A0A663E4W8_AQUCH Loading...

SRY-box transcription factor 14

AlphaFold DB , UniProt , Accession A0A663E4W8, Species AQUCH (Aquila chrysaetos chrysaetos), Gene SOX14, Length 240 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
1M40.5Very low75.6Confident246 Ų246136.5 Ų136.5100%1.21271%0.707SS**  098.40-71.8-175.9155.100109.5
2S52.2Low77.5Confident122 Ų122131 Ų13185%0.85368%0.677SS**PPolyproline II helixtrans-65.4132170.329.80000108.9
3K62.5Low79.1Confident190 Ų190127.8 Ų127.883%0.82666%0.662SS**PPolyproline II helixtrans-62144.1174.3-71.9171.1180163.50108.9S5K3-S5 PolarHBondContact O-N 3.07Å
4P53.9Low80.4Confident109 Ų109120 Ų12071%0.70863%0.626SS**PPolyproline II helixtrans-55.9125.4176.522.8-31.6000109.1D6P4-D6 PolarHBondContact O-N 3.06Å
5S67.4Low81.6Confident118 Ų118114.9 Ų114.983%0.82560%0.597SS**THydrogen-bonded Turntrans-75.82.7-171.1-164.50000113.3K3 H7K3-S5 PolarHBondContact O-N 3.07Å; S5-H7 VanDerWaalsContact C-N 3.3Å; S5-H7 PolarHBondContact O-N 3.21Å
6D83.8Confident82.6Confident146 Ų146112.9 Ų112.978%0.78159%0.585SS**THydrogen-bonded Turntrans-81.1-8.4-173.4-57.4-29.7000113.5P4 I8P4-D6 PolarHBondContact O-N 3.06Å; D6-I8 PolarHBondContact O-N 3.44Å; D6-I8 VanDerWaalsContact O-N 3.14Å
7H89Confident83.5Confident151 Ų151107.9 Ų107.970%0.69956%0.561SS**  trans-77.4104.2175.6-177.754.5000111.6S5 K9S5-H7 VanDerWaalsContact C-N 3.3Å; S5-H7 PolarHBondContact O-N 3.21Å; H7-K9 PolarHBondContact O-N 2.9Å
8I93.3Very high84.3Confident59 Ų59102.9 Ų102.930%0.30353%0.533SS..PPolyproline II helixtrans-63.7116.8171-59169000109.6D6 H68 H72 Y75D6-I8 PolarHBondContact O-N 3.44Å; D6-I8 VanDerWaalsContact O-N 3.14Å; I8-H68 WeakPolarHBondContact CG2-CE1 3.46Å; I8-H72 HydrophobicContact CD1-CB 4.2Å; I8-Y75 HydrophobicContact CB-CD2 3.88Å; I8-Y75 HydrophobicContact CB-CE2 4.17Å; I8-Y75 HydrophobicContact CD1-CD2 4.49Å; I8-Y75 HydrophobicContact CG2-CD2 3.46Å; I8-Y75 VanDerWaalsContact CG2-CD2 3.46Å; I8-Y75 HydrophobicContact CG2-CE2 3.83Å; I8-Y75 HydrophobicContact CG2-CG 4.3Å
9K94.7Very high85Confident168 Ų16897.5 Ų97.573%0.7351%0.505SS*.PPolyproline II helixtrans-77.1152.8176.8-66.6-175.7-178.6179.10110.8H7 H68H7-K9 PolarHBondContact O-N 2.9Å; K9-H68 PolarHBondContact O-CE1 3.22Å
10R97Very high85.6Confident149 Ų149101.3 Ų101.356%0.56251%0.512SS*.PPolyproline II helixtrans-62.9146.4173.9-54.8-179.8-163.9-157.715.2111Y75 Y77R10-Y75 WeakPolarHBondContact CG-OH 2.91Å; R10-Y77 VanDerWaalsContact NH1-CE2 3.34Å; R10-Y77 PolarHBondContact NH1-OH 3.03Å; R10-Y77 VanDerWaalsContact NH1-OH 3.15Å; R10-Y77 PolarHBondContact NH2-OH 3.49Å
11P97.5Very high86.1Confident43 Ų4398 Ų9828%0.27950%0.504SS..PPolyproline II helixtrans-64.1150.2167.428.1-32.9000110.1R65 H68P11-R65 HydrophobicContact CG-CG 4.49Å; P11-H68 HydrophobicContact CB-CB 3.97Å; P11-H68 HydrophobicContact CG-CB 4.22Å
12M97.8Very high88.8Confident71 Ų7189.3 Ų89.335%0.3546%0.461SS..PPolyproline II helixtrans-71.2133.7178.3-68.3-173.8-67.400110.5M16 V17 L64M12-M16 HydrophobicContact CB-CB 3.99Å; M12-M16 HydrophobicContact CG-CB 4.27Å; M12-V17 HydrophobicContact CB-CG2 3.79Å; M12-V17 HydrophobicContact CE-CG2 4.42Å; M12-L64 HydrophobicContact CB-CD1 4.3Å; M12-L64 HydrophobicContact CE-CD1 3.96Å
13N98.3Very high90.9Very high89 Ų8986.2 Ų86.248%0.47643%0.43SS..PPolyproline II helixtrans-77.9171.8168.371.225.1000110.9F15 M16 V17N13-F15 PolarHBondContact O-N 3.35Å; N13-F15 PolarHBondContact OD1-N 2.98Å; N13-M16 PolarHBondContact O-N 3.1Å; N13-M16 WeakPolarHBondContact OD1-CB 3.39Å; N13-M16 WeakPolarHBondContact OD1-CG 3.45Å; N13-M16 PolarHBondContact OD1-N 2.95Å; N13-V17 WeakPolarHBondContact O-CG2 3.48Å; N13-V17 PolarHBondContact O-N 3.11Å
14A97.9Very high92.6Very high19 Ų1986.4 Ų86.416%0.15743%0.426CS..Hα-helixtrans-54-47.8-176.100000113.2M16 V17 W18 W46 I58 A61A14-M16 VanDerWaalsContact C-N 3.33Å; A14-M16 PolarHBondContact O-N 2.88Å; A14-V17 PolarHBondContact O-N 3.47Å; A14-W18 PolarHBondContact O-N 3.22Å; A14-W46 HydrophobicContact CB-CH2 4.22Å; A14-W46 HydrophobicContact CB-CZ2 4.11Å; A14-I58 HydrophobicContact CB-CB 4.49Å; A14-I58 HydrophobicContact CB-CG1 3.9Å; A14-A61 HydrophobicContact CB-CB 4.08Å; A14-A61 VanDerWaalsContact N-CB 3.26Å
15F98.1Very high94.6Very high44 Ų4486.9 Ų86.919%0.19342%0.417CS..Hα-helixtrans-61.5-39.3176.6171.7-99.5000112.4N13 W18 S19 W46N13-F15 PolarHBondContact O-N 3.35Å; N13-F15 PolarHBondContact OD1-N 2.98Å; F15-W18 AromaticContact CD2-CE3 3.97Å; F15-W18 HydrophobicContact CD2-CE3 3.97Å; F15-W18 HydrophobicContact CD2-CZ3 4.07Å; F15-W18 HydrophobicContact CE2-CE3 4.09Å; F15-W18 AromaticContact CE2-CZ3 3.78Å; F15-W18 HydrophobicContact CE2-CZ3 3.78Å; F15-S19 WeakPolarHBondContact O-CB 3.47Å; F15-S19 PolarHBondContact O-N 2.83Å; F15-S19 PolarHBondContact O-OG 3.17Å; F15-W46 HydrophobicContact CB-CD2 4.48Å; F15-W46 HydrophobicContact CD2-CB 3.76Å; F15-W46 AromaticContact CD2-CD1 3.92Å; F15-W46 AromaticContact CD2-CD2 3.98Å; F15-W46 HydrophobicContact CD2-CD2 3.98Å; F15-W46 AromaticContact CD2-CG 3.58Å; F15-W46 HydrophobicContact CD2-CG 3.58Å; F15-W46 HydrophobicContact CE2-CB 3.93Å; F15-W46 HydrophobicContact CE2-CG 4.26Å
16M98.1Very high95.9Very high83 Ų8382.7 Ų82.741%0.40938%0.384SS..Hα-helixtrans-69.1-35.3178.8-69.6-63.6173.700111.9M12 N13 A14 R20M12-M16 HydrophobicContact CB-CB 3.99Å; M12-M16 HydrophobicContact CG-CB 4.27Å; N13-M16 PolarHBondContact O-N 3.1Å; N13-M16 WeakPolarHBondContact OD1-CB 3.39Å; N13-M16 WeakPolarHBondContact OD1-CG 3.45Å; N13-M16 PolarHBondContact OD1-N 2.95Å; A14-M16 VanDerWaalsContact C-N 3.33Å; A14-M16 PolarHBondContact O-N 2.88Å; M16-R20 PolarHBondContact O-N 3Å
17V98.1Very high96.4Very high28 Ų2877.6 Ų77.617%0.1736%0.363CS..Hα-helixtrans-63.2-53.6173.2177.70000110.1M12 N13 A14 Y57 E60 A61 L64M12-V17 HydrophobicContact CB-CG2 3.79Å; M12-V17 HydrophobicContact CE-CG2 4.42Å; N13-V17 WeakPolarHBondContact O-CG2 3.48Å; N13-V17 PolarHBondContact O-N 3.11Å; A14-V17 PolarHBondContact O-N 3.47Å; V17-Y57 HydrophobicContact CG1-CD1 4.12Å; V17-E60 HydrophobicContact CG1-CB 4.36Å; V17-E60 HydrophobicContact CG1-CG 3.86Å; V17-A61 HydrophobicContact CG2-CB 4.36Å; V17-L64 HydrophobicContact CG2-CD1 3.7Å
18W98Very high96.7Very high17 Ų1777.9 Ų77.96%0.06436%0.364CS..Hα-helixtrans-63.9-50.1-179.7170.381000112.9A14 F15 R20 G21 Q22 L42 E45 W46 L49 Y57A14-W18 PolarHBondContact O-N 3.22Å; F15-W18 AromaticContact CD2-CE3 3.97Å; F15-W18 HydrophobicContact CD2-CE3 3.97Å; F15-W18 HydrophobicContact CD2-CZ3 4.07Å; F15-W18 HydrophobicContact CE2-CE3 4.09Å; F15-W18 AromaticContact CE2-CZ3 3.78Å; F15-W18 HydrophobicContact CE2-CZ3 3.78Å; W18-R20 PolarHBondContact O-N 3.45Å; W18-R20 VanDerWaalsContact O-N 3.12Å; W18-G21 PolarHBondContact O-N 3.36Å; W18-Q22 HydrophobicContact CD2-CG 4.08Å; W18-Q22 HydrophobicContact CH2-CG 4.37Å; W18-Q22 HydrophobicContact CZ2-CB 4.49Å; W18-Q22 HydrophobicContact CZ2-CG 3.74Å; W18-Q22 PolarHBondContact O-N 3.49Å; W18-L42 HydrophobicContact CH2-CB 4.25Å; W18-L42 HydrophobicContact CH2-CD2 3.94Å; W18-L42 WeakPolarHBondContact CH2-O 3.25Å; W18-L42 HydrophobicContact CZ3-CB 4.01Å; W18-L42 HydrophobicContact CZ3-CD2 4.27Å; W18-L42 VanDerWaalsContact CZ3-O 3.27Å; W18-L42 WeakPolarHBondContact CZ3-O 3.27Å; W18-E45 HydrophobicContact CH2-CB 3.85Å; W18-E45 HydrophobicContact CZ2-CB 4.31Å; W18-W46 HydrophobicContact CB-CE3 4.12Å; W18-W46 HydrophobicContact CB-CH2 4.45Å; W18-W46 HydrophobicContact CB-CZ3 3.64Å; W18-W46 AromaticContact CD2-CE3 3.47Å; W18-W46 HydrophobicContact CD2-CE3 3.47Å; W18-W46 VanDerWaalsContact CD2-CE3 3.47Å; W18-W46 AromaticContact CD2-CZ3 3.86Å; W18-W46 HydrophobicContact CD2-CZ3 3.86Å; W18-W46 HydrophobicContact CE3-CB 4.23Å; W18-W46 HydrophobicContact CE3-CD2 4.2Å; W18-W46 AromaticContact CE3-CE3 3.49Å; W18-W46 HydrophobicContact CE3-CE3 3.49Å; W18-W46 VanDerWaalsContact CE3-CE3 3.49Å; W18-W46 HydrophobicContact CE3-CZ3 4.23Å; W18-W46 AromaticContact CG-CE3 3.77Å; W18-W46 HydrophobicContact CG-CE3 3.77Å; W18-W46 AromaticContact CG-CZ3 3.6Å; W18-W46 HydrophobicContact CG-CZ3 3.6Å; W18-W46 HydrophobicContact CH2-CB 4.08Å; W18-W46 HydrophobicContact CZ3-CB 3.71Å; W18-W46 HydrophobicContact CZ3-CE3 4.1Å; W18-W46 HydrophobicContact CZ3-CG 4.46Å; W18-L49 HydrophobicContact CD2-CD1 4.38Å; W18-L49 HydrophobicContact CH2-CD1 4.47Å; W18-L49 HydrophobicContact CZ2-CD1 3.63Å; W18-Y57 HydrophobicContact CB-CD1 3.74Å; W18-Y57 HydrophobicContact CB-CD2 4.15Å; W18-Y57 HydrophobicContact CB-CE1 4.08Å; W18-Y57 HydrophobicContact CB-CE2 4.49Å; W18-Y57 HydrophobicContact CB-CG 3.77Å; W18-Y57 AromaticContact CD1-CD2 3.92Å; W18-Y57 AromaticContact CD1-CE1 3.96Å; W18-Y57 AromaticContact CD1-CE2 3.52Å; W18-Y57 AromaticContact CD1-CZ 3.53Å; W18-Y57 HydrophobicContact CG-CD1 4.49Å; W18-Y57 HydrophobicContact CG-CD2 4.35Å; W18-Y57 HydrophobicContact CG-CE1 4.45Å; W18-Y57 HydrophobicContact CG-CE2 4.34Å; W18-Y57 HydrophobicContact CG-CG 4.43Å
19S97.7Very high96.7Very high0 Ų080.5 Ų80.50%038%0.375CS..Hα-helixtrans-65.5-19.7-17566.10000113F15 R23F15-S19 WeakPolarHBondContact O-CB 3.47Å; F15-S19 PolarHBondContact O-N 2.83Å; F15-S19 PolarHBondContact O-OG 3.17Å; S19-R23 WeakPolarHBondContact O-CB 3.34Å; S19-R23 PolarHBondContact O-N 3.2Å; S19-R23 PolarHBondContact OG-NH2 3.42Å
20R96.8Very high96.4Very high173 Ų17375.7 Ų75.765%0.65336%0.358SS*.Hα-helixtrans-61.1-46.4176.9-171.5178.9-176.8-162.50.6111.7M16 W18 R24M16-R20 PolarHBondContact O-N 3Å; W18-R20 PolarHBondContact O-N 3.45Å; W18-R20 VanDerWaalsContact O-N 3.12Å; R20-R24 PolarHBondContact O-N 3.28Å
21G96Very high96.1Very high33 Ų3374 Ų7434%0.3437%0.366SS..Hα-helixtrans-70-47.5177.400000111.8W18 R23 R24 K25W18-G21 PolarHBondContact O-N 3.36Å; G21-R23 PolarHBondContact O-N 3.22Å; G21-R24 WeakPolarHBondContact O-CB 3.45Å; G21-R24 PolarHBondContact O-N 3.12Å; G21-K25 PolarHBondContact O-N 2.97Å
22Q96.8Very high95.9Very high64 Ų6482.3 Ų82.330%0.29940%0.398SS..Hα-helixtrans-65.9-40.6-177.3-59.7-55.8-31.300112.9W18 R24 K25 M26 L42W18-Q22 HydrophobicContact CD2-CG 4.08Å; W18-Q22 HydrophobicContact CH2-CG 4.37Å; W18-Q22 HydrophobicContact CZ2-CB 4.49Å; W18-Q22 HydrophobicContact CZ2-CG 3.74Å; W18-Q22 PolarHBondContact O-N 3.49Å; Q22-R24 VanDerWaalsContact C-N 3.29Å; Q22-R24 PolarHBondContact O-N 3.45Å; Q22-K25 PolarHBondContact O-N 2.99Å; Q22-M26 WeakPolarHBondContact O-CG 2.98Å; Q22-M26 PolarHBondContact O-N 3.32Å; Q22-L42 HydrophobicContact CB-CD1 4.35Å; Q22-L42 HydrophobicContact CB-CD2 3.42Å; Q22-L42 VanDerWaalsContact CB-CD2 3.42Å; Q22-L42 HydrophobicContact CG-CD2 4.42Å
23R96.9Very high95.6Very high57 Ų5780.8 Ų80.822%0.21539%0.39CS..Hα-helixtrans-59.4-40.6174.7-177.7-170.5-71.4110.95.6111.7S19 G21 A27 N35 I38 L42S19-R23 WeakPolarHBondContact O-CB 3.34Å; S19-R23 PolarHBondContact O-N 3.2Å; S19-R23 PolarHBondContact OG-NH2 3.42Å; G21-R23 PolarHBondContact O-N 3.22Å; R23-A27 VanDerWaalsContact O-CB 3.25Å; R23-A27 WeakPolarHBondContact O-CB 3.11Å; R23-A27 PolarHBondContact O-N 2.93Å; R23-N35 WeakPolarHBondContact CD-ND2 3.5Å; R23-I38 HydrophobicContact CB-CG2 4.29Å; R23-I38 HydrophobicContact CG-CG2 3.95Å; R23-L42 HydrophobicContact CB-CD1 3.72Å
24R96.6Very high95.4Very high193 Ų19383.3 Ų83.373%0.72840%0.399SS*.Hα-helixtrans-65.3-44.1177-178.1173.761-170.20.1111.1R20 G21 Q22 A27 Q28R20-R24 PolarHBondContact O-N 3.28Å; G21-R24 WeakPolarHBondContact O-CB 3.45Å; G21-R24 PolarHBondContact O-N 3.12Å; Q22-R24 VanDerWaalsContact C-N 3.29Å; Q22-R24 PolarHBondContact O-N 3.45Å; R24-A27 PolarHBondContact O-N 3.34Å; R24-Q28 PolarHBondContact O-N 2.8Å
25K96.3Very high95.3Very high120 Ų12086.2 Ų86.252%0.52241%0.412SS..Hα-helixtrans-59.5-52.1176-177.5179.7172.2-1770111.5G21 Q22 A27 Q28 E29G21-K25 PolarHBondContact O-N 2.97Å; Q22-K25 PolarHBondContact O-N 2.99Å; K25-A27 VanDerWaalsContact C-N 3.32Å; K25-A27 PolarHBondContact O-N 3.26Å; K25-Q28 WeakPolarHBondContact O-CB 3.47Å; K25-Q28 PolarHBondContact O-N 3.41Å; K25-Q28 VanDerWaalsContact O-N 3.1Å; K25-E29 WeakPolarHBondContact CE-OE1 3.42Å; K25-E29 WeakPolarHBondContact CG-OE1 3.34Å; K25-E29 WeakPolarHBondContact O-CG 3.27Å; K25-E29 PolarHBondContact O-N 2.88Å
26M94.4Very high95.2Very high29 Ų2987 Ų8714%0.14342%0.423CS..Hα-helixtrans-62.6-37.1179.5-69.7-172.87400113.3Q22 Q28 E29 N30 M33 I38 R41 L42Q22-M26 WeakPolarHBondContact O-CG 2.98Å; Q22-M26 PolarHBondContact O-N 3.32Å; M26-Q28 VanDerWaalsContact C-N 3.31Å; M26-E29 PolarHBondContact O-N 3.3Å; M26-N30 WeakPolarHBondContact O-CB 3.35Å; M26-N30 PolarHBondContact O-N 3.42Å; M26-M33 HydrophobicContact CE-SD 4.45Å; M26-I38 HydrophobicContact CB-CG2 3.95Å; M26-I38 HydrophobicContact CE-CG2 4.5Å; M26-I38 HydrophobicContact SD-CG2 3.92Å; M26-R41 HydrophobicContact CE-CB 3.99Å; M26-L42 HydrophobicContact SD-CD2 3.51Å; M26-L42 VanDerWaalsContact SD-CD2 3.51Å; M26-L42 HydrophobicContact SD-CG 3.83Å
27A95Very high95.1Very high39 Ų3986.2 Ų86.232%0.32242%0.418SS..Hα-helixtrans-68-32.2176.400000112.2R23 R24 K25 N30 P31 I38R23-A27 VanDerWaalsContact O-CB 3.25Å; R23-A27 WeakPolarHBondContact O-CB 3.11Å; R23-A27 PolarHBondContact O-N 2.93Å; R24-A27 PolarHBondContact O-N 3.34Å; K25-A27 VanDerWaalsContact C-N 3.32Å; K25-A27 PolarHBondContact O-N 3.26Å; A27-N30 CarbonylContact O-C 3.56Å; A27-P31 VanDerWaalsContact O-CA 3.27Å; A27-P31 WeakPolarHBondContact O-CA 3.26Å; A27-I38 HydrophobicContact CB-CD1 4.06Å
28Q95.4Very high95Very high158 Ų15885 Ų8574%0.73841%0.41SS*.Hα-helixtrans-72-41.2175.4-170.463.344.100111.7R24 K25 M26R24-Q28 PolarHBondContact O-N 2.8Å; K25-Q28 WeakPolarHBondContact O-CB 3.47Å; K25-Q28 PolarHBondContact O-N 3.41Å; K25-Q28 VanDerWaalsContact O-N 3.1Å; M26-Q28 VanDerWaalsContact C-N 3.31Å
29E93.4Very high94.9Very high113 Ų11386 Ų8653%0.52842%0.42SS..Hα-helixtrans-70.7-32.9177.1-68.6169.1-177.100112.1K25 M26K25-E29 WeakPolarHBondContact CE-OE1 3.42Å; K25-E29 WeakPolarHBondContact CG-OE1 3.34Å; K25-E29 WeakPolarHBondContact O-CG 3.27Å; K25-E29 PolarHBondContact O-N 2.88Å; M26-E29 PolarHBondContact O-N 3.3Å
30N88.8Confident94.9Very high68 Ų6892.4 Ų92.436%0.36445%0.448SS..  trans-131.473.7-177.1-64.8-93.6000111.1M26 A27 K32 M33M26-N30 WeakPolarHBondContact O-CB 3.35Å; M26-N30 PolarHBondContact O-N 3.42Å; A27-N30 CarbonylContact O-C 3.56Å; N30-K32 PolarHBondContact O-N 3.1Å; N30-K32 VanDerWaalsContact O-N 3.11Å; N30-M33 HydrophobicContact CB-CB 3.75Å; N30-M33 HydrophobicContact CB-CE 3.85Å; N30-M33 WeakPolarHBondContact O-CB 3.46Å; N30-M33 PolarHBondContact O-N 3.16Å
31P90.5Very high94.9Very high113 Ų11389.8 Ų89.873%0.73444%0.438SS*.THydrogen-bonded Turntrans-65.3-18.3-17524.7-34.3000114.1A27A27-P31 VanDerWaalsContact O-CA 3.27Å; A27-P31 WeakPolarHBondContact O-CA 3.26Å
32K92.7Very high95Very high217 Ų21788.3 Ų88.394%0.94342%0.423SS*.THydrogen-bonded Turntrans-86.7-11.6174.2-66.3-177.2178.9179.20113.5N30N30-K32 PolarHBondContact O-N 3.1Å; N30-K32 VanDerWaalsContact O-N 3.11Å
33M92.2Very high95.1Very high39 Ų3986.4 Ų86.419%0.19242%0.42CS..SBendtrans-77.2128-177.2-171.3-179.9-63.500110.7M26 N30 E37 I38M26-M33 HydrophobicContact CE-SD 4.45Å; N30-M33 HydrophobicContact CB-CB 3.75Å; N30-M33 HydrophobicContact CB-CE 3.85Å; N30-M33 WeakPolarHBondContact O-CB 3.46Å; N30-M33 PolarHBondContact O-N 3.16Å; M33-E37 HydrophobicContact CG-CB 4.15Å; M33-E37 HydrophobicContact CG-CG 4.31Å; M33-E37 HydrophobicContact SD-CG 4.4Å; M33-I38 HydrophobicContact CB-CG1 4.34Å; M33-I38 HydrophobicContact CG-CG1 3.84Å; M33-I38 HydrophobicContact SD-CG1 3.63Å
34H94.7Very high95.1Very high143 Ų14386 Ų8666%0.66243%0.429SS*.  trans-72146.7179.6-164.956.5000111.9S36 E37 I38H34-S36 PolarHBondContact CD2-OG 2.9Å; H34-S36 VanDerWaalsContact CD2-OG 3.22Å; H34-S36 PolarHBondContact O-N 3.1Å; H34-E37 WeakPolarHBondContact O-CB 3.4Å; H34-E37 PolarHBondContact O-N 3.36Å; H34-I38 PolarHBondContact O-N 3.35Å
35N93.9Very high95.2Very high80 Ų8081.8 Ų81.843%0.42842%0.417SS..Hα-helixtrans-61.3-31.2-174.3-166.4-86.5000113.8R23 E37 I38 S39R23-N35 WeakPolarHBondContact CD-ND2 3.5Å; N35-E37 VanDerWaalsContact C-N 3.25Å; N35-E37 PolarHBondContact O-N 2.83Å; N35-I38 PolarHBondContact O-N 3.19Å; N35-S39 WeakPolarHBondContact O-CB 3.36Å; N35-S39 PolarHBondContact O-N 3.25Å; N35-S39 PolarHBondContact O-OG 2.93Å; N35-S39 PolarHBondContact OD1-OG 3.42Å
36S96Very high95.2Very high61 Ų6178.1 Ų78.143%0.42740%0.4SS..Hα-helixtrans-59.9-40.4175.465.10000111H34 S39 K40H34-S36 PolarHBondContact CD2-OG 2.9Å; H34-S36 VanDerWaalsContact CD2-OG 3.22Å; H34-S36 PolarHBondContact O-N 3.1Å; S36-S39 PolarHBondContact O-N 2.99Å; S36-K40 WeakPolarHBondContact O-CG 3.4Å; S36-K40 PolarHBondContact O-N 3.13Å; S36-K40 VanDerWaalsContact O-N 3.1Å
37E96.5Very high95.4Very high65 Ų6584.8 Ų84.830%0.30443%0.429SS..Hα-helixtrans-72.9-42.8179.8-168.155.5-149.700111.4M33 H34 N35 S39 K40 R41M33-E37 HydrophobicContact CG-CB 4.15Å; M33-E37 HydrophobicContact CG-CG 4.31Å; M33-E37 HydrophobicContact SD-CG 4.4Å; H34-E37 WeakPolarHBondContact O-CB 3.4Å; H34-E37 PolarHBondContact O-N 3.36Å; N35-E37 VanDerWaalsContact C-N 3.25Å; N35-E37 PolarHBondContact O-N 2.83Å; E37-S39 PolarHBondContact O-N 3.02Å; E37-K40 PolarHBondContact O-N 3.06Å; E37-K40 VanDerWaalsContact O-N 3.16Å; E37-K40 IonicContact OE2-NZ 3.25Å; E37-K40 PolarHBondContact OE2-NZ 3.44Å; E37-R41 PolarHBondContact O-N 2.68Å; E37-R41 VanDerWaalsContact O-N 3.1Å; E37-R41 IonicContact OE1-NE 3.79Å
38I96.3Very high95.5Very high2 Ų289.5 Ų89.51%0.0145%0.447CS..Hα-helixtrans-55.1-45.5171.7-61.8173.9000110R23 M26 A27 M33 H34 N35 K40 R41 L42R23-I38 HydrophobicContact CB-CG2 4.29Å; R23-I38 HydrophobicContact CG-CG2 3.95Å; M26-I38 HydrophobicContact CB-CG2 3.95Å; M26-I38 HydrophobicContact CE-CG2 4.5Å; M26-I38 HydrophobicContact SD-CG2 3.92Å; A27-I38 HydrophobicContact CB-CD1 4.06Å; M33-I38 HydrophobicContact CB-CG1 4.34Å; M33-I38 HydrophobicContact CG-CG1 3.84Å; M33-I38 HydrophobicContact SD-CG1 3.63Å; H34-I38 PolarHBondContact O-N 3.35Å; N35-I38 PolarHBondContact O-N 3.19Å; I38-K40 VanDerWaalsContact C-N 3.35Å; I38-K40 PolarHBondContact O-N 3.48Å; I38-R41 PolarHBondContact O-N 2.71Å; I38-L42 HydrophobicContact CG2-CD1 3.81Å; I38-L42 HydrophobicContact CG2-CG 4.17Å; I38-L42 WeakPolarHBondContact O-CB 3.41Å; I38-L42 VanDerWaalsContact O-CG 3.26Å; I38-L42 WeakPolarHBondContact O-CG 3.43Å; I38-L42 PolarHBondContact O-N 2.83Å
39S96.8Very high95.6Very high39 Ų3983.6 Ų83.627%0.27342%0.421SS..Hα-helixtrans-65.9-34.7-178.8-61.90000112.9N35 S36 E37 G43N35-S39 WeakPolarHBondContact O-CB 3.36Å; N35-S39 PolarHBondContact O-N 3.25Å; N35-S39 PolarHBondContact O-OG 2.93Å; N35-S39 PolarHBondContact OD1-OG 3.42Å; S36-S39 PolarHBondContact O-N 2.99Å; E37-S39 PolarHBondContact O-N 3.02Å; S39-G43 PolarHBondContact O-N 3.18Å
40K97.6Very high95.8Very high134 Ų13480.8 Ų80.858%0.58341%0.414SS*.Hα-helixtrans-63.3-48.9173.3-70.6178.8-155.5157.40111.3S36 E37 I38 G43 A44S36-K40 WeakPolarHBondContact O-CG 3.4Å; S36-K40 PolarHBondContact O-N 3.13Å; S36-K40 VanDerWaalsContact O-N 3.1Å; E37-K40 PolarHBondContact O-N 3.06Å; E37-K40 VanDerWaalsContact O-N 3.16Å; E37-K40 IonicContact OE2-NZ 3.25Å; E37-K40 PolarHBondContact OE2-NZ 3.44Å; I38-K40 VanDerWaalsContact C-N 3.35Å; I38-K40 PolarHBondContact O-N 3.48Å; K40-G43 PolarHBondContact O-N 3.4Å; K40-A44 PolarHBondContact O-N 3.26Å; K40-A44 VanDerWaalsContact O-N 3.16Å
41R97Very high96.2Very high118 Ų11883.1 Ų83.145%0.44542%0.422SS..Hα-helixtrans-61.5-48.1179.6-66.3-177.9-174.5-161.72.7111.5M26 E37 I38 G43 A44 E45M26-R41 HydrophobicContact CE-CB 3.99Å; E37-R41 PolarHBondContact O-N 2.68Å; E37-R41 VanDerWaalsContact O-N 3.1Å; E37-R41 IonicContact OE1-NE 3.79Å; I38-R41 PolarHBondContact O-N 2.71Å; R41-G43 PolarHBondContact O-N 2.84Å; R41-A44 WeakPolarHBondContact O-CB 3.44Å; R41-A44 PolarHBondContact O-N 3.49Å; R41-E45 WeakPolarHBondContact O-CG 3.44Å; R41-E45 PolarHBondContact O-N 2.72Å
42L97.6Very high96.5Very high3 Ų380.8 Ų80.82%0.01641%0.413CS..Hα-helixtrans-59.5-35.6175.6-68.2179.3000113W18 Q22 R23 M26 I38 A44 W46W18-L42 HydrophobicContact CH2-CB 4.25Å; W18-L42 HydrophobicContact CH2-CD2 3.94Å; W18-L42 WeakPolarHBondContact CH2-O 3.25Å; W18-L42 HydrophobicContact CZ3-CB 4.01Å; W18-L42 HydrophobicContact CZ3-CD2 4.27Å; W18-L42 VanDerWaalsContact CZ3-O 3.27Å; W18-L42 WeakPolarHBondContact CZ3-O 3.27Å; Q22-L42 HydrophobicContact CB-CD1 4.35Å; Q22-L42 HydrophobicContact CB-CD2 3.42Å; Q22-L42 VanDerWaalsContact CB-CD2 3.42Å; Q22-L42 HydrophobicContact CG-CD2 4.42Å; R23-L42 HydrophobicContact CB-CD1 3.72Å; M26-L42 HydrophobicContact SD-CD2 3.51Å; M26-L42 VanDerWaalsContact SD-CD2 3.51Å; M26-L42 HydrophobicContact SD-CG 3.83Å; I38-L42 HydrophobicContact CG2-CD1 3.81Å; I38-L42 HydrophobicContact CG2-CG 4.17Å; I38-L42 WeakPolarHBondContact O-CB 3.41Å; I38-L42 VanDerWaalsContact O-CG 3.26Å; I38-L42 WeakPolarHBondContact O-CG 3.43Å; I38-L42 PolarHBondContact O-N 2.83Å; L42-A44 VanDerWaalsContact C-N 3.3Å; L42-A44 PolarHBondContact O-N 2.73Å; L42-W46 WeakPolarHBondContact O-CB 3.4Å; L42-W46 PolarHBondContact O-N 3.03Å
43G97.9Very high96.7Very high23 Ų2375.2 Ų75.224%0.23739%0.39CS..Hα-helixtrans-64.3-34.3174.500000113.2S39 K40 R41 K47S39-G43 PolarHBondContact O-N 3.18Å; K40-G43 PolarHBondContact O-N 3.4Å; R41-G43 PolarHBondContact O-N 2.84Å; G43-K47 WeakPolarHBondContact O-CG 3.31Å; G43-K47 PolarHBondContact O-N 3.01Å
44A97.9Very high97Very high50 Ų5074.6 Ų74.641%0.41339%0.386SS..Hα-helixtrans-72.3-49.8174.600000111.3K40 R41 L42 W46 K47 L48K40-A44 PolarHBondContact O-N 3.26Å; K40-A44 VanDerWaalsContact O-N 3.16Å; R41-A44 WeakPolarHBondContact O-CB 3.44Å; R41-A44 PolarHBondContact O-N 3.49Å; L42-A44 VanDerWaalsContact C-N 3.3Å; L42-A44 PolarHBondContact O-N 2.73Å; A44-W46 VanDerWaalsContact C-N 3.3Å; A44-W46 PolarHBondContact O-N 3.06Å; A44-K47 WeakPolarHBondContact O-CB 3.28Å; A44-K47 PolarHBondContact O-N 3.24Å; A44-L48 PolarHBondContact O-N 2.96Å
45E97.6Very high97.1Very high103 Ų10375.2 Ų75.248%0.48138%0.383SS..Hα-helixtrans-55.5-44.1176.4-67.6-55.5138.900111.9W18 R41 K47 L48 L49W18-E45 HydrophobicContact CH2-CB 3.85Å; W18-E45 HydrophobicContact CZ2-CB 4.31Å; R41-E45 WeakPolarHBondContact O-CG 3.44Å; R41-E45 PolarHBondContact O-N 2.72Å; E45-K47 PolarHBondContact O-N 2.96Å; E45-L48 PolarHBondContact O-N 3.3Å; E45-L49 WeakPolarHBondContact O-CG 3.33Å; E45-L49 PolarHBondContact O-N 3Å
46W97.9Very high97.3Very high43 Ų4375 Ų7516%0.16339%0.386CS..Hα-helixtrans-59.5-35176.7-179.2-104.2000113A14 F15 W18 L42 A44 L48 L49 K54 Y57A14-W46 HydrophobicContact CB-CH2 4.22Å; A14-W46 HydrophobicContact CB-CZ2 4.11Å; F15-W46 HydrophobicContact CB-CD2 4.48Å; F15-W46 HydrophobicContact CD2-CB 3.76Å; F15-W46 AromaticContact CD2-CD1 3.92Å; F15-W46 AromaticContact CD2-CD2 3.98Å; F15-W46 HydrophobicContact CD2-CD2 3.98Å; F15-W46 AromaticContact CD2-CG 3.58Å; F15-W46 HydrophobicContact CD2-CG 3.58Å; F15-W46 HydrophobicContact CE2-CB 3.93Å; F15-W46 HydrophobicContact CE2-CG 4.26Å; W18-W46 HydrophobicContact CB-CE3 4.12Å; W18-W46 HydrophobicContact CB-CH2 4.45Å; W18-W46 HydrophobicContact CB-CZ3 3.64Å; W18-W46 AromaticContact CD2-CE3 3.47Å; W18-W46 HydrophobicContact CD2-CE3 3.47Å; W18-W46 VanDerWaalsContact CD2-CE3 3.47Å; W18-W46 AromaticContact CD2-CZ3 3.86Å; W18-W46 HydrophobicContact CD2-CZ3 3.86Å; W18-W46 HydrophobicContact CE3-CB 4.23Å; W18-W46 HydrophobicContact CE3-CD2 4.2Å; W18-W46 AromaticContact CE3-CE3 3.49Å; W18-W46 HydrophobicContact CE3-CE3 3.49Å; W18-W46 VanDerWaalsContact CE3-CE3 3.49Å; W18-W46 HydrophobicContact CE3-CZ3 4.23Å; W18-W46 AromaticContact CG-CE3 3.77Å; W18-W46 HydrophobicContact CG-CE3 3.77Å; W18-W46 AromaticContact CG-CZ3 3.6Å; W18-W46 HydrophobicContact CG-CZ3 3.6Å; W18-W46 HydrophobicContact CH2-CB 4.08Å; W18-W46 HydrophobicContact CZ3-CB 3.71Å; W18-W46 HydrophobicContact CZ3-CE3 4.1Å; W18-W46 HydrophobicContact CZ3-CG 4.46Å; L42-W46 WeakPolarHBondContact O-CB 3.4Å; L42-W46 PolarHBondContact O-N 3.03Å; A44-W46 VanDerWaalsContact C-N 3.3Å; A44-W46 PolarHBondContact O-N 3.06Å; W46-L48 VanDerWaalsContact C-N 3.35Å; W46-L49 HydrophobicContact CE3-CD1 3.81Å; W46-L49 HydrophobicContact CZ3-CD1 4.23Å; W46-K54 HydrophobicContact CE3-CG 4.4Å; W46-K54 HydrophobicContact CH2-CB 3.89Å; W46-K54 HydrophobicContact CH2-CD 4.48Å; W46-K54 HydrophobicContact CH2-CG 3.64Å; W46-K54 HydrophobicContact CZ2-CB 4.23Å; W46-K54 HydrophobicContact CZ2-CD 4.17Å; W46-K54 HydrophobicContact CZ2-CG 3.82Å; W46-K54 HydrophobicContact CZ3-CG 3.95Å; W46-K54 WeakPolarHBondContact O-CE 3.29Å; W46-K54 PolarHBondContact O-NZ 3.17Å; W46-Y57 HydrophobicContact CZ3-CD2 4.27Å
47K97.4Very high97.4Very high170 Ų17075.8 Ų75.874%0.73938%0.38SS*.Hα-helixtrans-70.5-35.9177.3-71.1174-179.8-176.30111.3G43 A44 E45 K54G43-K47 WeakPolarHBondContact O-CG 3.31Å; G43-K47 PolarHBondContact O-N 3.01Å; A44-K47 WeakPolarHBondContact O-CB 3.28Å; A44-K47 PolarHBondContact O-N 3.24Å; E45-K47 PolarHBondContact O-N 2.96Å; K47-K54 PolarHBondContact O-NZ 3.41Å
48L97.4Very high97.5Very high137 Ų13774.7 Ų74.772%0.71738%0.376SS*.Hα-helixtrans-74.8-28.1179.9-66174.2000113.6A44 E45 W46 S50A44-L48 PolarHBondContact O-N 2.96Å; E45-L48 PolarHBondContact O-N 3.3Å; W46-L48 VanDerWaalsContact C-N 3.35Å; L48-S50 PolarHBondContact O-N 3.45Å
49L96.9Very high97.6Very high34 Ų3478.5 Ų78.518%0.17840%0.396CS..SBendtrans-56.3138.8176.4-76.3173.1000111.8W18 E45 W46 E53 K54W18-L49 HydrophobicContact CD2-CD1 4.38Å; W18-L49 HydrophobicContact CH2-CD1 4.47Å; W18-L49 HydrophobicContact CZ2-CD1 3.63Å; E45-L49 WeakPolarHBondContact O-CG 3.33Å; E45-L49 PolarHBondContact O-N 3Å; W46-L49 HydrophobicContact CE3-CD1 3.81Å; W46-L49 HydrophobicContact CZ3-CD1 4.23Å; L49-E53 HydrophobicContact CD2-CB 4.1Å; L49-E53 HydrophobicContact CD2-CG 4.47Å; L49-K54 HydrophobicContact CB-CG 4.16Å; L49-K54 WeakPolarHBondContact O-CE 3.36Å; L49-K54 PolarHBondContact O-NZ 2.77Å
50S98.1Very high97.7Very high54 Ų5479.8 Ų79.838%0.37840%0.398SS..  trans-67.8157.9175.567.40000111.3L48 A52 E53 K54L48-S50 PolarHBondContact O-N 3.45Å; S50-A52 PolarHBondContact O-N 2.81Å; S50-E53 WeakPolarHBondContact CB-OE2 3.34Å; S50-E53 PolarHBondContact N-OE2 3.32Å; S50-E53 PolarHBondContact O-N 3.49Å; S50-E53 VanDerWaalsContact OG-CG 3.29Å; S50-E53 WeakPolarHBondContact OG-CG 3.17Å; S50-E53 PolarHBondContact OG-N 2.99Å; S50-E53 PolarHBondContact OG-OE2 3.16Å; S50-K54 WeakPolarHBondContact O-CG 3.15Å; S50-K54 PolarHBondContact O-N 3.03Å
51E96.6Very high97.7Very high117 Ų11774 Ų7455%0.54738%0.375SS..Hα-helixtrans-58.6-37176.5-159.468.1-153.300111E53 K54 R55E51-E53 PolarHBondContact O-N 3.49Å; E51-K54 WeakPolarHBondContact O-CB 3.41Å; E51-K54 PolarHBondContact O-N 3.2Å; E51-K54 VanDerWaalsContact O-N 3.13Å; E51-R55 VanDerWaalsContact O-CG 3.3Å; E51-R55 WeakPolarHBondContact O-CG 2.78Å; E51-R55 PolarHBondContact O-N 3.18Å
52A97.6Very high97.8Very high65 Ų6574.2 Ų74.254%0.53738%0.379SS..Hα-helixtrans-60.3-42.3178.100000112.4S50 K54 R55 P56S50-A52 PolarHBondContact O-N 2.81Å; A52-K54 VanDerWaalsContact C-N 3.33Å; A52-R55 PolarHBondContact O-N 2.92Å; A52-P56 WeakPolarHBondContact O-CD 3.33Å
53E96.9Very high97.8Very high99 Ų9979.6 Ų79.646%0.46340%0.399SS..Hα-helixtrans-71.8-29.6176.1-66.8165.2116.300112.2L49 S50 E51 P56 Y57L49-E53 HydrophobicContact CD2-CB 4.1Å; L49-E53 HydrophobicContact CD2-CG 4.47Å; S50-E53 WeakPolarHBondContact CB-OE2 3.34Å; S50-E53 PolarHBondContact N-OE2 3.32Å; S50-E53 PolarHBondContact O-N 3.49Å; S50-E53 VanDerWaalsContact OG-CG 3.29Å; S50-E53 WeakPolarHBondContact OG-CG 3.17Å; S50-E53 PolarHBondContact OG-N 2.99Å; S50-E53 PolarHBondContact OG-OE2 3.16Å; E51-E53 PolarHBondContact O-N 3.49Å; E53-P56 WeakPolarHBondContact O-CD 3.42Å; E53-P56 WeakPolarHBondContact O-CG 3.39Å; E53-Y57 VanDerWaalsContact O-CD2 3.28Å; E53-Y57 WeakPolarHBondContact O-CD2 3.41Å; E53-Y57 WeakPolarHBondContact O-CE2 3.3Å
54K97.9Very high97.9Very high26 Ų2680.1 Ų80.111%0.11340%0.397CS..Hα-helixtrans-74.5-31.8176.1-68.6167.7171.4152.40112.6W46 K47 L49 S50 E51 A52 Y57 I58W46-K54 HydrophobicContact CE3-CG 4.4Å; W46-K54 HydrophobicContact CH2-CB 3.89Å; W46-K54 HydrophobicContact CH2-CD 4.48Å; W46-K54 HydrophobicContact CH2-CG 3.64Å; W46-K54 HydrophobicContact CZ2-CB 4.23Å; W46-K54 HydrophobicContact CZ2-CD 4.17Å; W46-K54 HydrophobicContact CZ2-CG 3.82Å; W46-K54 HydrophobicContact CZ3-CG 3.95Å; W46-K54 WeakPolarHBondContact O-CE 3.29Å; W46-K54 PolarHBondContact O-NZ 3.17Å; K47-K54 PolarHBondContact O-NZ 3.41Å; L49-K54 HydrophobicContact CB-CG 4.16Å; L49-K54 WeakPolarHBondContact O-CE 3.36Å; L49-K54 PolarHBondContact O-NZ 2.77Å; S50-K54 WeakPolarHBondContact O-CG 3.15Å; S50-K54 PolarHBondContact O-N 3.03Å; E51-K54 WeakPolarHBondContact O-CB 3.41Å; E51-K54 PolarHBondContact O-N 3.2Å; E51-K54 VanDerWaalsContact O-N 3.13Å; A52-K54 VanDerWaalsContact C-N 3.33Å; K54-Y57 PolarHBondContact O-N 3.27Å; K54-I58 HydrophobicContact CB-CD1 3.84Å; K54-I58 HydrophobicContact CB-CG1 4.4Å; K54-I58 WeakPolarHBondContact O-CG1 3.47Å; K54-I58 PolarHBondContact O-N 3.19Å
55R98.1Very high97.9Very high156 Ų15686.3 Ų86.359%0.58941%0.409SS*.Hα-helixtrans-45.9-53.7-176.8-77.9-164.2-177.7150.20.5114.7E51 A52 Y57 I58 D59E51-R55 VanDerWaalsContact O-CG 3.3Å; E51-R55 WeakPolarHBondContact O-CG 2.78Å; E51-R55 PolarHBondContact O-N 3.18Å; A52-R55 PolarHBondContact O-N 2.92Å; R55-Y57 PolarHBondContact O-N 3.25Å; R55-I58 WeakPolarHBondContact O-CB 3.37Å; R55-I58 PolarHBondContact O-N 3.41Å; R55-I58 VanDerWaalsContact O-N 3.08Å; R55-D59 PolarHBondContact O-N 2.87Å
56P98.3Very high97.9Very high76 Ų7684.1 Ų84.149%0.49441%0.409SS..Hα-helixtrans-58.3-35.8-178.921.6-34.2000112.7A52 E53 E60A52-P56 WeakPolarHBondContact O-CD 3.33Å; E53-P56 WeakPolarHBondContact O-CD 3.42Å; E53-P56 WeakPolarHBondContact O-CG 3.39Å; P56-E60 VanDerWaalsContact O-CB 3.31Å; P56-E60 WeakPolarHBondContact O-CB 3.45Å; P56-E60 PolarHBondContact O-N 2.89Å
57Y98.2Very high97.9Very high78 Ų7885.6 Ų85.631%0.30642%0.417SS..Hα-helixtrans-78.6-30.8178.8-54.4-73.4000112.9V17 W18 W46 E53 K54 R55 A61V17-Y57 HydrophobicContact CG1-CD1 4.12Å; W18-Y57 HydrophobicContact CB-CD1 3.74Å; W18-Y57 HydrophobicContact CB-CD2 4.15Å; W18-Y57 HydrophobicContact CB-CE1 4.08Å; W18-Y57 HydrophobicContact CB-CE2 4.49Å; W18-Y57 HydrophobicContact CB-CG 3.77Å; W18-Y57 AromaticContact CD1-CD2 3.92Å; W18-Y57 AromaticContact CD1-CE1 3.96Å; W18-Y57 AromaticContact CD1-CE2 3.52Å; W18-Y57 AromaticContact CD1-CZ 3.53Å; W18-Y57 HydrophobicContact CG-CD1 4.49Å; W18-Y57 HydrophobicContact CG-CD2 4.35Å; W18-Y57 HydrophobicContact CG-CE1 4.45Å; W18-Y57 HydrophobicContact CG-CE2 4.34Å; W18-Y57 HydrophobicContact CG-CG 4.43Å; W46-Y57 HydrophobicContact CZ3-CD2 4.27Å; E53-Y57 VanDerWaalsContact O-CD2 3.28Å; E53-Y57 WeakPolarHBondContact O-CD2 3.41Å; E53-Y57 WeakPolarHBondContact O-CE2 3.3Å; K54-Y57 PolarHBondContact O-N 3.27Å; R55-Y57 PolarHBondContact O-N 3.25Å; Y57-A61 VanDerWaalsContact O-CB 3.29Å; Y57-A61 WeakPolarHBondContact O-CB 3.38Å; Y57-A61 PolarHBondContact O-N 2.89Å
58I98Very high97.9Very high42 Ų4278.5 Ų78.522%0.21539%0.387CS..Hα-helixtrans-65.1-47.3172.3-69.1168000109.6A14 K54 R55 A61 K62A14-I58 HydrophobicContact CB-CB 4.49Å; A14-I58 HydrophobicContact CB-CG1 3.9Å; K54-I58 HydrophobicContact CB-CD1 3.84Å; K54-I58 HydrophobicContact CB-CG1 4.4Å; K54-I58 WeakPolarHBondContact O-CG1 3.47Å; K54-I58 PolarHBondContact O-N 3.19Å; R55-I58 WeakPolarHBondContact O-CB 3.37Å; R55-I58 PolarHBondContact O-N 3.41Å; R55-I58 VanDerWaalsContact O-N 3.08Å; I58-A61 PolarHBondContact O-N 2.86Å; I58-K62 WeakPolarHBondContact O-CG 3.43Å; I58-K62 PolarHBondContact O-N 3.25Å
59D98.4Very high97.9Very high81 Ų8178.2 Ų78.243%0.43338%0.383SS..Hα-helixtrans-69-38.6-179.1-65.9-25.5000111.6R55 A61 K62 R63R55-D59 PolarHBondContact O-N 2.87Å; D59-A61 PolarHBondContact O-N 2.92Å; D59-K62 WeakPolarHBondContact O-CB 3.48Å; D59-K62 PolarHBondContact O-N 3.22Å; D59-K62 IonicContact OD1-NZ 2.89Å; D59-K62 PolarHBondContact OD1-NZ 3.23Å; D59-R63 WeakPolarHBondContact O-CB 3.48Å; D59-R63 PolarHBondContact O-N 3.08Å
60E98.3Very high97.9Very high66 Ų6685.3 Ų85.331%0.30841%0.413SS..Hα-helixtrans-63.5-40.1172.3-178.257.4-163.300112.2V17 P56 K62 R63 L64V17-E60 HydrophobicContact CG1-CB 4.36Å; V17-E60 HydrophobicContact CG1-CG 3.86Å; P56-E60 VanDerWaalsContact O-CB 3.31Å; P56-E60 WeakPolarHBondContact O-CB 3.45Å; P56-E60 PolarHBondContact O-N 2.89Å; E60-K62 VanDerWaalsContact C-N 3.35Å; E60-K62 PolarHBondContact O-N 3.46Å; E60-R63 WeakPolarHBondContact O-CB 3.4Å; E60-R63 PolarHBondContact O-N 2.89Å; E60-R63 IonicContact OE1-CZ 3.76Å; E60-R63 IonicContact OE1-NE 2.83Å; E60-R63 PolarHBondContact OE1-NE 2.9Å; E60-R63 IonicContact OE1-NH2 3.82Å; E60-R63 PolarHBondContact OE1-NH2 3.13Å; E60-R63 IonicContact OE2-CZ 2.83Å; E60-R63 IonicContact OE2-NE 2.71Å; E60-R63 PolarHBondContact OE2-NE 3.36Å; E60-R63 IonicContact OE2-NH2 3.39Å; E60-L64 HydrophobicContact CG-CD1 4.32Å; E60-L64 WeakPolarHBondContact O-CB 3.19Å; E60-L64 WeakPolarHBondContact O-CG 3.38Å; E60-L64 PolarHBondContact O-N 2.96Å
61A98.3Very high97.8Very high12 Ų1288 Ų8810%0.09942%0.419CS..Hα-helixtrans-65.5-37.2174.700000112.6A14 V17 Y57 I58 D59 R65A14-A61 HydrophobicContact CB-CB 4.08Å; A14-A61 VanDerWaalsContact N-CB 3.26Å; V17-A61 HydrophobicContact CG2-CB 4.36Å; Y57-A61 VanDerWaalsContact O-CB 3.29Å; Y57-A61 WeakPolarHBondContact O-CB 3.38Å; Y57-A61 PolarHBondContact O-N 2.89Å; I58-A61 PolarHBondContact O-N 2.86Å; D59-A61 PolarHBondContact O-N 2.92Å; A61-R65 WeakPolarHBondContact O-CB 3.49Å; A61-R65 PolarHBondContact O-N 2.86Å
62K98.6Very high97.8Very high123 Ų12385.5 Ų85.554%0.53541%0.408SS..Hα-helixtrans-62.5-45.3171.8-70171.9-168.1156.40110.6I58 D59 E60 R65 A66I58-K62 WeakPolarHBondContact O-CG 3.43Å; I58-K62 PolarHBondContact O-N 3.25Å; D59-K62 WeakPolarHBondContact O-CB 3.48Å; D59-K62 PolarHBondContact O-N 3.22Å; D59-K62 IonicContact OD1-NZ 2.89Å; D59-K62 PolarHBondContact OD1-NZ 3.23Å; E60-K62 VanDerWaalsContact C-N 3.35Å; E60-K62 PolarHBondContact O-N 3.46Å; K62-R65 PolarHBondContact O-N 2.96Å; K62-A66 PolarHBondContact O-N 3.3Å
63R98.5Very high97.6Very high116 Ų11687.1 Ų87.144%0.43841%0.413SS..Hα-helixtrans-58.5-49177.2-166.8-164.469.770.94.1111.3D59 E60 R65 A66 Q67D59-R63 WeakPolarHBondContact O-CB 3.48Å; D59-R63 PolarHBondContact O-N 3.08Å; E60-R63 WeakPolarHBondContact O-CB 3.4Å; E60-R63 PolarHBondContact O-N 2.89Å; E60-R63 IonicContact OE1-CZ 3.76Å; E60-R63 IonicContact OE1-NE 2.83Å; E60-R63 PolarHBondContact OE1-NE 2.9Å; E60-R63 IonicContact OE1-NH2 3.82Å; E60-R63 PolarHBondContact OE1-NH2 3.13Å; E60-R63 IonicContact OE2-CZ 2.83Å; E60-R63 IonicContact OE2-NE 2.71Å; E60-R63 PolarHBondContact OE2-NE 3.36Å; E60-R63 IonicContact OE2-NH2 3.39Å; R63-R65 VanDerWaalsContact C-N 3.32Å; R63-R65 PolarHBondContact O-N 2.88Å; R63-A66 PolarHBondContact O-N 3.46Å; R63-Q67 WeakPolarHBondContact O-CB 3.47Å; R63-Q67 PolarHBondContact O-N 3.42Å
64L98.3Very high97.5Very high35 Ų3589.8 Ų89.818%0.18343%0.43CS..Hα-helixtrans-61.7-38.7177-72.8172.1000112.4M12 V17 E60 H68M12-L64 HydrophobicContact CB-CD1 4.3Å; M12-L64 HydrophobicContact CE-CD1 3.96Å; V17-L64 HydrophobicContact CG2-CD1 3.7Å; E60-L64 HydrophobicContact CG-CD1 4.32Å; E60-L64 WeakPolarHBondContact O-CB 3.19Å; E60-L64 WeakPolarHBondContact O-CG 3.38Å; E60-L64 PolarHBondContact O-N 2.96Å; L64-H68 WeakPolarHBondContact O-CB 3.48Å; L64-H68 PolarHBondContact O-N 3.46Å
65R97.6Very high97.4Very high179 Ų17991.7 Ų91.768%0.67544%0.437SS*.Hα-helixtrans-65.1-44.5175.5-176179.8-179-177.6-0.7111.7P11 A61 K62 R63 H68 M69P11-R65 HydrophobicContact CG-CG 4.49Å; A61-R65 WeakPolarHBondContact O-CB 3.49Å; A61-R65 PolarHBondContact O-N 2.86Å; K62-R65 PolarHBondContact O-N 2.96Å; R63-R65 VanDerWaalsContact C-N 3.32Å; R63-R65 PolarHBondContact O-N 2.88Å; R65-H68 PolarHBondContact O-N 3Å; R65-M69 WeakPolarHBondContact O-CB 3.2Å; R65-M69 PolarHBondContact O-N 3.14Å
66A97.9Very high97.2Very high57 Ų5791.5 Ų91.547%0.47144%0.44SS..Hα-helixtrans-64.5-45.5177.900000111.4K62 R63 H68 M69 K70K62-A66 PolarHBondContact O-N 3.3Å; R63-A66 PolarHBondContact O-N 3.46Å; A66-H68 VanDerWaalsContact C-N 3.35Å; A66-H68 PolarHBondContact O-N 3.27Å; A66-M69 PolarHBondContact O-N 3.01Å; A66-K70 PolarHBondContact O-N 3.25Å
67Q98Very high97.1Very high74 Ų7493.3 Ų93.335%0.34644%0.438SS..Hα-helixtrans-57.7-48174.6179.2175.1-8.300111.1R63 M69 K70 E71R63-Q67 WeakPolarHBondContact O-CB 3.47Å; R63-Q67 PolarHBondContact O-N 3.42Å; Q67-M69 VanDerWaalsContact C-N 3.31Å; Q67-M69 PolarHBondContact O-N 3.48Å; Q67-K70 WeakPolarHBondContact O-CB 3.29Å; Q67-K70 PolarHBondContact O-N 2.99Å; Q67-K70 VanDerWaalsContact O-N 3.13Å; Q67-E71 HydrophobicContact CG-CG 4.34Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.45Å; Q67-E71 PolarHBondContact NE2-OE1 3.32Å; Q67-E71 WeakPolarHBondContact O-CG 3.45Å; Q67-E71 PolarHBondContact O-N 3Å
68H97.9Very high96.8Very high22 Ų2299 Ų9910%0.10246%0.459CS..Hα-helixtrans-61-39178.6-173.581.5000113I8 K9 P11 L64 R65 A66 K70 H72 Y75I8-H68 WeakPolarHBondContact CG2-CE1 3.46Å; K9-H68 PolarHBondContact O-CE1 3.22Å; P11-H68 HydrophobicContact CB-CB 3.97Å; P11-H68 HydrophobicContact CG-CB 4.22Å; L64-H68 WeakPolarHBondContact O-CB 3.48Å; L64-H68 PolarHBondContact O-N 3.46Å; R65-H68 PolarHBondContact O-N 3Å; A66-H68 VanDerWaalsContact C-N 3.35Å; A66-H68 PolarHBondContact O-N 3.27Å; H68-K70 VanDerWaalsContact C-N 3.32Å; H68-H72 AromaticContact CE1-CD2 3.53Å; H68-H72 AromaticContact ND1-CD2 3.58Å; H68-H72 WeakPolarHBondContact O-CB 3.23Å; H68-H72 PolarHBondContact O-N 3.11Å; H68-Y75 AromaticContact CD2-CD1 3.86Å; H68-Y75 AromaticContact NE2-CD1 3.46Å; H68-Y75 WeakPolarHBondContact NE2-CD1 3.32Å; H68-Y75 AromaticContact NE2-CD2 3.74Å; H68-Y75 AromaticContact NE2-CE1 3.69Å; H68-Y75 AromaticContact NE2-CE2 3.95Å; H68-Y75 AromaticContact NE2-CG 3.48Å; H68-Y75 AromaticContact NE2-CZ 3.92Å
69M97Very high96.6Very high130 Ų130101 Ų10164%0.6448%0.475SS*.Hα-helixtrans-70-30.6177.8-163.416370.600112.2R65 A66 Q67 H72 P73R65-M69 WeakPolarHBondContact O-CB 3.2Å; R65-M69 PolarHBondContact O-N 3.14Å; A66-M69 PolarHBondContact O-N 3.01Å; Q67-M69 VanDerWaalsContact C-N 3.31Å; Q67-M69 PolarHBondContact O-N 3.48Å; M69-H72 CarbonylContact O-C 3.35Å; M69-P73 WeakPolarHBondContact O-CA 3.37Å
70K97.3Very high96.2Very high184 Ų184107 Ų10780%0.849%0.492SS*.Hα-helixtrans-73.2-44.1173.2-175.5-176.6178.4-177.20112.1A66 Q67 H68 H72A66-K70 PolarHBondContact O-N 3.25Å; Q67-K70 WeakPolarHBondContact O-CB 3.29Å; Q67-K70 PolarHBondContact O-N 2.99Å; Q67-K70 VanDerWaalsContact O-N 3.13Å; H68-K70 VanDerWaalsContact C-N 3.32Å; K70-H72 VanDerWaalsContact C-N 3.34Å
71E96.9Very high95.8Very high109 Ų109115 Ų11551%0.50952%0.519SS..Hα-helixtrans-72.3-29.8180-71.4170.6-179.600112.4Q67Q67-E71 HydrophobicContact CG-CG 4.34Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.45Å; Q67-E71 PolarHBondContact NE2-OE1 3.32Å; Q67-E71 WeakPolarHBondContact O-CG 3.45Å; Q67-E71 PolarHBondContact O-N 3Å
72H95Very high95.3Very high65 Ų65122.3 Ų122.330%0.30155%0.548SS..  trans-132.275.9-178.7-53.7-66.8000110.9I8 H68 M69 K70 D74 Y75I8-H72 HydrophobicContact CD1-CB 4.2Å; H68-H72 AromaticContact CE1-CD2 3.53Å; H68-H72 AromaticContact ND1-CD2 3.58Å; H68-H72 WeakPolarHBondContact O-CB 3.23Å; H68-H72 PolarHBondContact O-N 3.11Å; M69-H72 CarbonylContact O-C 3.35Å; K70-H72 VanDerWaalsContact C-N 3.34Å; H72-D74 VanDerWaalsContact C-N 3.27Å; H72-D74 PolarHBondContact O-N 2.88Å; H72-Y75 VanDerWaalsContact O-CB 3.23Å; H72-Y75 WeakPolarHBondContact O-CB 3.42Å; H72-Y75 PolarHBondContact O-N 3.15Å; H72-Y75 VanDerWaalsContact O-N 3.11Å
73P94.9Very high94.8Very high100 Ų100121.7 Ų121.765%0.64956%0.557SS**THydrogen-bonded Turntrans-62.4-32.8-178.524.6-33.8000112.9M69 Y75M69-P73 WeakPolarHBondContact O-CA 3.37Å; P73-Y75 VanDerWaalsContact C-N 3.29Å; P73-Y75 PolarHBondContact O-N 3.31Å
74D94.6Very high94Very high155 Ų155125 Ų12583%0.82958%0.575SS**THydrogen-bonded Turntrans-86.24178.7-59.3-45.4000113.8H72 K76H72-D74 VanDerWaalsContact C-N 3.27Å; H72-D74 PolarHBondContact O-N 2.88Å; D74-K76 PolarHBondContact O-N 2.86Å; D74-K76 VanDerWaalsContact O-N 3.15Å
75Y95.8Very high93Very high66 Ų66130.3 Ų130.326%0.25960%0.603SS.*  trans-63.9119.8-178.5174.7-101.3000111.4I8 R10 H68 H72 P73I8-Y75 HydrophobicContact CB-CD2 3.88Å; I8-Y75 HydrophobicContact CB-CE2 4.17Å; I8-Y75 HydrophobicContact CD1-CD2 4.49Å; I8-Y75 HydrophobicContact CG2-CD2 3.46Å; I8-Y75 VanDerWaalsContact CG2-CD2 3.46Å; I8-Y75 HydrophobicContact CG2-CE2 3.83Å; I8-Y75 HydrophobicContact CG2-CG 4.3Å; R10-Y75 WeakPolarHBondContact CG-OH 2.91Å; H68-Y75 AromaticContact CD2-CD1 3.86Å; H68-Y75 AromaticContact NE2-CD1 3.46Å; H68-Y75 WeakPolarHBondContact NE2-CD1 3.32Å; H68-Y75 AromaticContact NE2-CD2 3.74Å; H68-Y75 AromaticContact NE2-CE1 3.69Å; H68-Y75 AromaticContact NE2-CE2 3.95Å; H68-Y75 AromaticContact NE2-CG 3.48Å; H68-Y75 AromaticContact NE2-CZ 3.92Å; H72-Y75 VanDerWaalsContact O-CB 3.23Å; H72-Y75 WeakPolarHBondContact O-CB 3.42Å; H72-Y75 PolarHBondContact O-N 3.15Å; H72-Y75 VanDerWaalsContact O-N 3.11Å; P73-Y75 VanDerWaalsContact C-N 3.29Å; P73-Y75 PolarHBondContact O-N 3.31Å
76K94.3Very high91.5Very high151 Ų151128.7 Ų128.766%0.65761%0.607SS**  trans-126.3125.5176-171.5169.7-175.7170.20111.4D74 R78D74-K76 PolarHBondContact O-N 2.86Å; D74-K76 VanDerWaalsContact O-N 3.15Å; K76-R78 PolarHBondContact O-N 3.43Å
77Y95.4Very high89.9Confident114 Ų114133.6 Ų133.645%0.44763%0.625SS.*  trans-69.4116.1175.6176.2-132.9000111.4R10 P79R10-Y77 VanDerWaalsContact NH1-CE2 3.34Å; R10-Y77 PolarHBondContact NH1-OH 3.03Å; R10-Y77 VanDerWaalsContact NH1-OH 3.15Å; R10-Y77 PolarHBondContact NH2-OH 3.49Å; Y77-P79 HydrophobicContact CD1-CG 4.32Å; Y77-P79 HydrophobicContact CE1-CB 4.43Å; Y77-P79 HydrophobicContact CE1-CG 3.63Å; Y77-P79 HydrophobicContact CE2-CB 4.18Å; Y77-P79 HydrophobicContact CE2-CG 4.03Å; Y77-P79 VanDerWaalsContact CZ-CG 3.47Å; Y77-P79 WeakPolarHBondContact OH-CB 3.46Å
78R92.9Very high88Confident199 Ų199139.8 Ų139.875%0.75165%0.65SS**  trans-121.992.1177-65.8179.6-179.7-121.15.2110.2K76 R80K76-R78 PolarHBondContact O-N 3.43Å; R78-R80 PolarHBondContact O-N 3Å
79P92.9Very high86.1Confident83 Ų83147.3 Ų147.354%0.53968%0.683SS.*  trans-58.8127.4175.4-3.34.8000111.2Y77 R81Y77-P79 HydrophobicContact CD1-CG 4.32Å; Y77-P79 HydrophobicContact CE1-CB 4.43Å; Y77-P79 HydrophobicContact CE1-CG 3.63Å; Y77-P79 HydrophobicContact CE2-CB 4.18Å; Y77-P79 HydrophobicContact CE2-CG 4.03Å; Y77-P79 VanDerWaalsContact CZ-CG 3.47Å; Y77-P79 WeakPolarHBondContact OH-CB 3.46Å; P79-R81 PolarHBondContact O-N 3.45Å
80R90.8Very high84.1Confident208 Ų208148.5 Ų148.579%0.78569%0.692SS**  trans-80.9114.7175.4-171.7171.5-172-86.52.1110.1R78R78-R80 PolarHBondContact O-N 3Å
81R89.9Confident82.2Confident232 Ų232150.6 Ų150.688%0.87570%0.695SS**PPolyproline II helixtrans-77.2128169.2-61.6-175.576.11611.5108.8P79P79-R81 PolarHBondContact O-N 3.45Å
82K87.8Confident80.1Confident167 Ų167156 Ų15673%0.72671%0.712SS**PPolyproline II helixtrans-86.8137.1167.4-67.4-174.8178.2-177.20108.3K84K82-K84 PolarHBondContact O-N 3.22Å
83P86.8Confident78.2Confident110 Ų110159.2 Ų159.271%0.71474%0.735SS**PPolyproline II helixtrans-60130.1172.625.1-31.9000108.9N85P83-N85 PolarHBondContact O-N 3.15Å
84K82.3Confident76.1Confident186 Ų186162.5 Ų162.581%0.80974%0.74SS**  trans-79.9112.2172-68.3-176.1178.6-178.50106.7K82 L86K82-K84 PolarHBondContact O-N 3.22Å; K84-L86 PolarHBondContact O-N 3.43Å
85N77.1Confident74.2Confident146 Ų146160.7 Ų160.778%0.78174%0.737SS**  trans-67.399.6170.4-76.3-60.9000108.5P83 L87P83-N85 PolarHBondContact O-N 3.15Å; N85-L87 PolarHBondContact O-N 3.35Å
86L66.8Low72Confident144 Ų144164.4 Ų164.475%0.75476%0.76SS**  trans-77-7.8177.7-75.1171.5000113.3K84 K88K84-L86 PolarHBondContact O-N 3.43Å; L86-K88 PolarHBondContact O-N 2.99Å
87L63.6Low70Confident161 Ų161163.3 Ų163.384%0.84377%0.768SS**THydrogen-bonded Turntrans-78.120.9-170.6-62.2174.9000116N85N85-L87 PolarHBondContact O-N 3.35Å
88K58.9Low67.7Low204 Ų204168.2 Ų168.289%0.88779%0.788SS**THydrogen-bonded Turntrans-128.421175.1-69.4-169.7178.7-1730113.6L86L86-K88 PolarHBondContact O-N 2.99Å
89K56.5Low65.6Low179 Ų179166.2 Ų166.278%0.77879%0.791SS**  trans-119.838-178.7-158.8154.3-179.7172.80114.1
90D55.4Low63Low155 Ų155165.1 Ų165.183%0.82980%0.795SS**SBendtrans-110.616.9167.9-72.9-23.7000113.4
91R58Low60.2Low229 Ų229163.7 Ų163.786%0.86480%0.797SS**SBendtrans-124.232.4178.4-80.1-83.8-77.9-169.7-4.4114
92Y51.8Low57.9Low223 Ų223158.1 Ų158.188%0.87579%0.789SS**  trans-138.472.1162.3-93.5-83.6000109.7
93V56.6Low55.3Low131 Ų131157.6 Ų157.679%0.79479%0.794SS**  trans-78.5111.8154.8179.20000105.6P95V93-P95 WeakPolarHBondContact O-CD 3.37Å
94F49.3Very low53.8Low170 Ų170157 Ų15775%0.74679%0.79SS**  trans-62119.3174-164.7-88.4000108.5L96F94-L96 HydrophobicContact CD1-CD1 4.11Å; F94-L96 HydrophobicContact CE1-CD1 4.46Å; F94-L96 PolarHBondContact O-N 3.05Å
95P55.2Low51.6Low117 Ų117156.3 Ų156.376%0.7679%0.794SS**  trans-72.2104176.5-13.829.2000109V93V93-P95 WeakPolarHBondContact O-CD 3.37Å
96L50.4Low49.8Very low144 Ų144158.9 Ų158.975%0.75480%0.799SS**  trans-78.2127.9165-125.493.8000107.8F94 Y98F94-L96 HydrophobicContact CD1-CD1 4.11Å; F94-L96 HydrophobicContact CE1-CD1 4.46Å; F94-L96 PolarHBondContact O-N 3.05Å; L96-Y98 PolarHBondContact O-N 3.34Å
97P51Low48.2Very low127 Ų127156.5 Ų156.583%0.82580%0.8SS**  trans-80.6108.7172.730.9-27.2000108.4
98Y47.9Very low46.8Very low217 Ų217154.1 Ų154.185%0.85180%0.803SS**  trans-98.7127.5168.7-176.7-99.8000109.3L96L96-Y98 PolarHBondContact O-N 3.34Å
99L48.2Very low45.6Very low158 Ų158148.2 Ų148.283%0.82780%0.8SS**  trans-82.2147.8174.9-91.7-170.5000112.1
100G38.2Very low44.6Very low60 Ų60147 Ų14762%0.61980%0.801SS**  trans96.3141.5159.300000114.1
101E33.3Very low44.3Very low178 Ų178145.1 Ų145.183%0.83280%0.798SS**  cis-172.5152.6-5.4-134.3-173.9144.700106.9
102T39.9Very low43.3Very low115 Ų115139.9 Ų139.971%0.70679%0.791SS**  trans52.8102.5154.762.60000122.9
103D34.3Very low42.5Very low155 Ų155132.5 Ų132.583%0.82978%0.782SS**  67.6162.4113.1-109.60.1000122.1
104P54.6Low41.5Very low98 Ų98130.2 Ų130.264%0.63678%0.778SS**  -116.3175.3-11035-17.4000113
105L35.8Very low41Very low171 Ų171127.8 Ų127.890%0.89578%0.777SS**  trans144.7143.4148.1-74.9165.1000112.2
106K39.3Very low40Very low201 Ų201128.9 Ų128.987%0.87478%0.776SS**  trans9682.6166.8-140.3168.5-169172.60114.9
107A33.6Very low39.3Very low93 Ų93125.7 Ų125.777%0.76977%0.766SS**  73.9123.869.800000115.1
108A35.7Very low38.8Very low111 Ų111127 Ų12792%0.91777%0.765SS**  trans86120.1152.400000120.1
109G31.8Very low38.5Very low80 Ų80124.6 Ų124.683%0.82577%0.766SS**  trans145.274.7151.600000117.4
110L37.2Very low37.8Very low153 Ų153122.3 Ų122.380%0.80176%0.763SS**  trans-71.1170.3159.8-81.5-178.4000110.9V112L110-V112 HydrophobicContact CD1-CG2 4.2Å; L110-V112 HydrophobicContact CD2-CG2 4.1Å
111P49.3Very low37.8Very low117 Ų117124.8 Ų124.876%0.7677%0.771SS**  cis-133.1150.737.924.51.2000115.7
112V36.5Very low38.4Very low119 Ų119121.1 Ų121.172%0.72176%0.763SS**  67.2120.270.2-175.70000114.6L110L110-V112 HydrophobicContact CD1-CG2 4.2Å; L110-V112 HydrophobicContact CD2-CG2 4.1Å
113G34.1Very low38.1Very low67 Ų67123.9 Ų123.969%0.69177%0.768SS**  trans16183.5166.200000107.5
114A35.7Very low38.2Very low84 Ų84126.5 Ų126.569%0.69477%0.772SS**  44108.865.500000110.4
115T39.9Very low37.5Very low118 Ų118126.7 Ų126.772%0.72478%0.781SS**  -172.3142.876.835.20000110.3
116D34.5Very low37.8Very low141 Ų141129.8 Ų129.875%0.75478%0.781SS**  trans55141.9133.9-69-63.2000121.3
117S35.5Very low38.1Very low77 Ų77123.8 Ų123.854%0.53877%0.769SS.*  cis-171140.1-5.1-1190000107.6
118L39.9Very low38.4Very low154 Ų154128.9 Ų128.981%0.80678%0.775SS**  trans50.6116.3132.8-53.3173.4000119.6
119L41.5Very low39.2Very low167 Ų167131.2 Ų131.287%0.87477%0.771SS**  -161.8118.3122.4-100.6147.4000111.7
120S34.4Very low40Very low109 Ų109133 Ų13376%0.76277%0.768SS**  trans68.2103.7149.6-63.30000121.5
121S36.6Very low40.6Very low112 Ų112131.9 Ų131.978%0.78377%0.77SS**  trans-78.5156.6135.4-151.30000107.6
122P46.7Very low40.2Very low101 Ų101132.7 Ų132.766%0.65677%0.773SS**  -153.1176.352.140.2-16.2000118.9
123E33Very low40.8Very low174 Ų174131.7 Ų131.781%0.81377%0.771SS**  trans7892.7148.7-74.2156.915800120.7
124K37.4Very low41.2Very low209 Ų209133.1 Ų133.191%0.90978%0.776SS**  -167.6110.998-130.3165.6-175162.70111.4
125A39.1Very low42.2Very low102 Ų102134 Ų13484%0.84378%0.775SS**  trans-65.3131.9160.500000109.9
126R42.8Very low41.8Very low236 Ų236138.5 Ų138.589%0.89178%0.78SS**  trans-144.2112.1143.1-158.1166.2-175136.9-0.6109.2
127A44.9Very low41.8Very low76 Ų76136.9 Ų136.963%0.62878%0.78SS**  trans-54.6143176.300000112.6
128F40Very low42.1Very low200 Ų200140.3 Ų140.388%0.87779%0.791SS**  trans-148.9106.5133.9-86.4-71.6000108.3
129L53.1Low42.2Very low159 Ų159140.4 Ų140.483%0.83279%0.792SS**  trans-71.1152.1168.7-65.8165.5000110.1
130P47Very low41.9Very low118 Ų118139.2 Ų139.277%0.76679%0.786SS**  trans-92.7145.7163.435.4-28.2000110.5
131P49.9Very low42.5Very low130 Ų130138.2 Ų138.284%0.84478%0.778SS**  trans-107.2119.716131.2-21000111.9
132T41.6Very low42.5Very low134 Ų134137.7 Ų137.782%0.82277%0.774SS**  trans-98.2148.6144-149.90000104.6
133S48.7Very low42.1Very low98 Ų98141.7 Ų141.769%0.68578%0.784SS**  cis-177.5142.628.345.20000110.3
134A42.8Very low42.1Very low96 Ų96143 Ų14379%0.79379%0.787SS**  trans48.3-177.2141.300000121
135P55.8Low42Very low104 Ų104137.5 Ų137.568%0.67578%0.775SS**  cis-145-179.5-9.337.4-14.3000118.3
136Y32.2Very low41.9Very low211 Ų211137.3 Ų137.383%0.82777%0.767SS**  trans70.7123.4152.4-69.1-66.2000126.3
137S35.8Very low41.5Very low108 Ų108132.4 Ų132.476%0.75577%0.769SS**  159.8112.6119.7-69.40000110.1
138L41.7Very low41.1Very low148 Ų148132.5 Ų132.578%0.77577%0.77SS**  79.4123.876.2-87.1173.1000116.1
139L41.3Very low41.2Very low157 Ų157130.8 Ų130.882%0.82277%0.768SS**  trans77.1141.4158.9-60.2151.7000116.3
140D34.2Very low40.5Very low141 Ų141130.8 Ų130.875%0.75476%0.764SS**  cis-167.6-158.7-2.7-161.817.1000107
141P49Very low39.9Very low89 Ų89134.6 Ų134.658%0.57877%0.769SS**  trans-117.7-172.3-135.536.9-11.8000112.8
142S34.7Very low39.1Very low100 Ų100135.9 Ų135.970%0.69977%0.765SS**  trans59.7104.3159.769.50000118.3
143Q39.5Very low38.7Very low185 Ų185135 Ų13586%0.86476%0.76SS**  trans176.2100.6131.3-99.6166.763.200110.4
144F33.3Very low37.7Very low203 Ų203138.4 Ų138.489%0.8977%0.765SS**  -148.298127.4-164.4-102.1000107.8
145S33.6Very low37.3Very low92 Ų92140 Ų14064%0.64376%0.764SS**  trans-85.1140172.3-65.20000110.1
146S37.6Very low37.2Very low98 Ų98139.3 Ų139.369%0.68576%0.76SS**  trans74.7112.1136.1-60.10000120.2
147S35.5Very low37.4Very low133 Ų133137 Ų13793%0.9376%0.757SS**  -135.899.3124.5-48.70000108.2
148A35.6Very low37.2Very low79 Ų79137.4 Ų137.465%0.65375%0.754SS**  trans-103.6133.7168.100000108.6
149I42.4Very low36.9Very low163 Ų163137.8 Ų137.884%0.83676%0.757SS**  trans-152.9101.6143.7-70.1-154.3000103.4
150Q37.5Very low36.6Very low160 Ų160134.7 Ų134.775%0.74875%0.753SS**  54.7111.565.1-96.4-175.9-9.400116.1
151K34.8Very low36.6Very low198 Ų198134.3 Ų134.386%0.86176%0.756SS**  trans174.296.8141-96.5171.8-175.9-172.20106.1
152M33.5Very low36.1Very low156 Ų156134.6 Ų134.677%0.76876%0.76SS**  33145.670.772.5175.2-77.900117.4
153T33.1Very low36.2Very low116 Ų116136 Ų13671%0.71277%0.765SS**  trans102.895.6175.5-430000113.1
154E28.4Very low36.6Very low170 Ų170135 Ų13579%0.79476%0.764SS**  95.29962.4-164.5-177.4178.400112.2
155V34.8Very low37.6Very low129 Ų129130.8 Ų130.878%0.78276%0.758SS**  trans39-178.5137-131.90000121.5
156P53.3Low37.5Very low90 Ų90136.6 Ų136.658%0.58477%0.767SS**  cis-123.8178.7-49.6167.3000113.8
157H35Very low37.3Very low163 Ų163135.9 Ų135.976%0.75577%0.767SS**  177.5111.2121.8-84-52.6000111.1
158T32.3Very low37.7Very low115 Ų115134.9 Ų134.971%0.70676%0.76SS**  75.3131.6114.864.80000114.6
159L35.9Very low37.9Very low157 Ų157137.4 Ų137.482%0.82277%0.768SS**  cis-153.8132.447.1-72.3160.8000110.8
160A35.7Very low38.1Very low91 Ų91138.4 Ų138.475%0.75277%0.774SS**  56.9123.7113.100000116.3
161T33Very low37.9Very low133 Ų133134.2 Ų134.282%0.81677%0.774SS**  -160139.678.7-57.80000111.9
162S38Very low38.3Very low95 Ų95136.3 Ų136.366%0.66478%0.778SS**  trans-35.2151.6170.451.70000116.8
163T37.2Very low38.4Very low131 Ų131138 Ų13880%0.80478%0.784SS**  -161.3133.862.942.40000113.6
164L48.5Very low38.7Very low162 Ų162140.3 Ų140.385%0.84879%0.792SS**  trans-88.8177161.7-83.9-179.9000109.6
165P53.4Low39Very low115 Ų115135.8 Ų135.875%0.74779%0.791SS**  cis-15015929.640.8-17.8000120.5
166Y32.6Very low39.3Very low214 Ų214134.3 Ų134.384%0.83979%0.792SS**  60.2121.5128.8-158.9-98.1000121.6
167A33.5Very low38.4Very low83 Ų83140.4 Ų140.469%0.68681%0.81SS**  176.9123.4110.300000111.4
168S43.3Very low38.5Very low112 Ų112136.1 Ų136.178%0.78381%0.809SS**  trans-94.6134.1160.6-65.30000108.8
169T40.5Very low38.7Very low133 Ų133136.1 Ų136.182%0.81681%0.814SS**  trans-144.1119.7156.155.90000110.8
170L46.1Very low39.2Very low184 Ų184137 Ų13796%0.96382%0.819SS**  trans-52.2133154.3-87.2149.1000109.6
171G32.8Very low39.1Very low72 Ų72137.8 Ų137.874%0.74282%0.819SS**  trans-158100.5173.700000111.3
172Y42.7Very low39.3Very low241 Ų241137.5 Ų137.595%0.94582%0.821SS**  trans-62.1126.4156.7-105.1-99.8000108.5
173Q36.4Very low39.5Very low192 Ų192138.9 Ų138.990%0.89783%0.828SS**  trans-158.3123.1148.3-119.6-172.946.500112.5
174N39.7Very low40Very low164 Ų164136.7 Ų136.788%0.87782%0.817SS**  trans-64.9148.2159.1-96-22000110.2
175G34.6Very low39.9Very low75 Ų75136.9 Ų136.977%0.77381%0.814SS**  trans132102.115100000116.7
176A40.9Very low40Very low98 Ų98139 Ų13981%0.8181%0.814SS**  trans-15.8130.8159.500000119.8
177F34.2Very low41Very low219 Ų219134.5 Ų134.596%0.96181%0.809SS**  -163.7150.6116.4-131.1-99.5000110.7
178G38.3Very low42.4Very low72 Ų72134.2 Ų134.274%0.74279%0.793SS**  trans-72.5153.3-154.400000118.7
179S34.6Very low43.6Very low116 Ų116133 Ų13381%0.81178%0.781SS**  trans-147.7126.5149.5177.40000109.2
180L47Very low44.7Very low176 Ų176131.9 Ų131.992%0.92177%0.766SS**  trans-60.6126-179.4-69138.3000111.7
181S33.6Very low45.6Very low107 Ų107127.4 Ų127.475%0.74875%0.748SS**  trans-156.2104.5155.844.60000112.1
182C36.5Very low46.5Very low127 Ų127125.4 Ų125.486%0.85872%0.722SS**  trans60148.9140-60.10000121.9
183P42.4Very low47.4Very low124 Ų124120.4 Ų120.481%0.80572%0.72SS**  trans-91137.7-154.335.1-32.1000114.3
184S48.4Very low48.7Very low84 Ų84117.2 Ų117.259%0.58771%0.713SS**  trans4386.1147.1-139.50000118.5H186S184-H186 PolarHBondContact OG-CD2 3.29Å; S184-H186 VanDerWaalsContact OG-CD2 3.27Å; S184-H186 PolarHBondContact OG-CE1 3.17Å; S184-H186 PolarHBondContact OG-NE2 3.34Å
185Q47.4Very low49.5Very low166 Ų166114 Ų11478%0.77670%0.697SS**  trans-91.5106.7146.3-66.5-164.66.400108T187Q185-T187 VanDerWaalsContact C-N 3.32Å; Q185-T187 PolarHBondContact O-N 3.04Å
186H53.8Low51Low161 Ų161116.3 Ų116.375%0.74570%0.697SS**  trans-73.588.5171.2-70.9-80.7000109.1S184 H188S184-H186 PolarHBondContact OG-CD2 3.29Å; S184-H186 VanDerWaalsContact OG-CD2 3.27Å; S184-H186 PolarHBondContact OG-CE1 3.17Å; S184-H186 PolarHBondContact OG-NE2 3.34Å; H186-H188 PolarHBondContact O-N 3.3Å
187T54Low52.3Low119 Ų119115.1 Ų115.173%0.7370%0.695SS**  trans-66.5119.3165.350.10000108.3Q185Q185-T187 VanDerWaalsContact C-N 3.32Å; Q185-T187 PolarHBondContact O-N 3.04Å
188H63.7Low53.9Low76 Ų76112.4 Ų112.435%0.35268%0.68SS.*EExtended strand (participates in β ladder)trans-119.9137.2174.569.9-99.1000110H186 H190 C202 C204H186-H188 PolarHBondContact O-N 3.3Å; H188-H190 AromaticContact CD2-CD2 3.42Å; H188-H190 PolarHBondContact CD2-CD2 2.05Å; H188-H190 VanDerWaalsContact CD2-CD2 3.42Å; H188-H190 AromaticContact CD2-CE1 3.9Å; H188-H190 AromaticContact CD2-NE2 2.98Å; H188-H190 PolarHBondContact CD2-NE2 3.05Å; H188-H190 AromaticContact NE2-CD2 3.68Å; H188-H190 AromaticContact NE2-NE2 3.11Å; H188-H190 PolarHBondContact NE2-NE2 3.26Å; H188-H190 VanDerWaalsContact NE2-NE2 3.11Å; H188-C202 PolarHBondContact CE1-SG 3.12Å; H188-C202 PolarHBondContact NE2-SG 3.17Å; H188-C202 PolarHBondContact O-N 3.07Å; H188-C204 VanDerWaalsContact CE1-SG 3.58Å
189T68.9Low55.7Low88 Ų88113.2 Ų113.254%0.5467%0.67SS.*EExtended strand (participates in β ladder)trans-108.2135.1-17727.90000109.7V199 P201T189-V199 HydrophobicContact CG2-CB 4.27Å; T189-V199 HydrophobicContact CG2-CG2 4.44Å; T189-P201 HydrophobicContact CG2-CB 4.37Å
190H63.4Low57.5Low109 Ų109111 Ų11151%0.50565%0.652SS.*EExtended strand (participates in β ladder)trans-117.1145173.6-68.3-74.8000110.2H188 V200H188-H190 AromaticContact CD2-CD2 3.42Å; H188-H190 PolarHBondContact CD2-CD2 2.05Å; H188-H190 VanDerWaalsContact CD2-CD2 3.42Å; H188-H190 AromaticContact CD2-CE1 3.9Å; H188-H190 AromaticContact CD2-NE2 2.98Å; H188-H190 PolarHBondContact CD2-NE2 3.05Å; H188-H190 AromaticContact NE2-CD2 3.68Å; H188-H190 AromaticContact NE2-NE2 3.11Å; H188-H190 PolarHBondContact NE2-NE2 3.26Å; H188-H190 VanDerWaalsContact NE2-NE2 3.11Å; H190-V200 PolarHBondContact N-O 3.22Å; H190-V200 PolarHBondContact O-N 3.2Å
191P64.6Low58.4Low89 Ų89107.1 Ų107.158%0.57864%0.637SS**EExtended strand (participates in β ladder)trans-68.7135.1172.127.1-31.3000110.3
192S52.3Low60.2Low30 Ų30103.8 Ų103.821%0.2161%0.613CS.*EExtended strand (participates in β ladder)trans-66.3133178.6-178.50000111.1T194 N195 Y198S192-T194 PolarHBondContact O-N 3Å; S192-T194 PolarHBondContact OG-OG1 3.3Å; S192-N195 CarbonylContact O-C 3.51Å; S192-N195 PolarHBondContact O-N 3.41Å; S192-N195 VanDerWaalsContact O-N 3.17Å; S192-Y198 PolarHBondContact N-O 3.21Å
193P60.8Low61.4Low136 Ų136104.4 Ų104.488%0.88361%0.608SS**THydrogen-bonded Turntrans-65.9-11.4-177.225.2-33.4000114
194T63.8Low62.3Low125 Ų125102 Ų10277%0.76759%0.593SS**THydrogen-bonded Turntrans-107.5-12179540000113.7S192S192-T194 PolarHBondContact O-N 3Å; S192-T194 PolarHBondContact OG-OG1 3.3Å
195N56.8Low62.6Low98 Ų98103.6 Ų103.652%0.52460%0.599SS.*EExtended strand (participates in β ladder)trans-155.5102.3-177.8-149.3-26.9000111.5S192 G197 Y198S192-N195 CarbonylContact O-C 3.51Å; S192-N195 PolarHBondContact O-N 3.41Å; S192-N195 VanDerWaalsContact O-N 3.17Å; N195-G197 PolarHBondContact O-N 3.42Å; N195-G197 VanDerWaalsContact O-N 3.07Å; N195-Y198 PolarHBondContact O-N 3.41Å
196P66.4Low62.7Low122 Ų12299.8 Ų99.879%0.79260%0.597SS**EExtended strand (participates in β ladder)trans-62.8-15.2-175.3-2232000115
197G67.6Low62.5Low74 Ų74104.4 Ų104.476%0.76361%0.608SS**EExtended strand (participates in β ladder)trans-88.2-3.4179.900000115.2N195N195-G197 PolarHBondContact O-N 3.42Å; N195-G197 VanDerWaalsContact O-N 3.07Å
198Y67.3Low62.1Low162 Ų162102.8 Ų102.864%0.63560%0.601SS**EExtended strand (participates in β ladder)trans-121.4117.2-177.2-162.2-98.5000110.9S192 N195 V200S192-Y198 PolarHBondContact N-O 3.21Å; N195-Y198 PolarHBondContact O-N 3.41Å; Y198-V200 HydrophobicContact CD1-CG2 3.77Å; Y198-V200 HydrophobicContact CE1-CG2 3.89Å
199V76.7Confident61.2Low89 Ų89103.4 Ų103.454%0.53962%0.619SS.*EExtended strand (participates in β ladder)trans-93.9129.1175-690000109.5T189T189-V199 HydrophobicContact CG2-CB 4.27Å; T189-V199 HydrophobicContact CG2-CG2 4.44Å
200V71.5Confident60.5Low70 Ų70104.6 Ų104.642%0.42463%0.631SS.*EExtended strand (participates in β ladder)trans-106.4125.3177.9-176.10000108.3H190 Y198 C202H190-V200 PolarHBondContact N-O 3.22Å; H190-V200 PolarHBondContact O-N 3.2Å; Y198-V200 HydrophobicContact CD1-CG2 3.77Å; Y198-V200 HydrophobicContact CE1-CG2 3.89Å; V200-C202 PolarHBondContact O-N 3.13Å
201P66.4Low59.8Low94 Ų94104.5 Ų104.561%0.6164%0.643SS**EExtended strand (participates in β ladder)trans-69.7124.3171.724.6-26.9000109.2T189T189-P201 HydrophobicContact CG2-CB 4.37Å
202C70.8Confident58.9Low36 Ų36107 Ų10724%0.24365%0.651CS.*EExtended strand (participates in β ladder)trans-84.5132.6165101.70000108.5H188 V200 C204H188-C202 PolarHBondContact CE1-SG 3.12Å; H188-C202 PolarHBondContact NE2-SG 3.17Å; H188-C202 PolarHBondContact O-N 3.07Å; V200-C202 PolarHBondContact O-N 3.13Å; C202-C204 VanDerWaalsContact C-N 3.27Å; C202-C204 WeakPolarHBondContact CB-SG 3.1Å; C202-C204 PolarHBondContact O-N 2.83Å; C202-C204 WeakPolarHBondContact SG-CB 3.25Å; C202-C204 PolarHBondContact SG-N 2.89Å; C202-C204 CovalentContact SG-SG 2.05Å; C202-C204 PolarHBondContact SG-SG 3.08Å
203N63.3Low58.7Low140 Ų140114.2 Ų114.275%0.74968%0.681SS**  trans-90.873.1163-168.824.9000108.1T205N203-T205 PolarHBondContact O-N 3.05Å
204C59.6Low58.2Low75 Ų75112.1 Ų112.151%0.50767%0.668SS.*  trans-84.995.9173.1-55.70000106.2H188 C202 A206H188-C204 VanDerWaalsContact CE1-SG 3.58Å; C202-C204 VanDerWaalsContact C-N 3.27Å; C202-C204 WeakPolarHBondContact CB-SG 3.1Å; C202-C204 PolarHBondContact O-N 2.83Å; C202-C204 WeakPolarHBondContact SG-CB 3.25Å; C202-C204 PolarHBondContact SG-N 2.89Å; C202-C204 CovalentContact SG-SG 2.05Å; C202-C204 PolarHBondContact SG-SG 3.08Å; C204-A206 PolarHBondContact O-N 2.81Å; C204-A206 VanDerWaalsContact O-N 3.12Å
205T54.7Low57.7Low116 Ų116112 Ų11271%0.71267%0.669SS**  trans-52.7122.2172.2-34.40000107.1N203 W207N203-T205 PolarHBondContact O-N 3.05Å; T205-W207 PolarHBondContact O-N 3.43Å
206A50.3Low57.6Low87 Ų87112.6 Ų112.672%0.71968%0.676SS**  trans-52.9116174.100000107.2C204 S208C204-A206 PolarHBondContact O-N 2.81Å; C204-A206 VanDerWaalsContact O-N 3.12Å; A206-S208 VanDerWaalsContact C-N 3.27Å; A206-S208 PolarHBondContact O-N 2.95Å
207W49.2Very low57Low258 Ų258111 Ų11198%0.97767%0.673SS**  trans-58.3102.4166-87.8-20.8000106.2T205 A209T205-W207 PolarHBondContact O-N 3.43Å; W207-A209 PolarHBondContact O-N 3.12Å; W207-A209 VanDerWaalsContact O-N 3.08Å
208S45.5Very low56.3Low84 Ų84117.2 Ų117.259%0.58768%0.675SS**  trans-58.7115.2166.9-101.50000106.4A206 S210A206-S208 VanDerWaalsContact C-N 3.27Å; A206-S208 PolarHBondContact O-N 2.95Å; S208-S210 PolarHBondContact O-N 3.11Å
209A46.5Very low56.1Low90 Ų90116 Ų11674%0.74468%0.678SS**G310 helixtrans-62.56.8170.500000113W207W207-A209 PolarHBondContact O-N 3.12Å; W207-A209 VanDerWaalsContact O-N 3.08Å
210S53.2Low55.1Low112 Ų112119.5 Ų119.578%0.78369%0.693SS**G310 helixtrans-86.8-4.6-177.2-44.60000114.6S208S208-S210 PolarHBondContact O-N 3.11Å
211S48.1Very low54Low108 Ų108124.8 Ų124.876%0.75571%0.71SS**G310 helixtrans-107.44.7179.162.90000115.1
212L46.4Very low53.2Low141 Ų141126.7 Ų126.774%0.73872%0.722SS**  trans-106.5106.1167.8-72.8164.8000107.9P214L212-P214 WeakPolarHBondContact O-CD 3.15Å
213Q47Very low52.4Low181 Ų181128.5 Ų128.585%0.84675%0.748SS**  trans-60.5112.6156.3-80.5-79-54.800106.7
214P52.1Low51.4Low93 Ų93130.8 Ų130.860%0.60476%0.756SS**  trans-65.1137.3169.428.3-31.4000107.6L212 V216L212-P214 WeakPolarHBondContact O-CD 3.15Å; P214-V216 PolarHBondContact O-N 3.33Å; P214-V216 VanDerWaalsContact O-N 3.13Å
215P52.2Low51.1Low123 Ų123133.7 Ų133.780%0.79977%0.771SS**  trans-58.9123.6163.225.8-31000106.9A217P215-A217 PolarHBondContact O-N 2.98Å
216V55Low51Low110 Ų110137.3 Ų137.367%0.66778%0.777SS**  trans-57.7100.7175.3178.90000107.4P214 Y218P214-V216 PolarHBondContact O-N 3.33Å; P214-V216 VanDerWaalsContact O-N 3.13Å; V216-Y218 HydrophobicContact CB-CD2 4.46Å; V216-Y218 HydrophobicContact CB-CE2 4.3Å; V216-Y218 HydrophobicContact CG1-CD2 3.77Å; V216-Y218 HydrophobicContact CG1-CE2 3.58Å; V216-Y218 PolarHBondContact O-N 3.3Å
217A53.5Low50.7Low88 Ų88139.2 Ų139.273%0.72778%0.781SS**  trans-73.396.4172.300000107.3P215 I219P215-A217 PolarHBondContact O-N 2.98Å; A217-I219 PolarHBondContact O-N 2.97Å; A217-I219 VanDerWaalsContact O-N 3.12Å
218Y53.5Low50.6Low204 Ų204130.2 Ų130.280%0.877%0.767SS**  trans-66.9108.3167-83.5-88.9000108.4V216 L220V216-Y218 HydrophobicContact CB-CD2 4.46Å; V216-Y218 HydrophobicContact CB-CE2 4.3Å; V216-Y218 HydrophobicContact CG1-CD2 3.77Å; V216-Y218 HydrophobicContact CG1-CE2 3.58Å; V216-Y218 PolarHBondContact O-N 3.3Å; Y218-L220 PolarHBondContact O-N 3.27Å; Y218-L220 VanDerWaalsContact O-N 3.17Å
219I62.4Low50.8Low137 Ų137134.6 Ų134.670%0.70378%0.782SS**  trans-73.7101.2166.4-61.7173.3000106.3A217 F221A217-I219 PolarHBondContact O-N 2.97Å; A217-I219 VanDerWaalsContact O-N 3.12Å; I219-F221 HydrophobicContact CG2-CD2 4.45Å; I219-F221 HydrophobicContact CG2-CE2 4.19Å; I219-F221 HydrophobicContact CG2-CZ 4.4Å; I219-F221 PolarHBondContact O-N 2.91Å
220L55.2Low50.8Low163 Ų163137.5 Ų137.585%0.85379%0.786SS**  trans-77.8104.6174.6-15179.7000108.3Y218Y218-L220 PolarHBondContact O-N 3.27Å; Y218-L220 VanDerWaalsContact O-N 3.17Å
221F50Low50.7Low180 Ų180138 Ų13879%0.78979%0.786SS**  trans-69.7133.6169.1-75.7-83.4000109.7I219 G223I219-F221 HydrophobicContact CG2-CD2 4.45Å; I219-F221 HydrophobicContact CG2-CE2 4.19Å; I219-F221 HydrophobicContact CG2-CZ 4.4Å; I219-F221 PolarHBondContact O-N 2.91Å; F221-G223 PolarHBondContact O-N 3.44Å
222P49.5Very low50.1Low134 Ų134143.4 Ų143.487%0.8779%0.791SS**SBendtrans-75.8121175.9-217.9000109.9
223G52.8Low50Low75 Ų75140.5 Ų140.577%0.77378%0.783SS**  trans125.84715900000118.5F221F221-G223 PolarHBondContact O-N 3.44Å
224M42.9Very low49.9Very low188 Ų188137.1 Ų137.193%0.92678%0.779SS**  trans-123.3102.6159.7-70.8-176.56900110.5
225T52.8Low49.5Very low135 Ų135136.6 Ų136.683%0.82878%0.782SS**  trans-71.9128.9164.546.20000109.5
226K52.5Low49.2Very low192 Ų192139.7 Ų139.784%0.83579%0.786SS**  trans-169.787.5154.4-108.2176.3179.9-177.80106.9
227T45.1Very low48.6Very low128 Ų128138.9 Ų138.979%0.78579%0.791SS**  50.7102.998.2640000114
228G45.9Very low48.1Very low68 Ų68141.6 Ų141.670%0.70180%0.799SS**  trans71.2108.4137.500000117.7
229I49.4Very low47.4Very low176 Ų176135.9 Ų135.990%0.90379%0.794SS**  -156.9111.6125.8-88.6137.7000105.8
230D46.4Very low46.4Very low152 Ų152142.1 Ų142.181%0.81382%0.823SS**  trans-71.6164.8175.7-86-40.3000112.2
231P52.4Low46Very low121 Ų121141.1 Ų141.179%0.78682%0.821SS**  trans-87.8135-160.133.9-31.4000112.7
232Y35.8Very low45.7Very low223 Ų223139.1 Ų139.188%0.87582%0.823SS**  trans-92.4106.5172.7-161.4-96.5000111.6
233S44Very low45.5Very low80 Ų80139.3 Ų139.356%0.55982%0.821SS**  trans50.3108.9131.3-143.90000121.2
234S44.6Very low45.1Very low110 Ų110143.1 Ų143.177%0.76982%0.823SS**  18.5120.1119.5155.60000118.5
235A43.9Very low45.3Very low81 Ų81140.3 Ų140.367%0.66982%0.817SS**  154.1124.9116.900000112.2
236H44.6Very low44.7Very low189 Ų189140.7 Ų140.788%0.87582%0.816SS**  trans16783.6141.7-93.9-72.3000106.2
237A43.3Very low44.2Very low93 Ų93137 Ų13777%0.76982%0.815SS**  77.696.889.400000112.9
238T43.4Very low44.1Very low145 Ų145137.7 Ų137.789%0.8982%0.817SS**  trans-69.3134153.6-56.20000109.5
239A38.4Very low44Very low84 Ų84143.5 Ų143.569%0.69483%0.827SS**  trans165.4133130.400000112.2
240M41.3Very low43.5Very low268 Ų268140.5 Ų140.5100%1.3282%0.82SS**  trans53.60143.1-59.9-164.9177.400120.6

Retrieved 240 of 240 residues in 103 ms (Link to these results)

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