.3000111.5V41 T45 W46 Q129V41-D43 PolarHBondContact O-N 2.95Å; D43-T45 PolarHBondContact O-N 3.41Å; D43-T45 WeakPolarHBondContact OD1-CA 3.35Å; D43-T45 VanDerWaalsContact OD1-CB 3.32Å; D43-T45 WeakPolarHBondContact OD1-CB 3.49Å; D43-T45 PolarHBondContact OD1-N 3.13Å; D43-T45 PolarHBondContact OD1-OG1 3.09Å; D43-W46 WeakPolarHBondContact O-CB 3.44Å; D43-W46 PolarHBondContact O-N 3.47Å; D43-Q129 CarbonylContact C-O 3.59Å
44N69.5Low81.1Confident112 Ų11268 Ų6860%0.59937%0.365SS*.THydrogen-bonded Turntrans-64-5.6178.8-66.6-32.4000114.5P131N44-P131 VanDerWaalsContact O-CB 3.23Å; N44-P131 WeakPolarHBondContact O-CB 3.42Å; N44-P131 WeakPolarHBondContact O-CG 3.19Å
45T72.7Confident81Confident101 Ų10166.6 Ų66.662%0.6234%0.344SS*.THydrogen-bonded Turntrans-94.5-5.7175.174.70000112.8D43 R47D43-T45 PolarHBondContact O-N 3.41Å; D43-T45 WeakPolarHBondContact OD1-CA 3.35Å; D43-T45 VanDerWaalsContact OD1-CB 3.32Å; D43-T45 WeakPolarHBondContact OD1-CB 3.49Å; D43-T45 PolarHBondContact OD1-N 3.13Å; D43-T45 PolarHBondContact OD1-OG1 3.09Å; T45-R47 WeakPolarHBondContact O-CG 3.46Å; T45-R47 PolarHBondContact O-N 3.1Å
46W75.3Confident81Confident52 Ų5266.2 Ų66.220%0.19734%0.34CS..  trans-62.5129-175-175.9-116.7000113.1I42 D43 G48 V53 I55I42-W46 HydrophobicContact CD1-CD2 4.34Å; I42-W46 HydrophobicContact CD1-CZ2 4.39Å; I42-W46 HydrophobicContact CG1-CD2 3.98Å; I42-W46 HydrophobicContact CG1-CE3 4.25Å; I42-W46 HydrophobicContact CG1-CG 4.25Å; I42-W46 HydrophobicContact CG2-CB 3.72Å; I42-W46 HydrophobicContact CG2-CD2 4.32Å; I42-W46 HydrophobicContact CG2-CG 3.7Å; D43-W46 WeakPolarHBondContact O-CB 3.44Å; D43-W46 PolarHBondContact O-N 3.47Å; W46-G48 VanDerWaalsContact CE2-CA 3.48Å; W46-G48 PolarHBondContact NE1-O 2.97Å; W46-V53 HydrophobicContact CH2-CG1 4.32Å; W46-V53 HydrophobicContact CZ2-CG1 3.97Å; W46-I55 HydrophobicContact CH2-CD1 4.23Å
47R67.4Low81Confident223 Ų22364.3 Ų64.384%0.84233%0.327SS*.  trans-112.12.8179.8-54.5-165.6-165.9-85.91.2113.8T45 S49T45-R47 WeakPolarHBondContact O-CG 3.46Å; T45-R47 PolarHBondContact O-N 3.1Å; R47-S49 PolarHBondContact O-N 2.91Å
48G69.2Low80.9Confident23 Ų2363.8 Ų63.824%0.23733%0.325CS..  trans-69.3104.9-179.800000111.3W46 R50W46-G48 VanDerWaalsContact CE2-CA 3.48Å; W46-G48 PolarHBondContact NE1-O 2.97Å; G48-R50 VanDerWaalsContact C-N 3.28Å; G48-R50 PolarHBondContact O-N 2.98Å
49S59.6Low80.6Confident78 Ų7865.2 Ų65.255%0.54533%0.334SS..THydrogen-bonded Turntrans-73.2-14.2-172.160.10000115R47R47-S49 PolarHBondContact O-N 2.91Å
50R65.9Low80.1Confident179 Ų17969.1 Ų69.168%0.67535%0.353SS*.THydrogen-bonded Turntrans-98.4-21.8-176.1-56.8-176.296.8-172.17.9114.2G48 D52G48-R50 VanDerWaalsContact C-N 3.28Å; G48-R50 PolarHBondContact O-N 2.98Å; R50-D52 HydrophobicContact CB-CB 4.38Å; R50-D52 WeakPolarHBondContact CB-OD2 3.33Å; R50-D52 WeakPolarHBondContact CD-OD2 3.49Å; R50-D52 IonicContact CZ-OD2 3.15Å; R50-D52 IonicContact NE-OD2 3.08Å; R50-D52 IonicContact NH1-OD2 2.75Å; R50-D52 PolarHBondContact O-N 2.85Å
51G70.8Confident79.9Confident7 Ų771.1 Ų71.17%0.07236%0.363CS..  trans71.310.1-172.900000114.5V53G51-V53 PolarHBondContact O-N 3.04Å
52D77.6Confident79.9Confident91 Ų9174.2 Ų74.249%0.48738%0.375SS..  trans-77.684-179.3-60.6-30.4000110R50 I55R50-D52 HydrophobicContact CB-CB 4.38Å; R50-D52 WeakPolarHBondContact CB-OD2 3.33Å; R50-D52 WeakPolarHBondContact CD-OD2 3.49Å; R50-D52 IonicContact CZ-OD2 3.15Å; R50-D52 IonicContact NE-OD2 3.08Å; R50-D52 IonicContact NH1-OD2 2.75Å; R50-D52 PolarHBondContact O-N 2.85Å; D52-I55 WeakPolarHBondContact O-CD1 3.32Å; D52-I55 VanDerWaalsContact O-CG1 3.29Å; D52-I55 WeakPolarHBondContact O-CG1 3.47Å
53V87.2Confident80.2Confident4 Ų475.3 Ų75.32%0.02438%0.381CS..  trans-123.2150.8169.5-69.40000109.5W10 H20 I42 W46 G51 I55W10-V53 HydrophobicContact CD2-CG2 4.25Å; W10-V53 HydrophobicContact CG-CG2 3.96Å; H20-V53 PolarHBondContact CE1-O 3.14Å; H20-V53 PolarHBondContact ND1-O 3.48Å; I42-V53 HydrophobicContact CD1-CB 4.27Å; I42-V53 HydrophobicContact CD1-CG1 3.74Å; I42-V53 HydrophobicContact CD1-CG2 3.68Å; W46-V53 HydrophobicContact CH2-CG1 4.32Å; W46-V53 HydrophobicContact CZ2-CG1 3.97Å; G51-V53 PolarHBondContact O-N 3.04Å; V53-I55 HydrophobicContact CG1-CD1 4.14Å; V53-I55 HydrophobicContact CG1-CG1 4.19Å
54P92.7Very high80.8Confident0 Ų074.3 Ų74.30%038%0.38CS..  cis-75.4145.515.628.5-34.5000115.7L7 S8 E22 V26 P66 I69L7-P54 HydrophobicContact CD1-CB 3.72Å; S8-P54 WeakPolarHBondContact O-CA 3.35Å; E22-P54 HydrophobicContact CB-CG 4.17Å; V26-P54 HydrophobicContact CG2-CB 4.32Å; V26-P54 HydrophobicContact CG2-CG 3.83Å; P54-P66 HydrophobicContact CG-CG 4.18Å; P54-I69 HydrophobicContact CB-CD1 4.06Å; P54-I69 HydrophobicContact CG-CD1 4.1Å
55I92.3Very high81.8Confident27 Ų2773.8 Ų73.814%0.13837%0.374CS..EExtended strand (participates in β ladder)trans-123.7123.6168.8-59.8167.3000108.4S8 W46 D52 V53 M62S8-I55 PolarHBondContact N-O 3.39Å; S8-I55 PolarHBondContact O-N 2.82Å; S8-I55 VanDerWaalsContact O-N 3.08Å; W46-I55 HydrophobicContact CH2-CD1 4.23Å; D52-I55 WeakPolarHBondContact O-CD1 3.32Å; D52-I55 VanDerWaalsContact O-CG1 3.29Å; D52-I55 WeakPolarHBondContact O-CG1 3.47Å; V53-I55 HydrophobicContact CG1-CD1 4.14Å; V53-I55 HydrophobicContact CG1-CG1 4.19Å; I55-M62 HydrophobicContact CG2-CE 3.88Å
56L92.4Very high82.8Confident1 Ų169.4 Ų69.41%0.00535%0.348CS..EExtended strand (participates in β ladder)trans-90.7122169.1-174.475.9000109L5 E6 L37 T58 M62 V63 I69 F72L5-L56 HydrophobicContact CB-CD1 4.34Å; E6-L56 CarbonylContact O-C 3.27Å; E6-L56 WeakPolarHBondContact O-CA 3.46Å; L37-L56 HydrophobicContact CD1-CD1 3.55Å; L56-T58 HydrophobicContact CD2-CG2 4.48Å; L56-M62 CarbonylContact O-C 3.38Å; L56-M62 WeakPolarHBondContact O-CA 3.26Å; L56-V63 PolarHBondContact N-O 3.5Å; L56-V63 PolarHBondContact O-N 2.6Å; L56-I69 HydrophobicContact CB-CD1 4.16Å; L56-I69 HydrophobicContact CB-CG1 3.93Å; L56-I69 HydrophobicContact CB-CG2 4.03Å; L56-I69 HydrophobicContact CD2-CG2 4.1Å; L56-I69 HydrophobicContact CG-CG2 4.5Å; L56-F72 HydrophobicContact CD2-CD1 3.4Å; L56-F72 VanDerWaalsContact CD2-CD1 3.4Å; L56-F72 HydrophobicContact CD2-CE1 3.77Å; L56-F72 HydrophobicContact CD2-CG 4.2Å
57T90.9Very high83.7Confident41 Ų4169.2 Ų69.225%0.25236%0.357SS..EExtended strand (participates in β ladder)trans-109130.8173.6-56.20000109.2E6 M62E6-T57 PolarHBondContact N-O 3.33Å; E6-T57 PolarHBondContact O-N 2.87Å; T57-M62 HydrophobicContact CG2-CG 4.25Å
58T88.9Confident85Confident22 Ų2264 Ų6414%0.13534%0.34CS..  trans-122.7175.9168.3680000108.6L5 L56 D60 N61 F72L5-T58 HydrophobicContact CD2-CG2 3.58Å; L56-T58 HydrophobicContact CD2-CG2 4.48Å; T58-D60 VanDerWaalsContact C-N 3.28Å; T58-D60 PolarHBondContact O-N 3.01Å; T58-N61 PolarHBondContact N-O 2.82Å; T58-N61 PolarHBondContact O-N 3.48Å; T58-N61 WeakPolarHBondContact OG1-CB 3.32Å; T58-N61 PolarHBondContact OG1-N 2.84Å; T58-N61 PolarHBondContact OG1-O 3.36Å; T58-F72 HydrophobicContact CG2-CE1 3.79Å; T58-F72 HydrophobicContact CG2-CZ 3.7Å
59E84.5Confident86.3Confident145 Ų14562.9 Ų62.968%0.67833%0.329SS*.SBendtrans-49.8-45.9179.7-73.7172.1-168.700113.2A3A3-E59 HydrophobicContact CB-CB 4.44Å; A3-E59 HydrophobicContact CB-CG 3.75Å; A3-E59 WeakPolarHBondContact CB-OE1 3.33Å
60D82.4Confident88Confident141 Ų14159.2 Ų59.275%0.75430%0.303SS*.SBendtrans-108.9-6.1-174.3-58.6-47.6000115.3T58T58-D60 VanDerWaalsContact C-N 3.28Å; T58-D60 PolarHBondContact O-N 3.01Å
61N85Confident89.3Confident91 Ų9154.3 Ų54.349%0.48729%0.291SS..  trans-142.2144.5-167.1-66.5-70.4000112.8T58T58-N61 PolarHBondContact N-O 2.82Å; T58-N61 PolarHBondContact O-N 3.48Å; T58-N61 WeakPolarHBondContact OG1-CB 3.32Å; T58-N61 PolarHBondContact OG1-N 2.84Å; T58-N61 PolarHBondContact OG1-O 3.36Å
62M89.8Confident90.5Very high139 Ų13955.4 Ų55.469%0.68529%0.294SS*.EExtended strand (participates in β ladder)trans-119.8120.8166.8-67.5-179.369.600109.1I55 L56 T57I55-M62 HydrophobicContact CG2-CE 3.88Å; L56-M62 CarbonylContact O-C 3.38Å; L56-M62 WeakPolarHBondContact O-CA 3.26Å; T57-M62 HydrophobicContact CG2-CG 4.25Å
63V91.7Very high91.3Very high27 Ų2751.1 Ų51.116%0.16427%0.27CS..EExtended strand (participates in β ladder)trans-120.4122.1-178.7-174.30000109L56 K68 I69 F72L56-V63 PolarHBondContact N-O 3.5Å; L56-V63 PolarHBondContact O-N 2.6Å; V63-K68 HydrophobicContact CG1-CB 3.63Å; V63-I69 HydrophobicContact CB-CG1 4.34Å; V63-I69 HydrophobicContact CG1-CG1 4.01Å; V63-I69 WeakPolarHBondContact O-CG1 3.23Å; V63-F72 HydrophobicContact CG2-CD2 4.2Å
64S90.1Very high91.6Very high56 Ų5654.7 Ų54.739%0.39228%0.283SS..EExtended strand (participates in β ladder)trans-108.3164.5172.963.10000111K68S64-K68 WeakPolarHBondContact O-CB 3.32Å
65Q91.6Very high91.6Very high101 Ų10162.7 Ų62.747%0.47232%0.318SS..SBendtrans78.4129.4-175.3-51.6173.9-3800113.8A67 K68 I69Q65-A67 PolarHBondContact O-N 3.17Å; Q65-K68 HydrophobicContact CB-CD 4.48Å; Q65-K68 PolarHBondContact O-N 2.79Å; Q65-K68 VanDerWaalsContact O-N 3.12Å; Q65-I69 WeakPolarHBondContact O-CG1 3.39Å; Q65-I69 PolarHBondContact O-N 3.29Å
66P93.7Very high91.5Very high9 Ų966.2 Ų66.26%0.05833%0.334CS..Hα-helixtrans-51.7-48.4-177.8-30.536.3000114.1E22 V25 V26 P54 K68 I69 L70E22-P66 HydrophobicContact CB-CG 3.43Å; E22-P66 VanDerWaalsContact CB-CG 3.43Å; E22-P66 HydrophobicContact CG-CG 3.77Å; E22-P66 WeakPolarHBondContact OE2-CD 3.43Å; V25-P66 HydrophobicContact CG1-CB 4.33Å; V26-P66 HydrophobicContact CG2-CB 4.01Å; V26-P66 HydrophobicContact CG2-CG 4.33Å; P54-P66 HydrophobicContact CG-CG 4.18Å; P66-K68 VanDerWaalsContact C-N 3.29Å; P66-K68 PolarHBondContact O-N 3.2Å; P66-I69 PolarHBondContact O-N 3.02Å; P66-I69 VanDerWaalsContact O-N 3.17Å; P66-L70 WeakPolarHBondContact O-CB 3.21Å; P66-L70 VanDerWaalsContact O-CD1 3.32Å; P66-L70 WeakPolarHBondContact O-CD1 3.45Å; P66-L70 PolarHBondContact O-N 3.36Å
67A94.2Very high91.5Very high48 Ų4873.9 Ų73.940%0.39737%0.367SS..Hα-helixtrans-59.4-39.4-17800000112.7Q65 N71Q65-A67 PolarHBondContact O-N 3.17Å; A67-N71 WeakPolarHBondContact O-CB 3.38Å; A67-N71 VanDerWaalsContact O-CG 3.22Å; A67-N71 PolarHBondContact O-N 3.31Å; A67-N71 PolarHBondContact O-ND2 2.83Å; A67-N71 VanDerWaalsContact O-ND2 3.11Å
68K95Very high91.6Very high113 Ų11375 Ų7549%0.49137%0.368SS..Hα-helixtrans-73-39.9177.9-67.6-179.6176.41590111.6V63 S64 Q65 P66 N71 F72V63-K68 HydrophobicContact CG1-CB 3.63Å; S64-K68 WeakPolarHBondContact O-CB 3.32Å; Q65-K68 HydrophobicContact CB-CD 4.48Å; Q65-K68 PolarHBondContact O-N 2.79Å; Q65-K68 VanDerWaalsContact O-N 3.12Å; P66-K68 VanDerWaalsContact C-N 3.29Å; P66-K68 PolarHBondContact O-N 3.2Å; K68-N71 PolarHBondContact O-N 3.41Å; K68-F72 WeakPolarHBondContact O-CB 3.44Å; K68-F72 PolarHBondContact O-N 2.97Å
69I95.5Very high91.8Very high0 Ų075.6 Ų75.60%037%0.37CS..Hα-helixtrans-63.2-47.9176.5-66.6169.6000110.5V26 P54 L56 V63 Q65 P66 N71 F72 L73V26-I69 HydrophobicContact CG1-CG2 3.6Å; V26-I69 HydrophobicContact CG2-CB 4.27Å; V26-I69 HydrophobicContact CG2-CD1 4.15Å; V26-I69 HydrophobicContact CG2-CG2 4.11Å; P54-I69 HydrophobicContact CB-CD1 4.06Å; P54-I69 HydrophobicContact CG-CD1 4.1Å; L56-I69 HydrophobicContact CB-CD1 4.16Å; L56-I69 HydrophobicContact CB-CG1 3.93Å; L56-I69 HydrophobicContact CB-CG2 4.03Å; L56-I69 HydrophobicContact CD2-CG2 4.1Å; L56-I69 HydrophobicContact CG-CG2 4.5Å; V63-I69 HydrophobicContact CB-CG1 4.34Å; V63-I69 HydrophobicContact CG1-CG1 4.01Å; V63-I69 WeakPolarHBondContact O-CG1 3.23Å; Q65-I69 WeakPolarHBondContact O-CG1 3.39Å; Q65-I69 PolarHBondContact O-N 3.29Å; P66-I69 PolarHBondContact O-N 3.02Å; P66-I69 VanDerWaalsContact O-N 3.17Å; I69-N71 VanDerWaalsContact C-N 3.34Å; I69-N71 PolarHBondContact O-N 3.17Å; I69-F72 WeakPolarHBondContact O-CB 3.31Å; I69-F72 PolarHBondContact O-N 3.1Å; I69-F72 VanDerWaalsContact O-N 3.11Å; I69-L73 HydrophobicContact CG2-CD1 4.4Å; I69-L73 WeakPolarHBondContact O-CG 3.49Å; I69-L73 PolarHBondContact O-N 2.97Å
70L95.3Very high92.2Very high1 Ų169.5 Ų69.51%0.00534%0.344CS..Hα-helixtrans-59-45.2175.5-91.958.3000111.2V25 V26 Y29 P66 F72 L73 R74 T197 Y201V25-L70 HydrophobicContact CG1-CD2 4.43Å; V26-L70 HydrophobicContact CB-CD1 4.46Å; V26-L70 HydrophobicContact CG2-CD1 3.99Å; Y29-L70 HydrophobicContact CD1-CB 4.45Å; Y29-L70 HydrophobicContact CD1-CD1 4.03Å; Y29-L70 HydrophobicContact CD1-CD2 4.37Å; Y29-L70 HydrophobicContact CD1-CG 3.57Å; Y29-L70 HydrophobicContact CD2-CD2 3.91Å; Y29-L70 HydrophobicContact CD2-CG 4.01Å; Y29-L70 HydrophobicContact CE1-CB 4.35Å; Y29-L70 HydrophobicContact CE1-CG 3.91Å; Y29-L70 HydrophobicContact CE2-CD2 4.32Å; Y29-L70 HydrophobicContact CE2-CG 4.35Å; Y29-L70 HydrophobicContact CG-CD1 4.03Å; Y29-L70 HydrophobicContact CG-CD2 3.91Å; Y29-L70 HydrophobicContact CG-CG 3.59Å; P66-L70 WeakPolarHBondContact O-CB 3.21Å; P66-L70 VanDerWaalsContact O-CD1 3.32Å; P66-L70 WeakPolarHBondContact O-CD1 3.45Å; P66-L70 PolarHBondContact O-N 3.36Å; L70-F72 VanDerWaalsContact C-N 3.29Å; L70-F72 PolarHBondContact O-N 3.11Å; L70-L73 PolarHBondContact O-N 3.07Å; L70-R74 WeakPolarHBondContact O-CG 3.49Å; L70-R74 PolarHBondContact O-N 3.03Å; L70-T197 HydrophobicContact CD2-CG2 3.93Å; L70-Y201 HydrophobicContact CD2-CD2 4.43Å; L70-Y201 HydrophobicContact CD2-CE2 3.68Å
71N94.7Very high92.7Very high76 Ų7664.1 Ų64.141%0.40632%0.315SS..Hα-helixtrans-60.7-37.3174.5-79.1-29.8000113.1A67 K68 I69 R74 K75A67-N71 WeakPolarHBondContact O-CB 3.38Å; A67-N71 VanDerWaalsContact O-CG 3.22Å; A67-N71 PolarHBondContact O-N 3.31Å; A67-N71 PolarHBondContact O-ND2 2.83Å; A67-N71 VanDerWaalsContact O-ND2 3.11Å; K68-N71 PolarHBondContact O-N 3.41Å; I69-N71 VanDerWaalsContact C-N 3.34Å; I69-N71 PolarHBondContact O-N 3.17Å; N71-R74 PolarHBondContact OD1-NH1 3.36Å; N71-K75 WeakPolarHBondContact O-CG 3.48Å; N71-K75 PolarHBondContact O-N 3.05Å
72F94.6Very high92.9Very high31 Ų3166.7 Ų66.714%0.13632%0.32CS..Hα-helixtrans-63.6-47.4173.9179.3-87.4000111.1L5 L56 T58 V63 K68 I69 L70 R74 K75 Q76L5-F72 HydrophobicContact CD2-CE1 3.93Å; L56-F72 HydrophobicContact CD2-CD1 3.4Å; L56-F72 VanDerWaalsContact CD2-CD1 3.4Å; L56-F72 HydrophobicContact CD2-CE1 3.77Å; L56-F72 HydrophobicContact CD2-CG 4.2Å; T58-F72 HydrophobicContact CG2-CE1 3.79Å; T58-F72 HydrophobicContact CG2-CZ 3.7Å; V63-F72 HydrophobicContact CG2-CD2 4.2Å; K68-F72 WeakPolarHBondContact O-CB 3.44Å; K68-F72 PolarHBondContact O-N 2.97Å; I69-F72 WeakPolarHBondContact O-CB 3.31Å; I69-F72 PolarHBondContact O-N 3.1Å; I69-F72 VanDerWaalsContact O-N 3.11Å; L70-F72 VanDerWaalsContact C-N 3.29Å; L70-F72 PolarHBondContact O-N 3.11Å; F72-R74 VanDerWaalsContact C-N 3.33Å; F72-R74 PolarHBondContact O-N 3.09Å; F72-K75 WeakPolarHBondContact O-CB 3.41Å; F72-K75 PolarHBondContact O-N 3.43Å; F72-K75 VanDerWaalsContact O-N 3.13Å; F72-Q76 HydrophobicContact CD1-CG 4.25Å; F72-Q76 HydrophobicContact CE1-CG 3.83Å; F72-Q76 HydrophobicContact CZ-CG 4.19Å; F72-Q76 PolarHBondContact O-N 3.24Å; F72-Q76 VanDerWaalsContact O-N 3.17Å
73L93.8Very high92.8Very high0 Ų067 Ų670%032%0.319CS..Hα-helixtrans-59.3-41.9176.8-68175.9000112.1L5 Y29 A35 I69 L70 K75 Q76 K77 Y78L5-L73 HydrophobicContact CD1-CD2 3.8Å; Y29-L73 HydrophobicContact CD1-CD1 3.92Å; Y29-L73 HydrophobicContact CE1-CB 4.19Å; Y29-L73 HydrophobicContact CE1-CD1 4.28Å; A35-L73 HydrophobicContact CB-CD2 4.38Å; I69-L73 HydrophobicContact CG2-CD1 4.4Å; I69-L73 WeakPolarHBondContact O-CG 3.49Å; I69-L73 PolarHBondContact O-N 2.97Å; L70-L73 PolarHBondContact O-N 3.07Å; L73-K75 VanDerWaalsContact C-N 3.32Å; L73-K75 PolarHBondContact O-N 3.06Å; L73-Q76 CarbonylContact O-C 3.59Å; L73-Q76 WeakPolarHBondContact O-CA 3.45Å; L73-Q76 WeakPolarHBondContact O-CB 3.49Å; L73-Q76 PolarHBondContact O-N 3.35Å; L73-K77 PolarHBondContact O-N 3.27Å; L73-Y78 CarbonylContact C-O 3.56Å; L73-Y78 VanDerWaalsContact C-O 3.27Å; L73-Y78 WeakPolarHBondContact O-CB 3.15Å; L73-Y78 PolarHBondContact O-N 2.83Å
74R93.7Very high92.8Very high79 Ų7967.5 Ų67.530%0.29832%0.321SS..Hα-helixtrans-58.5-41.6174.8-69.3173.1-163.1159.5-7.3112.5Y29 L70 N71 F72 Q76 K77 Y78 N79 D81 T197Y29-R74 WeakPolarHBondContact OH-CG 3.19Å; Y29-R74 PolarHBondContact OH-NE 3.35Å; L70-R74 WeakPolarHBondContact O-CG 3.49Å; L70-R74 PolarHBondContact O-N 3.03Å; N71-R74 PolarHBondContact OD1-NH1 3.36Å; F72-R74 VanDerWaalsContact C-N 3.33Å; F72-R74 PolarHBondContact O-N 3.09Å; R74-Q76 PolarHBondContact O-N 2.92Å; R74-K77 PolarHBondContact O-N 2.99Å; R74-Y78 WeakPolarHBondContact CA-O 3.37Å; R74-Y78 PolarHBondContact N-O 3.1Å; R74-N79 HydrophobicContact CG-CB 4.22Å; R74-D81 IonicContact CZ-OD2 3.71Å; R74-D81 IonicContact NE-OD2 3.4Å; R74-D81 IonicContact NH2-OD2 3.75Å; R74-T197 PolarHBondContact NH2-OG1 3.03Å; R74-T197 VanDerWaalsContact NH2-OG1 3.09Å
75K92.9Very high93.1Very high169 Ų16967.6 Ų67.674%0.73532%0.321SS*.Hα-helixtrans-62.9-32.2175.6-70.4175.6-178.7-176.40111.9N71 F72 L73 K77N71-K75 WeakPolarHBondContact O-CG 3.48Å; N71-K75 PolarHBondContact O-N 3.05Å; F72-K75 WeakPolarHBondContact O-CB 3.41Å; F72-K75 PolarHBondContact O-N 3.43Å; F72-K75 VanDerWaalsContact O-N 3.13Å; L73-K75 VanDerWaalsContact C-N 3.32Å; L73-K75 PolarHBondContact O-N 3.06Å; K75-K77 PolarHBondContact O-N 2.95Å
76Q90.5Very high93.2Very high100 Ų10067.2 Ų67.247%0.46734%0.336SS..THydrogen-bonded Turntrans-82.616.8174.4-59.6-59.5-24.300113.7F72 L73 R74 Y78F72-Q76 HydrophobicContact CD1-CG 4.25Å; F72-Q76 HydrophobicContact CE1-CG 3.83Å; F72-Q76 HydrophobicContact CZ-CG 4.19Å; F72-Q76 PolarHBondContact O-N 3.24Å; F72-Q76 VanDerWaalsContact O-N 3.17Å; L73-Q76 CarbonylContact O-C 3.59Å; L73-Q76 WeakPolarHBondContact O-CA 3.45Å; L73-Q76 WeakPolarHBondContact O-CB 3.49Å; L73-Q76 PolarHBondContact O-N 3.35Å; R74-Q76 PolarHBondContact O-N 2.92Å; Q76-Y78 HydrophobicContact CB-CD2 3.89Å; Q76-Y78 HydrophobicContact CB-CE2 4.24Å; Q76-Y78 WeakPolarHBondContact O-CD2 3.11Å; Q76-Y78 PolarHBondContact O-N 3.36Å
77K92.1Very high93.3Very high162 Ų16274.2 Ų74.270%0.70437%0.365SS*.THydrogen-bonded Turntrans67.914.7179.7-49.5-63.7-175.8177.30115.2L73 R74 K75 Y82L73-K77 PolarHBondContact O-N 3.27Å; R74-K77 PolarHBondContact O-N 2.99Å; K75-K77 PolarHBondContact O-N 2.95Å; K77-Y82 PolarHBondContact O-OH 2.96Å
78Y93.8Very high93.4Very high65 Ų6574.2 Ų74.226%0.25536%0.357SS..  trans-98.291.6170.6-62.4-69.2000109.4L5 A35 P36 L73 R74 Q76L5-Y78 HydrophobicContact CD1-CE2 4.28Å; A35-Y78 HydrophobicContact CB-CD1 3.76Å; A35-Y78 HydrophobicContact CB-CD2 4.13Å; A35-Y78 HydrophobicContact CB-CE1 4.26Å; A35-Y78 HydrophobicContact CB-CG 3.7Å; P36-Y78 WeakPolarHBondContact CD-OH 3.29Å; L73-Y78 CarbonylContact C-O 3.56Å; L73-Y78 VanDerWaalsContact C-O 3.27Å; L73-Y78 WeakPolarHBondContact O-CB 3.15Å; L73-Y78 PolarHBondContact O-N 2.83Å; R74-Y78 WeakPolarHBondContact CA-O 3.37Å; R74-Y78 PolarHBondContact N-O 3.1Å; Q76-Y78 HydrophobicContact CB-CD2 3.89Å; Q76-Y78 HydrophobicContact CB-CE2 4.24Å; Q76-Y78 WeakPolarHBondContact O-CD2 3.11Å; Q76-Y78 PolarHBondContact O-N 3.36Å
79N93.5Very high93.4Very high35 Ų3570.2 Ų70.219%0.18735%0.348CS..  trans-125.9124-179.7-174.920.1000111.1Y29 R74 D81 Y82Y29-N79 WeakPolarHBondContact OH-CA 3.38Å; Y29-N79 PolarHBondContact OH-OD1 3.09Å; Y29-N79 VanDerWaalsContact OH-OD1 3.14Å; R74-N79 HydrophobicContact CG-CB 4.22Å; N79-D81 VanDerWaalsContact C-N 3.3Å; N79-D81 WeakPolarHBondContact OD1-CB 3.37Å; N79-D81 PolarHBondContact OD1-N 2.82Å; N79-Y82 HydrophobicContact CB-CD1 4.45Å; N79-Y82 HydrophobicContact CB-CD2 3.91Å; N79-Y82 HydrophobicContact CB-CE1 4.09Å; N79-Y82 HydrophobicContact CB-CE2 3.51Å; N79-Y82 HydrophobicContact CB-CG 4.35Å; N79-Y82 WeakPolarHBondContact O-CD2 3.39Å; N79-Y82 VanDerWaalsContact O-CE2 3.26Å; N79-Y82 WeakPolarHBondContact O-CE2 3.35Å
80A92.6Very high93.4Very high17 Ų1773 Ų7314%0.1437%0.371CS..SBendtrans-80.6-12.1173.200000112.7Y29 F32 C33Y29-A80 HydrophobicContact CD2-CB 4.02Å; Y29-A80 HydrophobicContact CE2-CB 3.55Å; Y29-A80 PolarHBondContact OH-N 3.33Å; F32-A80 HydrophobicContact CB-CB 4.07Å; C33-A80 HydrophobicContact CB-CB 4.28Å
81D93.7Very high93.5Very high27 Ų2775 Ų7514%0.14438%0.382CS..  trans-98.717.7-171.5-54.6-38.5000113.3R74 N79 E83 L84 T197R74-D81 IonicContact CZ-OD2 3.71Å; R74-D81 IonicContact NE-OD2 3.4Å; R74-D81 IonicContact NH2-OD2 3.75Å; N79-D81 VanDerWaalsContact C-N 3.3Å; N79-D81 WeakPolarHBondContact OD1-CB 3.37Å; N79-D81 PolarHBondContact OD1-N 2.82Å; D81-E83 VanDerWaalsContact C-N 3.26Å; D81-E83 PolarHBondContact O-N 3.01Å; D81-L84 HydrophobicContact CB-CB 4.49Å; D81-L84 HydrophobicContact CB-CD1 3.78Å; D81-L84 HydrophobicContact CB-CG 4.1Å; D81-L84 PolarHBondContact O-N 3.02Å; D81-T197 VanDerWaalsContact OD1-CB 3.31Å; D81-T197 WeakPolarHBondContact OD1-CB 3.28Å; D81-T197 PolarHBondContact OD1-N 3.15Å; D81-T197 PolarHBondContact OD1-OG1 3.29Å; D81-T197 WeakPolarHBondContact OD2-CB 3.37Å; D81-T197 PolarHBondContact OD2-OG1 3.37Å
82Y88Confident93.6Very high146 Ų14671.8 Ų71.857%0.57336%0.364SS*.THydrogen-bonded Turntrans-60.5-33.8-173.8-82-60.9000113.8K77 N79K77-Y82 PolarHBondContact O-OH 2.96Å; N79-Y82 HydrophobicContact CB-CD1 4.45Å; N79-Y82 HydrophobicContact CB-CD2 3.91Å; N79-Y82 HydrophobicContact CB-CE1 4.09Å; N79-Y82 HydrophobicContact CB-CE2 3.51Å; N79-Y82 HydrophobicContact CB-CG 4.35Å; N79-Y82 WeakPolarHBondContact O-CD2 3.39Å; N79-Y82 VanDerWaalsContact O-CE2 3.26Å; N79-Y82 WeakPolarHBondContact O-CE2 3.35Å
83E88.3Confident93.7Very high145 Ų14576.2 Ų76.268%0.67839%0.389SS*.THydrogen-bonded Turntrans-89.7-2.8-177.4-61.8179.716700112.8D81 T194D81-E83 VanDerWaalsContact C-N 3.26Å; D81-E83 PolarHBondContact O-N 3.01Å; E83-T194 VanDerWaalsContact OE2-CG2 3.29Å; E83-T194 WeakPolarHBondContact OE2-CG2 3.13Å; E83-T194 PolarHBondContact OE2-OG1 3.4Å
84L92.1Very high93.9Very high37 Ų3779 Ų7919%0.19441%0.413CS..  trans-77.6131.6-176.8-63-170.3000111.8D81 Q88 F191D81-L84 HydrophobicContact CB-CB 4.49Å; D81-L84 HydrophobicContact CB-CD1 3.78Å; D81-L84 HydrophobicContact CB-CG 4.1Å; D81-L84 PolarHBondContact O-N 3.02Å; L84-Q88 HydrophobicContact CB-CB 4.17Å; L84-Q88 HydrophobicContact CD2-CB 4.1Å; L84-F191 HydrophobicContact CD1-CD2 4.09Å; L84-F191 HydrophobicContact CD1-CE2 4.18Å; L84-F191 HydrophobicContact CD2-CB 3.75Å; L84-F191 HydrophobicContact CD2-CD2 3.62Å; L84-F191 HydrophobicContact CD2-CE2 4.41Å; L84-F191 HydrophobicContact CD2-CG 3.8Å
85S94.7Very high94.1Very high58 Ų5877.8 Ų77.841%0.40641%0.408SS..  trans-66.5159165.865.70000111.5K87 Q88 G89S85-K87 PolarHBondContact O-N 3.31Å; S85-K87 VanDerWaalsContact O-N 3.15Å; S85-Q88 PolarHBondContact O-N 2.78Å; S85-Q88 WeakPolarHBondContact OG-CG 3.29Å; S85-Q88 PolarHBondContact OG-N 3.13Å; S85-Q88 PolarHBondContact OG-OE1 2.99Å; S85-G89 PolarHBondContact O-N 3.17Å
86A94.4Very high94.3Very high94 Ų9470.5 Ų70.578%0.77738%0.377SS*.Hα-helixtrans-55.4-3517600000112.9G89 A90A86-G89 PolarHBondContact O-N 3.37Å; A86-A90 PolarHBondContact O-N 3Å
87K96.3Very high94.6Very high156 Ų15668.3 Ų68.368%0.67838%0.376SS*.Hα-helixtrans-64.6-48.3174.5-176.2-179.2176.5-178.20111.4S85 G89 A90 D91S85-K87 PolarHBondContact O-N 3.31Å; S85-K87 VanDerWaalsContact O-N 3.15Å; K87-G89 VanDerWaalsContact C-N 3.28Å; K87-G89 PolarHBondContact O-N 3.07Å; K87-A90 PolarHBondContact O-N 3.39Å; K87-A90 VanDerWaalsContact O-N 3.17Å; K87-D91 VanDerWaalsContact O-CG 3.29Å; K87-D91 PolarHBondContact O-N 2.79Å
88Q95.9Very high94.9Very high47 Ų4762.6 Ų62.622%0.2235%0.353CS..Hα-helixtrans-64.8-33.5177.2-69.6162.8-52.900112L84 S85 D91 T92 F191L84-Q88 HydrophobicContact CB-CB 4.17Å; L84-Q88 HydrophobicContact CD2-CB 4.1Å; S85-Q88 PolarHBondContact O-N 2.78Å; S85-Q88 WeakPolarHBondContact OG-CG 3.29Å; S85-Q88 PolarHBondContact OG-N 3.13Å; S85-Q88 PolarHBondContact OG-OE1 2.99Å; Q88-D91 PolarHBondContact O-N 2.81Å; Q88-T92 WeakPolarHBondContact O-CB 3.49Å; Q88-T92 PolarHBondContact O-N 3.32Å; Q88-T92 PolarHBondContact O-OG1 2.87Å; Q88-F191 HydrophobicContact CB-CD1 3.9Å; Q88-F191 HydrophobicContact CB-CE1 3.78Å; Q88-F191 HydrophobicContact CB-CG 4.34Å; Q88-F191 HydrophobicContact CB-CZ 4.14Å; Q88-F191 HydrophobicContact CG-CD1 3.61Å; Q88-F191 HydrophobicContact CG-CE1 3.81Å; Q88-F191 HydrophobicContact CG-CG 4.3Å; Q88-F191 WeakPolarHBondContact O-CZ 3.15Å
89G94.8Very high95.1Very high29 Ų2959.5 Ų59.530%0.29934%0.341SS..Hα-helixtrans-62.3-43.2171.400000112.7S85 A86 K87 T92 L93S85-G89 PolarHBondContact O-N 3.17Å; A86-G89 PolarHBondContact O-N 3.37Å; K87-G89 VanDerWaalsContact C-N 3.28Å; K87-G89 PolarHBondContact O-N 3.07Å; G89-T92 WeakPolarHBondContact O-CB 3.37Å; G89-T92 PolarHBondContact O-N 3.31Å; G89-L93 PolarHBondContact O-N 3.37Å
90A96.5Very high95.2Very high58 Ų5861.8 Ų61.848%0.47935%0.351SS..Hα-helixtrans-65.6-43.8173.700000111.9A86 K87 T92 L93 A94A86-A90 PolarHBondContact O-N 3Å; K87-A90 PolarHBondContact O-N 3.39Å; K87-A90 VanDerWaalsContact O-N 3.17Å; A90-T92 VanDerWaalsContact C-N 3.27Å; A90-T92 PolarHBondContact O-N 2.84Å; A90-L93 PolarHBondContact O-N 3.37Å; A90-A94 PolarHBondContact O-N 3.31Å
91D96.6Very high95.3Very high45 Ų4565.4 Ų65.424%0.24136%0.364CS..Hα-helixtrans-58.4-40.9175.3-69-18.9000110.8K87 Q88 L93 A94 Y95 F191K87-D91 VanDerWaalsContact O-CG 3.29Å; K87-D91 PolarHBondContact O-N 2.79Å; Q88-D91 PolarHBondContact O-N 2.81Å; D91-L93 PolarHBondContact O-N 3.17Å; D91-A94 PolarHBondContact O-N 3.32Å; D91-Y95 HydrophobicContact CB-CD2 4.46Å; D91-Y95 HydrophobicContact CB-CE2 4.46Å; D91-Y95 WeakPolarHBondContact O-CD2 3.34Å; D91-Y95 PolarHBondContact O-N 3.14Å; D91-F191 HydrophobicContact CB-CE1 4.17Å; D91-F191 HydrophobicContact CB-CZ 4.11Å
92T96.7Very high95.5Very high7 Ų766.7 Ų66.74%0.04337%0.369CS..Hα-helixtrans-55.6-49.8176.2-61.20000111.5Q88 G89 A90 A94 Y95 I96 F191 T197 L198Q88-T92 WeakPolarHBondContact O-CB 3.49Å; Q88-T92 PolarHBondContact O-N 3.32Å; Q88-T92 PolarHBondContact O-OG1 2.87Å; G89-T92 WeakPolarHBondContact O-CB 3.37Å; G89-T92 PolarHBondContact O-N 3.31Å; A90-T92 VanDerWaalsContact C-N 3.27Å; A90-T92 PolarHBondContact O-N 2.84Å; T92-A94 VanDerWaalsContact C-N 3.33Å; T92-A94 PolarHBondContact O-N 3.1Å; T92-Y95 PolarHBondContact O-N 3.41Å; T92-I96 HydrophobicContact CG2-CD1 3.79Å; T92-I96 VanDerWaalsContact O-CG1 3.28Å; T92-I96 WeakPolarHBondContact O-CG1 3.32Å; T92-I96 PolarHBondContact O-N 3.04Å; T92-F191 WeakPolarHBondContact OG1-CE2 3.15Å; T92-F191 WeakPolarHBondContact OG1-CZ 3.18Å; T92-T197 HydrophobicContact CG2-CG2 4.24Å; T92-L198 HydrophobicContact CG2-CB 4.06Å
93L96.6Very high95.9Very high124 Ų12459.7 Ų59.765%0.64934%0.341SS*.Hα-helixtrans-64.1-39.7178.7-66.1177.4000111.8G89 A90 D91 I96 A97G89-L93 PolarHBondContact O-N 3.37Å; A90-L93 PolarHBondContact O-N 3.37Å; D91-L93 PolarHBondContact O-N 3.17Å; L93-I96 PolarHBondContact O-N 3.11Å; L93-A97 WeakPolarHBondContact O-CB 3.21Å; L93-A97 PolarHBondContact O-N 2.81Å
94A97.9Very high96.3Very high60 Ų6053.5 Ų53.550%0.49631%0.313SS..Hα-helixtrans-62.7-44177.300000112A90 D91 T92 A97 L98A90-A94 PolarHBondContact O-N 3.31Å; D91-A94 PolarHBondContact O-N 3.32Å; T92-A94 VanDerWaalsContact C-N 3.33Å; T92-A94 PolarHBondContact O-N 3.1Å; A94-A97 PolarHBondContact O-N 3.08Å; A94-L98 WeakPolarHBondContact O-CB 3.33Å; A94-L98 PolarHBondContact O-N 3.49Å
95Y98.1Very high96.5Very high52 Ų5252.1 Ų52.120%0.20431%0.306CS..Hα-helixtrans-70.9-35.4177.2-79-71000113.1D91 T92 A97 L98 L99 L180 R183 L198D91-Y95 HydrophobicContact CB-CD2 4.46Å; D91-Y95 HydrophobicContact CB-CE2 4.46Å; D91-Y95 WeakPolarHBondContact O-CD2 3.34Å; D91-Y95 PolarHBondContact O-N 3.14Å; T92-Y95 PolarHBondContact O-N 3.41Å; Y95-A97 VanDerWaalsContact C-N 3.35Å; Y95-L98 HydrophobicContact CD1-CD2 4.12Å; Y95-L98 HydrophobicContact CE1-CD2 4.45Å; Y95-L98 WeakPolarHBondContact O-CB 3.35Å; Y95-L98 PolarHBondContact O-N 2.88Å; Y95-L99 WeakPolarHBondContact O-CG 3.28Å; Y95-L99 PolarHBondContact O-N 3.35Å; Y95-L180 HydrophobicContact CD1-CD2 4.01Å; Y95-R183 HydrophobicContact CE1-CB 4.29Å; Y95-R183 HydrophobicContact CE1-CG 4.26Å; Y95-R183 HydrophobicContact CE2-CG 4.06Å; Y95-R183 WeakPolarHBondContact OH-CD 3.42Å; Y95-L198 VanDerWaalsContact CB-CD1 3.45Å; Y95-L198 HydrophobicContact CD2-CD2 3.9Å; Y95-L198 HydrophobicContact CG-CD1 4.32Å; Y95-L198 HydrophobicContact CG-CD2 4.18Å
96I97.5Very high96.6Very high17 Ų1749.4 Ų49.49%0.08729%0.287CS..Hα-helixtrans-62.5-45.5172.9-69.8168.1000110.2T92 L93 L98 L99 E100 T197 Y201T92-I96 HydrophobicContact CG2-CD1 3.79Å; T92-I96 VanDerWaalsContact O-CG1 3.28Å; T92-I96 WeakPolarHBondContact O-CG1 3.32Å; T92-I96 PolarHBondContact O-N 3.04Å; L93-I96 PolarHBondContact O-N 3.11Å; I96-L98 VanDerWaalsContact C-N 3.29Å; I96-L98 PolarHBondContact O-N 2.75Å; I96-L99 WeakPolarHBondContact O-CB 3.24Å; I96-L99 PolarHBondContact O-N 2.77Å; I96-E100 HydrophobicContact CG2-CG 4.45Å; I96-E100 WeakPolarHBondContact O-CG 3.12Å; I96-E100 PolarHBondContact O-N 3.35Å; I96-T197 HydrophobicContact CD1-CG2 3.97Å; I96-Y201 HydrophobicContact CD1-CD2 3.68Å; I96-Y201 HydrophobicContact CD1-CE2 3.81Å; I96-Y201 HydrophobicContact CD1-CG 4.05Å; I96-Y201 HydrophobicContact CG1-CD1 4.14Å; I96-Y201 HydrophobicContact CG1-CD2 3.99Å; I96-Y201 HydrophobicContact CG1-CE2 4.43Å; I96-Y201 HydrophobicContact CG1-CG 3.82Å; I96-Y201 HydrophobicContact CG2-CD1 3.98Å; I96-Y201 HydrophobicContact CG2-CE1 3.83Å; I96-Y201 HydrophobicContact CG2-CG 4.5Å
97A97.4Very high96.7Very high54 Ų5445.2 Ų45.245%0.44625%0.252SS..Hα-helixtrans-60-40.9174.600000111.5L93 A94 Y95 L99 E100 E101L93-A97 WeakPolarHBondContact O-CB 3.21Å; L93-A97 PolarHBondContact O-N 2.81Å; A94-A97 PolarHBondContact O-N 3.08Å; Y95-A97 VanDerWaalsContact C-N 3.35Å; A97-L99 PolarHBondContact O-N 2.97Å; A97-E100 PolarHBondContact O-N 3.14Å; A97-E101 WeakPolarHBondContact O-CB 3.29Å; A97-E101 PolarHBondContact O-N 2.82Å
98L97.8Very high96.7Very high42 Ų4239.1 Ų39.122%0.2223%0.226CC..Hα-helixtrans-61-43.4175-175.969.7000112.2A94 Y95 I96 K102 L179A94-L98 WeakPolarHBondContact O-CB 3.33Å; A94-L98 PolarHBondContact O-N 3.49Å; Y95-L98 HydrophobicContact CD1-CD2 4.12Å; Y95-L98 HydrophobicContact CE1-CD2 4.45Å; Y95-L98 WeakPolarHBondContact O-CB 3.35Å; Y95-L98 PolarHBondContact O-N 2.88Å; I96-L98 VanDerWaalsContact C-N 3.29Å; I96-L98 PolarHBondContact O-N 2.75Å; L98-K102 HydrophobicContact CD1-CB 4.33Å; L98-K102 HydrophobicContact CD1-CG 3.73Å; L98-K102 VanDerWaalsContact O-CB 3.31Å; L98-K102 WeakPolarHBondContact O-CB 3.47Å; L98-K102 PolarHBondContact O-N 2.9Å; L98-L179 HydrophobicContact CD2-CB 4.48Å; L98-L179 HydrophobicContact CD2-CD1 4.04Å
99L97.7Very high96.7Very high0 Ų037.4 Ų37.40%022%0.218CC..Iπ-helixtrans-62.5-49.8176.6-74166.1000111.6Y95 I96 A97 E101 L103 L104 L180 V202Y95-L99 WeakPolarHBondContact O-CG 3.28Å; Y95-L99 PolarHBondContact O-N 3.35Å; I96-L99 WeakPolarHBondContact O-CB 3.24Å; I96-L99 PolarHBondContact O-N 2.77Å; A97-L99 PolarHBondContact O-N 2.97Å; L99-E101 VanDerWaalsContact C-N 3.3Å; L99-E101 PolarHBondContact O-N 3.38Å; L99-L103 HydrophobicContact CD2-CB 4.38Å; L99-L103 HydrophobicContact CD2-CD2 3.6Å; L99-L103 WeakPolarHBondContact O-CA 3.44Å; L99-L103 WeakPolarHBondContact O-CB 3.48Å; L99-L103 PolarHBondContact O-N 3.44Å; L99-L104 PolarHBondContact O-N 3.32Å; L99-L180 HydrophobicContact CD2-CD1 3.57Å; L99-V202 HydrophobicContact CD1-CG2 3.91Å
100E95.6Very high96.8Very high83 Ų8336.2 Ų36.239%0.38821%0.205SC..Iπ-helixtrans-65.7-35-178.3-71.2-174.6169.300112.4I96 A97 L104I96-E100 HydrophobicContact CG2-CG 4.45Å; I96-E100 WeakPolarHBondContact O-CG 3.12Å; I96-E100 PolarHBondContact O-N 3.35Å; A97-E100 PolarHBondContact O-N 3.14Å; E100-L104 WeakPolarHBondContact O-CB 3.21Å
101E95.5Very high96.8Very high92 Ų9234 Ų3443%0.4318%0.184SC..Iπ-helixtrans-80.2-59.6179.8-174.656.1-158.400109.9A97 L99 P105 R154A97-E101 WeakPolarHBondContact O-CB 3.29Å; A97-E101 PolarHBondContact O-N 2.82Å; L99-E101 VanDerWaalsContact C-N 3.3Å; L99-E101 PolarHBondContact O-N 3.38Å; E101-P105 WeakPolarHBondContact O-CD 3.49Å; E101-P105 WeakPolarHBondContact O-CG 3.49Å; E101-R154 VanDerWaalsContact CG-NH2 3.26Å; E101-R154 PolarHBondContact O-NH2 3.5Å; E101-R154 IonicContact OE1-CZ 3.97Å; E101-R154 IonicContact OE1-NH1 3.52Å; E101-R154 PolarHBondContact OE1-NH1 2.99Å; E101-R154 IonicContact OE1-NH2 3.99Å; E101-R154 PolarHBondContact OE1-NH2 2.56Å; E101-R154 IonicContact OE2-NH2 2.59Å
102K96.6Very high96.8Very high54 Ų5432.6 Ų32.624%0.23518%0.176CC..Iπ-helixtrans-88-38.3-168.2-66.1-75.9-175.5172.90114.4L98 D172 C176L98-K102 HydrophobicContact CD1-CB 4.33Å; L98-K102 HydrophobicContact CD1-CG 3.73Å; L98-K102 VanDerWaalsContact O-CB 3.31Å; L98-K102 WeakPolarHBondContact O-CB 3.47Å; L98-K102 PolarHBondContact O-N 2.9Å; K102-D172 HydrophobicContact CB-CB 4.44Å; K102-D172 HydrophobicContact CD-CB 3.53Å; K102-D172 IonicContact NZ-OD1 2.79Å; K102-D172 PolarHBondContact NZ-OD1 3.37Å; K102-D172 IonicContact NZ-OD2 2.7Å; K102-D172 PolarHBondContact NZ-OD2 2.91Å; K102-D172 VanDerWaalsContact NZ-OD2 3.15Å; K102-C176 HydrophobicContact CB-CB 3.83Å
103L97.4Very high96.7Very high0 Ų033.9 Ų33.90%018%0.184CC..Iπ-helixtrans-92.2-43.4-173.1-179.161.8000112.8L99 P105 A106 V107 A173 L177 F205 L206 L219L99-L103 HydrophobicContact CD2-CB 4.38Å; L99-L103 HydrophobicContact CD2-CD2 3.6Å; L99-L103 WeakPolarHBondContact O-CA 3.44Å; L99-L103 WeakPolarHBondContact O-CB 3.48Å; L99-L103 PolarHBondContact O-N 3.44Å; L103-P105 VanDerWaalsContact C-CD 3.48Å; L103-A106 PolarHBondContact O-N 2.89Å; L103-A106 VanDerWaalsContact O-N 3.1Å; L103-V107 HydrophobicContact CD1-CG2 4.16Å; L103-V107 HydrophobicContact CG-CG2 4.01Å; L103-V107 PolarHBondContact O-N 3.37Å; L103-V107 VanDerWaalsContact O-N 3.08Å; L103-A173 HydrophobicContact CD1-CB 3.91Å; L103-L177 HydrophobicContact CD1-CD2 4.2Å; L103-L177 HydrophobicContact CD1-CG 4.29Å; L103-L177 HydrophobicContact CD2-CD2 4.32Å; L103-F205 HydrophobicContact CD2-CB 4.02Å; L103-L206 HydrophobicContact CD2-CD2 3.51Å; L103-L219 HydrophobicContact CD1-CD2 4.38Å
104L96.1Very high96.7Very high15 Ų1529.5 Ų29.58%0.07916%0.16CC..Hα-helixtrans-55.5-42.2-174.9-176.147.9000114.1L99 E100 A106 V107 L108 R149 F205L99-L104 PolarHBondContact O-N 3.32Å; E100-L104 WeakPolarHBondContact O-CB 3.21Å; L104-A106 VanDerWaalsContact C-N 3.28Å; L104-A106 PolarHBondContact O-N 3.14Å; L104-V107 PolarHBondContact O-N 3.27Å; L104-L108 HydrophobicContact CD1-CD1 4.04Å; L104-L108 HydrophobicContact CD1-CD2 4.29Å; L104-L108 HydrophobicContact CD1-CG 3.78Å; L104-L108 HydrophobicContact CG-CD1 4.08Å; L104-L108 HydrophobicContact CG-CG 4.3Å; L104-L108 WeakPolarHBondContact O-CB 3.11Å; L104-L108 WeakPolarHBondContact O-CG 3.31Å; L104-L108 PolarHBondContact O-N 3.35Å; L104-R149 VanDerWaalsContact CD2-CZ 3.45Å; L104-F205 HydrophobicContact CB-CD1 4.48Å; L104-F205 HydrophobicContact CB-CE1 3.76Å; L104-F205 HydrophobicContact CD1-CD1 4.39Å; L104-F205 HydrophobicContact CD1-CE1 3.63Å; L104-F205 HydrophobicContact CD1-CZ 4.42Å; L104-F205 HydrophobicContact CD2-CE1 4.03Å; L104-F205 HydrophobicContact CD2-CZ 4.32Å; L104-F205 HydrophobicContact CG-CE1 3.98Å
105P96.8Very high96.6Very high8 Ų829.5 Ų29.55%0.05216%0.157CC..Hα-helixtrans-59.4-39.7178-25.537000112.6E101 L103 L108 H109 I150 R154 I169E101-P105 WeakPolarHBondContact O-CD 3.49Å; E101-P105 WeakPolarHBondContact O-CG 3.49Å; L103-P105 VanDerWaalsContact C-CD 3.48Å; P105-L108 PolarHBondContact O-N 3.37Å; P105-H109 WeakPolarHBondContact O-CB 3.41Å; P105-H109 PolarHBondContact O-N 3.17Å; P105-I150 HydrophobicContact CB-CG1 4.28Å; P105-I150 WeakPolarHBondContact O-CD1 3.49Å; P105-R154 HydrophobicContact CB-CG 4.39Å; P105-R154 HydrophobicContact CG-CG 4.44Å; P105-I169 HydrophobicContact CB-CB 4.18Å; P105-I169 HydrophobicContact CB-CG2 3.83Å
106A97Very high96.5Very high0 Ų030.4 Ų30.40%017%0.165CC..Hα-helixtrans-72.1-35.6178.600000112.4L103 L104 H109 T110 I169 Y170 A173 L219L103-A106 PolarHBondContact O-N 2.89Å; L103-A106 VanDerWaalsContact O-N 3.1Å; L104-A106 VanDerWaalsContact C-N 3.28Å; L104-A106 PolarHBondContact O-N 3.14Å; A106-H109 PolarHBondContact O-N 2.66Å; A106-T110 WeakPolarHBondContact O-CB 2.95Å; A106-T110 PolarHBondContact O-N 3.31Å; A106-T110 PolarHBondContact O-OG1 2.96Å; A106-I169 HydrophobicContact CB-CB 4.49Å; A106-Y170 HydrophobicContact CB-CD1 4.15Å; A106-Y170 HydrophobicContact CB-CE1 4.42Å; A106-A173 HydrophobicContact CB-CB 3.42Å; A106-A173 VanDerWaalsContact CB-CB 3.42Å; A106-L219 HydrophobicContact CB-CD2 3.83Å
107V96.3Very high96.5Very high6 Ų629.6 Ų29.64%0.03616%0.161CC..Hα-helixtrans-62.9-48.7172.1174.50000110.3L103 L104 H109 T110 F111 L209L103-V107 HydrophobicContact CD1-CG2 4.16Å; L103-V107 HydrophobicContact CG-CG2 4.01Å; L103-V107 PolarHBondContact O-N 3.37Å; L103-V107 VanDerWaalsContact O-N 3.08Å; L104-V107 PolarHBondContact O-N 3.27Å; V107-H109 VanDerWaalsContact C-N 3.31Å; V107-H109 PolarHBondContact O-N 3.33Å; V107-T110 PolarHBondContact O-N 3.48Å; V107-F111 HydrophobicContact CG1-CD2 4.02Å; V107-F111 HydrophobicContact CG1-CE2 4.14Å; V107-F111 WeakPolarHBondContact O-CD2 3.48Å; V107-F111 PolarHBondContact O-N 2.95Å; V107-L209 HydrophobicContact CG2-CD2 4.31Å
108L96.1Very high96.5Very high28 Ų2828 Ų2815%0.14714%0.143CC..Hα-helixtrans-59.5-43.6176.7-72.9176.3000111.5L104 P105 F111 W112 A146 R149 I150L104-L108 HydrophobicContact CD1-CD1 4.04Å; L104-L108 HydrophobicContact CD1-CD2 4.29Å; L104-L108 HydrophobicContact CD1-CG 3.78Å; L104-L108 HydrophobicContact CG-CD1 4.08Å; L104-L108 HydrophobicContact CG-CG 4.3Å; L104-L108 WeakPolarHBondContact O-CB 3.11Å; L104-L108 WeakPolarHBondContact O-CG 3.31Å; L104-L108 PolarHBondContact O-N 3.35Å; P105-L108 PolarHBondContact O-N 3.37Å; L108-F111 PolarHBondContact O-N 2.94Å; L108-W112 WeakPolarHBondContact O-CB 3.22Å; L108-W112 PolarHBondContact O-N 3.37Å; L108-A146 HydrophobicContact CB-CB 4.22Å; L108-A146 HydrophobicContact CD2-CB 4.2Å; L108-R149 HydrophobicContact CD1-CG 4.49Å; L108-I150 HydrophobicContact CB-CD1 4.04Å; L108-I150 HydrophobicContact CB-CG1 4.47Å
109H96.8Very high96.4Very high12 Ų1232 Ų326%0.05616%0.159CC..Iπ-helixtrans-60-51.3176.8-173-87.1000111.1P105 A106 V107 F111 V113 E114 I150 E166 I169 Y170P105-H109 WeakPolarHBondContact O-CB 3.41Å; P105-H109 PolarHBondContact O-N 3.17Å; A106-H109 PolarHBondContact O-N 2.66Å; V107-H109 VanDerWaalsContact C-N 3.31Å; V107-H109 PolarHBondContact O-N 3.33Å; H109-F111 VanDerWaalsContact C-N 3.31Å; H109-F111 PolarHBondContact O-N 2.96Å; H109-V113 PolarHBondContact O-N 2.84Å; H109-E114 PolarHBondContact O-N 3.14Å; H109-I150 HydrophobicContact CB-CD1 3.92Å; H109-E166 IonicContact CE1-OE1 3.74Å; H109-E166 PolarHBondContact CE1-OE1 2.82Å; H109-I169 HydrophobicContact CB-CD1 3.56Å; H109-Y170 AromaticContact ND1-CE2 3.64Å; H109-Y170 AromaticContact ND1-CZ 3.59Å; H109-Y170 PolarHBondContact ND1-OH 3.12Å
110T96.7Very high96.4Very high3 Ų336 Ų362%0.01818%0.184CC..Iπ-helixtrans-58-40.9-178.5-56.70000112.6A106 V107 N117 Y170 L209 F214A106-T110 WeakPolarHBondContact O-CB 2.95Å; A106-T110 PolarHBondContact O-N 3.31Å; A106-T110 PolarHBondContact O-OG1 2.96Å; V107-T110 PolarHBondContact O-N 3.48Å; T110-N117 WeakPolarHBondContact O-CB 3.39Å; T110-N117 PolarHBondContact O-ND2 3.08Å; T110-Y170 PolarHBondContact OG1-OH 3.48Å; T110-L209 HydrophobicContact CG2-CD1 4.33Å; T110-F214 HydrophobicContact CG2-CD2 3.91Å; T110-F214 HydrophobicContact CG2-CE2 3.96Å; T110-F214 HydrophobicContact CG2-CG 4.41Å; T110-F214 HydrophobicContact CG2-CZ 4.47Å
111F95.8Very high96.4Very high11 Ų1133 Ų335%0.04817%0.171CC..Iπ-helixtrans-82.5-43.5-177.5-85.6-106.6000113V19 V107 L108 H109 T122 P208 V212 F214V19-F111 HydrophobicContact CG1-CE1 4.18Å; V107-F111 HydrophobicContact CG1-CD2 4.02Å; V107-F111 HydrophobicContact CG1-CE2 4.14Å; V107-F111 WeakPolarHBondContact O-CD2 3.48Å; V107-F111 PolarHBondContact O-N 2.95Å; L108-F111 PolarHBondContact O-N 2.94Å; H109-F111 VanDerWaalsContact C-N 3.31Å; H109-F111 PolarHBondContact O-N 2.96Å; F111-T122 HydrophobicContact CD1-CG2 4.48Å; F111-T122 WeakPolarHBondContact O-CB 3.36Å; F111-T122 VanDerWaalsContact O-CG2 3.31Å; F111-T122 WeakPolarHBondContact O-CG2 3.48Å; F111-T122 PolarHBondContact O-OG1 3.3Å; F111-P208 HydrophobicContact CE1-CB 4.34Å; F111-P208 HydrophobicContact CE2-CB 4.28Å; F111-P208 HydrophobicContact CZ-CB 3.55Å; F111-V212 HydrophobicContact CE1-CG2 4.18Å; F111-V212 HydrophobicContact CZ-CB 4.45Å; F111-V212 HydrophobicContact CZ-CG2 4.04Å; F111-F214 HydrophobicContact CD1-CE1 4.39Å; F111-F214 AromaticContact CD1-CZ 3.72Å; F111-F214 HydrophobicContact CD1-CZ 3.72Å; F111-F214 HydrophobicContact CD2-CE2 4.03Å; F111-F214 AromaticContact CD2-CZ 3.64Å; F111-F214 HydrophobicContact CD2-CZ 3.64Å; F111-F214 HydrophobicContact CE1-CE2 4.37Å; F111-F214 AromaticContact CE1-CZ 3.59Å; F111-F214 HydrophobicContact CE1-CZ 3.59Å; F111-F214 AromaticContact CE2-CE2 3.62Å; F111-F214 HydrophobicContact CE2-CE2 3.62Å; F111-F214 AromaticContact CE2-CZ 3.51Å; F111-F214 HydrophobicContact CE2-CZ 3.51Å; F111-F214 HydrophobicContact CG-CE1 4.48Å; F111-F214 AromaticContact CG-CZ 3.75Å; F111-F214 HydrophobicContact CG-CZ 3.75Å; F111-F214 AromaticContact CZ-CE2 3.8Å; F111-F214 HydrophobicContact CZ-CE2 3.8Å; F111-F214 AromaticContact CZ-CZ 3.47Å; F111-F214 HydrophobicContact CZ-CZ 3.47Å; F111-F214 VanDerWaalsContact CZ-CZ 3.47Å
112W95.9Very high96.4Very high16 Ų1628.8 Ų28.86%0.06115%0.151CC..Iπ-helixtrans-117.3-15.2-160.6-68.7104.5000115.2L108 Y118 T122 F126 P139 M142 S143 A146L108-W112 WeakPolarHBondContact O-CB 3.22Å; L108-W112 PolarHBondContact O-N 3.37Å; W112-Y118 HydrophobicContact CE3-CD2 4.16Å; W112-Y118 AromaticContact CE3-CE2 3.85Å; W112-Y118 HydrophobicContact CE3-CE2 3.85Å; W112-Y118 HydrophobicContact CZ3-CE2 4.12Å; W112-T122 HydrophobicContact CD2-CG2 4.09Å; W112-T122 HydrophobicContact CE3-CG2 4.02Å; W112-T122 HydrophobicContact CH2-CG2 4.01Å; W112-T122 HydrophobicContact CZ2-CG2 4.07Å; W112-T122 HydrophobicContact CZ3-CG2 3.99Å; W112-F126 HydrophobicContact CH2-CB 4.4Å; W112-F126 HydrophobicContact CH2-CD1 4.11Å; W112-F126 AromaticContact CH2-CD2 3.74Å; W112-F126 HydrophobicContact CH2-CD2 3.74Å; W112-F126 HydrophobicContact CH2-CE1 4.33Å; W112-F126 HydrophobicContact CH2-CE2 4.01Å; W112-F126 AromaticContact CH2-CG 3.82Å; W112-F126 HydrophobicContact CH2-CG 3.82Å; W112-F126 HydrophobicContact CH2-CZ 4.3Å; W112-F126 HydrophobicContact CZ2-CD1 4.38Å; W112-F126 AromaticContact CZ2-CD2 3.99Å; W112-F126 HydrophobicContact CZ2-CD2 3.99Å; W112-F126 HydrophobicContact CZ2-CE1 4.13Å; W112-F126 AromaticContact CZ2-CE2 3.75Å; W112-F126 HydrophobicContact CZ2-CE2 3.75Å; W112-F126 HydrophobicContact CZ2-CG 4.32Å; W112-F126 AromaticContact CZ2-CZ 3.82Å; W112-F126 HydrophobicContact CZ2-CZ 3.82Å; W112-P139 HydrophobicContact CZ3-CB 4.36Å; W112-M142 HydrophobicContact CD2-CB 4.33Å; W112-M142 HydrophobicContact CE3-CB 3.87Å; W112-M142 HydrophobicContact CH2-CB 3.7Å; W112-M142 HydrophobicContact CH2-CE 3.6Å; W112-M142 HydrophobicContact CH2-CG 4.27Å; W112-M142 HydrophobicContact CH2-SD 3.58Å; W112-M142 VanDerWaalsContact CH2-SD 3.58Å; W112-M142 HydrophobicContact CZ2-CB 4.16Å; W112-M142 HydrophobicContact CZ2-CE 3.45Å; W112-M142 VanDerWaalsContact CZ2-CE 3.45Å; W112-M142 HydrophobicContact CZ2-SD 4.1Å; W112-M142 HydrophobicContact CZ3-CB 3.54Å; W112-M142 HydrophobicContact CZ3-CG 4.49Å; W112-M142 HydrophobicContact CZ3-SD 4.27Å; W112-S143 WeakPolarHBondContact O-CB 3.29Å; W112-S143 PolarHBondContact O-OG 3.42Å; W112-A146 HydrophobicContact CB-CB 3.6Å; W112-A146 HydrophobicContact CG-CB 4.05Å
113V95.8Very high96.3Very high34 Ų3429.8 Ų29.821%0.20616%0.156CC..Iπ-helixtrans-116.2-40.8-175.5-175.70000111.4H109 S115 L147 I150H109-V113 PolarHBondContact O-N 2.84Å; V113-S115 PolarHBondContact O-N 3.27Å; V113-S115 VanDerWaalsContact O-N 3.11Å; V113-L147 HydrophobicContact CG1-CD1 4.06Å; V113-L147 HydrophobicContact CG2-CB 4.12Å; V113-L147 HydrophobicContact CG2-CD1 4.38Å; V113-I150 HydrophobicContact CG2-CD1 4.04Å
114E96.2Very high96.2Very high32 Ų3232.9 Ų32.915%0.1518%0.176CC..  trans-59.3116.9175.4178.253.8-102.200109.7H109 D116 N117 Y118 K216H109-E114 PolarHBondContact O-N 3.14Å; E114-D116 PolarHBondContact O-N 3.24Å; E114-N117 HydrophobicContact CB-CB 4.13Å; E114-N117 HydrophobicContact CG-CB 4.01Å; E114-N117 PolarHBondContact O-N 3.13Å; E114-Y118 VanDerWaalsContact O-CB 3.23Å; E114-Y118 WeakPolarHBondContact O-CB 3.33Å; E114-Y118 PolarHBondContact O-N 3.21Å; E114-K216 HydrophobicContact CG-CB 3.95Å; E114-K216 HydrophobicContact CG-CG 4.08Å
115S95.2Very high96.1Very high61 Ų6133.7 Ų33.743%0.42718%0.178SC..Hα-helixtrans-60.7-51.4-166.756.40000112.6V113 N117 Y118 F119V113-S115 PolarHBondContact O-N 3.27Å; V113-S115 VanDerWaalsContact O-N 3.11Å; S115-N117 VanDerWaalsContact C-N 3.35Å; S115-N117 PolarHBondContact O-N 2.94Å; S115-Y118 PolarHBondContact O-N 3.25Å; S115-F119 WeakPolarHBondContact O-CD2 3.43Å; S115-F119 PolarHBondContact O-N 3.43Å
116D96.4Very high95.9Very high71 Ų7133.5 Ų33.538%0.3818%0.176SC..Hα-helixtrans-61.8-45.5-178.9-72.2-23.4000110.5E114 T120 P215 K216E114-D116 PolarHBondContact O-N 3.24Å; D116-T120 WeakPolarHBondContact O-CB 3.33Å; D116-T120 VanDerWaalsContact O-CG2 3.28Å; D116-T120 WeakPolarHBondContact O-CG2 3.29Å; D116-T120 PolarHBondContact O-N 2.92Å; D116-T120 VanDerWaalsContact O-N 3.15Å; D116-T120 PolarHBondContact O-OG1 3.11Å; D116-P215 HydrophobicContact CB-CB 4.31Å; D116-K216 HydrophobicContact CB-CG 4Å; D116-K216 WeakPolarHBondContact OD2-CE 3.39Å; D116-K216 IonicContact OD2-NZ 3.07Å
117N96.9Very high95.6Very high0 Ų034.7 Ų34.70%019%0.186CC..Hα-helixtrans-64.6-44.5179-68.3-4.3000111.8T110 E114 S115 V121 T122 F214 P215 K216T110-N117 WeakPolarHBondContact O-CB 3.39Å; T110-N117 PolarHBondContact O-ND2 3.08Å; E114-N117 HydrophobicContact CB-CB 4.13Å; E114-N117 HydrophobicContact CG-CB 4.01Å; E114-N117 PolarHBondContact O-N 3.13Å; S115-N117 VanDerWaalsContact C-N 3.35Å; S115-N117 PolarHBondContact O-N 2.94Å; N117-V121 WeakPolarHBondContact O-CB 3.42Å; N117-V121 PolarHBondContact O-N 3.31Å; N117-T122 PolarHBondContact O-N 3.39Å; N117-T122 VanDerWaalsContact O-N 3.08Å; N117-F214 HydrophobicContact CB-CD1 3.67Å; N117-F214 HydrophobicContact CB-CE1 4.2Å; N117-F214 HydrophobicContact CB-CG 4.41Å; N117-F214 WeakPolarHBondContact OD1-CB 3.42Å; N117-P215 VanDerWaalsContact OD1-CD 3.25Å; N117-P215 WeakPolarHBondContact OD1-CD 3.23Å; N117-K216 PolarHBondContact ND2-O 3.27Å; N117-K216 VanDerWaalsContact ND2-O 3.08Å; N117-K216 WeakPolarHBondContact OD1-CB 3.44Å; N117-K216 PolarHBondContact OD1-N 2.88Å
118Y97.2Very high95.4Very high19 Ų1937.8 Ų37.88%0.07521%0.208CC..Iπ-helixtrans-65.1-49.3-177.1174.8-110.5000111.8W112 E114 S115 K123 P139 G140W112-Y118 HydrophobicContact CE3-CD2 4.16Å; W112-Y118 AromaticContact CE3-CE2 3.85Å; W112-Y118 HydrophobicContact CE3-CE2 3.85Å; W112-Y118 HydrophobicContact CZ3-CE2 4.12Å; E114-Y118 VanDerWaalsContact O-CB 3.23Å; E114-Y118 WeakPolarHBondContact O-CB 3.33Å; E114-Y118 PolarHBondContact O-N 3.21Å; S115-Y118 PolarHBondContact O-N 3.25Å; Y118-K123 HydrophobicContact CD2-CB 4.11Å; Y118-K123 HydrophobicContact CE1-CB 4.22Å; Y118-K123 HydrophobicContact CE1-CD 3.98Å; Y118-K123 HydrophobicContact CE2-CB 3.74Å; Y118-K123 HydrophobicContact CE2-CG 4.4Å; Y118-K123 HydrophobicContact CG-CB 4.49Å; Y118-K123 WeakPolarHBondContact O-CB 3.35Å; Y118-K123 PolarHBondContact O-N 2.81Å; Y118-P139 PolarHBondContact OH-O 3.38Å; Y118-G140 PolarHBondContact OH-N 2.93Å
119F97Very high95Very high128 Ų12838.9 Ų38.956%0.56121%0.212SC*.Iπ-helixtrans-76.1-29.9-175.3-73.8-68.9000113.7S115 K123 P124S115-F119 WeakPolarHBondContact O-CD2 3.43Å; S115-F119 PolarHBondContact O-N 3.43Å; F119-K123 HydrophobicContact CD1-CD 4.38Å; F119-P124 WeakPolarHBondContact O-CD 3.49Å; F119-P124 WeakPolarHBondContact O-CG 3.41Å
120T96.6Very high94.6Very high83 Ų8338.6 Ų38.651%0.50921%0.211SC..Iπ-helixtrans-93.1-31.9-176.464.10000113.7D116 P215D116-T120 WeakPolarHBondContact O-CB 3.33Å; D116-T120 VanDerWaalsContact O-CG2 3.28Å; D116-T120 WeakPolarHBondContact O-CG2 3.29Å; D116-T120 PolarHBondContact O-N 2.92Å; D116-T120 VanDerWaalsContact O-N 3.15Å; D116-T120 PolarHBondContact O-OG1 3.11Å; T120-P215 WeakPolarHBondContact OG1-CG 3.22Å
121V96.3Very high94.2Very high19 Ų1939.7 Ų39.712%0.11522%0.218CC..Iπ-helixtrans-119-62.3-172.2-178.50000111.6W14 N117 W125 V212 R213 F214W14-V121 HydrophobicContact CH2-CG1 3.92Å; W14-V121 HydrophobicContact CZ2-CG1 3.67Å; N117-V121 WeakPolarHBondContact O-CB 3.42Å; N117-V121 PolarHBondContact O-N 3.31Å; V121-W125 VanDerWaalsContact O-CB 3.27Å; V121-W125 WeakPolarHBondContact O-CB 3.33Å; V121-W125 PolarHBondContact O-N 3.06Å; V121-V212 HydrophobicContact CG1-CG1 3.71Å; V121-R213 WeakPolarHBondContact CG2-O 3.47Å; V121-F214 HydrophobicContact CB-CD1 4.29Å; V121-F214 HydrophobicContact CB-CE1 4.41Å; V121-F214 HydrophobicContact CG1-CD1 4.31Å; V121-F214 HydrophobicContact CG1-CE1 4.17Å; V121-F214 HydrophobicContact CG2-CD1 4.49Å
122T95.4Very high93.7Very high4 Ų446.9 Ų46.93%0.02525%0.25CC..Iπ-helixtrans-67.7-58.5-167.7-51.40000111.8F111 W112 N117 W125 F126F111-T122 HydrophobicContact CD1-CG2 4.48Å; F111-T122 WeakPolarHBondContact O-CB 3.36Å; F111-T122 VanDerWaalsContact O-CG2 3.31Å; F111-T122 WeakPolarHBondContact O-CG2 3.48Å; F111-T122 PolarHBondContact O-OG1 3.3Å; W112-T122 HydrophobicContact CD2-CG2 4.09Å; W112-T122 HydrophobicContact CE3-CG2 4.02Å; W112-T122 HydrophobicContact CH2-CG2 4.01Å; W112-T122 HydrophobicContact CZ2-CG2 4.07Å; W112-T122 HydrophobicContact CZ3-CG2 3.99Å; N117-T122 PolarHBondContact O-N 3.39Å; N117-T122 VanDerWaalsContact O-N 3.08Å; T122-W125 PolarHBondContact O-N 2.73Å; T122-F126 HydrophobicContact CG2-CD2 3.64Å; T122-F126 HydrophobicContact CG2-CE2 3.77Å; T122-F126 VanDerWaalsContact O-CD2 3.31Å; T122-F126 WeakPolarHBondContact O-CD2 3.42Å; T122-F126 PolarHBondContact O-N 3.22Å
123K95.3Very high93.4Very high76 Ų7649.5 Ų49.533%0.3327%0.269SS..Hα-helixtrans-58.7-49.1-176.4179.9-173178-1730112Y118 F119 W125 F126 A127 P139Y118-K123 HydrophobicContact CD2-CB 4.11Å; Y118-K123 HydrophobicContact CE1-CB 4.22Å; Y118-K123 HydrophobicContact CE1-CD 3.98Å; Y118-K123 HydrophobicContact CE2-CB 3.74Å; Y118-K123 HydrophobicContact CE2-CG 4.4Å; Y118-K123 HydrophobicContact CG-CB 4.49Å; Y118-K123 WeakPolarHBondContact O-CB 3.35Å; Y118-K123 PolarHBondContact O-N 2.81Å; F119-K123 HydrophobicContact CD1-CD 4.38Å; K123-W125 VanDerWaalsContact C-N 3.34Å; K123-W125 PolarHBondContact O-N 2.59Å; K123-F126 PolarHBondContact O-N 3.13Å; K123-A127 WeakPolarHBondContact O-CB 3.33Å; K123-A127 PolarHBondContact O-N 2.88Å; K123-P139 HydrophobicContact CG-CB 4Å
124P95.1Very high93Very high64 Ų6450.1 Ų50.142%0.41627%0.271SS..Hα-helixtrans-60.6-42.7179.4-24.335.7000112.7F119 S128F119-P124 WeakPolarHBondContact O-CD 3.49Å; F119-P124 WeakPolarHBondContact O-CG 3.41Å; P124-S128 PolarHBondContact O-N 3.19Å; P124-S128 VanDerWaalsContact O-N 3.07Å
125W93.7Very high92.8Very high33 Ų3349.5 Ų49.513%0.12527%0.27CS..Hα-helixtrans-65.6-48.5-180-176.290.3000112.1W10 G11 W14 V19 V121 T122 K123 S128 Q129W10-W125 HydrophobicContact CB-CH2 4.41Å; G11-W125 WeakPolarHBondContact O-CH2 3.43Å; G11-W125 WeakPolarHBondContact O-CZ2 3.4Å; W14-W125 HydrophobicContact CH2-CB 3.8Å; W14-W125 AromaticContact CH2-CD1 3.34Å; W14-W125 HydrophobicContact CH2-CD2 4.14Å; W14-W125 AromaticContact CH2-CG 3.46Å; W14-W125 HydrophobicContact CH2-CG 3.46Å; W14-W125 VanDerWaalsContact CH2-CG 3.46Å; W14-W125 AromaticContact CH2-NE1 3.94Å; W14-W125 AromaticContact CZ3-CD1 3.57Å; W14-W125 AromaticContact CZ3-CD2 3.95Å; W14-W125 HydrophobicContact CZ3-CD2 3.95Å; W14-W125 AromaticContact CZ3-CE2 3.96Å; W14-W125 AromaticContact CZ3-CG 3.75Å; W14-W125 HydrophobicContact CZ3-CG 3.75Å; W14-W125 AromaticContact CZ3-NE1 3.67Å; V19-W125 HydrophobicContact CB-CE3 4.34Å; V19-W125 HydrophobicContact CB-CH2 3.59Å; V19-W125 HydrophobicContact CB-CZ2 3.94Å; V19-W125 HydrophobicContact CB-CZ3 3.8Å; V19-W125 HydrophobicContact CG1-CE3 4.36Å; V19-W125 HydrophobicContact CG1-CH2 4.45Å; V19-W125 HydrophobicContact CG1-CZ3 4.22Å; V19-W125 HydrophobicContact CG2-CD2 4.33Å; V19-W125 HydrophobicContact CG2-CE3 4.46Å; V19-W125 HydrophobicContact CG2-CH2 3.53Å; V19-W125 HydrophobicContact CG2-CZ2 3.31Å; V19-W125 HydrophobicContact CG2-CZ3 4.1Å; V121-W125 VanDerWaalsContact O-CB 3.27Å; V121-W125 WeakPolarHBondContact O-CB 3.33Å; V121-W125 PolarHBondContact O-N 3.06Å; T122-W125 PolarHBondContact O-N 2.73Å; K123-W125 VanDerWaalsContact C-N 3.34Å; K123-W125 PolarHBondContact O-N 2.59Å; W125-S128 PolarHBondContact O-N 3.11Å; W125-S128 PolarHBondContact O-OG 3.11Å; W125-Q129 HydrophobicContact CH2-CG 4.36Å; W125-Q129 HydrophobicContact CZ2-CG 4.42Å; W125-Q129 WeakPolarHBondContact O-CG 3.36Å
126F91.6Very high92.5Very high4 Ų452.4 Ų52.42%0.01828%0.28CS..Hα-helixtrans-66.7-40.8178.7-82.5-88.6000111.3W10 V19 W112 T122 K123 S128 Q129 I130 P139 M142W10-F126 AromaticContact CD2-CD1 3.87Å; W10-F126 HydrophobicContact CD2-CD1 3.87Å; W10-F126 AromaticContact CD2-CE1 3.7Å; W10-F126 HydrophobicContact CD2-CE1 3.7Å; W10-F126 AromaticContact CE2-CD1 3.98Å; W10-F126 AromaticContact CE2-CE1 3.83Å; W10-F126 AromaticContact CE3-CD1 3.93Å; W10-F126 HydrophobicContact CE3-CD1 3.93Å; W10-F126 HydrophobicContact CE3-CE1 4.19Å; W10-F126 HydrophobicContact CG-CD1 4.47Å; W10-F126 AromaticContact CG-CE1 3.83Å; W10-F126 HydrophobicContact CG-CE1 3.83Å; W10-F126 HydrophobicContact CH2-CD1 4.27Å; W10-F126 HydrophobicContact CZ2-CD1 4.19Å; W10-F126 HydrophobicContact CZ2-CE1 4.44Å; W10-F126 HydrophobicContact CZ3-CD1 4.14Å; W10-F126 AromaticContact NE1-CE1 3.96Å; V19-F126 HydrophobicContact CG1-CE2 4.41Å; V19-F126 HydrophobicContact CG1-CZ 4.48Å; W112-F126 HydrophobicContact CH2-CB 4.4Å; W112-F126 HydrophobicContact CH2-CD1 4.11Å; W112-F126 AromaticContact CH2-CD2 3.74Å; W112-F126 HydrophobicContact CH2-CD2 3.74Å; W112-F126 HydrophobicContact CH2-CE1 4.33Å; W112-F126 HydrophobicContact CH2-CE2 4.01Å; W112-F126 AromaticContact CH2-CG 3.82Å; W112-F126 HydrophobicContact CH2-CG 3.82Å; W112-F126 HydrophobicContact CH2-CZ 4.3Å; W112-F126 HydrophobicContact CZ2-CD1 4.38Å; W112-F126 AromaticContact CZ2-CD2 3.99Å; W112-F126 HydrophobicContact CZ2-CD2 3.99Å; W112-F126 HydrophobicContact CZ2-CE1 4.13Å; W112-F126 AromaticContact CZ2-CE2 3.75Å; W112-F126 HydrophobicContact CZ2-CE2 3.75Å; W112-F126 HydrophobicContact CZ2-CG 4.32Å; W112-F126 AromaticContact CZ2-CZ 3.82Å; W112-F126 HydrophobicContact CZ2-CZ 3.82Å; T122-F126 HydrophobicContact CG2-CD2 3.64Å; T122-F126 HydrophobicContact CG2-CE2 3.77Å; T122-F126 VanDerWaalsContact O-CD2 3.31Å; T122-F126 WeakPolarHBondContact O-CD2 3.42Å; T122-F126 PolarHBondContact O-N 3.22Å; K123-F126 PolarHBondContact O-N 3.13Å; F126-S128 VanDerWaalsContact C-N 3.26Å; F126-S128 PolarHBondContact O-N 3.17Å; F126-Q129 PolarHBondContact O-N 3.41Å; F126-I130 WeakPolarHBondContact O-CD1 3.47Å; F126-I130 VanDerWaalsContact O-CG1 3.29Å; F126-I130 WeakPolarHBondContact O-CG1 3.27Å; F126-P139 HydrophobicContact CB-CG 4.49Å; F126-M142 HydrophobicContact CE1-CE 4.42Å
127A92.4Very high92.3Very high24 Ų2453.4 Ų53.420%0.19828%0.284CS..Hα-helixtrans-62-32.8178.800000112.7K123 Q129 I130 S135 P139K123-A127 WeakPolarHBondContact O-CB 3.33Å; K123-A127 PolarHBondContact O-N 2.88Å; A127-Q129 PolarHBondContact O-N 3Å; A127-I130 PolarHBondContact O-N 3.33Å; A127-S135 VanDerWaalsContact O-CB 3.29Å; A127-S135 WeakPolarHBondContact O-CB 3.42Å; A127-P139 HydrophobicContact CB-CG 4.24Å
128S91.1Very high92Very high72 Ų7253.6 Ų53.650%0.50329%0.285SS..Hα-helixtrans-71.6-16.817980.60000113.9P124 W125 F126P124-S128 PolarHBondContact O-N 3.19Å; P124-S128 VanDerWaalsContact O-N 3.07Å; W125-S128 PolarHBondContact O-N 3.11Å; W125-S128 PolarHBondContact O-OG 3.11Å; F126-S128 VanDerWaalsContact C-N 3.26Å; F126-S128 PolarHBondContact O-N 3.17Å
129Q87.8Confident91.8Very high51 Ų5152.7 Ų52.724%0.23828%0.282CS..THydrogen-bonded Turntrans-92.1-6.4178.2-54.7-55.5-44.100112.8W10 D43 W125 F126 A127W10-Q129 HydrophobicContact CE3-CB 4.47Å; W10-Q129 HydrophobicContact CZ3-CB 4.33Å; D43-Q129 CarbonylContact C-O 3.59Å; W125-Q129 HydrophobicContact CH2-CG 4.36Å; W125-Q129 HydrophobicContact CZ2-CG 4.42Å; W125-Q129 WeakPolarHBondContact O-CG 3.36Å; F126-Q129 PolarHBondContact O-N 3.41Å; A127-Q129 PolarHBondContact O-N 3Å
130I88.2Confident91.6Very high5 Ų547.8 Ų47.83%0.02627%0.267CS..SBendtrans-114.9136.6-170.4-58.2159.5000108.5W10 F126 A127 L134 S135 L138 P139W10-I130 HydrophobicContact CH2-CD1 3.7Å; W10-I130 HydrophobicContact CH2-CG1 3.75Å; W10-I130 HydrophobicContact CZ3-CD1 4.01Å; W10-I130 HydrophobicContact CZ3-CG1 3.69Å; F126-I130 WeakPolarHBondContact O-CD1 3.47Å; F126-I130 VanDerWaalsContact O-CG1 3.29Å; F126-I130 WeakPolarHBondContact O-CG1 3.27Å; A127-I130 PolarHBondContact O-N 3.33Å; I130-L134 HydrophobicContact CG2-CB 3.47Å; I130-L134 VanDerWaalsContact CG2-CB 3.47Å; I130-S135 WeakPolarHBondContact O-CB 3.46Å; I130-L138 HydrophobicContact CD1-CB 4.23Å; I130-L138 HydrophobicContact CD1-CD2 3.88Å; I130-L138 HydrophobicContact CD1-CG 4.3Å; I130-L138 HydrophobicContact CG1-CD2 4.48Å; I130-P139 HydrophobicContact CD1-CG 4.29Å
131P87.8Confident91.5Very high26 Ų2650.9 Ų50.917%0.16927%0.27CS..  trans-68.4149.1175.826.1-31.9000112.3N44 L134 S135N44-P131 VanDerWaalsContact O-CB 3.23Å; N44-P131 WeakPolarHBondContact O-CB 3.42Å; N44-P131 WeakPolarHBondContact O-CG 3.19Å; P131-L134 PolarHBondContact O-N 3.46Å; P131-S135 PolarHBondContact O-N 2.9Å; P131-S135 VanDerWaalsContact O-N 3.13Å
132F86.9Confident91.3Very high163 Ų16351.5 Ų51.572%0.71527%0.272SS*.THydrogen-bonded Turntrans-62.9138.1165.6176.2-89.8000109.9L136F132-L136 HydrophobicContact CD2-CD1 4.07Å; F132-L136 HydrophobicContact CD2-CG 4.35Å; F132-L136 HydrophobicContact CE2-CD1 3.63Å; F132-L136 HydrophobicContact CE2-CG 4.4Å
133P88.9Confident91.3Very high71 Ų7152.5 Ų52.546%0.46128%0.279SS..THydrogen-bonded Turncis-92.5-1.75.536.1-36.1000114.9S135 L136P133-S135 PolarHBondContact O-N 3.05Å; P133-L136 PolarHBondContact O-N 3.1Å; P133-L136 VanDerWaalsContact O-N 3.1Å
134L87.8Confident91.3Very high47 Ų4755.7 Ų55.725%0.24629%0.292CS..Hα-helixtrans-61.9-30.1-175.9-69.7175.4000112.5I130 P131 L136 I137 L138I130-L134 HydrophobicContact CG2-CB 3.47Å; I130-L134 VanDerWaalsContact CG2-CB 3.47Å; P131-L134 PolarHBondContact O-N 3.46Å; L134-L136 PolarHBondContact O-N 3.24Å; L134-I137 PolarHBondContact O-N 3.5Å; L134-L138 WeakPolarHBondContact O-CB 3.17Å; L134-L138 PolarHBondContact O-N 3.25Å
135S90.6Very high91.2Very high19 Ų1954.5 Ų54.513%0.13329%0.292CS..Hα-helixtrans-57.6-27.1175.358.40000114.1A127 I130 P131 P133 P139A127-S135 VanDerWaalsContact O-CB 3.29Å; A127-S135 WeakPolarHBondContact O-CB 3.42Å; I130-S135 WeakPolarHBondContact O-CB 3.46Å; P131-S135 PolarHBondContact O-N 2.9Å; P131-S135 VanDerWaalsContact O-N 3.13Å; P133-S135 PolarHBondContact O-N 3.05Å; S135-P139 VanDerWaalsContact O-CD 3.29Å; S135-P139 WeakPolarHBondContact O-CD 3.12Å
136L90.1Very high91.2Very high122 Ų12253.2 Ų53.264%0.63929%0.289SS*.Hα-helixtrans-81-26.2177.9-60.2-176.6000112.8F132 P133 L134F132-L136 HydrophobicContact CD2-CD1 4.07Å; F132-L136 HydrophobicContact CD2-CG 4.35Å; F132-L136 HydrophobicContact CE2-CD1 3.63Å; F132-L136 HydrophobicContact CE2-CG 4.4Å; P133-L136 PolarHBondContact O-N 3.1Å; P133-L136 VanDerWaalsContact O-N 3.1Å; L134-L136 PolarHBondContact O-N 3.24Å
137I91Very high91.4Very high91 Ų9155.6 Ų55.647%0.46730%0.301SS..Hα-helixtrans-103.3-46.5-168.9-58.1173.4000110.7L134 G140 R141L134-I137 PolarHBondContact O-N 3.5Å; I137-G140 PolarHBondContact O-N 2.86Å; I137-R141 HydrophobicContact CG2-CG 4.12Å; I137-R141 PolarHBondContact O-N 3.31Å
138L90.9Very high91.4Very high4 Ų458.8 Ų58.82%0.02132%0.315CS..Hα-helixtrans-66.5-47.5-166-176.959.3000113.2W10 I130 L134 G140 R141 M142W10-L138 HydrophobicContact CH2-CD2 4.09Å; W10-L138 HydrophobicContact CZ2-CD2 4.42Å; I130-L138 HydrophobicContact CD1-CB 4.23Å; I130-L138 HydrophobicContact CD1-CD2 3.88Å; I130-L138 HydrophobicContact CD1-CG 4.3Å; I130-L138 HydrophobicContact CG1-CD2 4.48Å; L134-L138 WeakPolarHBondContact O-CB 3.17Å; L134-L138 PolarHBondContact O-N 3.25Å; L138-G140 PolarHBondContact O-N 3.34Å; L138-R141 WeakPolarHBondContact O-CB 3.41Å; L138-R141 PolarHBondContact O-N 3.07Å; L138-M142 HydrophobicContact CD1-CG 4.2Å; L138-M142 HydrophobicContact CD1-SD 4.43Å; L138-M142 HydrophobicContact CG-CG 4.4Å; L138-M142 HydrophobicContact CG-SD 4.1Å; L138-M142 WeakPolarHBondContact O-CG 3.32Å; L138-M142 PolarHBondContact O-N 3.21Å
139P92.8Very high91.5Very high0 Ų060.5 Ų60.50%031%0.31CS..Hα-helixtrans-57.7-37.7175.9-2635.8000113.1W112 Y118 K123 F126 A127 I130 S135 M142 S143W112-P139 HydrophobicContact CZ3-CB 4.36Å; Y118-P139 PolarHBondContact OH-O 3.38Å; K123-P139 HydrophobicContact CG-CB 4Å; F126-P139 HydrophobicContact CB-CG 4.49Å; A127-P139 HydrophobicContact CB-CG 4.24Å; I130-P139 HydrophobicContact CD1-CG 4.29Å; S135-P139 VanDerWaalsContact O-CD 3.29Å; S135-P139 WeakPolarHBondContact O-CD 3.12Å; P139-M142 PolarHBondContact O-N 3.44Å; P139-S143 WeakPolarHBondContact O-CB 3.32Å; P139-S143 PolarHBondContact O-N 2.84Å
140G94.1Very high91.8Very high25 Ų2558.2 Ų58.226%0.25830%0.3SS..Hα-helixtrans-66.5-37.3175.600000113Y118 I137 L138 K144Y118-G140 PolarHBondContact OH-N 2.93Å; I137-G140 PolarHBondContact O-N 2.86Å; L138-G140 PolarHBondContact O-N 3.34Å; G140-K144 WeakPolarHBondContact O-CG 3.27Å; G140-K144 PolarHBondContact O-N 3.23Å
141R93.1Very high92Very high148 Ų14861.1 Ų61.156%0.55832%0.315SS*.Hα-helixtrans-67.2-42.3173.2-71.5-178.7671572.7112I137 L138 K144 G145I137-R141 HydrophobicContact CG2-CG 4.12Å; I137-R141 PolarHBondContact O-N 3.31Å; L138-R141 WeakPolarHBondContact O-CB 3.41Å; L138-R141 PolarHBondContact O-N 3.07Å; R141-K144 PolarHBondContact O-N 3.21Å; R141-G145 PolarHBondContact O-N 3.3Å
142M92.9Very high92.1Very high33 Ų3366 Ų6616%0.16334%0.339CS..Hα-helixtrans-62.7-43.7176.8-66.7176.279.300111W10 W112 F126 L138 P139 G145 A146W10-M142 HydrophobicContact CZ2-CE 4.22Å; W10-M142 HydrophobicContact CZ2-SD 4.16Å; W112-M142 HydrophobicContact CD2-CB 4.33Å; W112-M142 HydrophobicContact CE3-CB 3.87Å; W112-M142 HydrophobicContact CH2-CB 3.7Å; W112-M142 HydrophobicContact CH2-CE 3.6Å; W112-M142 HydrophobicContact CH2-CG 4.27Å; W112-M142 HydrophobicContact CH2-SD 3.58Å; W112-M142 VanDerWaalsContact CH2-SD 3.58Å; W112-M142 HydrophobicContact CZ2-CB 4.16Å; W112-M142 HydrophobicContact CZ2-CE 3.45Å; W112-M142 VanDerWaalsContact CZ2-CE 3.45Å; W112-M142 HydrophobicContact CZ2-SD 4.1Å; W112-M142 HydrophobicContact CZ3-CB 3.54Å; W112-M142 HydrophobicContact CZ3-CG 4.49Å; W112-M142 HydrophobicContact CZ3-SD 4.27Å; F126-M142 HydrophobicContact CE1-CE 4.42Å; L138-M142 HydrophobicContact CD1-CG 4.2Å; L138-M142 HydrophobicContact CD1-SD 4.43Å; L138-M142 HydrophobicContact CG-CG 4.4Å; L138-M142 HydrophobicContact CG-SD 4.1Å; L138-M142 WeakPolarHBondContact O-CG 3.32Å; L138-M142 PolarHBondContact O-N 3.21Å; P139-M142 PolarHBondContact O-N 3.44Å; M142-G145 PolarHBondContact O-N 3.23Å; M142-A146 WeakPolarHBondContact O-CB 3.4Å; M142-A146 PolarHBondContact O-N 2.87Å
143S95.3Very high92.2Very high24 Ų2461.2 Ų61.217%0.16832%0.323CS..Hα-helixtrans-58.6-48.6174.1174.30000112.7W112 P139 G145 A146 L147W112-S143 WeakPolarHBondContact O-CB 3.29Å; W112-S143 PolarHBondContact O-OG 3.42Å; P139-S143 WeakPolarHBondContact O-CB 3.32Å; P139-S143 PolarHBondContact O-N 2.84Å; S143-G145 VanDerWaalsContact C-N 3.32Å; S143-G145 PolarHBondContact O-N 2.96Å; S143-A146 PolarHBondContact O-N 3.42Å; S143-L147 PolarHBondContact O-N 2.96Å
144K94.4Very high92.2Very high143 Ų14359.5 Ų59.562%0.62231%0.308SS*.Hα-helixtrans-60.7-40.6174.8-72176.9-178.5-175.70112.4G140 R141 L147 N148G140-K144 WeakPolarHBondContact O-CG 3.27Å; G140-K144 PolarHBondContact O-N 3.23Å; R141-K144 PolarHBondContact O-N 3.21Å; K144-L147 PolarHBondContact O-N 3.32Å; K144-N148 WeakPolarHBondContact O-CB 3.21Å; K144-N148 PolarHBondContact O-N 3.18Å; K144-N148 PolarHBondContact O-ND2 3.09Å
145G93.9Very high91.9Very high39 Ų3958.6 Ų58.640%0.40231%0.31SS..Hα-helixtrans-62.4-44.2176.600000112.5R141 M142 S143 N148 R149R141-G145 PolarHBondContact O-N 3.3Å; M142-G145 PolarHBondContact O-N 3.23Å; S143-G145 VanDerWaalsContact C-N 3.32Å; S143-G145 PolarHBondContact O-N 2.96Å; G145-N148 PolarHBondContact O-N 3.33Å; G145-R149 WeakPolarHBondContact O-CB 3.31Å; G145-R149 PolarHBondContact O-N 3.18Å
146A94.5Very high91.2Very high7 Ų763 Ų636%0.05833%0.328CS..Hα-helixtrans-60.8-49.2175.700000111.7L108 W112 M142 S143 R149 I150L108-A146 HydrophobicContact CB-CB 4.22Å; L108-A146 HydrophobicContact CD2-CB 4.2Å; W112-A146 HydrophobicContact CB-CB 3.6Å; W112-A146 HydrophobicContact CG-CB 4.05Å; M142-A146 WeakPolarHBondContact O-CB 3.4Å; M142-A146 PolarHBondContact O-N 2.87Å; S143-A146 PolarHBondContact O-N 3.42Å; A146-R149 PolarHBondContact O-N 3.25Å; A146-I150 WeakPolarHBondContact O-CG1 3.38Å; A146-I150 PolarHBondContact O-N 3.42Å
147L94.4Very high90.2Very high53 Ų5361.5 Ų61.528%0.27733%0.326SS..Hα-helixtrans-60.5-47.6177.6179.760.5000111.8V113 S143 K144 R149 I150 L151 L162V113-L147 HydrophobicContact CG1-CD1 4.06Å; V113-L147 HydrophobicContact CG2-CB 4.12Å; V113-L147 HydrophobicContact CG2-CD1 4.38Å; S143-L147 PolarHBondContact O-N 2.96Å; K144-L147 PolarHBondContact O-N 3.32Å; L147-R149 VanDerWaalsContact C-N 3.3Å; L147-R149 PolarHBondContact O-N 2.6Å; L147-I150 PolarHBondContact O-N 2.79Å; L147-L151 HydrophobicContact CD1-CD1 4.08Å; L147-L151 HydrophobicContact CD1-CG 4.09Å; L147-L151 HydrophobicContact CG-CD1 3.99Å; L147-L151 HydrophobicContact CG-CG 4.39Å; L147-L151 WeakPolarHBondContact O-CG 3.33Å; L147-L151 PolarHBondContact O-N 3.23Å; L147-L162 HydrophobicContact CD1-CD1 4.21Å
148N93.8Very high89.1Confident91 Ų9162 Ų6249%0.48733%0.334SS..Hα-helixtrans-59.3-42.2178.4-75.2-16000111.6K144 G145 L151 L152K144-N148 WeakPolarHBondContact O-CB 3.21Å; K144-N148 PolarHBondContact O-N 3.18Å; K144-N148 PolarHBondContact O-ND2 3.09Å; G145-N148 PolarHBondContact O-N 3.33Å; N148-L151 PolarHBondContact O-N 2.88Å; N148-L152 WeakPolarHBondContact O-CB 3.28Å; N148-L152 WeakPolarHBondContact O-CG 3.11Å; N148-L152 PolarHBondContact O-N 3.5Å
149R93.1Very high88.2Confident108 Ų10863.6 Ų63.641%0.40834%0.343SS..Hα-helixtrans-61.2-45.5176.6-178174.9178.5174.14.4111.6L104 L108 G145 A146 L147 T153L104-R149 VanDerWaalsContact CD2-CZ 3.45Å; L108-R149 HydrophobicContact CD1-CG 4.49Å; G145-R149 WeakPolarHBondContact O-CB 3.31Å; G145-R149 PolarHBondContact O-N 3.18Å; A146-R149 PolarHBondContact O-N 3.25Å; L147-R149 VanDerWaalsContact C-N 3.3Å; L147-R149 PolarHBondContact O-N 2.6Å; R149-T153 WeakPolarHBondContact O-CB 3.45Å; R149-T153 WeakPolarHBondContact O-CG2 3.49Å; R149-T153 PolarHBondContact O-N 3.32Å; R149-T153 VanDerWaalsContact O-N 3.15Å; R149-T153 PolarHBondContact O-OG1 3.02Å
150I93.9Very high87.1Confident3 Ų372.1 Ų72.12%0.01538%0.376CS..Hα-helixtrans-61.4-48.4177.8-66.6162.4000110P105 L108 H109 V113 A146 L147 L152 T153 R154 V165 I169P105-I150 HydrophobicContact CB-CG1 4.28Å; P105-I150 WeakPolarHBondContact O-CD1 3.49Å; L108-I150 HydrophobicContact CB-CD1 4.04Å; L108-I150 HydrophobicContact CB-CG1 4.47Å; H109-I150 HydrophobicContact CB-CD1 3.92Å; V113-I150 HydrophobicContact CG2-CD1 4.04Å; A146-I150 WeakPolarHBondContact O-CG1 3.38Å; A146-I150 PolarHBondContact O-N 3.42Å; L147-I150 PolarHBondContact O-N 2.79Å; I150-L152 PolarHBondContact O-N 3.2Å; I150-T153 PolarHBondContact O-N 3.13Å; I150-T153 PolarHBondContact O-OG1 3.31Å; I150-R154 HydrophobicContact CG2-CB 4.47Å; I150-R154 WeakPolarHBondContact O-CA 3.18Å; I150-R154 VanDerWaalsContact O-CB 3.29Å; I150-R154 WeakPolarHBondContact O-CB 3.29Å; I150-R154 PolarHBondContact O-N 3.27Å; I150-V165 HydrophobicContact CG2-CG1 3.94Å; I150-I169 HydrophobicContact CG2-CD1 4.34Å
151L91.7Very high86.6Confident66 Ų6676.9 Ų76.935%0.34639%0.392SS..Hα-helixtrans-63.4-41.5-178.9-69.6178.1000112.9L147 N148 T153 G155 L162L147-L151 HydrophobicContact CD1-CD1 4.08Å; L147-L151 HydrophobicContact CD1-CG 4.09Å; L147-L151 HydrophobicContact CG-CD1 3.99Å; L147-L151 HydrophobicContact CG-CG 4.39Å; L147-L151 WeakPolarHBondContact O-CG 3.33Å; L147-L151 PolarHBondContact O-N 3.23Å; N148-L151 PolarHBondContact O-N 2.88Å; L151-T153 VanDerWaalsContact C-N 3.33Å; L151-T153 PolarHBondContact O-N 3.29Å; L151-G155 WeakPolarHBondContact O-CA 3.1Å; L151-G155 PolarHBondContact O-N 3.05Å; L151-L162 HydrophobicContact CD2-CD1 3.72Å
152L90.7Very high86.2Confident129 Ų12974.1 Ų74.168%0.67539%0.388SS*.Hα-helixtrans-66.2-35.7179.4-71.5170.4000112.7N148 I150 Q156N148-L152 WeakPolarHBondContact O-CB 3.28Å; N148-L152 WeakPolarHBondContact O-CG 3.11Å; N148-L152 PolarHBondContact O-N 3.5Å; I150-L152 PolarHBondContact O-N 3.2Å; L152-Q156 PolarHBondContact O-NE2 3.41Å
153T88.9Confident86Confident63 Ų6382.5 Ų82.539%0.38742%0.417SS..Hα-helixtrans-92.4-29.5-175.654.50000113.7R149 I150 L151R149-T153 WeakPolarHBondContact O-CB 3.45Å; R149-T153 WeakPolarHBondContact O-CG2 3.49Å; R149-T153 PolarHBondContact O-N 3.32Å; R149-T153 VanDerWaalsContact O-N 3.15Å; R149-T153 PolarHBondContact O-OG1 3.02Å; I150-T153 PolarHBondContact O-N 3.13Å; I150-T153 PolarHBondContact O-OG1 3.31Å; L151-T153 VanDerWaalsContact C-N 3.33Å; L151-T153 PolarHBondContact O-N 3.29Å
154R88.4Confident85.7Confident35 Ų3585.2 Ų85.213%0.13243%0.427CS..Hα-helixtrans-123.8-16.3-171.6-60.4-69.8-179.1-147.1-0.5114.5E101 P105 I150 Q156 L159 V165 I169E101-R154 VanDerWaalsContact CG-NH2 3.26Å; E101-R154 PolarHBondContact O-NH2 3.5Å; E101-R154 IonicContact OE1-CZ 3.97Å; E101-R154 IonicContact OE1-NH1 3.52Å; E101-R154 PolarHBondContact OE1-NH1 2.99Å; E101-R154 IonicContact OE1-NH2 3.99Å; E101-R154 PolarHBondContact OE1-NH2 2.56Å; E101-R154 IonicContact OE2-NH2 2.59Å; P105-R154 HydrophobicContact CB-CG 4.39Å; P105-R154 HydrophobicContact CG-CG 4.44Å; I150-R154 HydrophobicContact CG2-CB 4.47Å; I150-R154 WeakPolarHBondContact O-CA 3.18Å; I150-R154 VanDerWaalsContact O-CB 3.29Å; I150-R154 WeakPolarHBondContact O-CB 3.29Å; I150-R154 PolarHBondContact O-N 3.27Å; R154-Q156 PolarHBondContact O-N 3.4Å; R154-L159 WeakPolarHBondContact O-CD1 3.44Å; R154-V165 HydrophobicContact CB-CG1 3.75Å; R154-I169 HydrophobicContact CB-CG2 4.04Å; R154-I169 HydrophobicContact CG-CG2 3.66Å
155G81.1Confident85.6Confident28 Ų2878.5 Ų78.529%0.28940%0.399SS..  trans-83.224.9177.400000114.3L151L151-G155 WeakPolarHBondContact O-CA 3.1Å; L151-G155 PolarHBondContact O-N 3.05Å
156Q76.1Confident85.6Confident111 Ų11179.1 Ų79.152%0.51939%0.391SS..  trans-83158.3177.5-63.6-63-36.100110.6L152 R154 L159L152-Q156 PolarHBondContact O-NE2 3.41Å; R154-Q156 PolarHBondContact O-N 3.4Å; Q156-L159 PolarHBondContact O-N 3.03Å
157P68.8Low85.6Confident91 Ų9180.6 Ų80.659%0.59140%0.403SS*.THydrogen-bonded Turntrans-51.4140.3174.4-2634.8000111.8
158P67.8Low85.6Confident100 Ų10080.5 Ų80.565%0.64940%0.401SS*.THydrogen-bonded Turncis-91.110.810.837.6-37.3000114.7Y160P158-Y160 WeakPolarHBondContact O-CD2 3.41Å; P158-Y160 WeakPolarHBondContact O-CE2 3.44Å; P158-Y160 PolarHBondContact O-N 3.09Å
159L72.2Confident85.7Confident38 Ų3876.2 Ų76.220%0.19938%0.378CS..  trans-85.2100.5-174.3-58.7170.1000109.9R154 Q156 E164 V165 Q168R154-L159 WeakPolarHBondContact O-CD1 3.44Å; Q156-L159 PolarHBondContact O-N 3.03Å; L159-E164 HydrophobicContact CD2-CB 3.66Å; L159-V165 HydrophobicContact CB-CG2 3.84Å; L159-V165 HydrophobicContact CD1-CG2 4.33Å; L159-Q168 HydrophobicContact CD1-CB 4.12Å; L159-Q168 HydrophobicContact CD1-CG 4.21Å
160Y69.7Low85.9Confident179 Ų17971.5 Ų71.570%0.70236%0.361SS*.  trans-96.4-16.4-177.6-59.4-76.5000112.8P158 E164P158-Y160 WeakPolarHBondContact O-CD2 3.41Å; P158-Y160 WeakPolarHBondContact O-CE2 3.44Å; P158-Y160 PolarHBondContact O-N 3.09Å; Y160-E164 PolarHBondContact N-OE2 3.23Å
161H83Confident86Confident125 Ų12577.9 Ų77.958%0.57939%0.385SS*.SBendtrans-117.2141.7-176.9-64.2-61000112.9R163 E164 V165H161-R163 PolarHBondContact O-N 2.84Å; H161-E164 HydrophobicContact CB-CG 4.15Å; H161-E164 IonicContact CD2-OE1 3.89Å; H161-E164 WeakPolarHBondContact O-CB 3.31Å; H161-E164 PolarHBondContact O-N 3.17Å; H161-V165 PolarHBondContact O-N 3.02Å
162L86Confident86.3Confident91 Ų9175.1 Ų75.148%0.47637%0.37SS..Hα-helixtrans-57.5-35.1-178.4-168.466.2000113L147 L151 E164 V165 E166L147-L162 HydrophobicContact CD1-CD1 4.21Å; L151-L162 HydrophobicContact CD2-CD1 3.72Å; L162-E164 VanDerWaalsContact C-N 3.33Å; L162-E164 PolarHBondContact O-N 3.1Å; L162-V165 PolarHBondContact O-N 2.79Å; L162-E166 WeakPolarHBondContact O-CB 3.34Å; L162-E166 PolarHBondContact O-N 3.17Å
163R88.5Confident86.7Confident208 Ų20869 Ų6979%0.78534%0.338SS*.Hα-helixtrans-66.6-33.3177-63.4-171.6-165-141.54.4113H161 A167H161-R163 PolarHBondContact O-N 2.84Å; R163-A167 WeakPolarHBondContact O-CB 3.46Å; R163-A167 PolarHBondContact O-N 3.05Å
164E89.6Confident87.1Confident81 Ų8168.9 Ų68.938%0.37933%0.332SS..Hα-helixtrans-73-41.2178-60.2174164.400110.2L159 Y160 H161 L162 E166 A167 Q168L159-E164 HydrophobicContact CD2-CB 3.66Å; Y160-E164 PolarHBondContact N-OE2 3.23Å; H161-E164 HydrophobicContact CB-CG 4.15Å; H161-E164 IonicContact CD2-OE1 3.89Å; H161-E164 WeakPolarHBondContact O-CB 3.31Å; H161-E164 PolarHBondContact O-N 3.17Å; L162-E164 VanDerWaalsContact C-N 3.33Å; L162-E164 PolarHBondContact O-N 3.1Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E164-A167 PolarHBondContact O-N 3.38Å; E164-Q168 WeakPolarHBondContact O-CB 3.22Å; E164-Q168 PolarHBondContact O-N 3.06Å
165V92.4Very high87.6Confident3 Ų372.3 Ų72.32%0.01835%0.35CS..Hα-helixtrans-58.3-48.4171.6178.70000110.2I150 R154 L159 H161 L162 Q168 I169I150-V165 HydrophobicContact CG2-CG1 3.94Å; R154-V165 HydrophobicContact CB-CG1 3.75Å; L159-V165 HydrophobicContact CB-CG2 3.84Å; L159-V165 HydrophobicContact CD1-CG2 4.33Å; H161-V165 PolarHBondContact O-N 3.02Å; L162-V165 PolarHBondContact O-N 2.79Å; V165-Q168 PolarHBondContact O-N 3.26Å; V165-I169 HydrophobicContact CG1-CG2 4.47Å; V165-I169 WeakPolarHBondContact O-CG1 3.47Å; V165-I169 WeakPolarHBondContact O-CG2 3.29Å; V165-I169 PolarHBondContact O-N 2.72Å
166E93.4Very high88.4Confident51 Ų5171 Ų7124%0.23834%0.336CS..Hα-helixtrans-56.4-51.9175.7-178.9-176.1-175.400111.8H109 L162 E164 Q168 I169 Y170H109-E166 IonicContact CE1-OE1 3.74Å; H109-E166 PolarHBondContact CE1-OE1 2.82Å; L162-E166 WeakPolarHBondContact O-CB 3.34Å; L162-E166 PolarHBondContact O-N 3.17Å; E164-E166 VanDerWaalsContact C-N 3.34Å; E166-Q168 VanDerWaalsContact C-N 3.26Å; E166-Q168 PolarHBondContact O-N 3.27Å; E166-I169 WeakPolarHBondContact O-CG1 3.36Å; E166-I169 PolarHBondContact O-N 3.3Å; E166-Y170 HydrophobicContact CG-CD2 3.73Å; E166-Y170 HydrophobicContact CG-CE2 3.56Å; E166-Y170 WeakPolarHBondContact O-CD2 3.46Å; E166-Y170 PolarHBondContact O-N 3.41Å; E166-Y170 VanDerWaalsContact O-N 3.09Å
167A93.8Very high89.5Confident39 Ų3965.7 Ų65.732%0.32231%0.312SS..Hα-helixtrans-59.4-39.5178.400000111.7R163 E164 R171R163-A167 WeakPolarHBondContact O-CB 3.46Å; R163-A167 PolarHBondContact O-N 3.05Å; E164-A167 PolarHBondContact O-N 3.38Å; A167-R171 WeakPolarHBondContact O-CB 3.32Å; A167-R171 VanDerWaalsContact O-CG 3.3Å; A167-R171 WeakPolarHBondContact O-CG 3.42Å; A167-R171 PolarHBondContact O-N 3.11Å
168Q94.4Very high90.9Very high50 Ų5064.3 Ų64.323%0.23430%0.299CS..Hα-helixtrans-65.8-49.1177.8-177.158.730.700112.1L159 E164 V165 E166 Y170 R171 D172L159-Q168 HydrophobicContact CD1-CB 4.12Å; L159-Q168 HydrophobicContact CD1-CG 4.21Å; E164-Q168 WeakPolarHBondContact O-CB 3.22Å; E164-Q168 PolarHBondContact O-N 3.06Å; V165-Q168 PolarHBondContact O-N 3.26Å; E166-Q168 VanDerWaalsContact C-N 3.26Å; E166-Q168 PolarHBondContact O-N 3.27Å; Q168-Y170 VanDerWaalsContact C-N 3.29Å; Q168-Y170 PolarHBondContact O-N 3.01Å; Q168-R171 PolarHBondContact O-N 3.42Å; Q168-D172 PolarHBondContact NE2-OD1 2.92Å; Q168-D172 PolarHBondContact NE2-OD2 3.23Å; Q168-D172 WeakPolarHBondContact O-CB 3.24Å; Q168-D172 PolarHBondContact O-N 3.29Å
169I95.9Very high92.4Very high1 Ų163.1 Ų63.11%0.00529%0.287CS..Hα-helixtrans-63.4-36.3-178.663176.4000111.8P105 A106 H109 I150 R154 V165 E166 A173P105-I169 HydrophobicContact CB-CB 4.18Å; P105-I169 HydrophobicContact CB-CG2 3.83Å; A106-I169 HydrophobicContact CB-CB 4.49Å; H109-I169 HydrophobicContact CB-CD1 3.56Å; I150-I169 HydrophobicContact CG2-CD1 4.34Å; R154-I169 HydrophobicContact CB-CG2 4.04Å; R154-I169 HydrophobicContact CG-CG2 3.66Å; V165-I169 HydrophobicContact CG1-CG2 4.47Å; V165-I169 WeakPolarHBondContact O-CG1 3.47Å; V165-I169 WeakPolarHBondContact O-CG2 3.29Å; V165-I169 PolarHBondContact O-N 2.72Å; E166-I169 WeakPolarHBondContact O-CG1 3.36Å; E166-I169 PolarHBondContact O-N 3.3Å; I169-A173 WeakPolarHBondContact O-CB 3.47Å; I169-A173 PolarHBondContact O-N 3.27Å
170Y97.1Very high93.6Very high9 Ų961.3 Ų61.34%0.03528%0.278CS..Hα-helixtrans-72.3-36.1175.7-76.4-64.5000112.5A106 H109 T110 E166 Q168 K174 L219A106-Y170 HydrophobicContact CB-CD1 4.15Å; A106-Y170 HydrophobicContact CB-CE1 4.42Å; H109-Y170 AromaticContact ND1-CE2 3.64Å; H109-Y170 AromaticContact ND1-CZ 3.59Å; H109-Y170 PolarHBondContact ND1-OH 3.12Å; T110-Y170 PolarHBondContact OG1-OH 3.48Å; E166-Y170 HydrophobicContact CG-CD2 3.73Å; E166-Y170 HydrophobicContact CG-CE2 3.56Å; E166-Y170 WeakPolarHBondContact O-CD2 3.46Å; E166-Y170 PolarHBondContact O-N 3.41Å; E166-Y170 VanDerWaalsContact O-N 3.09Å; Q168-Y170 VanDerWaalsContact C-N 3.29Å; Q168-Y170 PolarHBondContact O-N 3.01Å; Y170-K174 VanDerWaalsContact O-CG 3.24Å; Y170-K174 WeakPolarHBondContact O-CG 3.42Å; Y170-K174 PolarHBondContact O-N 2.68Å; Y170-L219 HydrophobicContact CD1-CB 3.96Å; Y170-L219 HydrophobicContact CD1-CD1 4.43Å; Y170-L219 HydrophobicContact CD1-CD2 4.5Å; Y170-L219 HydrophobicContact CE1-CB 3.87Å; Y170-L219 HydrophobicContact CE1-CD2 4.48Å
171R97.1Very high95Very high137 Ų13753.4 Ų53.452%0.51725%0.249SC..Hα-helixtrans-61.2-50.9172.1-78.1-171.7-59.5-1073.7111.1A167 Q168 A173 K174 E175A167-R171 WeakPolarHBondContact O-CB 3.32Å; A167-R171 VanDerWaalsContact O-CG 3.3Å; A167-R171 WeakPolarHBondContact O-CG 3.42Å; A167-R171 PolarHBondContact O-N 3.11Å; Q168-R171 PolarHBondContact O-N 3.42Å; R171-A173 VanDerWaalsContact C-N 3.33Å; R171-A173 PolarHBondContact O-N 3.46Å; R171-K174 PolarHBondContact O-N 3.49Å; R171-E175 PolarHBondContact O-N 2.87Å
172D97.4Very high95.7Very high9 Ų953.5 Ų53.55%0.04825%0.253CS..Hα-helixtrans-59.1-42.6178.9-83.6-16.2000112.3K102 Q168 E175 C176K102-D172 HydrophobicContact CB-CB 4.44Å; K102-D172 HydrophobicContact CD-CB 3.53Å; K102-D172 IonicContact NZ-OD1 2.79Å; K102-D172 PolarHBondContact NZ-OD1 3.37Å; K102-D172 IonicContact NZ-OD2 2.7Å; K102-D172 PolarHBondContact NZ-OD2 2.91Å; K102-D172 VanDerWaalsContact NZ-OD2 3.15Å; Q168-D172 PolarHBondContact NE2-OD1 2.92Å; Q168-D172 PolarHBondContact NE2-OD2 3.23Å; Q168-D172 WeakPolarHBondContact O-CB 3.24Å; Q168-D172 PolarHBondContact O-N 3.29Å; D172-E175 PolarHBondContact O-N 2.93Å; D172-C176 WeakPolarHBondContact O-CB 3.3Å; D172-C176 PolarHBondContact O-N 3.06Å
173A98.3Very high96.2Very high0 Ų053.5 Ų53.50%025%0.247CC..Hα-helixtrans-65.2-41.9176.700000112.3L103 A106 I169 R171 C176 L177 L219L103-A173 HydrophobicContact CD1-CB 3.91Å; A106-A173 HydrophobicContact CB-CB 3.42Å; A106-A173 VanDerWaalsContact CB-CB 3.42Å; I169-A173 WeakPolarHBondContact O-CB 3.47Å; I169-A173 PolarHBondContact O-N 3.27Å; R171-A173 VanDerWaalsContact C-N 3.33Å; R171-A173 PolarHBondContact O-N 3.46Å; A173-C176 WeakPolarHBondContact O-CB 3.32Å; A173-C176 PolarHBondContact O-N 3.35Å; A173-L177 VanDerWaalsContact O-CG 3.31Å; A173-L177 WeakPolarHBondContact O-CG 3.28Å; A173-L177 PolarHBondContact O-N 2.74Å; A173-L219 HydrophobicContact CB-CD1 3.8Å; A173-L219 HydrophobicContact CB-CD2 4.35Å
174K98.5Very high96.7Very high61 Ų6143.7 Ų43.727%0.26521%0.21SC..Hα-helixtrans-63.5-41.3176.4-72.1177.5-177.8-169.90111.9Y170 R171 L177 N178 L219 H222Y170-K174 VanDerWaalsContact O-CG 3.24Å; Y170-K174 WeakPolarHBondContact O-CG 3.42Å; Y170-K174 PolarHBondContact O-N 2.68Å; R171-K174 PolarHBondContact O-N 3.49Å; K174-L177 PolarHBondContact O-N 3Å; K174-N178 VanDerWaalsContact O-CG 3.25Å; K174-N178 PolarHBondContact O-N 3.24Å; K174-N178 PolarHBondContact O-ND2 3.36Å; K174-L219 HydrophobicContact CG-CD1 4.2Å; K174-H222 HydrophobicContact CD-CB 4.29Å; K174-H222 HydrophobicContact CG-CB 4.03Å
175E98.4Very high97Very high106 Ų10641.4 Ų41.450%0.49521%0.209SC..Hα-helixtrans-60.4-47173.3-174-178.5-176.400111.2R171 D172 L177 N178 L179R171-E175 PolarHBondContact O-N 2.87Å; D172-E175 PolarHBondContact O-N 2.93Å; E175-L177 PolarHBondContact O-N 3.32Å; E175-N178 WeakPolarHBondContact O-CB 3.32Å; E175-N178 PolarHBondContact O-N 2.92Å; E175-N178 VanDerWaalsContact O-N 3.16Å; E175-L179 HydrophobicContact CG-CD1 4.45Å; E175-L179 WeakPolarHBondContact O-CG 3.35Å; E175-L179 PolarHBondContact O-N 3.3Å
176C98.5Very high97.2Very high1 Ų147.4 Ų47.41%0.00725%0.245CC..Hα-helixtrans-57.2-46.3175.4-179.50000112.1K102 D172 A173 N178 L179 L180K102-C176 HydrophobicContact CB-CB 3.83Å; D172-C176 WeakPolarHBondContact O-CB 3.3Å; D172-C176 PolarHBondContact O-N 3.06Å; A173-C176 WeakPolarHBondContact O-CB 3.32Å; A173-C176 PolarHBondContact O-N 3.35Å; C176-N178 VanDerWaalsContact C-N 3.32Å; C176-N178 PolarHBondContact O-N 3.17Å; C176-L179 PolarHBondContact O-N 2.57Å; C176-L180 VanDerWaalsContact O-CG 3.3Å; C176-L180 WeakPolarHBondContact O-CG 3.34Å; C176-L180 PolarHBondContact O-N 3.15Å
177L98.6Very high97.3Very high0 Ų047.5 Ų47.50%025%0.252CS..Hα-helixtrans-60.4-40.3176.6-70177.9000112.2L103 A173 K174 E175 L180 S181 L206 L219 L223 L226 L229L103-L177 HydrophobicContact CD1-CD2 4.2Å; L103-L177 HydrophobicContact CD1-CG 4.29Å; L103-L177 HydrophobicContact CD2-CD2 4.32Å; A173-L177 VanDerWaalsContact O-CG 3.31Å; A173-L177 WeakPolarHBondContact O-CG 3.28Å; A173-L177 PolarHBondContact O-N 2.74Å; K174-L177 PolarHBondContact O-N 3Å; E175-L177 PolarHBondContact O-N 3.32Å; L177-L180 PolarHBondContact O-N 2.76Å; L177-S181 WeakPolarHBondContact O-CB 3.39Å; L177-S181 PolarHBondContact O-N 2.81Å; L177-L206 HydrophobicContact CD2-CD1 4.21Å; L177-L206 HydrophobicContact CD2-CD2 3.51Å; L177-L219 HydrophobicContact CD1-CD1 3.9Å; L177-L223 HydrophobicContact CD1-CB 4.1Å; L177-L223 HydrophobicContact CD1-CD1 4.47Å; L177-L223 HydrophobicContact CD2-CD1 4.1Å; L177-L226 HydrophobicContact CB-CD1 3.7Å; L177-L229 HydrophobicContact CD2-CD1 4.4Å
178N98.6Very high97.4Very high62 Ų6249.6 Ų49.633%0.33226%0.255SS..Hα-helixtrans-64.7-42.4175.5-67.4-24.9000111.6K174 E175 C176 S181 N182 H222K174-N178 VanDerWaalsContact O-CG 3.25Å; K174-N178 PolarHBondContact O-N 3.24Å; K174-N178 PolarHBondContact O-ND2 3.36Å; E175-N178 WeakPolarHBondContact O-CB 3.32Å; E175-N178 PolarHBondContact O-N 2.92Å; E175-N178 VanDerWaalsContact O-N 3.16Å; C176-N178 VanDerWaalsContact C-N 3.32Å; C176-N178 PolarHBondContact O-N 3.17Å; N178-S181 PolarHBondContact O-N 2.69Å; N178-N182 WeakPolarHBondContact O-CB 3.43Å; N178-N182 PolarHBondContact O-N 3.11Å; N178-N182 PolarHBondContact O-ND2 2.88Å; N178-H222 PolarHBondContact OD1-NE2 3Å
179L98.4Very high97.5Very high75 Ų7547.6 Ų47.639%0.39325%0.245SC..Hα-helixtrans-62.1-43.3175.9-69.8172.7000111.8L98 E175 C176 N182 R183L98-L179 HydrophobicContact CD2-CB 4.48Å; L98-L179 HydrophobicContact CD2-CD1 4.04Å; E175-L179 HydrophobicContact CG-CD1 4.45Å; E175-L179 WeakPolarHBondContact O-CG 3.35Å; E175-L179 PolarHBondContact O-N 3.3Å; C176-L179 PolarHBondContact O-N 2.57Å; L179-N182 PolarHBondContact O-N 3.36Å; L179-R183 WeakPolarHBondContact O-CB 3.26Å; L179-R183 PolarHBondContact O-N 2.79Å
180L98.4Very high97.5Very high0 Ų047.9 Ų47.90%025%0.246CC..Hα-helixtrans-64-43.4176-68.8169.7000111.7Y95 L99 C176 L177 R183 L184 F190 V202 L229Y95-L180 HydrophobicContact CD1-CD2 4.01Å; L99-L180 HydrophobicContact CD2-CD1 3.57Å; C176-L180 VanDerWaalsContact O-CG 3.3Å; C176-L180 WeakPolarHBondContact O-CG 3.34Å; C176-L180 PolarHBondContact O-N 3.15Å; L177-L180 PolarHBondContact O-N 2.76Å; L180-R183 PolarHBondContact O-N 3.28Å; L180-L184 WeakPolarHBondContact O-CB 3.31Å; L180-L184 PolarHBondContact O-N 3.48Å; L180-F190 HydrophobicContact CB-CE1 4.3Å; L180-F190 HydrophobicContact CB-CZ 4.14Å; L180-F190 HydrophobicContact CD2-CE1 3.76Å; L180-F190 HydrophobicContact CD2-CZ 3.99Å; L180-V202 HydrophobicContact CD2-CG2 3.99Å; L180-L229 HydrophobicContact CB-CD1 4.42Å; L180-L229 HydrophobicContact CB-CD2 4.34Å
181S98.4Very high97.5Very high13 Ų1348.8 Ų48.89%0.09125%0.25CS..Hα-helixtrans-59.8-47.8175.2175.80000111.4L177 N178 R183 L184 G185 N228L177-S181 WeakPolarHBondContact O-CB 3.39Å; L177-S181 PolarHBondContact O-N 2.81Å; N178-S181 PolarHBondContact O-N 2.69Å; S181-R183 VanDerWaalsContact C-N 3.29Å; S181-R183 PolarHBondContact O-N 3.08Å; S181-L184 PolarHBondContact O-N 3.31Å; S181-G185 PolarHBondContact O-N 3.2Å; S181-N228 PolarHBondContact O-ND2 3.08Å; S181-N228 PolarHBondContact OG-ND2 2.9Å; S181-N228 PolarHBondContact OG-OD1 3.25Å
182N97.9Very high97.1Very high127 Ų12743.4 Ų43.468%0.67924%0.238SC*.Hα-helixtrans-61.9-39177-71.3-20.3000111.8N178 L179N178-N182 WeakPolarHBondContact O-CB 3.43Å; N178-N182 PolarHBondContact O-N 3.11Å; N178-N182 PolarHBondContact O-ND2 2.88Å; L179-N182 PolarHBondContact O-N 3.36Å
183R97.4Very high96.8Very high91 Ų9149.3 Ų49.334%0.34327%0.269SS..Hα-helixtrans-68.6-42.7178.7175.558.8-169.6-175.22.5112.4Y95 L179 L180 S181 G185 F190 F191Y95-R183 HydrophobicContact CE1-CB 4.29Å; Y95-R183 HydrophobicContact CE1-CG 4.26Å; Y95-R183 HydrophobicContact CE2-CG 4.06Å; Y95-R183 WeakPolarHBondContact OH-CD 3.42Å; L179-R183 WeakPolarHBondContact O-CB 3.26Å; L179-R183 PolarHBondContact O-N 2.79Å; L180-R183 PolarHBondContact O-N 3.28Å; S181-R183 VanDerWaalsContact C-N 3.29Å; S181-R183 PolarHBondContact O-N 3.08Å; R183-G185 VanDerWaalsContact C-N 3.34Å; R183-F190 HydrophobicContact CB-CD1 4.26Å; R183-F190 HydrophobicContact CB-CE1 4.08Å; R183-F190 HydrophobicContact CG-CD1 3.56Å; R183-F190 HydrophobicContact CG-CE1 3.89Å; R183-F190 PolarHBondContact NH2-O 3.39Å; R183-F191 VanDerWaalsContact NH2-CD1 3.27Å
184L97.9Very high96.5Very high1 Ų152.1 Ų52.11%0.00529%0.286CS..Hα-helixtrans-66.7-39.9176.7-178.666.6000110.9L180 S181 T186 S187 F190 N228 L229 F232L180-L184 WeakPolarHBondContact O-CB 3.31Å; L180-L184 PolarHBondContact O-N 3.48Å; S181-L184 PolarHBondContact O-N 3.31Å; L184-T186 PolarHBondContact O-N 2.77Å; L184-S187 WeakPolarHBondContact O-CB 3.16Å; L184-S187 PolarHBondContact O-N 3.31Å; L184-F190 HydrophobicContact CB-CE1 4.34Å; L184-F190 HydrophobicContact CB-CE2 4.3Å; L184-F190 HydrophobicContact CB-CZ 4.07Å; L184-F190 HydrophobicContact CD1-CD2 4.02Å; L184-F190 HydrophobicContact CD1-CE2 4.09Å; L184-N228 HydrophobicContact CD2-CB 4.34Å; L184-L229 HydrophobicContact CB-CD2 4.47Å; L184-L229 HydrophobicContact CD2-CD2 3.89Å; L184-F232 HydrophobicContact CD1-CD2 4.21Å; L184-F232 HydrophobicContact CD2-CB 3.75Å; L184-F232 HydrophobicContact CD2-CD2 4.27Å; L184-F232 HydrophobicContact CD2-CG 4.17Å
185G96.7Very high96.4Very high34 Ų3450 Ų5035%0.35128%0.279SS..THydrogen-bonded Turntrans56.7-123.2-179.400000111S181 R183 N228S181-G185 PolarHBondContact O-N 3.2Å; R183-G185 VanDerWaalsContact C-N 3.34Å; G185-N228 PolarHBondContact O-ND2 3.36Å
186T95.6Very high96.4Very high129 Ų12945 Ų4579%0.79126%0.256SS*.THydrogen-bonded Turntrans-98-9.3176.854.10000113.6L184 R231L184-T186 PolarHBondContact O-N 2.77Å; T186-R231 PolarHBondContact O-NH2 3.44Å
187S96Very high96.3Very high53 Ų5345.1 Ų45.137%0.37126%0.256SS..  trans-63.2158.4-176.1-56.10000112.6L184 F189 R231L184-S187 WeakPolarHBondContact O-CB 3.16Å; L184-S187 PolarHBondContact O-N 3.31Å; S187-F189 VanDerWaalsContact CB-O 3.3Å; S187-F189 WeakPolarHBondContact CB-O 3.16Å; S187-R231 PolarHBondContact O-NH2 3.19Å
188Q95.1Very high96.3Very high83 Ų8345.1 Ų45.139%0.38826%0.256SS..SBendtrans-73.5-44.6174.4-170.6175.83000111.2F232Q188-F232 WeakPolarHBondContact O-CD2 3.34Å
189F97.3Very high96.2Very high8 Ų842.1 Ų42.14%0.03524%0.241CC..BIsolated β-bridgetrans-125.9166.3177.7-59.2-71.8000111.2S187 F191 G192 D193 P195 D199 F232 I236 Y240S187-F189 VanDerWaalsContact CB-O 3.3Å; S187-F189 WeakPolarHBondContact CB-O 3.16Å; F189-F191 PolarHBondContact O-N 3.4Å; F189-F191 VanDerWaalsContact O-N 3.17Å; F189-G192 WeakPolarHBondContact CB-O 3.37Å; F189-G192 PolarHBondContact N-O 2.87Å; F189-G192 PolarHBondContact O-N 3.43Å; F189-D193 WeakPolarHBondContact CD2-O 3.44Å; F189-D193 WeakPolarHBondContact CE2-O 3.34Å; F189-P195 HydrophobicContact CD1-CB 3.87Å; F189-P195 HydrophobicContact CD2-CB 4.5Å; F189-P195 HydrophobicContact CE1-CB 3.69Å; F189-P195 HydrophobicContact CE2-CB 4.33Å; F189-P195 HydrophobicContact CG-CB 4.28Å; F189-P195 HydrophobicContact CZ-CB 3.93Å; F189-P195 HydrophobicContact CZ-CG 4.38Å; F189-D199 VanDerWaalsContact CA-OD1 3.32Å; F189-D199 WeakPolarHBondContact CA-OD1 3.47Å; F189-D199 VanDerWaalsContact CB-OD1 3.29Å; F189-D199 WeakPolarHBondContact CB-OD1 3.37Å; F189-D199 HydrophobicContact CD1-CB 4.13Å; F189-F232 HydrophobicContact CD1-CE2 4.12Å; F189-I236 HydrophobicContact CE1-CD1 4.39Å; F189-I236 HydrophobicContact CE1-CG1 4.11Å; F189-Y240 HydrophobicContact CZ-CE2 4.18Å
190F96.9Very high96.2Very high6 Ų638.6 Ų38.63%0.02622%0.222CC..THydrogen-bonded Turntrans-66-18.6-173.5-85.6-102.1000114.8L180 R183 L184 L198 D199 V202 L229 F232L180-F190 HydrophobicContact CB-CE1 4.3Å; L180-F190 HydrophobicContact CB-CZ 4.14Å; L180-F190 HydrophobicContact CD2-CE1 3.76Å; L180-F190 HydrophobicContact CD2-CZ 3.99Å; R183-F190 HydrophobicContact CB-CD1 4.26Å; R183-F190 HydrophobicContact CB-CE1 4.08Å; R183-F190 HydrophobicContact CG-CD1 3.56Å; R183-F190 HydrophobicContact CG-CE1 3.89Å; R183-F190 PolarHBondContact NH2-O 3.39Å; L184-F190 HydrophobicContact CB-CE1 4.34Å; L184-F190 HydrophobicContact CB-CE2 4.3Å; L184-F190 HydrophobicContact CB-CZ 4.07Å; L184-F190 HydrophobicContact CD1-CD2 4.02Å; L184-F190 HydrophobicContact CD1-CE2 4.09Å; F190-L198 HydrophobicContact CB-CD2 3.67Å; F190-L198 HydrophobicContact CB-CG 4.06Å; F190-L198 HydrophobicContact CD1-CD2 3.76Å; F190-L198 HydrophobicContact CD1-CG 4.22Å; F190-L198 HydrophobicContact CG-CD2 3.86Å; F190-L198 HydrophobicContact CG-CG 4.05Å; F190-D199 WeakPolarHBondContact CD2-OD1 3.47Å; F190-D199 PolarHBondContact N-OD1 2.9Å; F190-V202 HydrophobicContact CD2-CG2 4.35Å; F190-V202 HydrophobicContact CE1-CG2 4.33Å; F190-V202 HydrophobicContact CE2-CB 3.96Å; F190-V202 HydrophobicContact CE2-CG1 3.73Å; F190-V202 HydrophobicContact CE2-CG2 3.78Å; F190-V202 HydrophobicContact CZ-CB 4.29Å; F190-V202 HydrophobicContact CZ-CG1 3.87Å; F190-V202 HydrophobicContact CZ-CG2 3.78Å; F190-L229 HydrophobicContact CZ-CD2 4.44Å; F190-F232 HydrophobicContact CD2-CE2 4.18Å; F190-F232 HydrophobicContact CD2-CZ 4.33Å; F190-F232 HydrophobicContact CE2-CE2 4.2Å; F190-F232 HydrophobicContact CE2-CZ 4.14Å
191F95.3Very high96.2Very high28 Ų2839.2 Ų39.212%0.12322%0.224CC..THydrogen-bonded Turntrans-12413.4178.8-63.2-58.1000114.4L84 Q88 D91 T92 R183 F189 S196 L198L84-F191 HydrophobicContact CD1-CD2 4.09Å; L84-F191 HydrophobicContact CD1-CE2 4.18Å; L84-F191 HydrophobicContact CD2-CB 3.75Å; L84-F191 HydrophobicContact CD2-CD2 3.62Å; L84-F191 HydrophobicContact CD2-CE2 4.41Å; L84-F191 HydrophobicContact CD2-CG 3.8Å; Q88-F191 HydrophobicContact CB-CD1 3.9Å; Q88-F191 HydrophobicContact CB-CE1 3.78Å; Q88-F191 HydrophobicContact CB-CG 4.34Å; Q88-F191 HydrophobicContact CB-CZ 4.14Å; Q88-F191 HydrophobicContact CG-CD1 3.61Å; Q88-F191 HydrophobicContact CG-CE1 3.81Å; Q88-F191 HydrophobicContact CG-CG 4.3Å; Q88-F191 WeakPolarHBondContact O-CZ 3.15Å; D91-F191 HydrophobicContact CB-CE1 4.17Å; D91-F191 HydrophobicContact CB-CZ 4.11Å; T92-F191 WeakPolarHBondContact OG1-CE2 3.15Å; T92-F191 WeakPolarHBondContact OG1-CZ 3.18Å; R183-F191 VanDerWaalsContact NH2-CD1 3.27Å; F189-F191 PolarHBondContact O-N 3.4Å; F189-F191 VanDerWaalsContact O-N 3.17Å; F191-S196 WeakPolarHBondContact CD2-OG 3.36Å; F191-L198 HydrophobicContact CE2-CB 3.82Å; F191-L198 HydrophobicContact CE2-CD2 3.67Å; F191-L198 HydrophobicContact CE2-CG 4.4Å; F191-L198 HydrophobicContact CZ-CD2 3.68Å
192G90.4Very high96.2Very high24 Ų2438.6 Ų38.625%0.24722%0.22CC..BIsolated β-bridgetrans133-130.1176.200000112.2F189F189-G192 WeakPolarHBondContact CB-O 3.37Å; F189-G192 PolarHBondContact N-O 2.87Å; F189-G192 PolarHBondContact O-N 3.43Å
193D90.4Very high96.3Very high133 Ų13332.5 Ų32.571%0.71119%0.188SC*.SBendtrans-100.1-10.3-172.4-57.5-41000113.4F189F189-D193 WeakPolarHBondContact CD2-O 3.44Å; F189-D193 WeakPolarHBondContact CE2-O 3.34Å
194T92.5Very high96.3Very high59 Ų5928.2 Ų28.236%0.36217%0.171SC..SBendtrans-107.7137.4176.552.30000111.2E83E83-T194 VanDerWaalsContact OE2-CG2 3.29Å; E83-T194 WeakPolarHBondContact OE2-CG2 3.13Å; E83-T194 PolarHBondContact OE2-OG1 3.4Å
195P96.6Very high96.2Very high17 Ų1728.4 Ų28.411%0.1117%0.172CC..  trans-72.9144.7178.733.2-39.4000111.4F32 F189 Y240F32-P195 HydrophobicContact CB-CB 4.07Å; F32-P195 HydrophobicContact CB-CG 3.81Å; F32-P195 HydrophobicContact CD1-CB 3.72Å; F32-P195 HydrophobicContact CD1-CG 3.86Å; F32-P195 HydrophobicContact CD2-CB 3.63Å; F32-P195 HydrophobicContact CD2-CG 4.32Å; F32-P195 HydrophobicContact CE1-CB 3.98Å; F32-P195 HydrophobicContact CE2-CB 3.86Å; F32-P195 HydrophobicContact CG-CB 3.55Å; F32-P195 HydrophobicContact CG-CG 3.76Å; F32-P195 HydrophobicContact CZ-CB 4.04Å; F189-P195 HydrophobicContact CD1-CB 3.87Å; F189-P195 HydrophobicContact CD2-CB 4.5Å; F189-P195 HydrophobicContact CE1-CB 3.69Å; F189-P195 HydrophobicContact CE2-CB 4.33Å; F189-P195 HydrophobicContact CG-CB 4.28Å; F189-P195 HydrophobicContact CZ-CB 3.93Å; F189-P195 HydrophobicContact CZ-CG 4.38Å; P195-Y240 WeakPolarHBondContact CG-OH 3.42Å
196S96.7Very high96.3Very high2 Ų226.8 Ų26.81%0.01416%0.156CC..  trans-124178.9-178.571.20000113F191 L198 D199 A200F191-S196 WeakPolarHBondContact CD2-OG 3.36Å; S196-L198 PolarHBondContact O-N 2.84Å; S196-L198 PolarHBondContact OG-N 3.01Å; S196-D199 WeakPolarHBondContact CB-OD2 3.26Å; S196-D199 PolarHBondContact N-OD2 3.32Å; S196-D199 PolarHBondContact O-N 2.9Å; S196-D199 PolarHBondContact OG-OD2 3.22Å; S196-A200 PolarHBondContact O-N 3.19Å
197T97.4Very high96.4Very high2 Ų220.7 Ų20.71%0.01212%0.118CC..Hα-helixtrans-53.6-40.9168.4-680000111.3Y29 L70 R74 D81 T92 I96 D199 A200 Y201Y29-T197 WeakPolarHBondContact CE2-OG1 3.36Å; L70-T197 HydrophobicContact CD2-CG2 3.93Å; R74-T197 PolarHBondContact NH2-OG1 3.03Å; R74-T197 VanDerWaalsContact NH2-OG1 3.09Å; D81-T197 VanDerWaalsContact OD1-CB 3.31Å; D81-T197 WeakPolarHBondContact OD1-CB 3.28Å; D81-T197 PolarHBondContact OD1-N 3.15Å; D81-T197 PolarHBondContact OD1-OG1 3.29Å; D81-T197 WeakPolarHBondContact OD2-CB 3.37Å; D81-T197 PolarHBondContact OD2-OG1 3.37Å; T92-T197 HydrophobicContact CG2-CG2 4.24Å; I96-T197 HydrophobicContact CD1-CG2 3.97Å; T197-D199 VanDerWaalsContact C-N 3.32Å; T197-D199 PolarHBondContact O-N 3.03Å; T197-A200 WeakPolarHBondContact O-CB 3.41Å; T197-A200 PolarHBondContact O-N 3.32Å; T197-Y201 HydrophobicContact CG2-CD2 3.75Å; T197-Y201 HydrophobicContact CG2-CE2 3.82Å; T197-Y201 WeakPolarHBondContact O-CD2 3.45Å; T197-Y201 PolarHBondContact O-N 3.39Å; T197-Y201 VanDerWaalsContact O-N 3.09Å
198L97.8Very high96.4Very high0 Ų018.1 Ų18.10%010%0.1CC..Hα-helixtrans-60.8-44.7-178.8178.453.4000110.9T92 Y95 F190 F191 S196 A200 Y201 V202T92-L198 HydrophobicContact CG2-CB 4.06Å; Y95-L198 VanDerWaalsContact CB-CD1 3.45Å; Y95-L198 HydrophobicContact CD2-CD2 3.9Å; Y95-L198 HydrophobicContact CG-CD1 4.32Å; Y95-L198 HydrophobicContact CG-CD2 4.18Å; F190-L198 HydrophobicContact CB-CD2 3.67Å; F190-L198 HydrophobicContact CB-CG 4.06Å; F190-L198 HydrophobicContact CD1-CD2 3.76Å; F190-L198 HydrophobicContact CD1-CG 4.22Å; F190-L198 HydrophobicContact CG-CD2 3.86Å; F190-L198 HydrophobicContact CG-CG 4.05Å; F191-L198 HydrophobicContact CE2-CB 3.82Å; F191-L198 HydrophobicContact CE2-CD2 3.67Å; F191-L198 HydrophobicContact CE2-CG 4.4Å; F191-L198 HydrophobicContact CZ-CD2 3.68Å; S196-L198 PolarHBondContact O-N 2.84Å; S196-L198 PolarHBondContact OG-N 3.01Å; L198-A200 VanDerWaalsContact C-N 3.26Å; L198-A200 PolarHBondContact O-N 3.3Å; L198-Y201 PolarHBondContact O-N 2.89Å; L198-V202 HydrophobicContact CD1-CG2 3.88Å; L198-V202 HydrophobicContact CG-CG2 4.3Å; L198-V202 WeakPolarHBondContact O-CG2 3.42Å; L198-V202 PolarHBondContact O-N 3.31Å
199D98.3Very high96.4Very high0 Ų014.2 Ų14.20%08%0.082CC..Hα-helixtrans-60.4-38.4178.3-57.7-78.7000111.5F32 F189 F190 S196 T197 F203 F232F32-D199 HydrophobicContact CE2-CB 3.89Å; F32-D199 HydrophobicContact CZ-CB 4.43Å; F189-D199 VanDerWaalsContact CA-OD1 3.32Å; F189-D199 WeakPolarHBondContact CA-OD1 3.47Å; F189-D199 VanDerWaalsContact CB-OD1 3.29Å; F189-D199 WeakPolarHBondContact CB-OD1 3.37Å; F189-D199 HydrophobicContact CD1-CB 4.13Å; F190-D199 WeakPolarHBondContact CD2-OD1 3.47Å; F190-D199 PolarHBondContact N-OD1 2.9Å; S196-D199 WeakPolarHBondContact CB-OD2 3.26Å; S196-D199 PolarHBondContact N-OD2 3.32Å; S196-D199 PolarHBondContact O-N 2.9Å; S196-D199 PolarHBondContact OG-OD2 3.22Å; T197-D199 VanDerWaalsContact C-N 3.32Å; T197-D199 PolarHBondContact O-N 3.03Å; D199-F203 WeakPolarHBondContact O-CB 3.21Å; D199-F203 PolarHBondContact O-N 3.24Å; D199-F232 HydrophobicContact CB-CE2 4.11Å; D199-F232 HydrophobicContact CB-CZ 3.93Å; D199-F232 WeakPolarHBondContact OD1-CE2 3.45Å
200A98.2Very high96.4Very high0 Ų015.9 Ų15.90%09%0.088CC..Hα-helixtrans-66.2-41.7179.200000111.4V25 A28 Y29 F32 S196 T197 L198 G204V25-A200 HydrophobicContact CG1-CB 4.48Å; A28-A200 HydrophobicContact CB-CB 4.11Å; Y29-A200 HydrophobicContact CD2-CB 4.46Å; F32-A200 HydrophobicContact CD2-CB 4.02Å; F32-A200 HydrophobicContact CE2-CB 3.76Å; S196-A200 PolarHBondContact O-N 3.19Å; T197-A200 WeakPolarHBondContact O-CB 3.41Å; T197-A200 PolarHBondContact O-N 3.32Å; L198-A200 VanDerWaalsContact C-N 3.26Å; L198-A200 PolarHBondContact O-N 3.3Å; A200-G204 PolarHBondContact O-N 2.86Å
201Y98.3Very high96.3Very high13 Ų1318.1 Ų18.15%0.05110%0.098CC..Hα-helixtrans-65.8-51.3174.8-90.1-94.1000111.7V25 L70 I96 T197 L198 F203 G204 F205V25-Y201 HydrophobicContact CG1-CD1 4.16Å; V25-Y201 HydrophobicContact CG1-CD2 3.64Å; V25-Y201 HydrophobicContact CG1-CE1 4.22Å; V25-Y201 HydrophobicContact CG1-CE2 3.7Å; V25-Y201 HydrophobicContact CG1-CG 3.89Å; V25-Y201 HydrophobicContact CG2-CD1 4.3Å; V25-Y201 HydrophobicContact CG2-CG 4.42Å; L70-Y201 HydrophobicContact CD2-CD2 4.43Å; L70-Y201 HydrophobicContact CD2-CE2 3.68Å; I96-Y201 HydrophobicContact CD1-CD2 3.68Å; I96-Y201 HydrophobicContact CD1-CE2 3.81Å; I96-Y201 HydrophobicContact CD1-CG 4.05Å; I96-Y201 HydrophobicContact CG1-CD1 4.14Å; I96-Y201 HydrophobicContact CG1-CD2 3.99Å; I96-Y201 HydrophobicContact CG1-CE2 4.43Å; I96-Y201 HydrophobicContact CG1-CG 3.82Å; I96-Y201 HydrophobicContact CG2-CD1 3.98Å; I96-Y201 HydrophobicContact CG2-CE1 3.83Å; I96-Y201 HydrophobicContact CG2-CG 4.5Å; T197-Y201 HydrophobicContact CG2-CD2 3.75Å; T197-Y201 HydrophobicContact CG2-CE2 3.82Å; T197-Y201 WeakPolarHBondContact O-CD2 3.45Å; T197-Y201 PolarHBondContact O-N 3.39Å; T197-Y201 VanDerWaalsContact O-N 3.09Å; L198-Y201 PolarHBondContact O-N 2.89Å; Y201-F203 VanDerWaalsContact C-N 3.31Å; Y201-F203 PolarHBondContact O-N 3.16Å; Y201-G204 PolarHBondContact O-N 2.83Å; Y201-F205 HydrophobicContact CD1-CE2 4.01Å; Y201-F205 WeakPolarHBondContact O-CD2 3.49Å; Y201-F205 PolarHBondContact O-N 3.42Å
202V98.4Very high96.3Very high0 Ų017 Ų170%09%0.093CC..Hα-helixtrans-57.5-48.5178.9176.50000110L99 L180 F190 L198 G204 F205 L206 F232L99-V202 HydrophobicContact CD1-CG2 3.91Å; L180-V202 HydrophobicContact CD2-CG2 3.99Å; F190-V202 HydrophobicContact CD2-CG2 4.35Å; F190-V202 HydrophobicContact CE1-CG2 4.33Å; F190-V202 HydrophobicContact CE2-CB 3.96Å; F190-V202 HydrophobicContact CE2-CG1 3.73Å; F190-V202 HydrophobicContact CE2-CG2 3.78Å; F190-V202 HydrophobicContact CZ-CB 4.29Å; F190-V202 HydrophobicContact CZ-CG1 3.87Å; F190-V202 HydrophobicContact CZ-CG2 3.78Å; L198-V202 HydrophobicContact CD1-CG2 3.88Å; L198-V202 HydrophobicContact CG-CG2 4.3Å; L198-V202 WeakPolarHBondContact O-CG2 3.42Å; L198-V202 PolarHBondContact O-N 3.31Å; V202-G204 PolarHBondContact O-N 3.35Å; V202-F205 PolarHBondContact O-N 3.05Å; V202-L206 HydrophobicContact CG1-CD1 3.83Å; V202-L206 HydrophobicContact CG1-CG 3.92Å; V202-L206 WeakPolarHBondContact O-CB 3.47Å; V202-L206 VanDerWaalsContact O-CG 3.26Å; V202-L206 WeakPolarHBondContact O-CG 3.44Å; V202-L206 PolarHBondContact O-N 3.12Å; V202-F232 HydrophobicContact CB-CE1 4.15Å; V202-F232 HydrophobicContact CB-CZ 4.35Å; V202-F232 HydrophobicContact CG1-CD1 4.44Å; V202-F232 HydrophobicContact CG1-CE1 3.81Å; V202-F232 HydrophobicContact CG1-CZ 4.39Å
203F98.4Very high96.5Very high0 Ų025.6 Ų25.60%012%0.118CC..Hα-helixtrans-57.1-48.5177.3173.2-103.5000112.8L24 A28 D199 Y201 F205 L206 A207 F232 I236 L237 F241L24-F203 HydrophobicContact CB-CE1 4.37Å; L24-F203 HydrophobicContact CD2-CE1 4.26Å; A28-F203 HydrophobicContact CB-CD1 3.67Å; A28-F203 HydrophobicContact CB-CE1 4.13Å; D199-F203 WeakPolarHBondContact O-CB 3.21Å; D199-F203 PolarHBondContact O-N 3.24Å; Y201-F203 VanDerWaalsContact C-N 3.31Å; Y201-F203 PolarHBondContact O-N 3.16Å; F203-F205 PolarHBondContact O-N 3.17Å; F203-L206 PolarHBondContact O-N 3.01Å; F203-A207 HydrophobicContact CD2-CB 3.89Å; F203-A207 HydrophobicContact CE1-CB 4.47Å; F203-A207 HydrophobicContact CE2-CB 3.54Å; F203-A207 HydrophobicContact CG-CB 4.49Å; F203-A207 HydrophobicContact CZ-CB 3.87Å; F203-A207 WeakPolarHBondContact O-CB 3.35Å; F203-A207 PolarHBondContact O-N 2.97Å; F203-F232 HydrophobicContact CB-CE1 4Å; F203-F232 HydrophobicContact CB-CZ 4.4Å; F203-I236 HydrophobicContact CB-CD1 3.87Å; F203-I236 HydrophobicContact CD1-CG2 4.1Å; F203-I236 HydrophobicContact CD2-CB 3.85Å; F203-I236 HydrophobicContact CD2-CD1 3.99Å; F203-I236 HydrophobicContact CD2-CG2 3.61Å; F203-I236 HydrophobicContact CE1-CG2 4.11Å; F203-I236 HydrophobicContact CE2-CB 3.99Å; F203-I236 HydrophobicContact CE2-CG2 3.63Å; F203-I236 HydrophobicContact CG-CB 4.45Å; F203-I236 HydrophobicContact CG-CD1 4.1Å; F203-I236 HydrophobicContact CG-CG2 3.85Å; F203-I236 HydrophobicContact CZ-CG2 3.88Å; F203-L237 HydrophobicContact CE2-CD2 4.18Å; F203-L237 HydrophobicContact CE2-CG 3.89Å; F203-L237 HydrophobicContact CZ-CD2 3.77Å; F203-L237 HydrophobicContact CZ-CG 4.01Å; F203-F241 AromaticContact CE1-CE2 3.92Å; F203-F241 HydrophobicContact CE1-CE2 3.92Å; F203-F241 HydrophobicContact CE1-CZ 4.48Å; F203-F241 HydrophobicContact CZ-CD2 4.43Å; F203-F241 HydrophobicContact CZ-CE2 4.13Å
204G97.4Very high96.6Very high0 Ų019.8 Ų19.80%09%0.087CC..Hα-helixtrans-62.4-30.9-17700000113.7S21 A200 Y201 V202 P208S21-G204 WeakPolarHBondContact CA-O 3.05Å; S21-G204 WeakPolarHBondContact CB-O 3.24Å; S21-G204 PolarHBondContact OG-O 2.94Å; S21-G204 VanDerWaalsContact OG-O 3.11Å; A200-G204 PolarHBondContact O-N 2.86Å; Y201-G204 PolarHBondContact O-N 2.83Å; V202-G204 PolarHBondContact O-N 3.35Å; G204-P208 WeakPolarHBondContact O-CD 3.46Å; G204-P208 WeakPolarHBondContact O-CG 3.25Å
205F97Very high96.7Very high6 Ų620.3 Ų20.33%0.0269%0.091CC..Hα-helixtrans-84.1-41.1176.4-77-109.2000112.2V25 L103 L104 Y201 V202 F203V25-F205 HydrophobicContact CG2-CD2 4.31Å; V25-F205 HydrophobicContact CG2-CE2 4.24Å; L103-F205 HydrophobicContact CD2-CB 4.02Å; L104-F205 HydrophobicContact CB-CD1 4.48Å; L104-F205 HydrophobicContact CB-CE1 3.76Å; L104-F205 HydrophobicContact CD1-CD1 4.39Å; L104-F205 HydrophobicContact CD1-CE1 3.63Å; L104-F205 HydrophobicContact CD1-CZ 4.42Å; L104-F205 HydrophobicContact CD2-CE1 4.03Å; L104-F205 HydrophobicContact CD2-CZ 4.32Å; L104-F205 HydrophobicContact CG-CE1 3.98Å; Y201-F205 HydrophobicContact CD1-CE2 4.01Å; Y201-F205 WeakPolarHBondContact O-CD2 3.49Å; Y201-F205 PolarHBondContact O-N 3.42Å; V202-F205 PolarHBondContact O-N 3.05Å; F203-F205 PolarHBondContact O-N 3.17Å
206L98.1Very high96.6Very high0 Ų024.6 Ų24.60%011%0.108CC..Hα-helixtrans-78.7-37.5-174.6-61.8-153.4000112.7L103 L177 V202 F203 L209 Y210 L223 L229L103-L206 HydrophobicContact CD2-CD2 3.51Å; L177-L206 HydrophobicContact CD2-CD1 4.21Å; L177-L206 HydrophobicContact CD2-CD2 3.51Å; V202-L206 HydrophobicContact CG1-CD1 3.83Å; V202-L206 HydrophobicContact CG1-CG 3.92Å; V202-L206 WeakPolarHBondContact O-CB 3.47Å; V202-L206 VanDerWaalsContact O-CG 3.26Å; V202-L206 WeakPolarHBondContact O-CG 3.44Å; V202-L206 PolarHBondContact O-N 3.12Å; F203-L206 PolarHBondContact O-N 3.01Å; L206-L209 CarbonylContact O-C 3.52Å; L206-L209 PolarHBondContact O-N 2.88Å; L206-Y210 VanDerWaalsContact O-CB 3.24Å; L206-Y210 WeakPolarHBondContact O-CB 3.5Å; L206-Y210 PolarHBondContact O-N 3.41Å; L206-L223 HydrophobicContact CD1-CD1 3.98Å; L206-L229 HydrophobicContact CD1-CB 4.09Å; L206-L229 HydrophobicContact CD1-CD1 3.91Å; L206-L229 HydrophobicContact CD1-CD2 4.21Å; L206-L229 HydrophobicContact CD1-CG 4.31Å
207A97.4Very high96.4Very high0 Ų026.3 Ų26.30%012%0.119CC..Hα-helixtrans-64.3-45-172.100000113.6L16 L24 F203 L209 Y210 K211L16-A207 HydrophobicContact CD2-CB 3.73Å; L24-A207 HydrophobicContact CD1-CB 4.21Å; F203-A207 HydrophobicContact CD2-CB 3.89Å; F203-A207 HydrophobicContact CE1-CB 4.47Å; F203-A207 HydrophobicContact CE2-CB 3.54Å; F203-A207 HydrophobicContact CG-CB 4.49Å; F203-A207 HydrophobicContact CZ-CB 3.87Å; F203-A207 WeakPolarHBondContact O-CB 3.35Å; F203-A207 PolarHBondContact O-N 2.97Å; A207-L209 PolarHBondContact O-N 2.96Å; A207-Y210 PolarHBondContact O-N 2.95Å; A207-K211 WeakPolarHBondContact O-CB 3.2Å; A207-K211 WeakPolarHBondContact O-CG 3.5Å; A207-K211 PolarHBondContact O-N 3.36Å
208P95.9Very high96.1Very high0 Ų030.5 Ų30.50%014%0.138CC..Hα-helixtrans-59.5-46.3171.8-2537.3000112.2L16 L24 F111 G204 Y210 K211 V212L16-P208 HydrophobicContact CD1-CB 4.31Å; L16-P208 HydrophobicContact CD1-CG 4.33Å; L24-P208 HydrophobicContact CD1-CG 3.48Å; L24-P208 VanDerWaalsContact CD1-CG 3.48Å; F111-P208 HydrophobicContact CE1-CB 4.34Å; F111-P208 HydrophobicContact CE2-CB 4.28Å; F111-P208 HydrophobicContact CZ-CB 3.55Å; G204-P208 WeakPolarHBondContact O-CD 3.46Å; G204-P208 WeakPolarHBondContact O-CG 3.25Å; P208-Y210 PolarHBondContact O-N 2.9Å; P208-K211 PolarHBondContact O-N 3.39Å; P208-V212 WeakPolarHBondContact O-CB 3.31Å; P208-V212 WeakPolarHBondContact O-CG2 3.3Å; P208-V212 PolarHBondContact O-N 3.35Å; P208-V212 VanDerWaalsContact O-N 3.1Å
209L95.8Very high95.9Very high0 Ų030.6 Ų30.60%014%0.138CC..Hα-helixtrans-64.9-28.3178.6-179.864.5000112.4V107 T110 L206 A207 L219 Q220 L223V107-L209 HydrophobicContact CG2-CD2 4.31Å; T110-L209 HydrophobicContact CG2-CD1 4.33Å; L206-L209 CarbonylContact O-C 3.52Å; L206-L209 PolarHBondContact O-N 2.88Å; A207-L209 PolarHBondContact O-N 2.96Å; L209-L219 HydrophobicContact CD1-CB 4.34Å; L209-L219 HydrophobicContact CD1-CD2 3.91Å; L209-L219 HydrophobicContact CD1-CG 4.2Å; L209-L219 HydrophobicContact CD2-CD2 3.51Å; L209-L219 HydrophobicContact CD2-CG 3.78Å; L209-L219 HydrophobicContact CG-CD2 4.35Å; L209-Q220 HydrophobicContact CD1-CG 3.93Å; L209-Q220 VanDerWaalsContact O-CG 3.24Å; L209-Q220 WeakPolarHBondContact O-CG 3.43Å; L209-Q220 PolarHBondContact O-NE2 2.73Å; L209-L223 HydrophobicContact CB-CD2 4.35Å; L209-L223 HydrophobicContact CD2-CD2 4.02Å; L209-L223 HydrophobicContact CG-CD2 4.02Å
210Y96.5Very high95.8Very high44 Ų4430.7 Ų30.717%0.17314%0.139CC..Hα-helixtrans-82.9-42.5178.9171.5-139000112.4L206 A207 P208 K224 C230 C233 D234L206-Y210 VanDerWaalsContact O-CB 3.24Å; L206-Y210 WeakPolarHBondContact O-CB 3.5Å; L206-Y210 PolarHBondContact O-N 3.41Å; A207-Y210 PolarHBondContact O-N 2.95Å; P208-Y210 PolarHBondContact O-N 2.9Å; Y210-K224 HydrophobicContact CD2-CG 4.35Å; Y210-K224 HydrophobicContact CE2-CG 4.38Å; Y210-C230 HydrophobicContact CE1-CB 4.43Å; Y210-C230 HydrophobicContact CE2-CB 4.19Å; Y210-C233 HydrophobicContact CD1-CB 3.83Å; Y210-C233 HydrophobicContact CE1-CB 4.21Å; Y210-D234 WeakPolarHBondContact CE1-OD1 3.44Å; Y210-D234 WeakPolarHBondContact CE1-OD2 2.85Å; Y210-D234 PolarHBondContact OH-OD2 3.19Å
211K95.5Very high95.7Very high53 Ų5336 Ų3623%0.2316%0.164CC..Hα-helixtrans-92.9-31.4-167.8-64.9-58.9-169.8-177.60115W14 L16 A207 P208 D234 L237W14-K211 HydrophobicContact CB-CB 4.41Å; L16-K211 HydrophobicContact CD1-CB 4.02Å; L16-K211 HydrophobicContact CD2-CB 4.08Å; L16-K211 HydrophobicContact CD2-CG 3.72Å; L16-K211 HydrophobicContact CG-CB 3.95Å; L16-K211 HydrophobicContact CG-CG 4.14Å; A207-K211 WeakPolarHBondContact O-CB 3.2Å; A207-K211 WeakPolarHBondContact O-CG 3.5Å; A207-K211 PolarHBondContact O-N 3.36Å; P208-K211 PolarHBondContact O-N 3.39Å; K211-D234 VanDerWaalsContact CE-OD1 3.27Å; K211-D234 WeakPolarHBondContact CE-OD1 3.45Å; K211-D234 IonicContact NZ-OD1 3.86Å; K211-D234 PolarHBondContact NZ-OD1 3.47Å; K211-D234 IonicContact NZ-OD2 3.97Å; K211-L237 HydrophobicContact CG-CD1 4.39Å
212V95.3Very high95.7Very high3 Ų336.8 Ų36.82%0.01817%0.168CC..SBendtrans-66.6139.5-179.2179.10000109.7W14 V19 F111 V121 P208 F214 Q220W14-V212 HydrophobicContact CD2-CB 4.49Å; W14-V212 HydrophobicContact CD2-CG1 4.31Å; W14-V212 HydrophobicContact CD2-CG2 4.16Å; W14-V212 HydrophobicContact CE3-CG1 4.45Å; W14-V212 HydrophobicContact CE3-CG2 3.86Å; W14-V212 HydrophobicContact CH2-CG1 4.46Å; W14-V212 HydrophobicContact CZ2-CG1 4.34Å; W14-V212 HydrophobicContact CZ3-CG2 4.32Å; V19-V212 HydrophobicContact CG1-CG2 4.3Å; F111-V212 HydrophobicContact CE1-CG2 4.18Å; F111-V212 HydrophobicContact CZ-CB 4.45Å; F111-V212 HydrophobicContact CZ-CG2 4.04Å; V121-V212 HydrophobicContact CG1-CG1 3.71Å; P208-V212 WeakPolarHBondContact O-CB 3.31Å; P208-V212 WeakPolarHBondContact O-CG2 3.3Å; P208-V212 PolarHBondContact O-N 3.35Å; P208-V212 VanDerWaalsContact O-N 3.1Å; V212-F214 HydrophobicContact CB-CD2 4.31Å; V212-F214 HydrophobicContact CB-CE1 4.49Å; V212-F214 HydrophobicContact CB-CE2 3.76Å; V212-F214 HydrophobicContact CB-CZ 3.86Å; V212-F214 HydrophobicContact CG1-CD1 4.03Å; V212-F214 HydrophobicContact CG1-CD2 4.18Å; V212-F214 HydrophobicContact CG1-CE1 3.59Å; V212-F214 HydrophobicContact CG1-CE2 3.74Å; V212-F214 HydrophobicContact CG1-CG 4.3Å; V212-F214 HydrophobicContact CG1-CZ 3.42Å; V212-F214 VanDerWaalsContact CG1-CZ 3.42Å; V212-F214 PolarHBondContact O-N 2.87Å; V212-Q220 PolarHBondContact O-NE2 2.88Å
213R93.9Very high95.6Very high205 Ų20536.8 Ų36.877%0.77417%0.168SC*.  trans-93.886.1-178.3-65.9-177.4-177.8155.1-0.5110.6V121V121-R213 WeakPolarHBondContact CG2-O 3.47Å
214F94.3Very high95.6Very high12 Ų1242.1 Ų42.15%0.05319%0.191CC..  trans-82.2145.6177.7-68.5-58.9000112.5T110 F111 N117 V121 V212 K216 V217 Q220T110-F214 HydrophobicContact CG2-CD2 3.91Å; T110-F214 HydrophobicContact CG2-CE2 3.96Å; T110-F214 HydrophobicContact CG2-CG 4.41Å; T110-F214 HydrophobicContact CG2-CZ 4.47Å; F111-F214 HydrophobicContact CD1-CE1 4.39Å; F111-F214 AromaticContact CD1-CZ 3.72Å; F111-F214 HydrophobicContact CD1-CZ 3.72Å; F111-F214 HydrophobicContact CD2-CE2 4.03Å; F111-F214 AromaticContact CD2-CZ 3.64Å; F111-F214 HydrophobicContact CD2-CZ 3.64Å; F111-F214 HydrophobicContact CE1-CE2 4.37Å; F111-F214 AromaticContact CE1-CZ 3.59Å; F111-F214 HydrophobicContact CE1-CZ 3.59Å; F111-F214 AromaticContact CE2-CE2 3.62Å; F111-F214 HydrophobicContact CE2-CE2 3.62Å; F111-F214 AromaticContact CE2-CZ 3.51Å; F111-F214 HydrophobicContact CE2-CZ 3.51Å; F111-F214 HydrophobicContact CG-CE1 4.48Å; F111-F214 AromaticContact CG-CZ 3.75Å; F111-F214 HydrophobicContact CG-CZ 3.75Å; F111-F214 AromaticContact CZ-CE2 3.8Å; F111-F214 HydrophobicContact CZ-CE2 3.8Å; F111-F214 AromaticContact CZ-CZ 3.47Å; F111-F214 HydrophobicContact CZ-CZ 3.47Å; F111-F214 VanDerWaalsContact CZ-CZ 3.47Å; N117-F214 HydrophobicContact CB-CD1 3.67Å; N117-F214 HydrophobicContact CB-CE1 4.2Å; N117-F214 HydrophobicContact CB-CG 4.41Å; N117-F214 WeakPolarHBondContact OD1-CB 3.42Å; V121-F214 HydrophobicContact CB-CD1 4.29Å; V121-F214 HydrophobicContact CB-CE1 4.41Å; V121-F214 HydrophobicContact CG1-CD1 4.31Å; V121-F214 HydrophobicContact CG1-CE1 4.17Å; V121-F214 HydrophobicContact CG2-CD1 4.49Å; V212-F214 HydrophobicContact CB-CD2 4.31Å; V212-F214 HydrophobicContact CB-CE1 4.49Å; V212-F214 HydrophobicContact CB-CE2 3.76Å; V212-F214 HydrophobicContact CB-CZ 3.86Å; V212-F214 HydrophobicContact CG1-CD1 4.03Å; V212-F214 HydrophobicContact CG1-CD2 4.18Å; V212-F214 HydrophobicContact CG1-CE1 3.59Å; V212-F214 HydrophobicContact CG1-CE2 3.74Å; V212-F214 HydrophobicContact CG1-CG 4.3Å; V212-F214 HydrophobicContact CG1-CZ 3.42Å; V212-F214 VanDerWaalsContact CG1-CZ 3.42Å; V212-F214 PolarHBondContact O-N 2.87Å; F214-K216 WeakPolarHBondContact CB-O 3.37Å; F214-V217 HydrophobicContact CB-CG1 4.46Å; F214-V217 WeakPolarHBondContact O-CG1 3.32Å; F214-Q220 HydrophobicContact CD2-CG 4.29Å
215P94.5Very high95.6Very high70 Ų7049 Ų4946%0.45522%0.223SC..SBendtrans-64-41.8166.6-22.429.3000113.5D116 N117 T120D116-P215 HydrophobicContact CB-CB 4.31Å; N117-P215 VanDerWaalsContact OD1-CD 3.25Å; N117-P215 WeakPolarHBondContact OD1-CD 3.23Å; T120-P215 WeakPolarHBondContact OG1-CG 3.22Å
216K93.7Very high95.7Very high106 Ų10649.9 Ų49.946%0.46123%0.228SC..  trans-100.5114.1176.1-63.7-69.5-179.7177.10109.5E114 D116 N117 F214E114-K216 HydrophobicContact CG-CB 3.95Å; E114-K216 HydrophobicContact CG-CG 4.08Å; D116-K216 HydrophobicContact CB-CG 4Å; D116-K216 WeakPolarHBondContact OD2-CE 3.39Å; D116-K216 IonicContact OD2-NZ 3.07Å; N117-K216 PolarHBondContact ND2-O 3.27Å; N117-K216 VanDerWaalsContact ND2-O 3.08Å; N117-K216 WeakPolarHBondContact OD1-CB 3.44Å; N117-K216 PolarHBondContact OD1-N 2.88Å; F214-K216 WeakPolarHBondContact CB-O 3.37Å
217V92.1Very high95.6Very high39 Ų3954.2 Ų54.224%0.23626%0.258CS..  trans-115.515.7-164-620000114.4F214 L219 Q220 E221F214-V217 HydrophobicContact CB-CG1 4.46Å; F214-V217 WeakPolarHBondContact O-CG1 3.32Å; V217-L219 VanDerWaalsContact C-N 3.32Å; V217-L219 PolarHBondContact O-N 3.49Å; V217-L219 VanDerWaalsContact O-N 3.12Å; V217-Q220 HydrophobicContact CB-CB 4.24Å; V217-Q220 VanDerWaalsContact CG1-OE1 3.3Å; V217-Q220 CarbonylContact O-C 3.58Å; V217-Q220 WeakPolarHBondContact O-CA 3.35Å; V217-Q220 WeakPolarHBondContact O-CB 3.48Å; V217-Q220 PolarHBondContact O-N 3.08Å; V217-E221 HydrophobicContact CB-CG 4.16Å; V217-E221 HydrophobicContact CG2-CG 3.65Å; V217-E221 VanDerWaalsContact CG2-OE1 3.29Å; V217-E221 WeakPolarHBondContact CG2-OE1 3.42Å; V217-E221 WeakPolarHBondContact O-CG 3.41Å; V217-E221 PolarHBondContact O-N 3.48Å
218Q91Very high95.7Very high89 Ų8955.4 Ų55.442%0.41627%0.265SS..Hα-helixtrans-50.7-44.4-170.7-173.1-172.314.200114.5
219L94Very high95.8Very high2 Ų255.4 Ų55.41%0.0127%0.265CS..Hα-helixtrans-81.1-33.3177.9-17363.5000112.1L103 A106 Y170 A173 K174 L177 L209 V217 H222 L223L103-L219 HydrophobicContact CD1-CD2 4.38Å; A106-L219 HydrophobicContact CB-CD2 3.83Å; Y170-L219 HydrophobicContact CD1-CB 3.96Å; Y170-L219 HydrophobicContact CD1-CD1 4.43Å; Y170-L219 HydrophobicContact CD1-CD2 4.5Å; Y170-L219 HydrophobicContact CE1-CB 3.87Å; Y170-L219 HydrophobicContact CE1-CD2 4.48Å; A173-L219 HydrophobicContact CB-CD1 3.8Å; A173-L219 HydrophobicContact CB-CD2 4.35Å; K174-L219 HydrophobicContact CG-CD1 4.2Å; L177-L219 HydrophobicContact CD1-CD1 3.9Å; L209-L219 HydrophobicContact CD1-CB 4.34Å; L209-L219 HydrophobicContact CD1-CD2 3.91Å; L209-L219 HydrophobicContact CD1-CG 4.2Å; L209-L219 HydrophobicContact CD2-CD2 3.51Å; L209-L219 HydrophobicContact CD2-CG 3.78Å; L209-L219 HydrophobicContact CG-CD2 4.35Å; V217-L219 VanDerWaalsContact C-N 3.32Å; V217-L219 PolarHBondContact O-N 3.49Å; V217-L219 VanDerWaalsContact O-N 3.12Å; L219-H222 PolarHBondContact O-N 3.35Å; L219-L223 PolarHBondContact O-N 3.44Å
220Q95.3Very high95.9Very high3 Ų356 Ų561%0.01427%0.269CS..Hα-helixtrans-66.4-37.7178-55.5-166.2-70.400112.1L209 V212 F214 V217 L223 K224L209-Q220 HydrophobicContact CD1-CG 3.93Å; L209-Q220 VanDerWaalsContact O-CG 3.24Å; L209-Q220 WeakPolarHBondContact O-CG 3.43Å; L209-Q220 PolarHBondContact O-NE2 2.73Å; V212-Q220 PolarHBondContact O-NE2 2.88Å; F214-Q220 HydrophobicContact CD2-CG 4.29Å; V217-Q220 HydrophobicContact CB-CB 4.24Å; V217-Q220 VanDerWaalsContact CG1-OE1 3.3Å; V217-Q220 CarbonylContact O-C 3.58Å; V217-Q220 WeakPolarHBondContact O-CA 3.35Å; V217-Q220 WeakPolarHBondContact O-CB 3.48Å; V217-Q220 PolarHBondContact O-N 3.08Å; Q220-L223 PolarHBondContact O-N 3.05Å; Q220-K224 WeakPolarHBondContact O-CB 3.33Å; Q220-K224 VanDerWaalsContact O-CG 3.26Å; Q220-K224 WeakPolarHBondContact O-CG 3.37Å; Q220-K224 PolarHBondContact O-N 3.32Å
221E96.6Very high96Very high111 Ų11158.6 Ų58.652%0.51928%0.278SS..Hα-helixtrans-60.8-46.2176.5-75.1175.7157.700111V217 K224 Q225V217-E221 HydrophobicContact CB-CG 4.16Å; V217-E221 HydrophobicContact CG2-CG 3.65Å; V217-E221 VanDerWaalsContact CG2-OE1 3.29Å; V217-E221 WeakPolarHBondContact CG2-OE1 3.42Å; V217-E221 WeakPolarHBondContact O-CG 3.41Å; V217-E221 PolarHBondContact O-N 3.48Å; E221-K224 PolarHBondContact O-N 2.83Å; E221-Q225 WeakPolarHBondContact O-CG 3.17Å; E221-Q225 PolarHBondContact O-N 3.31Å
222H97.8Very high96.1Very high29 Ų2956.2 Ų56.213%0.13427%0.268CS..Hα-helixtrans-62.3-45.1175.6-169.485.2000111.6K174 N178 L219 K224 Q225K174-H222 HydrophobicContact CD-CB 4.29Å; K174-H222 HydrophobicContact CG-CB 4.03Å; N178-H222 PolarHBondContact OD1-NE2 3Å; L219-H222 PolarHBondContact O-N 3.35Å; H222-K224 VanDerWaalsContact C-N 3.31Å; H222-K224 PolarHBondContact O-N 2.89Å; H222-Q225 WeakPolarHBondContact O-CB 3.47Å; H222-Q225 PolarHBondContact O-N 3.49Å
223L97.8Very high96.2Very high1 Ų156.1 Ų56.11%0.00527%0.267CS..Hα-helixtrans-59.6-41.3176.5176.857000112L177 L206 L209 L219 Q220 Q225 L226 L229 C230L177-L223 HydrophobicContact CD1-CB 4.1Å; L177-L223 HydrophobicContact CD1-CD1 4.47Å; L177-L223 HydrophobicContact CD2-CD1 4.1Å; L206-L223 HydrophobicContact CD1-CD1 3.98Å; L209-L223 HydrophobicContact CB-CD2 4.35Å; L209-L223 HydrophobicContact CD2-CD2 4.02Å; L209-L223 HydrophobicContact CG-CD2 4.02Å; L219-L223 PolarHBondContact O-N 3.44Å; Q220-L223 PolarHBondContact O-N 3.05Å; L223-Q225 PolarHBondContact O-N 3.04Å; L223-L226 WeakPolarHBondContact O-CB 3.49Å; L223-L226 PolarHBondContact O-N 2.91Å; L223-L229 HydrophobicContact CD1-CB 4.07Å; L223-L229 HydrophobicContact CD1-CD1 4.1Å; L223-C230 PolarHBondContact O-SG 2.71Å
224K97.1Very high96.4Very high112 Ų11248.6 Ų48.649%0.48724%0.242SC..Hα-helixtrans-67.1-22.2179.2-75.6171.8-178.3174.30113.8Y210 Q220 E221 H222Y210-K224 HydrophobicContact CD2-CG 4.35Å; Y210-K224 HydrophobicContact CE2-CG 4.38Å; Q220-K224 WeakPolarHBondContact O-CB 3.33Å; Q220-K224 VanDerWaalsContact O-CG 3.26Å; Q220-K224 WeakPolarHBondContact O-CG 3.37Å; Q220-K224 PolarHBondContact O-N 3.32Å; E221-K224 PolarHBondContact O-N 2.83Å; H222-K224 VanDerWaalsContact C-N 3.31Å; H222-K224 PolarHBondContact O-N 2.89Å
225Q97.9Very high96.5Very high144 Ų14450.8 Ų50.867%0.67325%0.254SS*.Hα-helixtrans-72.6-20.8171.9-67.8169-300112.1E221 H222 L223 S227E221-Q225 WeakPolarHBondContact O-CG 3.17Å; E221-Q225 PolarHBondContact O-N 3.31Å; H222-Q225 WeakPolarHBondContact O-CB 3.47Å; H222-Q225 PolarHBondContact O-N 3.49Å; L223-Q225 PolarHBondContact O-N 3.04Å; Q225-S227 PolarHBondContact O-N 2.87Å
226L98.3Very high96.6Very high24 Ų2447.5 Ų47.513%0.12623%0.233CC..  trans-92.381.9177.7-55.6173.1000109.5L177 L223 N228 L229 C230L177-L226 HydrophobicContact CB-CD1 3.7Å; L223-L226 WeakPolarHBondContact O-CB 3.49Å; L223-L226 PolarHBondContact O-N 2.91Å; L226-N228 VanDerWaalsContact C-N 3.29Å; L226-N228 PolarHBondContact O-N 3.23Å; L226-L229 HydrophobicContact CB-CB 4.32Å; L226-L229 HydrophobicContact CB-CD1 4.07Å; L226-L229 HydrophobicContact CB-CG 4.26Å; L226-L229 HydrophobicContact CD1-CD1 3.78Å; L226-L229 PolarHBondContact O-N 3.28Å; L226-L229 VanDerWaalsContact O-N 3.17Å; L226-C230 PolarHBondContact O-N 3.48Å; L226-C230 VanDerWaalsContact O-N 3.16Å; L226-C230 PolarHBondContact O-SG 2.94Å
227S98Very high96.7Very high92 Ų9243.5 Ų43.564%0.64322%0.217SC*.Hα-helixtrans-61.8-33.1-171.859.80000114Q225 C230 R231Q225-S227 PolarHBondContact O-N 2.87Å; S227-C230 PolarHBondContact O-N 3.41Å; S227-R231 WeakPolarHBondContact O-CB 3.46Å; S227-R231 PolarHBondContact O-N 3.44Å
228N98.3Very high96.8Very high24 Ų2443.2 Ų43.213%0.12822%0.217CC..Hα-helixtrans-64.2-40.3175.659.8-21000112.7S181 L184 G185 L226 F232S181-N228 PolarHBondContact O-ND2 3.08Å; S181-N228 PolarHBondContact OG-ND2 2.9Å; S181-N228 PolarHBondContact OG-OD1 3.25Å; L184-N228 HydrophobicContact CD2-CB 4.34Å; G185-N228 PolarHBondContact O-ND2 3.36Å; L226-N228 VanDerWaalsContact C-N 3.29Å; L226-N228 PolarHBondContact O-N 3.23Å; N228-F232 WeakPolarHBondContact O-CB 3.43Å; N228-F232 PolarHBondContact O-N 3.49Å
229L98.4Very high97Very high0 Ų042.6 Ų42.60%022%0.222CC..Hα-helixtrans-70.3-36.1175.2-65.3-177.2000112.1L177 L180 L184 F190 L206 L223 L226 F232 C233L177-L229 HydrophobicContact CD2-CD1 4.4Å; L180-L229 HydrophobicContact CB-CD1 4.42Å; L180-L229 HydrophobicContact CB-CD2 4.34Å; L184-L229 HydrophobicContact CB-CD2 4.47Å; L184-L229 HydrophobicContact CD2-CD2 3.89Å; F190-L229 HydrophobicContact CZ-CD2 4.44Å; L206-L229 HydrophobicContact CD1-CB 4.09Å; L206-L229 HydrophobicContact CD1-CD1 3.91Å; L206-L229 HydrophobicContact CD1-CD2 4.21Å; L206-L229 HydrophobicContact CD1-CG 4.31Å; L223-L229 HydrophobicContact CD1-CB 4.07Å; L223-L229 HydrophobicContact CD1-CD1 4.1Å; L226-L229 HydrophobicContact CB-CB 4.32Å; L226-L229 HydrophobicContact CB-CD1 4.07Å; L226-L229 HydrophobicContact CB-CG 4.26Å; L226-L229 HydrophobicContact CD1-CD1 3.78Å; L226-L229 PolarHBondContact O-N 3.28Å; L226-L229 VanDerWaalsContact O-N 3.17Å; L229-F232 WeakPolarHBondContact O-CB 3.32Å; L229-F232 PolarHBondContact O-N 3.4Å; L229-C233 PolarHBondContact O-N 3.44Å; L229-C233 VanDerWaalsContact O-N 3.11Å; L229-C233 PolarHBondContact O-SG 2.89Å
230C98.2Very high97Very high13 Ų1345.5 Ų45.59%0.08823%0.233CC..Hα-helixtrans-63.7-49.3173.4-64.80000110.9Y210 L223 L226 S227 F232 C233 D234Y210-C230 HydrophobicContact CE1-CB 4.43Å; Y210-C230 HydrophobicContact CE2-CB 4.19Å; L223-C230 PolarHBondContact O-SG 2.71Å; L226-C230 PolarHBondContact O-N 3.48Å; L226-C230 VanDerWaalsContact O-N 3.16Å; L226-C230 PolarHBondContact O-SG 2.94Å; S227-C230 PolarHBondContact O-N 3.41Å; C230-F232 VanDerWaalsContact C-N 3.32Å; C230-F232 PolarHBondContact O-N 2.96Å; C230-C233 PolarHBondContact O-N 3.41Å; C230-C233 VanDerWaalsContact O-N 3.17Å; C230-D234 PolarHBondContact O-N 3.38Å
231R97.9Very high96.8Very high99 Ų9947 Ų4737%0.37424%0.24SC..Hα-helixtrans-54.2-48.6173.7179.8-168.369.1175.55.3111T186 S187 S227 C233 D234 D235T186-R231 PolarHBondContact O-NH2 3.44Å; S187-R231 PolarHBondContact O-NH2 3.19Å; S227-R231 WeakPolarHBondContact O-CB 3.46Å; S227-R231 PolarHBondContact O-N 3.44Å; R231-C233 VanDerWaalsContact C-N 3.32Å; R231-C233 PolarHBondContact O-N 2.95Å; R231-D234 PolarHBondContact O-N 2.9Å; R231-D234 VanDerWaalsContact O-N 3.11Å; R231-D235 WeakPolarHBondContact CG-OD2 3.48Å; R231-D235 WeakPolarHBondContact O-CB 3.24Å; R231-D235 VanDerWaalsContact O-CG 3.24Å; R231-D235 PolarHBondContact O-N 3.04Å
232F98.4Very high95.9Very high3 Ų350.6 Ų50.61%0.01325%0.248CC..Hα-helixtrans-53.5-46.5177168.7-95.4000112.7L184 Q188 F189 F190 D199 V202 F203 N228 L229 C230 I236L184-F232 HydrophobicContact CD1-CD2 4.21Å; L184-F232 HydrophobicContact CD2-CB 3.75Å; L184-F232 HydrophobicContact CD2-CD2 4.27Å; L184-F232 HydrophobicContact CD2-CG 4.17Å; Q188-F232 WeakPolarHBondContact O-CD2 3.34Å; F189-F232 HydrophobicContact CD1-CE2 4.12Å; F190-F232 HydrophobicContact CD2-CE2 4.18Å; F190-F232 HydrophobicContact CD2-CZ 4.33Å; F190-F232 HydrophobicContact CE2-CE2 4.2Å; F190-F232 HydrophobicContact CE2-CZ 4.14Å; D199-F232 HydrophobicContact CB-CE2 4.11Å; D199-F232 HydrophobicContact CB-CZ 3.93Å; D199-F232 WeakPolarHBondContact OD1-CE2 3.45Å; V202-F232 HydrophobicContact CB-CE1 4.15Å; V202-F232 HydrophobicContact CB-CZ 4.35Å; V202-F232 HydrophobicContact CG1-CD1 4.44Å; V202-F232 HydrophobicContact CG1-CE1 3.81Å; V202-F232 HydrophobicContact CG1-CZ 4.39Å; F203-F232 HydrophobicContact CB-CE1 4Å; F203-F232 HydrophobicContact CB-CZ 4.4Å; N228-F232 WeakPolarHBondContact O-CB 3.43Å; N228-F232 PolarHBondContact O-N 3.49Å; L229-F232 WeakPolarHBondContact O-CB 3.32Å; L229-F232 PolarHBondContact O-N 3.4Å; C230-F232 VanDerWaalsContact C-N 3.32Å; C230-F232 PolarHBondContact O-N 2.96Å; F232-I236 HydrophobicContact CD1-CD1 4.14Å; F232-I236 HydrophobicContact CD2-CD1 4.04Å; F232-I236 HydrophobicContact CE1-CD1 3.6Å; F232-I236 HydrophobicContact CE2-CD1 3.51Å; F232-I236 HydrophobicContact CG-CD1 4.34Å; F232-I236 HydrophobicContact CZ-CD1 3.26Å; F232-I236 WeakPolarHBondContact O-CG1 3.33Å; F232-I236 PolarHBondContact O-N 3.21Å; F232-I236 VanDerWaalsContact O-N 3.11Å
233C97.7Very high93.8Very high0 Ų056 Ų560%028%0.278CS..Hα-helixtrans-64.9-42.7177-650000112.2Y210 L229 C230 R231 L237Y210-C233 HydrophobicContact CD1-CB 3.83Å; Y210-C233 HydrophobicContact CE1-CB 4.21Å; L229-C233 PolarHBondContact O-N 3.44Å; L229-C233 VanDerWaalsContact O-N 3.11Å; L229-C233 PolarHBondContact O-SG 2.89Å; C230-C233 PolarHBondContact O-N 3.41Å; C230-C233 VanDerWaalsContact O-N 3.17Å; R231-C233 VanDerWaalsContact C-N 3.32Å; R231-C233 PolarHBondContact O-N 2.95Å; C233-L237 WeakPolarHBondContact O-CB 3.42Å; C233-L237 WeakPolarHBondContact O-CG 3.29Å; C233-L237 PolarHBondContact O-N 3.36Å
234D97.2Very high91.2Very high48 Ų4861.2 Ų61.226%0.25731%0.314SS..Hα-helixtrans-66.8-38.9-179.6-75.1-34.8000112.7Y210 K211 C230 R231 S238Y210-D234 WeakPolarHBondContact CE1-OD1 3.44Å; Y210-D234 WeakPolarHBondContact CE1-OD2 2.85Å; Y210-D234 PolarHBondContact OH-OD2 3.19Å; K211-D234 VanDerWaalsContact CE-OD1 3.27Å; K211-D234 WeakPolarHBondContact CE-OD1 3.45Å; K211-D234 IonicContact NZ-OD1 3.86Å; K211-D234 PolarHBondContact NZ-OD1 3.47Å; K211-D234 IonicContact NZ-OD2 3.97Å; C230-D234 PolarHBondContact O-N 3.38Å; R231-D234 PolarHBondContact O-N 2.9Å; R231-D234 VanDerWaalsContact O-N 3.11Å; D234-S238 WeakPolarHBondContact O-CB 3.43Å; D234-S238 PolarHBondContact O-N 3.01Å; D234-S238 PolarHBondContact O-OG 3Å; D234-S238 VanDerWaalsContact O-OG 3.1Å
235D96.4Very high88.6Confident57 Ų5762.5 Ų62.531%0.30533%0.326SS..Hα-helixtrans-67.7-40.8177.5-72-13.5000111.4R231 S238 S239R231-D235 WeakPolarHBondContact CG-OD2 3.48Å; R231-D235 WeakPolarHBondContact O-CB 3.24Å; R231-D235 VanDerWaalsContact O-CG 3.24Å; R231-D235 PolarHBondContact O-N 3.04Å; D235-S238 WeakPolarHBondContact O-CB 3.35Å; D235-S238 PolarHBondContact O-N 3.39Å; D235-S239 VanDerWaalsContact O-CB 3.24Å; D235-S239 WeakPolarHBondContact O-CB 3.47Å; D235-S239 PolarHBondContact O-N 3.28Å; D235-S239 PolarHBondContact O-OG 3.42Å
236I96.9Very high85.4Confident1 Ų159.6 Ų59.61%0.00534%0.335CS..Hα-helixtrans-66.5-47.2175.6-72.4169.7000110.9F32 F189 F203 F232 S238 S239 Y240 F241F32-I236 HydrophobicContact CE1-CG2 4.2Å; F32-I236 HydrophobicContact CZ-CD1 4.04Å; F32-I236 HydrophobicContact CZ-CG1 4.3Å; F32-I236 HydrophobicContact CZ-CG2 4.17Å; F189-I236 HydrophobicContact CE1-CD1 4.39Å; F189-I236 HydrophobicContact CE1-CG1 4.11Å; F203-I236 HydrophobicContact CB-CD1 3.87Å; F203-I236 HydrophobicContact CD1-CG2 4.1Å; F203-I236 HydrophobicContact CD2-CB 3.85Å; F203-I236 HydrophobicContact CD2-CD1 3.99Å; F203-I236 HydrophobicContact CD2-CG2 3.61Å; F203-I236 HydrophobicContact CE1-CG2 4.11Å; F203-I236 HydrophobicContact CE2-CB 3.99Å; F203-I236 HydrophobicContact CE2-CG2 3.63Å; F203-I236 HydrophobicContact CG-CB 4.45Å; F203-I236 HydrophobicContact CG-CD1 4.1Å; F203-I236 HydrophobicContact CG-CG2 3.85Å; F203-I236 HydrophobicContact CZ-CG2 3.88Å; F232-I236 HydrophobicContact CD1-CD1 4.14Å; F232-I236 HydrophobicContact CD2-CD1 4.04Å; F232-I236 HydrophobicContact CE1-CD1 3.6Å; F232-I236 HydrophobicContact CE2-CD1 3.51Å; F232-I236 HydrophobicContact CG-CD1 4.34Å; F232-I236 HydrophobicContact CZ-CD1 3.26Å; F232-I236 WeakPolarHBondContact O-CG1 3.33Å; F232-I236 PolarHBondContact O-N 3.21Å; F232-I236 VanDerWaalsContact O-N 3.11Å; I236-S238 PolarHBondContact O-N 3.07Å; I236-S239 PolarHBondContact O-N 3.4Å; I236-Y240 HydrophobicContact CG2-CD2 4.19Å; I236-Y240 PolarHBondContact O-N 2.88Å; I236-F241 HydrophobicContact CG2-CD2 4.31Å; I236-F241 HydrophobicContact CG2-CE2 4Å
237L95.9Very high82.3Confident22 Ų2261.4 Ų61.412%0.11536%0.359CS..Hα-helixtrans-57-43.8175.6-75.7168.3000111L16 F203 K211 C233 F241 R242L16-L237 HydrophobicContact CD2-CD1 4.11Å; L16-L237 HydrophobicContact CD2-CD2 4.05Å; F203-L237 HydrophobicContact CE2-CD2 4.18Å; F203-L237 HydrophobicContact CE2-CG 3.89Å; F203-L237 HydrophobicContact CZ-CD2 3.77Å; F203-L237 HydrophobicContact CZ-CG 4.01Å; K211-L237 HydrophobicContact CG-CD1 4.39Å; C233-L237 WeakPolarHBondContact O-CB 3.42Å; C233-L237 WeakPolarHBondContact O-CG 3.29Å; C233-L237 PolarHBondContact O-N 3.36Å; L237-F241 HydrophobicContact CD2-CD2 4.43Å; L237-F241 CarbonylContact O-C 3.23Å; L237-F241 VanDerWaalsContact O-C 3.23Å; L237-F241 VanDerWaalsContact O-CA 3.32Å; L237-F241 WeakPolarHBondContact O-CA 3.44Å; L237-F241 WeakPolarHBondContact O-CB 3.22Å; L237-F241 PolarHBondContact O-N 2.87Å; L237-F241 VanDerWaalsContact O-N 3.1Å; L237-R242 PolarHBondContact O-N 3.17Å
238S94.7Very high79.4Confident34 Ų3464.1 Ų64.124%0.23837%0.365CS..Hα-helixtrans-63.3-49.1176.7-84.30000113.1D234 D235 I236 R242D234-S238 WeakPolarHBondContact O-CB 3.43Å; D234-S238 PolarHBondContact O-N 3.01Å; D234-S238 PolarHBondContact O-OG 3Å; D234-S238 VanDerWaalsContact O-OG 3.1Å; D235-S238 WeakPolarHBondContact O-CB 3.35Å; D235-S238 PolarHBondContact O-N 3.39Å; I236-S238 PolarHBondContact O-N 3.07Å; S238-R242 VanDerWaalsContact CB-NE 3.32Å; S238-R242 WeakPolarHBondContact O-CB 3.31Å; S238-R242 WeakPolarHBondContact O-CD 3.48Å; S238-R242 WeakPolarHBondContact O-CG 3.48Å; S238-R242 PolarHBondContact O-NE 2.89Å; S238-R242 VanDerWaalsContact O-NE 3.17Å; S238-R242 PolarHBondContact OG-NE 3.48Å; S238-R242 PolarHBondContact OG-NH2 2.98Å
239S94.3Very high76.3Confident75 Ų7567.2 Ų67.252%0.52439%0.389SS..Hα-helixtrans-81.6-33.2-167.7-53.70000112.5D235 I236D235-S239 VanDerWaalsContact O-CB 3.24Å; D235-S239 WeakPolarHBondContact O-CB 3.47Å; D235-S239 PolarHBondContact O-N 3.28Å; D235-S239 PolarHBondContact O-OG 3.42Å; I236-S239 PolarHBondContact O-N 3.4Å
240Y94.3Very high73.3Confident63 Ų6371.5 Ų71.525%0.24742%0.416CS..Hα-helixtrans-112.1-17.1-172.1-62-82.3000114.1K31 F32 F189 P195 I236K31-Y240 HydrophobicContact CB-CD1 3.97Å; K31-Y240 HydrophobicContact CB-CG 4.33Å; F32-Y240 AromaticContact CD1-CD1 3.9Å; F32-Y240 HydrophobicContact CD1-CD1 3.9Å; F32-Y240 HydrophobicContact CD1-CD2 4.12Å; F32-Y240 AromaticContact CD1-CE1 3.73Å; F32-Y240 HydrophobicContact CD1-CE1 3.73Å; F32-Y240 AromaticContact CD1-CE2 3.97Å; F32-Y240 HydrophobicContact CD1-CE2 3.97Å; F32-Y240 HydrophobicContact CD1-CG 4.09Å; F32-Y240 AromaticContact CD1-CZ 3.78Å; F32-Y240 HydrophobicContact CE1-CD1 4.22Å; F32-Y240 AromaticContact CE1-CD2 3.62Å; F32-Y240 HydrophobicContact CE1-CD2 3.62Å; F32-Y240 HydrophobicContact CE1-CE1 4.22Å; F32-Y240 AromaticContact CE1-CE2 3.62Å; F32-Y240 HydrophobicContact CE1-CE2 3.62Å; F32-Y240 AromaticContact CE1-CG 3.93Å; F32-Y240 HydrophobicContact CE1-CG 3.93Å; F32-Y240 AromaticContact CE1-CZ 3.94Å; F189-Y240 HydrophobicContact CZ-CE2 4.18Å; P195-Y240 WeakPolarHBondContact CG-OH 3.42Å; I236-Y240 HydrophobicContact CG2-CD2 4.19Å; I236-Y240 PolarHBondContact O-N 2.88Å
241F91.8Very high70.6Confident35 Ų3573.6 Ų73.615%0.15443%0.434CS..Hα-helixtrans-127.49.4-173.9-57.3-78.2000114P17 M27 A28 K31 F203 I236 L237 L243P17-F241 HydrophobicContact CB-CD1 4.03Å; P17-F241 HydrophobicContact CB-CE1 4.36Å; P17-F241 HydrophobicContact CG-CD1 3.67Å; P17-F241 HydrophobicContact CG-CE1 3.82Å; P17-F241 HydrophobicContact CG-CG 4.05Å; P17-F241 HydrophobicContact CG-CZ 4.32Å; M27-F241 HydrophobicContact CB-CE1 4.24Å; M27-F241 HydrophobicContact CB-CZ 4.33Å; A28-F241 HydrophobicContact CB-CE2 4.42Å; A28-F241 HydrophobicContact CB-CZ 4.25Å; K31-F241 HydrophobicContact CG-CE1 3.92Å; K31-F241 HydrophobicContact CG-CZ 4.08Å; F203-F241 AromaticContact CE1-CE2 3.92Å; F203-F241 HydrophobicContact CE1-CE2 3.92Å; F203-F241 HydrophobicContact CE1-CZ 4.48Å; F203-F241 HydrophobicContact CZ-CD2 4.43Å; F203-F241 HydrophobicContact CZ-CE2 4.13Å; I236-F241 HydrophobicContact CG2-CD2 4.31Å; I236-F241 HydrophobicContact CG2-CE2 4Å; L237-F241 HydrophobicContact CD2-CD2 4.43Å; L237-F241 CarbonylContact O-C 3.23Å; L237-F241 VanDerWaalsContact O-C 3.23Å; L237-F241 VanDerWaalsContact O-CA 3.32Å; L237-F241 WeakPolarHBondContact O-CA 3.44Å; L237-F241 WeakPolarHBondContact O-CB 3.22Å; L237-F241 PolarHBondContact O-N 2.87Å; L237-F241 VanDerWaalsContact O-N 3.1Å; F241-L243 PolarHBondContact O-N 3.22Å
242R76.6Confident68Low186 Ų18671 Ų7170%0.70244%0.439SS*.THydrogen-bonded Turntrans-59.9104.6168.3-92173.1-155.7179.75.9109.5L237 S238L237-R242 PolarHBondContact O-N 3.17Å; S238-R242 VanDerWaalsContact CB-NE 3.32Å; S238-R242 WeakPolarHBondContact O-CB 3.31Å; S238-R242 WeakPolarHBondContact O-CD 3.48Å; S238-R242 WeakPolarHBondContact O-CG 3.48Å; S238-R242 PolarHBondContact O-NE 2.89Å; S238-R242 VanDerWaalsContact O-NE 3.17Å; S238-R242 PolarHBondContact OG-NE 3.48Å; S238-R242 PolarHBondContact OG-NH2 2.98Å
243L54.1Low65.4Low143 Ų14377.5 Ų77.575%0.74947%0.469SS*.THydrogen-bonded Turntrans72.976.2166.2-60.7159.6000116.9F241 L245F241-L243 PolarHBondContact O-N 3.22Å; L243-L245 HydrophobicContact CD2-CB 4.01Å; L243-L245 HydrophobicContact CD2-CD1 3.97Å
244S42.6Very low63.1Low111 Ų11184.1 Ų84.178%0.77650%0.5SS*.  trans-103.242.9136.4-178.20000110.5
245L42.3Very low61.3Low138 Ų13885.5 Ų85.572%0.72351%0.51SS*.THydrogen-bonded Turntrans-83.76.1171.7-89.3151.1000112.6L243L243-L245 HydrophobicContact CD2-CB 4.01Å; L243-L245 HydrophobicContact CD2-CD1 3.97Å
246G32Very low59.8Low84 Ų8487 Ų8787%0.86652%0.521SS*.THydrogen-bonded Turntrans-97.48.5178.600000115.6
247G32Very low58.6Low62 Ų6291 Ų9164%0.63954%0.543SS*.  trans-1163.9-172.500000116.2S249G247-S249 PolarHBondContact O-N 2.93Å
248I38Very low57.5Low148 Ų14891.8 Ų91.876%0.75955%0.553SS**  trans-88.890.4170.6-54170.6000106.5
249S32.9Very low56.6Low90 Ų9094.5 Ų94.563%0.62956%0.564SS**  trans-60.5130.5166.5-166.20000108.3G247 A251G247-S249 PolarHBondContact O-N 2.93Å; S249-A251 PolarHBondContact O-N 3.01Å
250P35.8Very low55.8Low89 Ų8995.9 Ų95.958%0.57857%0.565SS**THydrogen-bonded Turntrans-65.92.2-176.525.4-32.6000114.5G252 Q253 E254P250-G252 PolarHBondContact O-N 3.4Å; P250-G252 VanDerWaalsContact O-N 3.09Å; P250-Q253 PolarHBondContact O-N 3.16Å; P250-E254 PolarHBondContact O-N 3.03Å
251A41.7Very low55.1Low57 Ų5799.4 Ų99.447%0.47158%0.584SS.*Hα-helixtrans-57.2-25.2-179.900000114.3S249 T255S249-A251 PolarHBondContact O-N 3.01Å; A251-T255 VanDerWaalsContact O-CG2 3.31Å; A251-T255 WeakPolarHBondContact O-CG2 3.36Å; A251-T255 PolarHBondContact O-OG1 3.42Å
252G42.5Very low54.8Low45 Ų45103.9 Ų103.946%0.46460%0.603SS.*Hα-helixtrans-76.9-30176.600000114.3P250 T255 V256P250-G252 PolarHBondContact O-N 3.4Å; P250-G252 VanDerWaalsContact O-N 3.09Å; G252-T255 PolarHBondContact O-OG1 3.35Å; G252-T255 VanDerWaalsContact O-OG1 3.1Å; G252-V256 VanDerWaalsContact O-CG2 3.3Å; G252-V256 WeakPolarHBondContact O-CG2 3.13Å; G252-V256 PolarHBondContact O-N 2.89Å
253Q44Very low55Low140 Ų140100 Ų10065%0.65460%0.596SS**Hα-helixtrans-80.4-43.5-178-147.581.716.100110.5P250 T255 V256 D257P250-Q253 PolarHBondContact O-N 3.16Å; Q253-T255 VanDerWaalsContact C-N 3.28Å; Q253-T255 PolarHBondContact O-N 3.06Å; Q253-V256 PolarHBondContact O-N 3.28Å; Q253-D257 PolarHBondContact O-N 3.42Å
254E48.7Very low56.5Low138 Ų13896.8 Ų96.865%0.64558%0.583SS**Hα-helixtrans-63.1-33.9177.5-70-174.2162.300112.7P250 A258P250-E254 PolarHBondContact O-N 3.03Å; E254-A258 WeakPolarHBondContact O-CB 3.2Å; E254-A258 PolarHBondContact O-N 3.21Å
255T59.7Low58.6Low77 Ų7798.2 Ų98.247%0.47258%0.577SS.*Hα-helixtrans-72.7-34.4177.845.30000112.3A251 G252 Q253 N259A251-T255 VanDerWaalsContact O-CG2 3.31Å; A251-T255 WeakPolarHBondContact O-CG2 3.36Å; A251-T255 PolarHBondContact O-OG1 3.42Å; G252-T255 PolarHBondContact O-OG1 3.35Å; G252-T255 VanDerWaalsContact O-OG1 3.1Å; Q253-T255 VanDerWaalsContact C-N 3.28Å; Q253-T255 PolarHBondContact O-N 3.06Å; T255-N259 VanDerWaalsContact O-CB 3.3Å; T255-N259 WeakPolarHBondContact O-CB 3.39Å; T255-N259 PolarHBondContact O-N 2.91Å; T255-N259 PolarHBondContact O-ND2 2.94Å
256V65.9Low60.7Low89 Ų8996.7 Ų96.754%0.53957%0.569SS.*Hα-helixtrans-68.5-44.1173.5173.90000110.5G252 Q253 N259 L260G252-V256 VanDerWaalsContact O-CG2 3.3Å; G252-V256 WeakPolarHBondContact O-CG2 3.13Å; G252-V256 PolarHBondContact O-N 2.89Å; Q253-V256 PolarHBondContact O-N 3.28Å; V256-N259 PolarHBondContact O-N 3.2Å; V256-L260 WeakPolarHBondContact O-CB 3.34Å; V256-L260 PolarHBondContact O-N 3.11Å
257D70.9Confident63.2Low85 Ų8596.7 Ų96.746%0.45555%0.552SS.*Hα-helixtrans-66.2-39.9177.9-69.8-27000111.9Q253 N259 L260 Q261Q253-D257 PolarHBondContact O-N 3.42Å; D257-N259 PolarHBondContact O-N 2.94Å; D257-L260 PolarHBondContact O-N 2.82Å; D257-Q261 WeakPolarHBondContact O-CB 3.48Å; D257-Q261 WeakPolarHBondContact O-CG 3.42Å; D257-Q261 PolarHBondContact O-N 2.89Å
258A72.6Confident65.7Low39 Ų3998.2 Ų98.232%0.32255%0.545SS..Hα-helixtrans-65.4-37.5174.700000112.5E254 K262E254-A258 WeakPolarHBondContact O-CB 3.2Å; E254-A258 PolarHBondContact O-N 3.21Å; A258-K262 WeakPolarHBondContact O-CG 3.1Å; A258-K262 PolarHBondContact O-N 3.36Å
259N75.6Confident68.2Low90 Ų9097.8 Ų97.848%0.48154%0.538SS..Hα-helixtrans-71.2-37.1176-73.3-26.5000111.8T255 V256 D257 K262 L263T255-N259 VanDerWaalsContact O-CB 3.3Å; T255-N259 WeakPolarHBondContact O-CB 3.39Å; T255-N259 PolarHBondContact O-N 2.91Å; T255-N259 PolarHBondContact O-ND2 2.94Å; V256-N259 PolarHBondContact O-N 3.2Å; D257-N259 PolarHBondContact O-N 2.94Å; N259-K262 PolarHBondContact O-N 3.44Å; N259-L263 PolarHBondContact O-N 3.1Å
260L77.5Confident70.6Confident105 Ų10599.8 Ų99.855%0.5554%0.538SS..Hα-helixtrans-65.9-42.5175.1-164.565.8000111.1V256 D257 K262 L263 T264V256-L260 WeakPolarHBondContact O-CB 3.34Å; V256-L260 PolarHBondContact O-N 3.11Å; D257-L260 PolarHBondContact O-N 2.82Å; L260-K262 PolarHBondContact O-N 3.33Å; L260-L263 PolarHBondContact O-N 3Å; L260-T264 PolarHBondContact O-N 2.64Å; L260-T264 PolarHBondContact O-OG1 2.93Å
261Q79.8Confident72.8Confident136 Ų13698.5 Ų98.564%0.63653%0.53SS*.Hα-helixtrans-61.4-40.6173.4-75.8179.6-1.900112.7D257 T264 Q265D257-Q261 WeakPolarHBondContact O-CB 3.48Å; D257-Q261 WeakPolarHBondContact O-CG 3.42Å; D257-Q261 PolarHBondContact O-N 2.89Å; Q261-T264 PolarHBondContact O-N 2.9Å; Q261-Q265 PolarHBondContact O-N 2.91Å
262K85.3Confident74.8Confident129 Ų129100.2 Ų100.256%0.56153%0.532SS*.Hα-helixtrans-63.7-40.9174.5-77.6176.2-177.3175.70112.1A258 N259 L260 Q265 L266A258-K262 WeakPolarHBondContact O-CG 3.1Å; A258-K262 PolarHBondContact O-N 3.36Å; N259-K262 PolarHBondContact O-N 3.44Å; L260-K262 PolarHBondContact O-N 3.33Å; K262-Q265 PolarHBondContact O-N 3.19Å; K262-L266 WeakPolarHBondContact O-CG 3.38Å; K262-L266 PolarHBondContact O-N 3.48Å
263L80.4Confident76.7Confident105 Ų105102.6 Ų102.655%0.5553%0.534SS..Hα-helixtrans-63.5-44.6174.8-79.6166.3000111.4N259 L260 Q265 L266 V267N259-L263 PolarHBondContact O-N 3.1Å; L260-L263 PolarHBondContact O-N 3Å; L263-Q265 VanDerWaalsContact C-N 3.33Å; L263-Q265 PolarHBondContact O-N 3.37Å; L263-L266 PolarHBondContact O-N 3.02Å; L263-V267 WeakPolarHBondContact O-CG2 3.21Å; L263-V267 PolarHBondContact O-N 2.81Å
264T86.6Confident78.4Confident76 Ų76101.5 Ų101.547%0.46653%0.531SS..Hα-helixtrans-61.8-39.8175.5-51.80000112L260 Q261 V267 N268L260-T264 PolarHBondContact O-N 2.64Å; L260-T264 PolarHBondContact O-OG1 2.93Å; Q261-T264 PolarHBondContact O-N 2.9Å; T264-V267 PolarHBondContact O-N 2.93Å; T264-N268 WeakPolarHBondContact O-CB 3.21Å; T264-N268 PolarHBondContact O-N 3.39Å
265Q85.8Confident79.8Confident141 Ų141100.7 Ų100.766%0.65953%0.527SS*.Hα-helixtrans-64.7-38.9174.7-80.8-173.6-3.300112.9Q261 K262 L263 K269Q261-Q265 PolarHBondContact O-N 2.91Å; K262-Q265 PolarHBondContact O-N 3.19Å; L263-Q265 VanDerWaalsContact C-N 3.33Å; L263-Q265 PolarHBondContact O-N 3.37Å; Q265-K269 WeakPolarHBondContact O-CB 3.35Å; Q265-K269 PolarHBondContact O-N 2.93Å
266L87.4Confident80.9Confident105 Ų105103.8 Ų103.855%0.5553%0.534SS..Hα-helixtrans-66.1-44.5177-77.1167.5000111.7K262 L263 N268 K269 E270K262-L266 WeakPolarHBondContact O-CG 3.38Å; K262-L266 PolarHBondContact O-N 3.48Å; L263-L266 PolarHBondContact O-N 3.02Å; L266-N268 VanDerWaalsContact C-N 3.35Å; L266-N268 PolarHBondContact O-N 3.15Å; L266-K269 WeakPolarHBondContact O-CB 3.14Å; L266-K269 PolarHBondContact O-N 3.38Å; L266-K269 VanDerWaalsContact O-N 3.14Å; L266-E270 PolarHBondContact O-N 3.4Å
267V85.3Confident81.4Confident85 Ų85105.6 Ų105.652%0.51554%0.538SS..Hα-helixtrans-62.4-41.9177.1173.50000111.3L263 T264 K269 E270 S271L263-V267 WeakPolarHBondContact O-CG2 3.21Å; L263-V267 PolarHBondContact O-N 2.81Å; T264-V267 PolarHBondContact O-N 2.93Å; V267-K269 VanDerWaalsContact C-N 3.33Å; V267-K269 PolarHBondContact O-N 3.28Å; V267-E270 PolarHBondContact O-N 3.05Å; V267-S271 WeakPolarHBondContact O-CB 3.49Å; V267-S271 PolarHBondContact O-N 3.3Å; V267-S271 PolarHBondContact O-OG 3.19Å
268N84.4Confident81.7Confident93 Ų93105 Ų10550%0.49754%0.535SS..Hα-helixtrans-66.1-35.5174.9-79-3.5000112.2T264 L266 S271 N272T264-N268 WeakPolarHBondContact O-CB 3.21Å; T264-N268 PolarHBondContact O-N 3.39Å; L266-N268 VanDerWaalsContact C-N 3.35Å; L266-N268 PolarHBondContact O-N 3.15Å; N268-S271 PolarHBondContact O-N 2.7Å; N268-N272 WeakPolarHBondContact O-CB 3.45Å; N268-N272 PolarHBondContact O-N 3.04Å; N268-N272 PolarHBondContact O-ND2 2.87Å
269K89.4Confident81.8Confident140 Ų140107 Ų10761%0.60954%0.54SS*.Hα-helixtrans-68.3-41177.2-169.1177.6-179.6-177.90111.9Q265 L266 V267 L273Q265-K269 WeakPolarHBondContact O-CB 3.35Å; Q265-K269 PolarHBondContact O-N 2.93Å; L266-K269 WeakPolarHBondContact O-CB 3.14Å; L266-K269 PolarHBondContact O-N 3.38Å; L266-K269 VanDerWaalsContact O-N 3.14Å; V267-K269 VanDerWaalsContact C-N 3.33Å; V267-K269 PolarHBondContact O-N 3.28Å; K269-L273 HydrophobicContact CG-CD1 4.45Å; K269-L273 WeakPolarHBondContact O-CG 3.44Å; K269-L273 PolarHBondContact O-N 3.09Å; K269-L273 VanDerWaalsContact O-N 3.1Å
270E84.6Confident81.8Confident132 Ų132107.9 Ų107.962%0.61755%0.545SS*.Hα-helixtrans-65-43173.6-77.3-165.8155.700111.9L266 V267 N272 L273 I274L266-E270 PolarHBondContact O-N 3.4Å; V267-E270 PolarHBondContact O-N 3.05Å; E270-N272 VanDerWaalsContact C-N 3.33Å; E270-N272 PolarHBondContact O-N 3.43Å; E270-L273 WeakPolarHBondContact O-CB 3.35Å; E270-L273 PolarHBondContact O-N 3.36Å; E270-L273 VanDerWaalsContact O-N 3.09Å; E270-I274 WeakPolarHBondContact O-CG1 3.2Å; E270-I274 PolarHBondContact O-N 3.32Å
271S81.6Confident81.3Confident61 Ų61108.7 Ų108.743%0.42755%0.549SS..Hα-helixtrans-58.8-44.8177.6-57.20000111.6V267 N268 L273 I274 E275V267-S271 WeakPolarHBondContact O-CB 3.49Å; V267-S271 PolarHBondContact O-N 3.3Å; V267-S271 PolarHBondContact O-OG 3.19Å; N268-S271 PolarHBondContact O-N 2.7Å; S271-L273 VanDerWaalsContact C-N 3.32Å; S271-L273 PolarHBondContact O-N 2.89Å; S271-I274 PolarHBondContact O-N 3.42Å; S271-E275 PolarHBondContact O-N 3.01Å
272N83.4Confident80.7Confident93 Ų93111 Ų11150%0.49755%0.552SS.*Hα-helixtrans-65.9-31.2175.9-76.3-28.4000113.5N268 E270 K276N268-N272 WeakPolarHBondContact O-CB 3.45Å; N268-N272 PolarHBondContact O-N 3.04Å; N268-N272 PolarHBondContact O-ND2 2.87Å; E270-N272 VanDerWaalsContact C-N 3.33Å; E270-N272 PolarHBondContact O-N 3.43Å; N272-K276 WeakPolarHBondContact O-CB 3.3Å; N272-K276 WeakPolarHBondContact O-CG 3.47Å; N272-K276 PolarHBondContact O-N 2.92Å; N272-K276 VanDerWaalsContact O-N 3.13Å
273L82.1Confident79.9Confident96 Ų96112.3 Ų112.350%0.50356%0.56SS.*Hα-helixtrans-71.7-40.2176-78.7164.6000111.1K269 E270 S271 K276 M277K269-L273 HydrophobicContact CG-CD1 4.45Å; K269-L273 WeakPolarHBondContact O-CG 3.44Å; K269-L273 PolarHBondContact O-N 3.09Å; K269-L273 VanDerWaalsContact O-N 3.1Å; E270-L273 WeakPolarHBondContact O-CB 3.35Å; E270-L273 PolarHBondContact O-N 3.36Å; E270-L273 VanDerWaalsContact O-N 3.09Å; S271-L273 VanDerWaalsContact C-N 3.32Å; S271-L273 PolarHBondContact O-N 2.89Å; L273-K276 PolarHBondContact O-N 2.97Å; L273-M277 WeakPolarHBondContact O-CG 3.29Å; L273-M277 PolarHBondContact O-N 2.75Å
274I79.5Confident78.8Confident116 Ų116110.9 Ų110.960%0.59556%0.559SS**Hα-helixtrans-63.2-45.1176.1-66.6164.5000110.2E270 S271 K276 M277 D278E270-I274 WeakPolarHBondContact O-CG1 3.2Å; E270-I274 PolarHBondContact O-N 3.32Å; S271-I274 PolarHBondContact O-N 3.42Å; I274-K276 PolarHBondContact O-N 3.15Å; I274-M277 PolarHBondContact O-N 2.92Å; I274-M277 VanDerWaalsContact O-N 3.17Å; I274-D278 PolarHBondContact O-N 2.7Å
275E79.3Confident77.4Confident122 Ų122113.1 Ų113.157%0.5758%0.575SS**Hα-helixtrans-62.2-43177.9-162.1172-163.200111.7S271 M277 D278 D279S271-E275 PolarHBondContact O-N 3.01Å; E275-M277 VanDerWaalsContact C-N 3.32Å; E275-M277 PolarHBondContact O-N 2.91Å; E275-D278 PolarHBondContact O-N 3.3Å; E275-D279 PolarHBondContact O-N 3.23Å
276K81.1Confident76.1Confident141 Ų141115.3 Ų115.361%0.61359%0.585SS**Hα-helixtrans-65.5-30.9174-79.8-177.7178.5-177.60114.1N272 L273 I274 N280N272-K276 WeakPolarHBondContact O-CB 3.3Å; N272-K276 WeakPolarHBondContact O-CG 3.47Å; N272-K276 PolarHBondContact O-N 2.92Å; N272-K276 VanDerWaalsContact O-N 3.13Å; L273-K276 PolarHBondContact O-N 2.97Å; I274-K276 PolarHBondContact O-N 3.15Å; K276-N280 WeakPolarHBondContact O-CB 3.38Å; K276-N280 PolarHBondContact O-N 3.33Å; K276-N280 VanDerWaalsContact O-N 3.14Å; K276-N280 PolarHBondContact O-ND2 3.31Å
277M76.7Confident74.5Confident127 Ų127118 Ų11863%0.62660%0.599SS**Hα-helixtrans-71.4-40.7174.1-76.1178.464.300110.8L273 I274 E275 N280 L281L273-M277 WeakPolarHBondContact O-CG 3.29Å; L273-M277 PolarHBondContact O-N 2.75Å; I274-M277 PolarHBondContact O-N 2.92Å; I274-M277 VanDerWaalsContact O-N 3.17Å; E275-M277 VanDerWaalsContact C-N 3.32Å; E275-M277 PolarHBondContact O-N 2.91Å; M277-N280 PolarHBondContact O-N 3.45Å; M277-L281 WeakPolarHBondContact O-CD1 3.37Å; M277-L281 PolarHBondContact O-N 3.28Å
278D76.8Confident72.8Confident74 Ų74119.1 Ų119.140%0.39661%0.608SS.*Hα-helixtrans-65.7-39.4176.5-156.246.5000111.6I274 E275 L281 R282I274-D278 PolarHBondContact O-N 2.7Å; E275-D278 PolarHBondContact O-N 3.3Å; D278-L281 WeakPolarHBondContact O-CB 3.42Å; D278-L281 PolarHBondContact O-N 3.48Å; D278-R282 VanDerWaalsContact O-CG 3.31Å; D278-R282 WeakPolarHBondContact O-CG 3.47Å; D278-R282 PolarHBondContact O-N 2.99Å; D278-R282 IonicContact OD2-CZ 3.54Å; D278-R282 IonicContact OD2-NE 3.11Å; D278-R282 PolarHBondContact OD2-NE 2.91Å; D278-R282 VanDerWaalsContact OD2-NE 3.11Å; D278-R282 IonicContact OD2-NH2 3.93Å; D278-R282 PolarHBondContact OD2-NH2 2.79Å; D278-R282 VanDerWaalsContact OD2-NH2 3.07Å
279D75.8Confident71Confident81 Ų81120.7 Ų120.743%0.43362%0.623SS.*Hα-helixtrans-65.1-40.2174.4-81.8-21.5000112.9E275 L281 R282 Q283E275-D279 PolarHBondContact O-N 3.23Å; D279-L281 VanDerWaalsContact C-N 3.32Å; D279-L281 PolarHBondContact O-N 2.78Å; D279-R282 PolarHBondContact O-N 3.44Å; D279-Q283 WeakPolarHBondContact O-CB 3.2Å; D279-Q283 WeakPolarHBondContact O-CG 3.01Å; D279-Q283 PolarHBondContact O-N 3.18Å
280N74.4Confident68.8Low107 Ų107125.8 Ų125.857%0.57264%0.639SS**Hα-helixtrans-66.5-34.2174.4-88.4-69000112.5K276 M277 Q283 S284K276-N280 WeakPolarHBondContact O-CB 3.38Å; K276-N280 PolarHBondContact O-N 3.33Å; K276-N280 VanDerWaalsContact O-N 3.14Å; K276-N280 PolarHBondContact O-ND2 3.31Å; M277-N280 PolarHBondContact O-N 3.45Å; N280-Q283 PolarHBondContact O-N 3.4Å; N280-S284 PolarHBondContact O-N 2.9Å; N280-S284 VanDerWaalsContact O-N 3.15Å; N280-S284 PolarHBondContact O-OG 2.88Å; N280-S284 VanDerWaalsContact O-OG 3.11Å
281L67.4Low66.9Low122 Ų122129 Ų12964%0.63965%0.651SS**Hα-helixtrans-66.7-38.7172.7-83.9153.8000111.3M277 D278 D279M277-L281 WeakPolarHBondContact O-CD1 3.37Å; M277-L281 PolarHBondContact O-N 3.28Å; D278-L281 WeakPolarHBondContact O-CB 3.42Å; D278-L281 PolarHBondContact O-N 3.48Å; D279-L281 VanDerWaalsContact C-N 3.32Å; D279-L281 PolarHBondContact O-N 2.78Å
282R68.6Low65.2Low185 Ų185134 Ų13470%0.69867%0.672SS**Hα-helixtrans-70.7-29.1175.3-71.3170.6-172.5-124.74.4113.5D278 D279D278-R282 VanDerWaalsContact O-CG 3.31Å; D278-R282 WeakPolarHBondContact O-CG 3.47Å; D278-R282 PolarHBondContact O-N 2.99Å; D278-R282 IonicContact OD2-CZ 3.54Å; D278-R282 IonicContact OD2-NE 3.11Å; D278-R282 PolarHBondContact OD2-NE 2.91Å; D278-R282 VanDerWaalsContact OD2-NE 3.11Å; D278-R282 IonicContact OD2-NH2 3.93Å; D278-R282 PolarHBondContact OD2-NH2 2.79Å; D278-R282 VanDerWaalsContact OD2-NH2 3.07Å; D279-R282 PolarHBondContact O-N 3.44Å
283Q66.9Low63.1Low156 Ų156135 Ų13573%0.72968%0.684SS**Hα-helixtrans-90.9-3.9179.3-69.3-176.17.900114.2D279 N280D279-Q283 WeakPolarHBondContact O-CB 3.2Å; D279-Q283 WeakPolarHBondContact O-CG 3.01Å; D279-Q283 PolarHBondContact O-N 3.18Å; N280-Q283 PolarHBondContact O-N 3.4Å
284S57.8Low61.3Low75 Ų75137.2 Ų137.252%0.52470%0.701SS.*SBendtrans-66.8131.3174.1-75.90000111N280 Q286N280-S284 PolarHBondContact O-N 2.9Å; N280-S284 VanDerWaalsContact O-N 3.15Å; N280-S284 PolarHBondContact O-OG 2.88Å; N280-S284 VanDerWaalsContact O-OG 3.11Å; S284-Q286 PolarHBondContact O-N 3.37Å
285P56.8Low59.2Low123 Ų123139.6 Ų139.680%0.79971%0.714SS**PPolyproline II helixtrans-65.3122.6-178.923.4-30.3000110.8L287P285-L287 PolarHBondContact O-N 3.2Å
286Q59.1Low57.2Low187 Ų187143.3 Ų143.387%0.87473%0.728SS**PPolyproline II helixtrans-61.7122.9172.1-69.4-98.2-12.800109.4S284S284-Q286 PolarHBondContact O-N 3.37Å
287L52.7Low55.2Low161 Ų161144.7 Ų144.784%0.84374%0.742SS**PPolyproline II helixtrans-61.5133.8169.3-84.4149.8000109.4P285P285-L287 PolarHBondContact O-N 3.2Å
288P50.6Low53.2Low109 Ų109145 Ų14571%0.70875%0.751SS**PPolyproline II helixtrans-64.7150.1178.725-31.5000111.1R290P288-R290 PolarHBondContact O-N 3.36Å
289P45.8Very low51.5Low126 Ų126147.3 Ų147.382%0.81877%0.77SS**PPolyproline II helixtrans-62.3125.5-175.724-32.1000110.9K291P289-K291 PolarHBondContact O-N 3.22Å
290R43.8Very low49.7Very low247 Ų247147.9 Ų147.993%0.93279%0.786SS**  trans-67.7113.6176.7-155.8175.1-172.7168.41.5108.6P288 L292P288-R290 PolarHBondContact O-N 3.36Å; R290-L292 PolarHBondContact O-N 3.27Å
291K43.8Very low47.7Very low200 Ų200152.3 Ų152.387%0.8780%0.803SS**PPolyproline II helixtrans-61.8121.4173.7-71-176178.2-178.70109.8P289P289-K291 PolarHBondContact O-N 3.22Å
292L46.7Very low46.2Very low165 Ų165155.1 Ų155.186%0.86481%0.813SS**PPolyproline II helixtrans-67.5133.2167.3-83.8138.1000109.7R290R290-L292 PolarHBondContact O-N 3.27Å
293P39.6Very low44.5Very low116 Ų116154.6 Ų154.675%0.75382%0.819SS**PPolyproline II helixtrans-74.8127.3171-6.322.1000110.7L295P293-L295 PolarHBondContact O-N 3.07Å
294T43.6Very low42.9Very low141 Ų141153 Ų15387%0.86582%0.815SS**  trans-56.8115.6166.71.40000110.9
295L36.8Very low41.7Very low167 Ų167156 Ų15687%0.87483%0.825SS**PPolyproline II helixtrans-91.4118.6165.5-95.6152.4000108.8P293P293-L295 PolarHBondContact O-N 3.07Å
296K37.1Very low40.8Very low199 Ų199155.1 Ų155.187%0.86582%0.822SS**PPolyproline II helixtrans-71.4138.4173.7-75-179174.6-179.40110
297L39.4Very low39.8Very low171 Ų171155.8 Ų155.890%0.89582%0.823SS**PPolyproline II helixtrans-71.8135.9166-83.4111.2000111.1
298T33.8Very low39.1Very low134 Ų134157.1 Ų157.182%0.82282%0.824SS**  trans-139.5149151.238.10000109.1
299P40.6Very low38.5Very low121 Ų121163 Ų16379%0.78683%0.833SS**  trans-97.3156.7-154.137.2-32.6000114.7
300A38.8Very low38.1Very low94 Ų94165 Ų16578%0.77784%0.835SS**  trans33.3124.9148.800000120.3
301E32.3Very low38Very low199 Ų199157.9 Ų157.993%0.9382%0.824SS**  trans-153.8147.8132.9-110.7167.6-159.200110.5
302E35.1Very low38.7Very low181 Ų181158 Ų15885%0.84685%0.845SS**  trans-76.2152.3-168.2-63.7166.6137.600112.3
303E33.5Very low38.3Very low175 Ų175157.7 Ų157.782%0.81884%0.844SS**  158.1115.7119.1-89.5-164.2147.900112.9
304N32.3Very low38.2Very low122 Ų122159.8 Ų159.865%0.65285%0.848SS**  73125.9119.8-134.24.5000121.8
305N33.4Very low37.9Very low137 Ų137160.9 Ų160.973%0.73385%0.848SS**  trans65140.9149.9-75.9-26.2000118.3
306S37.3Very low38Very low106 Ų106160.5 Ų160.574%0.74185%0.846SS**  cis-171155.612.731.10000109.3
307F39.2Very low38.1Very low201 Ų201158.1 Ų158.188%0.88285%0.845SS**  trans-43.8143.5169-76.3-103.4000115.2
308Q38.1Very low38Very low189 Ų189157.3 Ų157.388%0.88384%0.841SS**  -169.5122.8118.8-107.2168.9-3.100113.6
309R37.7Very low38.3Very low233 Ų233158.9 Ų158.988%0.87984%0.843SS**  trans-58.7152.2150.7-80.3176178.7-178.6-0.7109.2
310L37.5Very low38.1Very low166 Ų166161.8 Ų161.887%0.86985%0.847SS**  178.8121114.1-91.5154000110.4
311S42.3Very low38Very low99 Ų99167.5 Ų167.569%0.69285%0.853SS**  trans-75166.5145.5-44.40000108.1
312P57.6Low38.5Very low202 Ų202164.6 Ų164.6100%1.31285%0.846SS**  -106.3056-5.926.7000114.8

Retrieved 312 of 312 residues in 60 ms (Link to these results)

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