X5MD71_CAEEL Loading...

Amino acid transporter transmembrane domain-containing protein

AlphaFold DB , UniProt , Accession X5MD71, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 388 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
1M79.4Confident80.7Confident46 Ų4687.5 Ų87.523%0.22744%0.435CS..  0-79.90-59.8-44.8176.700110.9L3 E4 S5 V76 F84 V93 F97M1-L3 PolarHBondContact O-N 2.89Å; M1-E4 PolarHBondContact O-N 3.3Å; M1-E4 VanDerWaalsContact O-N 3.1Å; M1-S5 PolarHBondContact O-N 3.41Å; M1-S5 PolarHBondContact O-OG 3.44Å; M1-V76 HydrophobicContact CG-CG1 4.5Å; M1-F84 HydrophobicContact CE-CE2 4.12Å; M1-F84 HydrophobicContact SD-CE2 3.79Å; M1-V93 HydrophobicContact CE-CB 3.81Å; M1-V93 HydrophobicContact CE-CG1 3.22Å; M1-V93 HydrophobicContact CE-CG2 3.27Å; M1-V93 HydrophobicContact SD-CG2 4.37Å; M1-F97 HydrophobicContact CE-CE1 4.4Å; M1-F97 HydrophobicContact CE-CE2 3.26Å; M1-F97 HydrophobicContact CE-CZ 3.2Å; M1-F97 HydrophobicContact CG-CZ 4.16Å; M1-F97 HydrophobicContact SD-CE1 4.15Å; M1-F97 HydrophobicContact SD-CE2 4.06Å; M1-F97 HydrophobicContact SD-CZ 3.36Å; M1-F97 WeakPolarHBondContact SD-CZ 3.49Å
2M83.3Confident80Confident119 Ų11983.5 Ų83.559%0.58643%0.433SS*.Hα-helixtrans-54.9-48.7-177.3-67.5-178.774.600113.2E4 S5 L6 F79M2-E4 PolarHBondContact O-N 3.46Å; M2-S5 WeakPolarHBondContact CA-OG 3.21Å; M2-S5 PolarHBondContact O-N 3.36Å; M2-S5 PolarHBondContact O-OG 3.47Å; M2-L6 WeakPolarHBondContact O-CG 3.46Å; M2-L6 PolarHBondContact O-N 3.36Å; M2-F79 HydrophobicContact CE-CD2 4.36Å; M2-F79 HydrophobicContact CE-CE2 3.84Å; M2-F79 HydrophobicContact CE-CZ 4.15Å; M2-F79 HydrophobicContact CG-CB 4.3Å; M2-F79 HydrophobicContact CG-CD2 3.56Å; M2-F79 HydrophobicContact CG-CE2 4.02Å; M2-F79 HydrophobicContact CG-CG 3.92Å; M2-F79 HydrophobicContact SD-CD2 4.29Å; M2-F79 HydrophobicContact SD-CE2 4.28Å
3L80.8Confident79.3Confident143 Ų14386.7 Ų86.775%0.74944%0.444SS*.Hα-helixtrans-62.2-39.4178.2-71.4170.6000113.3M1 L6 P7M1-L3 PolarHBondContact O-N 2.89Å; L3-L6 HydrophobicContact CD2-CD1 4.14Å; L3-L6 PolarHBondContact O-N 3.47Å; L3-P7 WeakPolarHBondContact O-CD 3.21Å
4E80.4Confident78.9Confident76 Ų7684.6 Ų84.636%0.35543%0.428SS..Hα-helixtrans-72.5-28.8177.6-66.6-60.5160.500112.5M1 M2 L6 P7 A83 F97M1-E4 PolarHBondContact O-N 3.3Å; M1-E4 VanDerWaalsContact O-N 3.1Å; M2-E4 PolarHBondContact O-N 3.46Å; E4-L6 VanDerWaalsContact C-N 3.33Å; E4-P7 WeakPolarHBondContact O-CD 3.36Å; E4-P7 WeakPolarHBondContact O-CG 3.49Å; E4-A83 HydrophobicContact CB-CB 4.32Å; E4-F97 HydrophobicContact CG-CD1 4.06Å; E4-F97 HydrophobicContact CG-CE1 3.74Å
5S80.1Confident78.4Confident0 Ų083.3 Ų83.30%043%0.43CS..Hα-helixtrans-75.9-19.517761.20000113.5M1 M2 T8 I9 F79M1-S5 PolarHBondContact O-N 3.41Å; M1-S5 PolarHBondContact O-OG 3.44Å; M2-S5 WeakPolarHBondContact CA-OG 3.21Å; M2-S5 PolarHBondContact O-N 3.36Å; M2-S5 PolarHBondContact O-OG 3.47Å; S5-T8 PolarHBondContact O-N 3.17Å; S5-I9 WeakPolarHBondContact O-CB 3.5Å; S5-I9 WeakPolarHBondContact O-CD1 3.49Å; S5-I9 WeakPolarHBondContact O-CG1 3.47Å; S5-I9 PolarHBondContact O-N 3.41Å; S5-F79 WeakPolarHBondContact OG-CD1 3.43Å
6L81.2Confident77.8Confident101 Ų10187.1 Ų87.153%0.52945%0.449SS..Hα-helixtrans-59-50.4-178-74.7172.9000114.6M2 L3 E4 T8 I9 Y10M2-L6 WeakPolarHBondContact O-CG 3.46Å; M2-L6 PolarHBondContact O-N 3.36Å; L3-L6 HydrophobicContact CD2-CD1 4.14Å; L3-L6 PolarHBondContact O-N 3.47Å; E4-L6 VanDerWaalsContact C-N 3.33Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.37Å; L6-I9 PolarHBondContact O-N 2.79Å; L6-Y10 WeakPolarHBondContact O-CB 3.45Å; L6-Y10 PolarHBondContact O-N 3.25Å
7P80.3Confident77.4Confident69 Ų6988.6 Ų88.645%0.44845%0.454SS..Hα-helixtrans-59.4-46.1177.321.6-33.2000111.2L3 E4 I9 Y10 D11L3-P7 WeakPolarHBondContact O-CD 3.21Å; E4-P7 WeakPolarHBondContact O-CD 3.36Å; E4-P7 WeakPolarHBondContact O-CG 3.49Å; P7-I9 VanDerWaalsContact C-N 3.32Å; P7-I9 PolarHBondContact O-N 3.36Å; P7-Y10 WeakPolarHBondContact O-CB 3.45Å; P7-Y10 PolarHBondContact O-N 3.24Å; P7-Y10 VanDerWaalsContact O-N 3.09Å; P7-D11 PolarHBondContact O-N 3.43Å
8T77.8Confident77.3Confident23 Ų2384.3 Ų84.314%0.14143%0.432CS..Hα-helixtrans-60.1-39.6177.8-50.50000113.2S5 L6 G12 W14 V82 Y85S5-T8 PolarHBondContact O-N 3.17Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.37Å; T8-G12 PolarHBondContact O-N 2.94Å; T8-W14 HydrophobicContact CG2-CB 3.86Å; T8-V82 HydrophobicContact CG2-CG1 4.27Å; T8-V82 WeakPolarHBondContact CG2-O 3.42Å; T8-Y85 HydrophobicContact CG2-CD1 3.65Å; T8-Y85 HydrophobicContact CG2-CE1 3.35Å
9I81.7Confident77.4Confident61 Ų6182.8 Ų82.831%0.31343%0.427SS..Hα-helixtrans-68.6-38.3176.5-71.7164.9000110.9S5 L6 P7 G12 F79 V82S5-I9 WeakPolarHBondContact O-CB 3.5Å; S5-I9 WeakPolarHBondContact O-CD1 3.49Å; S5-I9 WeakPolarHBondContact O-CG1 3.47Å; S5-I9 PolarHBondContact O-N 3.41Å; L6-I9 PolarHBondContact O-N 2.79Å; P7-I9 VanDerWaalsContact C-N 3.32Å; P7-I9 PolarHBondContact O-N 3.36Å; I9-G12 PolarHBondContact O-N 3.45Å; I9-F79 HydrophobicContact CD1-CD1 4.16Å; I9-F79 HydrophobicContact CD1-CE1 4.13Å; I9-V82 HydrophobicContact CD1-CG1 4.31Å; I9-V82 HydrophobicContact CG1-CG1 3.73Å
10Y82.9Confident77.5Confident208 Ų20887.9 Ų87.982%0.81644%0.44SS*.Hα-helixtrans-67.3-37.6179.1-175.1-96.9000112.3L6 P7 G12L6-Y10 WeakPolarHBondContact O-CB 3.45Å; L6-Y10 PolarHBondContact O-N 3.25Å; P7-Y10 WeakPolarHBondContact O-CB 3.45Å; P7-Y10 PolarHBondContact O-N 3.24Å; P7-Y10 VanDerWaalsContact O-N 3.09Å; Y10-G12 PolarHBondContact O-N 3.09Å
11D79.6Confident77.6Confident117 Ų11793.8 Ų93.863%0.62646%0.458SS*.Hα-helixtrans-70.9-18.8177.5-68-22.2000112.8P7 E13P7-D11 PolarHBondContact O-N 3.43Å; D11-E13 PolarHBondContact O-N 3.33Å
12G73Confident77.7Confident39 Ų3999.2 Ų99.240%0.40248%0.476SS..  trans73-12.5169.400000116.3T8 I9 Y10 W14T8-G12 PolarHBondContact O-N 2.94Å; I9-G12 PolarHBondContact O-N 3.45Å; Y10-G12 PolarHBondContact O-N 3.09Å; G12-W14 VanDerWaalsContact C-N 3.26Å; G12-W14 PolarHBondContact O-N 3.47Å
13E70.1Confident77.6Confident125 Ų12597.8 Ų97.858%0.58448%0.476SS*.THydrogen-bonded Turntrans-71.5-18-179.1-62-161149.400113.8D11 S15 I16 H17D11-E13 PolarHBondContact O-N 3.33Å; E13-S15 PolarHBondContact O-N 2.86Å; E13-I16 PolarHBondContact O-N 3.49Å; E13-H17 PolarHBondContact O-CD2 3.17Å
14W74.1Confident77.4Confident58 Ų5898.5 Ų98.522%0.2248%0.475CS..Hα-helixtrans-57.6-34.1-178.468.1-86.3000113.5T8 G12 I16 H17 V18 W20 V82 Y85T8-W14 HydrophobicContact CG2-CB 3.86Å; G12-W14 VanDerWaalsContact C-N 3.26Å; G12-W14 PolarHBondContact O-N 3.47Å; W14-I16 PolarHBondContact O-N 3.37Å; W14-I16 VanDerWaalsContact O-N 3.17Å; W14-H17 PolarHBondContact O-N 3.44Å; W14-V18 HydrophobicContact CE3-CG2 4.06Å; W14-V18 WeakPolarHBondContact O-CB 3.42Å; W14-V18 WeakPolarHBondContact O-CG2 3.39Å; W14-V18 PolarHBondContact O-N 2.98Å; W14-V18 VanDerWaalsContact O-N 3.09Å; W14-W20 HydrophobicContact CZ3-CH2 4.29Å; W14-W20 HydrophobicContact CZ3-CZ2 4.17Å; W14-V82 HydrophobicContact CB-CG1 4.16Å; W14-V82 HydrophobicContact CD2-CG1 3.93Å; W14-V82 HydrophobicContact CD2-CG2 4.47Å; W14-V82 HydrophobicContact CE3-CG1 4.02Å; W14-V82 HydrophobicContact CE3-CG2 3.76Å; W14-V82 HydrophobicContact CG-CG1 4.01Å; W14-V82 HydrophobicContact CZ3-CG2 3.9Å; W14-Y85 HydrophobicContact CB-CD1 4.44Å; W14-Y85 HydrophobicContact CB-CE1 4.5Å
15S71.1Confident77.4Confident65 Ų6596.6 Ų96.646%0.45548%0.476SS..Hα-helixtrans-64.7-22.7-175.5-179.20000113.6E13E13-S15 PolarHBondContact O-N 2.86Å
16I69.6Low77.8Confident144 Ų144102.6 Ų102.674%0.73850%0.502SS*.Hα-helixtrans-88.7-30.4-176.7-59.9167.5000110.7E13 W14E13-I16 PolarHBondContact O-N 3.49Å; W14-I16 PolarHBondContact O-N 3.37Å; W14-I16 VanDerWaalsContact O-N 3.17Å
17H71.2Confident78Confident113 Ų113100.9 Ų100.952%0.52349%0.493SS..Hα-helixtrans-94.3-18.7-176.5-66.7-69000114.1E13 W14 V19 Y85E13-H17 PolarHBondContact O-CD2 3.17Å; W14-H17 PolarHBondContact O-N 3.44Å; H17-V19 PolarHBondContact O-N 3.34Å; H17-Y85 HydrophobicContact CB-CD2 3.46Å; H17-Y85 VanDerWaalsContact CB-CD2 3.46Å; H17-Y85 HydrophobicContact CB-CE2 3.73Å; H17-Y85 AromaticContact CD2-CE2 3.8Å; H17-Y85 AromaticContact CG-CE2 3.92Å
18V75.6Confident78.3Confident10 Ų1099 Ų996%0.06148%0.48CS..  trans-69.8117.5175.9161.90000110W14 W20 Y81W14-V18 HydrophobicContact CE3-CG2 4.06Å; W14-V18 WeakPolarHBondContact O-CB 3.42Å; W14-V18 WeakPolarHBondContact O-CG2 3.39Å; W14-V18 PolarHBondContact O-N 2.98Å; W14-V18 VanDerWaalsContact O-N 3.09Å; V18-W20 HydrophobicContact CG1-CD2 4.04Å; V18-W20 HydrophobicContact CG1-CE3 4.49Å; V18-W20 HydrophobicContact CG1-CG 4.46Å; V18-W20 HydrophobicContact CG1-CH2 4.43Å; V18-W20 HydrophobicContact CG1-CZ2 3.97Å; V18-W20 PolarHBondContact O-N 2.96Å; V18-Y81 HydrophobicContact CB-CE1 4.2Å; V18-Y81 HydrophobicContact CG1-CD1 4.03Å; V18-Y81 HydrophobicContact CG1-CE1 3.6Å; V18-Y81 HydrophobicContact CG2-CD1 4.32Å; V18-Y81 HydrophobicContact CG2-CE1 4.13Å
19V79.2Confident78.8Confident56 Ų56101 Ų10134%0.33949%0.494SS..  trans-87.9104.3174.5-173.20000109.6H17 W21 R22 Y81H17-V19 PolarHBondContact O-N 3.34Å; V19-W21 VanDerWaalsContact C-N 3.3Å; V19-W21 PolarHBondContact O-N 3.19Å; V19-R22 HydrophobicContact CB-CG 4.19Å; V19-R22 HydrophobicContact CG1-CG 3.48Å; V19-R22 VanDerWaalsContact CG1-CG 3.48Å; V19-Y81 PolarHBondContact N-OH 2.74Å
20W77.9Confident79.2Confident184 Ų18499.9 Ų99.970%0.69749%0.489SS*.SBendtrans-67-26.3-176.3-6594.4000114.6W14 V18W14-W20 HydrophobicContact CZ3-CH2 4.29Å; W14-W20 HydrophobicContact CZ3-CZ2 4.17Å; V18-W20 HydrophobicContact CG1-CD2 4.04Å; V18-W20 HydrophobicContact CG1-CE3 4.49Å; V18-W20 HydrophobicContact CG1-CG 4.46Å; V18-W20 HydrophobicContact CG1-CH2 4.43Å; V18-W20 HydrophobicContact CG1-CZ2 3.97Å; V18-W20 PolarHBondContact O-N 2.96Å
21W81.4Confident79.5Confident212 Ų21290 Ų9080%0.80345%0.45SS*.  trans-138.7110.8-176.9-170.8-100.6000111.5V19V19-W21 VanDerWaalsContact C-N 3.3Å; V19-W21 PolarHBondContact O-N 3.19Å
22R80.9Confident80Confident160 Ų16086.6 Ų86.660%0.60443%0.432SS*.  trans-131115.2166.5-65-163.9-177.6-164.43.3108.8V19 Q24V19-R22 HydrophobicContact CB-CG 4.19Å; V19-R22 HydrophobicContact CG1-CG 3.48Å; V19-R22 VanDerWaalsContact CG1-CG 3.48Å; R22-Q24 PolarHBondContact O-N 3.34Å
23P79.9Confident80.9Confident90 Ų9089.1 Ų89.158%0.58444%0.439SS*.  trans-75.7-15.217730.5-34.3000112.5G25 F26P23-G25 PolarHBondContact O-N 3.25Å; P23-F26 WeakPolarHBondContact O-CB 3.36Å; P23-F26 PolarHBondContact O-N 3.48Å
24Q77.8Confident81.8Confident158 Ų15885.3 Ų85.374%0.73843%0.426SS*.THydrogen-bonded Turntrans-62.5126.9175.8-67.5164.8-15.100109.6R22 F26R22-Q24 PolarHBondContact O-N 3.34Å; Q24-F26 VanDerWaalsContact C-N 3.34Å
25G80.8Confident82.4Confident36 Ų3685.6 Ų85.637%0.37143%0.43SS..THydrogen-bonded Turntrans82.51.2-178.600000115.3P23 L27 T28 C29P23-G25 PolarHBondContact O-N 3.25Å; G25-L27 VanDerWaalsContact C-N 3.26Å; G25-L27 PolarHBondContact O-N 3.29Å; G25-T28 WeakPolarHBondContact CA-OG1 3.14Å; G25-T28 PolarHBondContact O-N 3.17Å; G25-T28 PolarHBondContact O-OG1 3.32Å; G25-C29 PolarHBondContact O-N 2.85Å; G25-C29 PolarHBondContact O-SG 3.36Å; G25-C29 VanDerWaalsContact O-SG 3.36Å
26F87.1Confident83.3Confident125 Ų12584.5 Ų84.555%0.54843%0.425SS..Hα-helixtrans-55.4-42.3177.8177.8-101.7000112.6P23 Q24 T28 C29 L30P23-F26 WeakPolarHBondContact O-CB 3.36Å; P23-F26 PolarHBondContact O-N 3.48Å; Q24-F26 VanDerWaalsContact C-N 3.34Å; F26-T28 VanDerWaalsContact C-N 3.29Å; F26-T28 PolarHBondContact O-N 3.38Å; F26-C29 PolarHBondContact O-N 3.09Å; F26-L30 HydrophobicContact CD1-CD1 4.46Å; F26-L30 HydrophobicContact CE1-CD1 3.53Å; F26-L30 HydrophobicContact CE2-CD1 4.43Å; F26-L30 HydrophobicContact CZ-CD1 3.52Å; F26-L30 VanDerWaalsContact O-CB 3.25Å; F26-L30 WeakPolarHBondContact O-CB 3.28Å; F26-L30 PolarHBondContact O-N 3.38Å
27L86.8Confident84.2Confident65 Ų6580.1 Ų80.134%0.3440%0.402SS..Hα-helixtrans-72.5-16.7179.2-67.7175.8000114G25 P31 A237 S238 A241G25-L27 VanDerWaalsContact C-N 3.26Å; G25-L27 PolarHBondContact O-N 3.29Å; L27-P31 WeakPolarHBondContact O-CD 3.38Å; L27-A237 HydrophobicContact CD2-CB 4.49Å; L27-S238 WeakPolarHBondContact O-CB 3.45Å; L27-A241 HydrophobicContact CB-CB 3.78Å
28T86Confident85Confident30 Ų3076.5 Ų76.518%0.18439%0.389CS..Hα-helixtrans-88.9-33.4173.156.20000111.3G25 F26 P31 A241 I242G25-T28 WeakPolarHBondContact CA-OG1 3.14Å; G25-T28 PolarHBondContact O-N 3.17Å; G25-T28 PolarHBondContact O-OG1 3.32Å; F26-T28 VanDerWaalsContact C-N 3.29Å; F26-T28 PolarHBondContact O-N 3.38Å; T28-P31 WeakPolarHBondContact O-CD 3.46Å; T28-P31 VanDerWaalsContact O-CG 3.28Å; T28-P31 WeakPolarHBondContact O-CG 3.47Å; T28-A241 HydrophobicContact CG2-CB 4.03Å; T28-I242 HydrophobicContact CG2-CG1 4.18Å
29C88.4Confident85.5Confident64 Ų6478.5 Ų78.543%0.43240%0.403SS..Hα-helixtrans-78.5-36.9177-58.20000113.5G25 F26 I32 V33G25-C29 PolarHBondContact O-N 2.85Å; G25-C29 PolarHBondContact O-SG 3.36Å; G25-C29 VanDerWaalsContact O-SG 3.36Å; F26-C29 PolarHBondContact O-N 3.09Å; C29-I32 WeakPolarHBondContact O-CB 3.33Å; C29-I32 PolarHBondContact O-N 3.36Å; C29-I32 VanDerWaalsContact O-N 3.07Å; C29-V33 PolarHBondContact O-N 3.38Å
30L89.4Confident85.8Confident39 Ų3979 Ų7920%0.20440%0.401CS..Hα-helixtrans-50.9-49.7-179-175.5141.8000113.9F26 I32 V33 C34 I234F26-L30 HydrophobicContact CD1-CD1 4.46Å; F26-L30 HydrophobicContact CE1-CD1 3.53Å; F26-L30 HydrophobicContact CE2-CD1 4.43Å; F26-L30 HydrophobicContact CZ-CD1 3.52Å; F26-L30 VanDerWaalsContact O-CB 3.25Å; F26-L30 WeakPolarHBondContact O-CB 3.28Å; F26-L30 PolarHBondContact O-N 3.38Å; L30-I32 VanDerWaalsContact C-N 3.32Å; L30-I32 PolarHBondContact O-N 2.99Å; L30-V33 PolarHBondContact O-N 3.3Å; L30-C34 WeakPolarHBondContact O-CB 3.27Å; L30-C34 PolarHBondContact O-N 3.49Å; L30-C34 PolarHBondContact O-SG 3.41Å; L30-I234 HydrophobicContact CD2-CB 4.28Å; L30-I234 HydrophobicContact CD2-CD1 4.02Å; L30-I234 HydrophobicContact CD2-CG1 3.84Å; L30-I234 HydrophobicContact CD2-CG2 3.47Å; L30-I234 VanDerWaalsContact CD2-CG2 3.47Å
31P89.9Confident86.1Confident0 Ų074.5 Ų74.50%040%0.395CS..Hα-helixtrans-63.9-33.8177.626.1-37.9000113.4L27 T28 C34 M35 G180 A181 I242L27-P31 WeakPolarHBondContact O-CD 3.38Å; T28-P31 WeakPolarHBondContact O-CD 3.46Å; T28-P31 VanDerWaalsContact O-CG 3.28Å; T28-P31 WeakPolarHBondContact O-CG 3.47Å; P31-C34 PolarHBondContact O-N 3.44Å; P31-M35 WeakPolarHBondContact O-CB 3.4Å; P31-M35 PolarHBondContact O-N 3.4Å; P31-G180 WeakPolarHBondContact O-CA 3.48Å; P31-A181 HydrophobicContact CB-CB 3.92Å; P31-A181 VanDerWaalsContact CB-N 3.34Å; P31-I242 HydrophobicContact CG-CD1 3.93Å
32I90.6Very high86.4Confident46 Ų4669.3 Ų69.324%0.23638%0.379CS..Hα-helixtrans-65.6-45.8177.6-58.7174.1000109.7C29 L30 M35 A36 E173 L176C29-I32 WeakPolarHBondContact O-CB 3.33Å; C29-I32 PolarHBondContact O-N 3.36Å; C29-I32 VanDerWaalsContact O-N 3.07Å; L30-I32 VanDerWaalsContact C-N 3.32Å; L30-I32 PolarHBondContact O-N 2.99Å; I32-M35 WeakPolarHBondContact O-CB 3.44Å; I32-M35 PolarHBondContact O-N 3.48Å; I32-A36 WeakPolarHBondContact O-CB 3.5Å; I32-A36 PolarHBondContact O-N 2.91Å; I32-E173 HydrophobicContact CD1-CG 4Å; I32-L176 HydrophobicContact CG1-CB 4.37Å; I32-L176 HydrophobicContact CG2-CB 4.48Å
33V90.7Very high86.7Confident91 Ų9164.8 Ų64.855%0.55237%0.367SS*.Hα-helixtrans-63.4-45.8175.8175.90000110.5C29 L30 M35 A36 M37C29-V33 PolarHBondContact O-N 3.38Å; L30-V33 PolarHBondContact O-N 3.3Å; V33-M35 VanDerWaalsContact C-N 3.28Å; V33-M35 PolarHBondContact O-N 3.07Å; V33-A36 PolarHBondContact O-N 3.4Å; V33-M37 HydrophobicContact CG1-CG 4.49Å; V33-M37 VanDerWaalsContact O-CG 3.3Å; V33-M37 WeakPolarHBondContact O-CG 3.48Å; V33-M37 PolarHBondContact O-N 2.97Å; V33-M37 VanDerWaalsContact O-N 3.08Å
34C88.4Confident87Confident46 Ų4668 Ų6831%0.31137%0.372SS..Hα-helixtrans-56.1-45.2175.5-71.50000111.2L30 P31 M37 C38L30-C34 WeakPolarHBondContact O-CB 3.27Å; L30-C34 PolarHBondContact O-N 3.49Å; L30-C34 PolarHBondContact O-SG 3.41Å; P31-C34 PolarHBondContact O-N 3.44Å; C34-M37 PolarHBondContact O-N 3.42Å; C34-C38 PolarHBondContact O-N 3.06Å; C34-C38 PolarHBondContact O-SG 3.09Å
35M87.9Confident87.4Confident63 Ų6364.1 Ų64.131%0.3136%0.361SS..Hα-helixtrans-62.7-45177.3-171.9175.7169.900112.8P31 I32 V33 M37 C38 L176 T179P31-M35 WeakPolarHBondContact O-CB 3.4Å; P31-M35 PolarHBondContact O-N 3.4Å; I32-M35 WeakPolarHBondContact O-CB 3.44Å; I32-M35 PolarHBondContact O-N 3.48Å; V33-M35 VanDerWaalsContact C-N 3.28Å; V33-M35 PolarHBondContact O-N 3.07Å; M35-M37 PolarHBondContact O-N 3.27Å; M35-C38 VanDerWaalsContact O-CB 3.27Å; M35-C38 WeakPolarHBondContact O-CB 3.25Å; M35-C38 PolarHBondContact O-N 3.04Å; M35-L176 HydrophobicContact CE-CD2 4.36Å; M35-L176 HydrophobicContact SD-CD2 4.38Å; M35-T179 HydrophobicContact CE-CG2 3.47Å; M35-T179 VanDerWaalsContact CE-CG2 3.47Å; M35-T179 HydrophobicContact SD-CG2 3.77Å
36A90.5Very high87.7Confident42 Ų4265.4 Ų65.435%0.34736%0.361SS..Hα-helixtrans-61.3-32179.300000112I32 V33 C38 Y73I32-A36 WeakPolarHBondContact O-CB 3.5Å; I32-A36 PolarHBondContact O-N 2.91Å; V33-A36 PolarHBondContact O-N 3.4Å; A36-C38 VanDerWaalsContact C-N 3.35Å; A36-Y73 HydrophobicContact CB-CD2 4.3Å; A36-Y73 HydrophobicContact CB-CE2 3.76Å
37M88.7Confident87.7Confident52 Ų5262.3 Ų62.326%0.25635%0.35SS..THydrogen-bonded Turntrans-86.2-2.9176.6-58.4-54.7-63.200113.4V33 C34 M35 C39 I66 A70 Y73V33-M37 HydrophobicContact CG1-CG 4.49Å; V33-M37 VanDerWaalsContact O-CG 3.3Å; V33-M37 WeakPolarHBondContact O-CG 3.48Å; V33-M37 PolarHBondContact O-N 2.97Å; V33-M37 VanDerWaalsContact O-N 3.08Å; C34-M37 PolarHBondContact O-N 3.42Å; M35-M37 PolarHBondContact O-N 3.27Å; M37-C39 PolarHBondContact O-N 3.39Å; M37-I66 HydrophobicContact CE-CB 4.47Å; M37-I66 HydrophobicContact CE-CG2 3.44Å; M37-I66 VanDerWaalsContact CE-CG2 3.44Å; M37-A70 HydrophobicContact CE-CB 3.81Å; M37-A70 HydrophobicContact SD-CB 4.36Å; M37-Y73 HydrophobicContact SD-CD2 3.97Å; M37-Y73 HydrophobicContact SD-CE2 4.19Å
38C86.4Confident87.8Confident38 Ų3864.3 Ų64.326%0.25737%0.369SS..  trans-76.3109.4178.8-750000111.9C34 M35 A36C34-C38 PolarHBondContact O-N 3.06Å; C34-C38 PolarHBondContact O-SG 3.09Å; M35-C38 VanDerWaalsContact O-CB 3.27Å; M35-C38 WeakPolarHBondContact O-CB 3.25Å; M35-C38 PolarHBondContact O-N 3.04Å; A36-C38 VanDerWaalsContact C-N 3.35Å
39C86.3Confident87.9Confident52 Ų5268.2 Ų68.235%0.35140%0.396SS..  trans-121.89.5172.554.20000113M37 T41 Q42 L43M37-C39 PolarHBondContact O-N 3.39Å; C39-T41 VanDerWaalsContact C-N 3.27Å; C39-T41 PolarHBondContact O-N 2.95Å; C39-Q42 PolarHBondContact O-N 2.86Å; C39-Q42 VanDerWaalsContact O-N 3.16Å; C39-Q42 PolarHBondContact O-OE1 3.34Å; C39-L43 PolarHBondContact O-N 3.3Å
40Q86.8Confident87.9Confident65 Ų6566.9 Ų66.930%0.30439%0.385SS..G310 helixtrans-65.3-31.4-168.9-53.183.9-8.500112.2Q42 L43 V187Q40-Q42 VanDerWaalsContact C-N 3.28Å; Q40-Q42 PolarHBondContact O-N 3.47Å; Q40-L43 VanDerWaalsContact O-CB 3.31Å; Q40-L43 WeakPolarHBondContact O-CB 3.44Å; Q40-L43 PolarHBondContact O-N 3.36Å; Q40-V187 HydrophobicContact CB-CG1 3.97Å
41T84.4Confident87.6Confident90 Ų9073.5 Ų73.555%0.55241%0.412SS*.G310 helixtrans-72.5-22.7-179.3570000112.6C39 V187C39-T41 VanDerWaalsContact C-N 3.27Å; C39-T41 PolarHBondContact O-N 2.95Å; T41-V187 HydrophobicContact CG2-CG1 4.1Å
42Q86.9Confident87.3Confident104 Ų10478.7 Ų78.749%0.48644%0.44SS..G310 helixtrans-90.6-5.7176.3-66.374.824.900113.2C39 Q40 F44 P45 V46C39-Q42 PolarHBondContact O-N 2.86Å; C39-Q42 VanDerWaalsContact O-N 3.16Å; C39-Q42 PolarHBondContact O-OE1 3.34Å; Q40-Q42 VanDerWaalsContact C-N 3.28Å; Q40-Q42 PolarHBondContact O-N 3.47Å; Q42-F44 PolarHBondContact O-N 3.41Å; Q42-P45 VanDerWaalsContact O-CD 3.29Å; Q42-P45 WeakPolarHBondContact O-CD 3.19Å; Q42-V46 VanDerWaalsContact O-CG2 3.29Å; Q42-V46 WeakPolarHBondContact O-CG2 3.38Å; Q42-V46 PolarHBondContact O-N 3.05Å
43L87.7Confident86.9Confident64 Ų6479.1 Ų79.134%0.33545%0.45SS..Hα-helixtrans-60.1-44.4-174.7-175.359.7000112.3C39 Q40 V46 L47 V58 V62C39-L43 PolarHBondContact O-N 3.3Å; Q40-L43 VanDerWaalsContact O-CB 3.31Å; Q40-L43 WeakPolarHBondContact O-CB 3.44Å; Q40-L43 PolarHBondContact O-N 3.36Å; L43-V46 PolarHBondContact O-N 3.38Å; L43-L47 HydrophobicContact CD1-CD1 3.46Å; L43-L47 VanDerWaalsContact CD1-CD1 3.46Å; L43-L47 HydrophobicContact CG-CD1 3.7Å; L43-L47 VanDerWaalsContact O-CD1 3.23Å; L43-L47 WeakPolarHBondContact O-CD1 3.48Å; L43-L47 PolarHBondContact O-N 3.39Å; L43-V58 HydrophobicContact CD1-CG1 4.33Å; L43-V62 HydrophobicContact CD1-CG2 3.8Å
44F86Confident86.8Confident157 Ų15778 Ų7869%0.68944%0.444SS*.Hα-helixtrans-63.6-46.8-177.5-63.8-75.2000114.3Q42 V46 L47 S48Q42-F44 PolarHBondContact O-N 3.41Å; F44-V46 VanDerWaalsContact C-N 3.31Å; F44-V46 PolarHBondContact O-N 3.23Å; F44-L47 PolarHBondContact O-N 2.92Å; F44-S48 PolarHBondContact O-N 3.33Å; F44-S48 PolarHBondContact O-OG 3.26Å; F44-S48 VanDerWaalsContact O-OG 3.13Å
45P85.4Confident86.7Confident78 Ų7881.5 Ų81.551%0.50646%0.463SS..Hα-helixtrans-55.8-43.8169.4-27.232.1000113.1Q42 L47 S48 C49Q42-P45 VanDerWaalsContact O-CD 3.29Å; Q42-P45 WeakPolarHBondContact O-CD 3.19Å; P45-L47 PolarHBondContact O-N 3.37Å; P45-S48 WeakPolarHBondContact O-CB 3.43Å; P45-S48 PolarHBondContact O-N 2.85Å; P45-S48 VanDerWaalsContact O-N 3.15Å; P45-C49 PolarHBondContact O-N 3.47Å; P45-C49 PolarHBondContact O-SG 2.94Å
46V87.6Confident86.7Confident63 Ų6384.8 Ų84.838%0.38248%0.482SS..Hα-helixtrans-64.8-41-178.7172.70000111.6Q42 L43 F44 S48 C49 I50Q42-V46 VanDerWaalsContact O-CG2 3.29Å; Q42-V46 WeakPolarHBondContact O-CG2 3.38Å; Q42-V46 PolarHBondContact O-N 3.05Å; L43-V46 PolarHBondContact O-N 3.38Å; F44-V46 VanDerWaalsContact C-N 3.31Å; F44-V46 PolarHBondContact O-N 3.23Å; V46-S48 PolarHBondContact O-N 3.45Å; V46-C49 WeakPolarHBondContact O-CB 3.32Å; V46-C49 PolarHBondContact O-N 3.11Å; V46-I50 HydrophobicContact CG1-CD1 4.18Å; V46-I50 PolarHBondContact O-N 3.12Å
47L88.3Confident86.6Confident60 Ų6089.1 Ų89.131%0.31449%0.49SS..Hα-helixtrans-56.4-36.9174.5-101.371000112.2L43 F44 P45 C49 I50 V58L43-L47 HydrophobicContact CD1-CD1 3.46Å; L43-L47 VanDerWaalsContact CD1-CD1 3.46Å; L43-L47 HydrophobicContact CG-CD1 3.7Å; L43-L47 VanDerWaalsContact O-CD1 3.23Å; L43-L47 WeakPolarHBondContact O-CD1 3.48Å; L43-L47 PolarHBondContact O-N 3.39Å; F44-L47 PolarHBondContact O-N 2.92Å; P45-L47 PolarHBondContact O-N 3.37Å; L47-C49 PolarHBondContact O-N 2.91Å; L47-I50 PolarHBondContact O-N 3.07Å; L47-V58 HydrophobicContact CD1-CG1 3.62Å; L47-V58 HydrophobicContact CD1-CG2 4.29Å; L47-V58 HydrophobicContact CG-CG1 4.35Å; L47-V58 HydrophobicContact CG-CG2 4.17Å
48S87.6Confident86.7Confident106 Ų10687.6 Ų87.674%0.74148%0.483SS*.Hα-helixtrans-71-18-179.5-53.90000112.6F44 P45 V46F44-S48 PolarHBondContact O-N 3.33Å; F44-S48 PolarHBondContact O-OG 3.26Å; F44-S48 VanDerWaalsContact O-OG 3.13Å; P45-S48 WeakPolarHBondContact O-CB 3.43Å; P45-S48 PolarHBondContact O-N 2.85Å; P45-S48 VanDerWaalsContact O-N 3.15Å; V46-S48 PolarHBondContact O-N 3.45Å
49C88.5Confident86.9Confident112 Ų11291 Ų9176%0.75750%0.499SS*.Hα-helixtrans-90.6-17.5176.1-60.30000113.2P45 V46 L47P45-C49 PolarHBondContact O-N 3.47Å; P45-C49 PolarHBondContact O-SG 2.94Å; V46-C49 WeakPolarHBondContact O-CB 3.32Å; V46-C49 PolarHBondContact O-N 3.11Å; L47-C49 PolarHBondContact O-N 2.91Å
50I88.6Confident87.1Confident37 Ų3796.2 Ų96.219%0.1951%0.512CS..SBendtrans-83.9120.7-178.2-64.2169000109.4V46 L47 D52 A53 V58V46-I50 HydrophobicContact CG1-CD1 4.18Å; V46-I50 PolarHBondContact O-N 3.12Å; L47-I50 PolarHBondContact O-N 3.07Å; I50-D52 PolarHBondContact O-N 2.89Å; I50-A53 HydrophobicContact CB-CB 4.47Å; I50-A53 HydrophobicContact CG2-CB 4.42Å; I50-V58 HydrophobicContact CD1-CG2 4.11Å
51K82.6Confident87.3Confident178 Ų17896 Ų9677%0.77452%0.515SS*.THydrogen-bonded Turntrans-70.1125.1173.6-168.1175.4-179-179.40109.7
52D83.1Confident87.6Confident109 Ų10993.4 Ų93.458%0.58350%0.499SS*.THydrogen-bonded Turntrans5568.8-174.8-51.2-42.3000112.2I50 T54I50-D52 PolarHBondContact O-N 2.89Å; D52-T54 PolarHBondContact O-N 3.25Å
53A82.3Confident87.8Confident54 Ų5490.9 Ų90.945%0.44649%0.493SS..  trans-69.171.8-178.600000112.8I50 V58I50-A53 HydrophobicContact CB-CB 4.47Å; I50-A53 HydrophobicContact CG2-CB 4.42Å; A53-V58 HydrophobicContact CB-CG2 4.16Å
54T89.1Confident88.1Confident69 Ų6990.6 Ų90.642%0.42349%0.492SS..  trans-75.6145.6165.755.80000110.2D52 D56 R57 V58D52-T54 PolarHBondContact O-N 3.25Å; T54-D56 VanDerWaalsContact C-N 3.28Å; T54-D56 PolarHBondContact O-N 2.85Å; T54-R57 PolarHBondContact O-N 3.26Å; T54-R57 WeakPolarHBondContact OG1-CB 3.36Å; T54-R57 WeakPolarHBondContact OG1-CD 3.29Å; T54-R57 VanDerWaalsContact OG1-CG 3.23Å; T54-R57 WeakPolarHBondContact OG1-CG 3.15Å; T54-V58 PolarHBondContact O-N 3.47Å; T54-V58 VanDerWaalsContact O-N 3.1Å
55T87Confident88.4Confident118 Ų11886.5 Ų86.572%0.72448%0.483SS*.Hα-helixtrans-51-44-178.1-50.20000113.1R57 V58 D59T55-R57 PolarHBondContact O-N 3.13Å; T55-V58 PolarHBondContact O-N 2.89Å; T55-D59 WeakPolarHBondContact O-CB 3.25Å; T55-D59 PolarHBondContact O-N 3.2Å
56D87.9Confident88.8Confident133 Ų13385.4 Ų85.471%0.71147%0.472SS*.Hα-helixtrans-65.9-36.6-178.3-56-25.3000113T54 Y60T54-D56 VanDerWaalsContact C-N 3.28Å; T54-D56 PolarHBondContact O-N 2.85Å; D56-Y60 WeakPolarHBondContact O-CB 3.31Å; D56-Y60 PolarHBondContact O-N 2.97Å
57R88.6Confident89.1Confident133 Ų13387 Ų8750%0.50248%0.478SS..Hα-helixtrans-70.8-42.3177.4-72.8-180178.2176.20.1111.4T54 T55 D59 Y60 V61T54-R57 PolarHBondContact O-N 3.26Å; T54-R57 WeakPolarHBondContact OG1-CB 3.36Å; T54-R57 WeakPolarHBondContact OG1-CD 3.29Å; T54-R57 VanDerWaalsContact OG1-CG 3.23Å; T54-R57 WeakPolarHBondContact OG1-CG 3.15Å; T55-R57 PolarHBondContact O-N 3.13Å; R57-D59 VanDerWaalsContact C-N 3.35Å; R57-Y60 PolarHBondContact O-N 3.24Å; R57-V61 VanDerWaalsContact O-CG2 3.29Å; R57-V61 WeakPolarHBondContact O-CG2 3.32Å; R57-V61 PolarHBondContact O-N 3.02Å
58V90.4Very high89.5Confident19 Ų1989.3 Ų89.312%0.11549%0.49CS..Hα-helixtrans-62-46.9176.4173.10000109.6L43 L47 I50 A53 T54 T55 Y60 V61 V62L43-V58 HydrophobicContact CD1-CG1 4.33Å; L47-V58 HydrophobicContact CD1-CG1 3.62Å; L47-V58 HydrophobicContact CD1-CG2 4.29Å; L47-V58 HydrophobicContact CG-CG1 4.35Å; L47-V58 HydrophobicContact CG-CG2 4.17Å; I50-V58 HydrophobicContact CD1-CG2 4.11Å; A53-V58 HydrophobicContact CB-CG2 4.16Å; T54-V58 PolarHBondContact O-N 3.47Å; T54-V58 VanDerWaalsContact O-N 3.1Å; T55-V58 PolarHBondContact O-N 2.89Å; V58-Y60 PolarHBondContact O-N 2.86Å; V58-V61 PolarHBondContact O-N 3.41Å; V58-V62 HydrophobicContact CG1-CG2 4.23Å; V58-V62 WeakPolarHBondContact O-CB 3.5Å; V58-V62 VanDerWaalsContact O-CG2 3.26Å; V58-V62 WeakPolarHBondContact O-CG2 3.38Å; V58-V62 PolarHBondContact O-N 3.47Å
59D89.4Confident89.8Confident109 Ų10986.1 Ų86.158%0.58347%0.467SS*.Hα-helixtrans-60.9-45178.2-170.457.2000111.8T55 R57 V61 V62 S63T55-D59 WeakPolarHBondContact O-CB 3.25Å; T55-D59 PolarHBondContact O-N 3.2Å; R57-D59 VanDerWaalsContact C-N 3.35Å; D59-V61 PolarHBondContact O-N 3.2Å; D59-V62 PolarHBondContact O-N 3.43Å; D59-S63 WeakPolarHBondContact O-CB 3.47Å; D59-S63 PolarHBondContact O-N 3.33Å
60Y90.8Very high90Very high162 Ų16282.5 Ų82.564%0.63545%0.445SS*.Hα-helixtrans-59.1-45.1175.4179.9-96.3000112.9D56 R57 V58 N64D56-Y60 WeakPolarHBondContact O-CB 3.31Å; D56-Y60 PolarHBondContact O-N 2.97Å; R57-Y60 PolarHBondContact O-N 3.24Å; V58-Y60 PolarHBondContact O-N 2.86Å; Y60-N64 WeakPolarHBondContact CE1-ND2 3.41Å; Y60-N64 WeakPolarHBondContact CE2-ND2 3.41Å; Y60-N64 WeakPolarHBondContact O-CB 3.23Å; Y60-N64 PolarHBondContact O-N 2.98Å; Y60-N64 VanDerWaalsContact O-N 3.11Å; Y60-N64 PolarHBondContact O-ND2 3.01Å
61V91.8Very high90.4Very high60 Ų6083.6 Ų83.636%0.36446%0.46SS..Hα-helixtrans-67.4-45.9-179.8170.90000110.9R57 V58 D59 S65R57-V61 VanDerWaalsContact O-CG2 3.29Å; R57-V61 WeakPolarHBondContact O-CG2 3.32Å; R57-V61 PolarHBondContact O-N 3.02Å; V58-V61 PolarHBondContact O-N 3.41Å; D59-V61 PolarHBondContact O-N 3.2Å; V61-S65 WeakPolarHBondContact O-CB 3.43Å; V61-S65 PolarHBondContact O-N 3Å; V61-S65 PolarHBondContact O-OG 2.97Å
62V90.8Very high90.9Very high37 Ų3781 Ų8122%0.22445%0.452CS..Hα-helixtrans-65.7-47.7-179.5171.20000110.4L43 V58 D59 N64 S65 I66L43-V62 HydrophobicContact CD1-CG2 3.8Å; V58-V62 HydrophobicContact CG1-CG2 4.23Å; V58-V62 WeakPolarHBondContact O-CB 3.5Å; V58-V62 VanDerWaalsContact O-CG2 3.26Å; V58-V62 WeakPolarHBondContact O-CG2 3.38Å; V58-V62 PolarHBondContact O-N 3.47Å; D59-V62 PolarHBondContact O-N 3.43Å; V62-N64 PolarHBondContact O-N 3.35Å; V62-S65 PolarHBondContact O-N 2.91Å; V62-S65 VanDerWaalsContact O-N 3.16Å; V62-I66 HydrophobicContact CG1-CD1 3.62Å; V62-I66 HydrophobicContact CG1-CG1 4.3Å; V62-I66 WeakPolarHBondContact O-CB 3.33Å; V62-I66 VanDerWaalsContact O-CG1 3.3Å; V62-I66 WeakPolarHBondContact O-CG1 3.38Å; V62-I66 PolarHBondContact O-N 3.01Å
63S91.1Very high91.4Very high50 Ų5081.5 Ų81.535%0.3545%0.447SS..Hα-helixtrans-59.4-46.7179.7-177.90000112D59 S65 I66 N67D59-S63 WeakPolarHBondContact O-CB 3.47Å; D59-S63 PolarHBondContact O-N 3.33Å; S63-S65 PolarHBondContact O-N 3.05Å; S63-I66 PolarHBondContact O-N 3.39Å; S63-N67 WeakPolarHBondContact O-CB 3.41Å; S63-N67 VanDerWaalsContact O-CG 3.24Å; S63-N67 PolarHBondContact O-N 3.16Å; S63-N67 PolarHBondContact O-ND2 3.15Å
64N93.6Very high91.9Very high59 Ų5981.7 Ų81.732%0.31645%0.448SS..Hα-helixtrans-62.9-40.3175.2-79.5-53.2000112.8Y60 V62 N67 I68Y60-N64 WeakPolarHBondContact CE1-ND2 3.41Å; Y60-N64 WeakPolarHBondContact CE2-ND2 3.41Å; Y60-N64 WeakPolarHBondContact O-CB 3.23Å; Y60-N64 PolarHBondContact O-N 2.98Å; Y60-N64 VanDerWaalsContact O-N 3.11Å; Y60-N64 PolarHBondContact O-ND2 3.01Å; V62-N64 PolarHBondContact O-N 3.35Å; N64-N67 PolarHBondContact O-N 3Å; N64-I68 VanDerWaalsContact O-CG1 3.31Å; N64-I68 WeakPolarHBondContact O-CG1 3.34Å; N64-I68 PolarHBondContact O-N 3.03Å
65S93.2Very high92.1Very high71 Ų7180.2 Ų80.250%0.49744%0.443SS..Hα-helixtrans-63.9-43.7178.8-57.20000111.6V61 V62 S63 I68 C69V61-S65 WeakPolarHBondContact O-CB 3.43Å; V61-S65 PolarHBondContact O-N 3Å; V61-S65 PolarHBondContact O-OG 2.97Å; V62-S65 PolarHBondContact O-N 2.91Å; V62-S65 VanDerWaalsContact O-N 3.16Å; S63-S65 PolarHBondContact O-N 3.05Å; S65-I68 PolarHBondContact O-N 3.46Å; S65-C69 WeakPolarHBondContact O-CB 3.4Å; S65-C69 PolarHBondContact O-N 3.01Å
66I92.7Very high92.3Very high55 Ų5578.7 Ų78.728%0.28243%0.433SS..Hα-helixtrans-63.2-43.7176.1-71.1175000110.6M37 V62 S63 C69 A70M37-I66 HydrophobicContact CE-CB 4.47Å; M37-I66 HydrophobicContact CE-CG2 3.44Å; M37-I66 VanDerWaalsContact CE-CG2 3.44Å; V62-I66 HydrophobicContact CG1-CD1 3.62Å; V62-I66 HydrophobicContact CG1-CG1 4.3Å; V62-I66 WeakPolarHBondContact O-CB 3.33Å; V62-I66 VanDerWaalsContact O-CG1 3.3Å; V62-I66 WeakPolarHBondContact O-CG1 3.38Å; V62-I66 PolarHBondContact O-N 3.01Å; S63-I66 PolarHBondContact O-N 3.39Å; I66-C69 WeakPolarHBondContact O-CB 3.49Å; I66-C69 PolarHBondContact O-N 3.05Å; I66-A70 WeakPolarHBondContact O-CB 3.26Å; I66-A70 PolarHBondContact O-N 2.87Å
67N94.1Very high92.4Very high95 Ų9574.5 Ų74.551%0.50842%0.421SS..Hα-helixtrans-63.5-42.1178.7-73.7-28.6000112.6S63 N64 C69 A70 A71S63-N67 WeakPolarHBondContact O-CB 3.41Å; S63-N67 VanDerWaalsContact O-CG 3.24Å; S63-N67 PolarHBondContact O-N 3.16Å; S63-N67 PolarHBondContact O-ND2 3.15Å; N64-N67 PolarHBondContact O-N 3Å; N67-C69 VanDerWaalsContact C-N 3.35Å; N67-A70 PolarHBondContact O-N 2.66Å; N67-A71 WeakPolarHBondContact O-CB 3.25Å; N67-A71 PolarHBondContact O-N 2.95Å
68I95.5Very high92.3Very high109 Ų10972.3 Ų72.356%0.55942%0.422SS*.Hα-helixtrans-64.2-42.9175.6-67165.9000110.4N64 S65 A71 M72N64-I68 VanDerWaalsContact O-CG1 3.31Å; N64-I68 WeakPolarHBondContact O-CG1 3.34Å; N64-I68 PolarHBondContact O-N 3.03Å; S65-I68 PolarHBondContact O-N 3.46Å; I68-A71 PolarHBondContact O-N 3.4Å; I68-M72 PolarHBondContact O-N 3.48Å
69C94.5Very high92.2Very high39 Ų3974.2 Ų74.226%0.26443%0.429SS..Hα-helixtrans-60.8-48.5176.6-167.90000111.6S65 I66 N67 A71 M72 Y73S65-C69 WeakPolarHBondContact O-CB 3.4Å; S65-C69 PolarHBondContact O-N 3.01Å; I66-C69 WeakPolarHBondContact O-CB 3.49Å; I66-C69 PolarHBondContact O-N 3.05Å; N67-C69 VanDerWaalsContact C-N 3.35Å; C69-A71 VanDerWaalsContact C-N 3.33Å; C69-A71 PolarHBondContact O-N 3.22Å; C69-M72 PolarHBondContact O-N 3.26Å; C69-Y73 PolarHBondContact O-N 3.49Å; C69-Y73 WeakPolarHBondContact SG-CE2 3.39Å; C69-Y73 VanDerWaalsContact SG-CZ 3.59Å
70A93.9Very high92.2Very high36 Ų3669.4 Ų69.430%0.29841%0.405SS..Hα-helixtrans-59.1-42.8176.800000112M37 I66 N67 M72 Y73 A74M37-A70 HydrophobicContact CE-CB 3.81Å; M37-A70 HydrophobicContact SD-CB 4.36Å; I66-A70 WeakPolarHBondContact O-CB 3.26Å; I66-A70 PolarHBondContact O-N 2.87Å; N67-A70 PolarHBondContact O-N 2.66Å; A70-M72 PolarHBondContact O-N 3.44Å; A70-Y73 PolarHBondContact O-N 3.44Å; A70-A74 VanDerWaalsContact O-CB 3.29Å; A70-A74 WeakPolarHBondContact O-CB 3.42Å; A70-A74 PolarHBondContact O-N 2.98Å
71A95.2Very high91.9Very high61 Ų6165.7 Ų65.750%0.50439%0.391SS..Hα-helixtrans-63.3-40.8177.100000112N67 I68 C69 A74 A75N67-A71 WeakPolarHBondContact O-CB 3.25Å; N67-A71 PolarHBondContact O-N 2.95Å; I68-A71 PolarHBondContact O-N 3.4Å; C69-A71 VanDerWaalsContact C-N 3.33Å; C69-A71 PolarHBondContact O-N 3.22Å; A71-A74 PolarHBondContact O-N 3.49Å; A71-A75 WeakPolarHBondContact O-CB 3.4Å; A71-A75 PolarHBondContact O-N 3.25Å
72M94.9Very high91.6Very high122 Ų12263.2 Ų63.260%0.60138%0.376SS*.Hα-helixtrans-66.2-44.1175.3-76.1-144.4-85.500112.2I68 C69 A70 A75 V76I68-M72 PolarHBondContact O-N 3.48Å; C69-M72 PolarHBondContact O-N 3.26Å; A70-M72 PolarHBondContact O-N 3.44Å; M72-A75 PolarHBondContact O-N 3.12Å; M72-V76 WeakPolarHBondContact O-CG2 3.34Å; M72-V76 PolarHBondContact O-N 3.01Å
73Y93.8Very high91.3Very high121 Ų12162 Ų6248%0.47537%0.37SS..Hα-helixtrans-62.9-41.8175.3-68.6-24.2000112.3A36 M37 C69 A70 V76 G77A36-Y73 HydrophobicContact CB-CD2 4.3Å; A36-Y73 HydrophobicContact CB-CE2 3.76Å; M37-Y73 HydrophobicContact SD-CD2 3.97Å; M37-Y73 HydrophobicContact SD-CE2 4.19Å; C69-Y73 PolarHBondContact O-N 3.49Å; C69-Y73 WeakPolarHBondContact SG-CE2 3.39Å; C69-Y73 VanDerWaalsContact SG-CZ 3.59Å; A70-Y73 PolarHBondContact O-N 3.44Å; Y73-V76 PolarHBondContact O-N 3.12Å; Y73-G77 PolarHBondContact O-N 2.87Å
74A92.5Very high90.9Very high58 Ų5860.3 Ų60.348%0.47936%0.356SS..Hα-helixtrans-61.9-45.4175.100000111.4A70 A71 G77 V78A70-A74 VanDerWaalsContact O-CB 3.29Å; A70-A74 WeakPolarHBondContact O-CB 3.42Å; A70-A74 PolarHBondContact O-N 2.98Å; A71-A74 PolarHBondContact O-N 3.49Å; A74-G77 PolarHBondContact O-N 3.47Å; A74-V78 WeakPolarHBondContact O-CB 3.45Å; A74-V78 VanDerWaalsContact O-CG2 3.25Å; A74-V78 WeakPolarHBondContact O-CG2 3.32Å; A74-V78 PolarHBondContact O-N 3.41Å
75A92.1Very high90.2Very high38 Ų3861.1 Ų61.131%0.31436%0.355SS..Hα-helixtrans-60.4-51.217700000111.4A71 M72 G77 V78 F79A71-A75 WeakPolarHBondContact O-CB 3.4Å; A71-A75 PolarHBondContact O-N 3.25Å; M72-A75 PolarHBondContact O-N 3.12Å; A75-G77 VanDerWaalsContact C-N 3.32Å; A75-G77 PolarHBondContact O-N 3.36Å; A75-V78 PolarHBondContact O-N 3.29Å; A75-F79 HydrophobicContact CB-CD2 4.36Å; A75-F79 HydrophobicContact CB-CE2 4.3Å; A75-F79 WeakPolarHBondContact O-CB 3.36Å; A75-F79 WeakPolarHBondContact O-CD2 3.33Å; A75-F79 PolarHBondContact O-N 3.18Å
76V90.9Very high89.2Confident86 Ų8661.4 Ų61.452%0.52136%0.358SS..Hα-helixtrans-61.7-40.8179.3173.70000111.4M1 M72 Y73 G80M1-V76 HydrophobicContact CG-CG1 4.5Å; M72-V76 WeakPolarHBondContact O-CG2 3.34Å; M72-V76 PolarHBondContact O-N 3.01Å; Y73-V76 PolarHBondContact O-N 3.12Å; V76-G80 PolarHBondContact O-N 3.4Å
77G89.8Confident88.3Confident44 Ų4463.7 Ų63.745%0.45437%0.367SS..Hα-helixtrans-64.4-47.1177.500000112.8Y73 A74 A75 G80 Y81Y73-G77 PolarHBondContact O-N 2.87Å; A74-G77 PolarHBondContact O-N 3.47Å; A75-G77 VanDerWaalsContact C-N 3.32Å; A75-G77 PolarHBondContact O-N 3.36Å; G77-G80 PolarHBondContact O-N 3.33Å; G77-Y81 WeakPolarHBondContact O-CB 3.33Å; G77-Y81 PolarHBondContact O-N 3.28Å
78V88.1Confident87.3Confident87 Ų8765.9 Ų65.953%0.52737%0.374SS..Hα-helixtrans-64.6-50.7178.6171.70000110.9A74 A75 G80 Y81 V82A74-V78 WeakPolarHBondContact O-CB 3.45Å; A74-V78 VanDerWaalsContact O-CG2 3.25Å; A74-V78 WeakPolarHBondContact O-CG2 3.32Å; A74-V78 PolarHBondContact O-N 3.41Å; A75-V78 PolarHBondContact O-N 3.29Å; V78-G80 VanDerWaalsContact C-N 3.3Å; V78-G80 PolarHBondContact O-N 3.17Å; V78-Y81 PolarHBondContact O-N 3.36Å; V78-V82 WeakPolarHBondContact O-CG2 3.47Å; V78-V82 PolarHBondContact O-N 3.27Å
79F88.4Confident86.3Confident59 Ų5964.1 Ų64.126%0.25937%0.365SS..Hα-helixtrans-66-33.8179.3-69.4-60.5000112.4M2 S5 I9 A75 A83M2-F79 HydrophobicContact CE-CD2 4.36Å; M2-F79 HydrophobicContact CE-CE2 3.84Å; M2-F79 HydrophobicContact CE-CZ 4.15Å; M2-F79 HydrophobicContact CG-CB 4.3Å; M2-F79 HydrophobicContact CG-CD2 3.56Å; M2-F79 HydrophobicContact CG-CE2 4.02Å; M2-F79 HydrophobicContact CG-CG 3.92Å; M2-F79 HydrophobicContact SD-CD2 4.29Å; M2-F79 HydrophobicContact SD-CE2 4.28Å; S5-F79 WeakPolarHBondContact OG-CD1 3.43Å; I9-F79 HydrophobicContact CD1-CD1 4.16Å; I9-F79 HydrophobicContact CD1-CE1 4.13Å; A75-F79 HydrophobicContact CB-CD2 4.36Å; A75-F79 HydrophobicContact CB-CE2 4.3Å; A75-F79 WeakPolarHBondContact O-CB 3.36Å; A75-F79 WeakPolarHBondContact O-CD2 3.33Å; A75-F79 PolarHBondContact O-N 3.18Å; F79-A83 VanDerWaalsContact O-CB 3.26Å; F79-A83 WeakPolarHBondContact O-CB 3.35Å; F79-A83 PolarHBondContact O-N 3.23Å
80G87.6Confident85.4Confident8 Ų868.5 Ų68.58%0.08238%0.382CS..Hα-helixtrans-65.5-43.7173.500000112.3V76 G77 V78 A83 F84V76-G80 PolarHBondContact O-N 3.4Å; G77-G80 PolarHBondContact O-N 3.33Å; V78-G80 VanDerWaalsContact C-N 3.3Å; V78-G80 PolarHBondContact O-N 3.17Å; G80-A83 PolarHBondContact O-N 2.87Å; G80-F84 WeakPolarHBondContact O-CD2 3.39Å; G80-F84 PolarHBondContact O-N 3.39Å
81Y86.5Confident84.6Confident85 Ų8568.8 Ų68.833%0.33339%0.388SS..Hα-helixtrans-65.3-42.2177.9-170.4-121000112.1V18 V19 G77 V78 Y85 L89V18-Y81 HydrophobicContact CB-CE1 4.2Å; V18-Y81 HydrophobicContact CG1-CD1 4.03Å; V18-Y81 HydrophobicContact CG1-CE1 3.6Å; V18-Y81 HydrophobicContact CG2-CD1 4.32Å; V18-Y81 HydrophobicContact CG2-CE1 4.13Å; V19-Y81 PolarHBondContact N-OH 2.74Å; G77-Y81 WeakPolarHBondContact O-CB 3.33Å; G77-Y81 PolarHBondContact O-N 3.28Å; V78-Y81 PolarHBondContact O-N 3.36Å; Y81-Y85 PolarHBondContact O-N 3.47Å; Y81-L89 HydrophobicContact CD2-CD1 3.83Å; Y81-L89 HydrophobicContact CE2-CD1 4.32Å
82V85.4Confident84.1Confident7 Ų768.6 Ų68.64%0.04238%0.379CS..Hα-helixtrans-67.8-38.5176.7174.60000111.7T8 I9 W14 V78 F84 Y85T8-V82 HydrophobicContact CG2-CG1 4.27Å; T8-V82 WeakPolarHBondContact CG2-O 3.42Å; I9-V82 HydrophobicContact CD1-CG1 4.31Å; I9-V82 HydrophobicContact CG1-CG1 3.73Å; W14-V82 HydrophobicContact CB-CG1 4.16Å; W14-V82 HydrophobicContact CD2-CG1 3.93Å; W14-V82 HydrophobicContact CD2-CG2 4.47Å; W14-V82 HydrophobicContact CE3-CG1 4.02Å; W14-V82 HydrophobicContact CE3-CG2 3.76Å; W14-V82 HydrophobicContact CG-CG1 4.01Å; W14-V82 HydrophobicContact CZ3-CG2 3.9Å; V78-V82 WeakPolarHBondContact O-CG2 3.47Å; V78-V82 PolarHBondContact O-N 3.27Å; V82-F84 VanDerWaalsContact C-N 3.29Å; V82-F84 PolarHBondContact O-N 3.31Å; V82-Y85 WeakPolarHBondContact O-CD1 3.45Å
83A84Confident83.7Confident13 Ų1365.1 Ų65.111%0.10736%0.364CS..Hα-helixtrans-63.8-33.1-179.400000113.3E4 F79 G80E4-A83 HydrophobicContact CB-CB 4.32Å; F79-A83 VanDerWaalsContact O-CB 3.26Å; F79-A83 WeakPolarHBondContact O-CB 3.35Å; F79-A83 PolarHBondContact O-N 3.23Å; G80-A83 PolarHBondContact O-N 2.87Å
84F82.2Confident83.1Confident14 Ų1460.8 Ų60.86%0.06135%0.349CS..THydrogen-bonded Turntrans-120.526.7-170.6-61.8-65.4000113.4M1 G80 V82 S86 H87 L89 V93 Q96 F97M1-F84 HydrophobicContact CE-CE2 4.12Å; M1-F84 HydrophobicContact SD-CE2 3.79Å; G80-F84 WeakPolarHBondContact O-CD2 3.39Å; G80-F84 PolarHBondContact O-N 3.39Å; V82-F84 VanDerWaalsContact C-N 3.29Å; V82-F84 PolarHBondContact O-N 3.31Å; F84-S86 PolarHBondContact O-N 2.96Å; F84-H87 PolarHBondContact O-N 2.95Å; F84-L89 HydrophobicContact CB-CD2 3.64Å; F84-L89 HydrophobicContact CB-CG 4.42Å; F84-L89 HydrophobicContact CD2-CD2 4.3Å; F84-L89 HydrophobicContact CG-CD2 4.26Å; F84-V93 HydrophobicContact CD2-CG2 3.93Å; F84-V93 HydrophobicContact CE2-CG2 3.84Å; F84-Q96 HydrophobicContact CD1-CB 4.34Å; F84-Q96 HydrophobicContact CD1-CG 3.5Å; F84-Q96 HydrophobicContact CE1-CB 4.16Å; F84-Q96 HydrophobicContact CE1-CG 3.68Å; F84-Q96 HydrophobicContact CG-CG 4.01Å; F84-Q96 HydrophobicContact CZ-CB 4.33Å; F84-Q96 HydrophobicContact CZ-CG 4.32Å; F84-F97 HydrophobicContact CE2-CE1 4.41Å; F84-F97 HydrophobicContact CE2-CZ 4.33Å; F84-F97 AromaticContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD2 4.43Å; F84-F97 AromaticContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE2 4.48Å; F84-F97 HydrophobicContact CZ-CG 4.22Å; F84-F97 HydrophobicContact CZ-CZ 4.29Å
85Y79.4Confident82.6Confident75 Ų7561.3 Ų61.329%0.29435%0.346SS..THydrogen-bonded Turntrans-57.9-23.3-17878.4-83.9000114.1T8 W14 H17 Y81 V82T8-Y85 HydrophobicContact CG2-CD1 3.65Å; T8-Y85 HydrophobicContact CG2-CE1 3.35Å; W14-Y85 HydrophobicContact CB-CD1 4.44Å; W14-Y85 HydrophobicContact CB-CE1 4.5Å; H17-Y85 HydrophobicContact CB-CD2 3.46Å; H17-Y85 VanDerWaalsContact CB-CD2 3.46Å; H17-Y85 HydrophobicContact CB-CE2 3.73Å; H17-Y85 AromaticContact CD2-CE2 3.8Å; H17-Y85 AromaticContact CG-CE2 3.92Å; Y81-Y85 PolarHBondContact O-N 3.47Å; V82-Y85 WeakPolarHBondContact O-CD1 3.45Å
86S72.1Confident82.1Confident78 Ų7861.9 Ų61.955%0.54534%0.342SS..THydrogen-bonded Turntrans-86-10.5-179.656.30000114.4F84F84-S86 PolarHBondContact O-N 2.96Å
87H73.4Confident81.7Confident103 Ų10358.6 Ų58.648%0.47732%0.321SS..SBendtrans-119.7151.5-174.2-65.1-69.6000112.2F84 L89F84-H87 PolarHBondContact O-N 2.95Å; H87-L89 PolarHBondContact O-N 2.96Å; H87-L89 VanDerWaalsContact O-N 3.17Å
88E73.3Confident81.3Confident141 Ų14159.5 Ų59.566%0.65932%0.319SS*.  trans-71.2109173.3-169.1171.9-166.900110.2H90E88-H90 PolarHBondContact O-N 3.41Å; E88-H90 PolarHBondContact O-ND1 3.35Å
89L75.3Confident80.9Confident72 Ų7260.6 Ų60.638%0.37733%0.328SS..  trans-73.4121-177.7-75.3172.5000110.9Y81 F84 H87 V93Y81-L89 HydrophobicContact CD2-CD1 3.83Å; Y81-L89 HydrophobicContact CE2-CD1 4.32Å; F84-L89 HydrophobicContact CB-CD2 3.64Å; F84-L89 HydrophobicContact CB-CG 4.42Å; F84-L89 HydrophobicContact CD2-CD2 4.3Å; F84-L89 HydrophobicContact CG-CD2 4.26Å; H87-L89 PolarHBondContact O-N 2.96Å; H87-L89 VanDerWaalsContact O-N 3.17Å; L89-V93 HydrophobicContact CD2-CG2 4.4Å
90H74.9Confident80.9Confident130 Ų13060.6 Ų60.660%0.60233%0.333SS*.  trans-89.3158.8168-74.161.8000110.4E88 D92E88-H90 PolarHBondContact O-N 3.41Å; E88-H90 PolarHBondContact O-ND1 3.35Å; H90-D92 CarbonylContact O-C 3.55Å; H90-D92 PolarHBondContact O-N 3.26Å
91G77.3Confident80.9Confident42 Ų4267.5 Ų67.543%0.43337%0.366SS..SBendtrans-54.8-19.9178.100000115.9E173G91-E173 WeakPolarHBondContact CA-OE2 3.04Å
92D85Confident80.9Confident58 Ų5868.6 Ų68.631%0.3138%0.381SS..  trans-108.8103166.5-1732.7000111.7H90 L94 V95 V172H90-D92 CarbonylContact O-C 3.55Å; H90-D92 PolarHBondContact O-N 3.26Å; D92-L94 PolarHBondContact O-N 3.34Å; D92-L94 VanDerWaalsContact OD1-CB 3.23Å; D92-L94 WeakPolarHBondContact OD1-CB 3.35Å; D92-L94 PolarHBondContact OD1-N 3.06Å; D92-V95 HydrophobicContact CB-CG2 4.05Å; D92-V95 WeakPolarHBondContact O-CB 3.49Å; D92-V95 PolarHBondContact O-N 3.25Å; D92-V172 HydrophobicContact CB-CG2 3.98Å
93V84.6Confident80.9Confident49 Ų4968.6 Ų68.630%0.29738%0.381SS..G310 helixtrans-68.5-19.9178.173.10000113.1M1 F84 L89 V95 Q96 F97M1-V93 HydrophobicContact CE-CB 3.81Å; M1-V93 HydrophobicContact CE-CG1 3.22Å; M1-V93 HydrophobicContact CE-CG2 3.27Å; M1-V93 HydrophobicContact SD-CG2 4.37Å; F84-V93 HydrophobicContact CD2-CG2 3.93Å; F84-V93 HydrophobicContact CE2-CG2 3.84Å; L89-V93 HydrophobicContact CD2-CG2 4.4Å; V93-V95 PolarHBondContact O-N 3.25Å; V93-Q96 PolarHBondContact O-N 2.9Å; V93-F97 WeakPolarHBondContact O-CD2 3.49Å
94L82.3Confident81.1Confident29 Ų2973.5 Ų73.515%0.15240%0.402CS..G310 helixtrans-64.6-27.2177.6-71.6154000111.6D92 Q96 F97 K107 F110D92-L94 PolarHBondContact O-N 3.34Å; D92-L94 VanDerWaalsContact OD1-CB 3.23Å; D92-L94 WeakPolarHBondContact OD1-CB 3.35Å; D92-L94 PolarHBondContact OD1-N 3.06Å; L94-Q96 PolarHBondContact O-N 3.24Å; L94-F97 HydrophobicContact CD2-CE2 4.46Å; L94-K107 HydrophobicContact CD2-CG 4.29Å; L94-K107 WeakPolarHBondContact O-CE 3.01Å; L94-K107 PolarHBondContact O-NZ 3.17Å; L94-F110 HydrophobicContact CD1-CD1 3.66Å; L94-F110 HydrophobicContact CD1-CE1 3.62Å; L94-F110 HydrophobicContact CD1-CG 4.28Å; L94-F110 HydrophobicContact CD1-CZ 4.22Å
95V81.7Confident81.5Confident69 Ų6976.1 Ų76.142%0.41842%0.422SS..G310 helixtrans-70.5-21.1179.9176.70000112.3D92 V93 K256D92-V95 HydrophobicContact CB-CG2 4.05Å; D92-V95 WeakPolarHBondContact O-CB 3.49Å; D92-V95 PolarHBondContact O-N 3.25Å; V93-V95 PolarHBondContact O-N 3.25Å; V95-K256 PolarHBondContact O-NZ 3.16Å; V95-K256 VanDerWaalsContact O-NZ 3.16Å
96Q81.8Confident81.9Confident51 Ų5177 Ų7724%0.23843%0.431CS..G310 helixtrans-86.7-16.4-177.3-164.356.727.100113.7F84 V93 L94F84-Q96 HydrophobicContact CD1-CB 4.34Å; F84-Q96 HydrophobicContact CD1-CG 3.5Å; F84-Q96 HydrophobicContact CE1-CB 4.16Å; F84-Q96 HydrophobicContact CE1-CG 3.68Å; F84-Q96 HydrophobicContact CG-CG 4.01Å; F84-Q96 HydrophobicContact CZ-CB 4.33Å; F84-Q96 HydrophobicContact CZ-CG 4.32Å; V93-Q96 PolarHBondContact O-N 2.9Å; L94-Q96 PolarHBondContact O-N 3.24Å
97F81.9Confident82.8Confident16 Ų1676.8 Ų76.87%0.0742%0.421CS..SBendtrans-69.8139179.2-73-86.3000112.5M1 E4 F84 V93 L94 T103M1-F97 HydrophobicContact CE-CE1 4.4Å; M1-F97 HydrophobicContact CE-CE2 3.26Å; M1-F97 HydrophobicContact CE-CZ 3.2Å; M1-F97 HydrophobicContact CG-CZ 4.16Å; M1-F97 HydrophobicContact SD-CE1 4.15Å; M1-F97 HydrophobicContact SD-CE2 4.06Å; M1-F97 HydrophobicContact SD-CZ 3.36Å; M1-F97 WeakPolarHBondContact SD-CZ 3.49Å; E4-F97 HydrophobicContact CG-CD1 4.06Å; E4-F97 HydrophobicContact CG-CE1 3.74Å; F84-F97 HydrophobicContact CE2-CE1 4.41Å; F84-F97 HydrophobicContact CE2-CZ 4.33Å; F84-F97 AromaticContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD1 3.96Å; F84-F97 HydrophobicContact CZ-CD2 4.43Å; F84-F97 AromaticContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE1 3.99Å; F84-F97 HydrophobicContact CZ-CE2 4.48Å; F84-F97 HydrophobicContact CZ-CG 4.22Å; F84-F97 HydrophobicContact CZ-CZ 4.29Å; V93-F97 WeakPolarHBondContact O-CD2 3.49Å; L94-F97 HydrophobicContact CD2-CE2 4.46Å; F97-T103 HydrophobicContact CB-CG2 3.94Å; F97-T103 HydrophobicContact CD1-CG2 4.08Å; F97-T103 HydrophobicContact CG-CG2 4.28Å
98P81.3Confident83.6Confident63 Ų6377.4 Ų77.441%0.40943%0.427SS..  trans-61145.417326.7-34000110.2T100 T103P98-T100 PolarHBondContact O-N 3.4Å; P98-T103 PolarHBondContact O-OG1 3.44Å
99P81.3Confident84.6Confident110 Ų11073.5 Ų73.571%0.71442%0.419SS*.  trans-75.586.6-179.631.5-34.2000110.3
100T88.2Confident85.4Confident60 Ų6075.2 Ų75.237%0.36842%0.423SS..  trans-107.3160.5169.866.80000109.2P98 V102 T103 Q104P98-T100 PolarHBondContact O-N 3.4Å; T100-V102 PolarHBondContact O-N 2.99Å; T100-T103 PolarHBondContact N-OG1 2.9Å; T100-T103 PolarHBondContact O-N 3.45Å; T100-T103 VanDerWaalsContact O-N 3.17Å; T100-T103 PolarHBondContact O-OG1 3.49Å; T100-T103 VanDerWaalsContact O-OG1 3.04Å; T100-T103 WeakPolarHBondContact OG1-CG2 3.36Å; T100-T103 PolarHBondContact OG1-N 2.96Å; T100-T103 PolarHBondContact OG1-OG1 3.27Å; T100-Q104 WeakPolarHBondContact O-CB 3.24Å; T100-Q104 WeakPolarHBondContact O-CG 3.25Å; T100-Q104 PolarHBondContact O-N 3.27Å
101I88.1Confident86.2Confident152 Ų15274.2 Ų74.278%0.77942%0.422SS*.Hα-helixtrans-56.1-38.4178.1-60.1170000110.5S105I101-S105 WeakPolarHBondContact O-CB 3.29Å; I101-S105 PolarHBondContact O-N 2.95Å; I101-S105 PolarHBondContact O-OG 2.9Å
102V86Confident87.1Confident108 Ų10877.7 Ų77.766%0.65543%0.43SS*.Hα-helixtrans-64.9-50.1177.9177.30000111T100 Q104 S105 L106T100-V102 PolarHBondContact O-N 2.99Å; V102-Q104 VanDerWaalsContact C-N 3.35Å; V102-Q104 PolarHBondContact O-N 3.49Å; V102-S105 PolarHBondContact O-N 3.21Å; V102-S105 PolarHBondContact O-OG 3.46Å; V102-L106 PolarHBondContact O-N 2.97Å
103T85.7Confident87.5Confident7 Ų778.3 Ų78.34%0.04344%0.439CS..Hα-helixtrans-68.6-34.7-178.660.30000112F97 P98 T100 L106 K107F97-T103 HydrophobicContact CB-CG2 3.94Å; F97-T103 HydrophobicContact CD1-CG2 4.08Å; F97-T103 HydrophobicContact CG-CG2 4.28Å; P98-T103 PolarHBondContact O-OG1 3.44Å; T100-T103 PolarHBondContact N-OG1 2.9Å; T100-T103 PolarHBondContact O-N 3.45Å; T100-T103 VanDerWaalsContact O-N 3.17Å; T100-T103 PolarHBondContact O-OG1 3.49Å; T100-T103 VanDerWaalsContact O-OG1 3.04Å; T100-T103 WeakPolarHBondContact OG1-CG2 3.36Å; T100-T103 PolarHBondContact OG1-N 2.96Å; T100-T103 PolarHBondContact OG1-OG1 3.27Å; T103-L106 PolarHBondContact O-N 3.42Å; T103-K107 WeakPolarHBondContact O-CG 3.43Å; T103-K107 PolarHBondContact O-N 3.48Å
104Q88Confident88Confident117 Ų11779.4 Ų79.455%0.54744%0.442SS..Hα-helixtrans-65.7-42.1172.6-71.8-170.3-6.600112T100 V102 L106 K107 L108T100-Q104 WeakPolarHBondContact O-CB 3.24Å; T100-Q104 WeakPolarHBondContact O-CG 3.25Å; T100-Q104 PolarHBondContact O-N 3.27Å; V102-Q104 VanDerWaalsContact C-N 3.35Å; V102-Q104 PolarHBondContact O-N 3.49Å; Q104-L106 VanDerWaalsContact C-N 3.3Å; Q104-L106 PolarHBondContact O-N 3.24Å; Q104-K107 PolarHBondContact O-N 2.88Å; Q104-L108 PolarHBondContact O-N 3.27Å
105S89.4Confident88.5Confident68 Ų6880.5 Ų80.548%0.47646%0.455SS..Hα-helixtrans-62.3-38.1175.175.40000112.1I101 V102 L108 A109I101-S105 WeakPolarHBondContact O-CB 3.29Å; I101-S105 PolarHBondContact O-N 2.95Å; I101-S105 PolarHBondContact O-OG 2.9Å; V102-S105 PolarHBondContact O-N 3.21Å; V102-S105 PolarHBondContact O-OG 3.46Å; S105-L108 PolarHBondContact O-N 3.41Å; S105-A109 WeakPolarHBondContact O-CB 3.36Å; S105-A109 PolarHBondContact O-N 3.16Å
106L89.1Confident89.1Confident94 Ų9481.3 Ų81.349%0.49246%0.461SS..Hα-helixtrans-64.7-45.1175.4-17669.8000111.7V102 T103 Q104 L108 A109 F110V102-L106 PolarHBondContact O-N 2.97Å; T103-L106 PolarHBondContact O-N 3.42Å; Q104-L106 VanDerWaalsContact C-N 3.3Å; Q104-L106 PolarHBondContact O-N 3.24Å; L106-L108 VanDerWaalsContact C-N 3.32Å; L106-L108 PolarHBondContact O-N 3.17Å; L106-A109 PolarHBondContact O-N 3.11Å; L106-F110 WeakPolarHBondContact O-CB 3.2Å; L106-F110 PolarHBondContact O-N 3.14Å
107K89.8Confident89.7Confident73 Ų7380.9 Ų80.932%0.31746%0.463SS..Hα-helixtrans-59.8-42.6175.2-73.4174.6-178.4-174.10111.5L94 T103 Q104 F110 L111L94-K107 HydrophobicContact CD2-CG 4.29Å; L94-K107 WeakPolarHBondContact O-CE 3.01Å; L94-K107 PolarHBondContact O-NZ 3.17Å; T103-K107 WeakPolarHBondContact O-CG 3.43Å; T103-K107 PolarHBondContact O-N 3.48Å; Q104-K107 PolarHBondContact O-N 2.88Å; K107-F110 PolarHBondContact O-N 3.3Å; K107-L111 WeakPolarHBondContact O-CB 3.25Å; K107-L111 PolarHBondContact O-N 2.91Å
108L91.4Very high90.1Very high117 Ų11784 Ų8461%0.61348%0.48SS*.Hα-helixtrans-65.3-43.4177.2-176.563.1000111.9Q104 S105 L106 L111 L112Q104-L108 PolarHBondContact O-N 3.27Å; S105-L108 PolarHBondContact O-N 3.41Å; L106-L108 VanDerWaalsContact C-N 3.32Å; L106-L108 PolarHBondContact O-N 3.17Å; L108-L111 PolarHBondContact O-N 3.26Å; L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 PolarHBondContact O-N 2.97Å
109A93.3Very high90.6Very high59 Ų5985 Ų8549%0.48849%0.486SS..Hα-helixtrans-63-42.3176.700000111.9S105 L106 L112 S113S105-A109 WeakPolarHBondContact O-CB 3.36Å; S105-A109 PolarHBondContact O-N 3.16Å; L106-A109 PolarHBondContact O-N 3.11Å; A109-L112 PolarHBondContact O-N 3.23Å; A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 3.44Å
110F92.1Very high91Very high107 Ų10785.8 Ų85.847%0.46948%0.483SS..Hα-helixtrans-61.9-46.4174.6177.5-111.3000111.8L94 L106 K107 L112 S113 I114L94-F110 HydrophobicContact CD1-CD1 3.66Å; L94-F110 HydrophobicContact CD1-CE1 3.62Å; L94-F110 HydrophobicContact CD1-CG 4.28Å; L94-F110 HydrophobicContact CD1-CZ 4.22Å; L106-F110 WeakPolarHBondContact O-CB 3.2Å; L106-F110 PolarHBondContact O-N 3.14Å; K107-F110 PolarHBondContact O-N 3.3Å; F110-L112 VanDerWaalsContact C-N 3.35Å; F110-L112 PolarHBondContact O-N 3.43Å; F110-S113 WeakPolarHBondContact O-CB 3.34Å; F110-S113 PolarHBondContact O-N 3.48Å; F110-I114 HydrophobicContact CD1-CD1 3.88Å; F110-I114 HydrophobicContact CD2-CD1 4.4Å; F110-I114 HydrophobicContact CE1-CD1 3.38Å; F110-I114 HydrophobicContact CE2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CG1 4.41Å; F110-I114 HydrophobicContact CG-CD1 4.38Å; F110-I114 HydrophobicContact CZ-CD1 3.43Å; F110-I114 VanDerWaalsContact CZ-CD1 3.43Å; F110-I114 HydrophobicContact CZ-CG1 4.35Å; F110-I114 WeakPolarHBondContact O-CG1 3.29Å; F110-I114 PolarHBondContact O-N 3.1Å
111L93Very high91.1Very high110 Ų11089.4 Ų89.458%0.57650%0.498SS*.Hα-helixtrans-59.7-44.6176.4-178.664.6000111.8K107 L108 S113 I114 A115K107-L111 WeakPolarHBondContact O-CB 3.25Å; K107-L111 PolarHBondContact O-N 2.91Å; L108-L111 PolarHBondContact O-N 3.26Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.92Å; L111-I114 PolarHBondContact O-N 3.4Å; L111-A115 WeakPolarHBondContact O-CB 3.14Å; L111-A115 PolarHBondContact O-N 3.39Å
112L94.4Very high91.1Very high114 Ų11483.4 Ų83.460%0.59747%0.467SS*.Hα-helixtrans-64.7-39.6177.8-173.463.9000111.6L108 A109 F110 I114 A115 V116L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 PolarHBondContact O-N 2.97Å; A109-L112 PolarHBondContact O-N 3.23Å; F110-L112 VanDerWaalsContact C-N 3.35Å; F110-L112 PolarHBondContact O-N 3.43Å; L112-I114 VanDerWaalsContact C-N 3.33Å; L112-I114 PolarHBondContact O-N 3.45Å; L112-A115 PolarHBondContact O-N 2.84Å; L112-V116 WeakPolarHBondContact O-CG2 3.43Å; L112-V116 PolarHBondContact O-N 3.33Å
113S95.3Very high91.2Very high71 Ų7184.6 Ų84.650%0.49746%0.464SS..Hα-helixtrans-59.5-43.7174.6-175.20000111.7A109 F110 L111 V116 S117A109-S113 WeakPolarHBondContact O-CB 3.37Å; A109-S113 PolarHBondContact O-N 3.44Å; F110-S113 WeakPolarHBondContact O-CB 3.34Å; F110-S113 PolarHBondContact O-N 3.48Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.92Å; S113-V116 PolarHBondContact O-N 3.46Å; S113-S117 WeakPolarHBondContact O-CB 3.37Å; S113-S117 PolarHBondContact O-N 3.38Å; S113-S117 PolarHBondContact O-OG 2.85Å
114I93.4Very high91.2Very high72 Ų7287.8 Ų87.837%0.36948%0.484SS..Hα-helixtrans-64.9-45.3175.6-68.4168.3000110.5F110 L111 L112 V116 S117 I118F110-I114 HydrophobicContact CD1-CD1 3.88Å; F110-I114 HydrophobicContact CD2-CD1 4.4Å; F110-I114 HydrophobicContact CE1-CD1 3.38Å; F110-I114 HydrophobicContact CE2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CG1 4.41Å; F110-I114 HydrophobicContact CG-CD1 4.38Å; F110-I114 HydrophobicContact CZ-CD1 3.43Å; F110-I114 VanDerWaalsContact CZ-CD1 3.43Å; F110-I114 HydrophobicContact CZ-CG1 4.35Å; F110-I114 WeakPolarHBondContact O-CG1 3.29Å; F110-I114 PolarHBondContact O-N 3.1Å; L111-I114 PolarHBondContact O-N 3.4Å; L112-I114 VanDerWaalsContact C-N 3.33Å; L112-I114 PolarHBondContact O-N 3.45Å; I114-V116 VanDerWaalsContact C-N 3.26Å; I114-V116 PolarHBondContact O-N 2.87Å; I114-S117 WeakPolarHBondContact O-CB 3.31Å; I114-S117 PolarHBondContact O-N 3.4Å; I114-I118 HydrophobicContact CG2-CD1 4.11Å; I114-I118 HydrophobicContact CG2-CG1 4.39Å; I114-I118 WeakPolarHBondContact O-CG1 3.4Å; I114-I118 PolarHBondContact O-N 2.88Å
115A92.8Very high91.2Very high52 Ų5284.4 Ų84.443%0.4348%0.477SS..Hα-helixtrans-57.6-3918000000112.3L111 L112 P119L111-A115 WeakPolarHBondContact O-CB 3.14Å; L111-A115 PolarHBondContact O-N 3.39Å; L112-A115 PolarHBondContact O-N 2.84Å; A115-P119 WeakPolarHBondContact O-CD 3.44Å
116V94.7Very high91.2Very high87 Ų8783.8 Ų83.853%0.52746%0.464SS..Hα-helixtrans-75-30.2175.61750000112.3L112 S113 I114 P119L112-V116 WeakPolarHBondContact O-CG2 3.43Å; L112-V116 PolarHBondContact O-N 3.33Å; S113-V116 PolarHBondContact O-N 3.46Å; I114-V116 VanDerWaalsContact C-N 3.26Å; I114-V116 PolarHBondContact O-N 2.87Å; V116-P119 WeakPolarHBondContact O-CD 3.39Å
117S94.1Very high90.9Very high41 Ų4182.4 Ų82.429%0.28746%0.459SS..Hα-helixtrans-72.3-33.7-179.9-610000112.9S113 I114 L120 M121S113-S117 WeakPolarHBondContact O-CB 3.37Å; S113-S117 PolarHBondContact O-N 3.38Å; S113-S117 PolarHBondContact O-OG 2.85Å; I114-S117 WeakPolarHBondContact O-CB 3.31Å; I114-S117 PolarHBondContact O-N 3.4Å; S117-L120 PolarHBondContact O-N 3.37Å; S117-L120 VanDerWaalsContact O-N 3.16Å; S117-M121 PolarHBondContact O-N 3.33Å
118I91.9Very high90.8Very high83 Ų8381.9 Ų81.943%0.42647%0.469SS..Hα-helixtrans-55.1-54.6-179.2-71164.2000111.5I114 L120 M121 M122I114-I118 HydrophobicContact CG2-CD1 4.11Å; I114-I118 HydrophobicContact CG2-CG1 4.39Å; I114-I118 WeakPolarHBondContact O-CG1 3.4Å; I114-I118 PolarHBondContact O-N 2.88Å; I118-L120 VanDerWaalsContact C-N 3.26Å; I118-L120 PolarHBondContact O-N 2.99Å; I118-M121 PolarHBondContact O-N 3.41Å; I118-M122 HydrophobicContact CG2-CG 4.12Å; I118-M122 WeakPolarHBondContact O-CB 3.31Å; I118-M122 WeakPolarHBondContact O-CG 3.36Å; I118-M122 PolarHBondContact O-N 3.35Å
119P90.3Very high90.5Very high82 Ų8278.7 Ų78.753%0.53245%0.452SS..Hα-helixtrans-55.1-38.9176.9-26.732.2000114.1A115 V116 M122 F123A115-P119 WeakPolarHBondContact O-CD 3.44Å; V116-P119 WeakPolarHBondContact O-CD 3.39Å; P119-M122 PolarHBondContact O-N 3.4Å; P119-F123 PolarHBondContact O-N 3Å
120L90Very high90.1Very high127 Ų12777.4 Ų77.467%0.66544%0.435SS*.Hα-helixtrans-67.4-39.9-179.2-64175.7000111.7S117 I118 P124S117-L120 PolarHBondContact O-N 3.37Å; S117-L120 VanDerWaalsContact O-N 3.16Å; I118-L120 VanDerWaalsContact C-N 3.26Å; I118-L120 PolarHBondContact O-N 2.99Å; L120-P124 WeakPolarHBondContact O-CD 3.39Å
121M90.5Very high89.7Confident136 Ų13674.4 Ų74.467%0.6743%0.427SS*.Hα-helixtrans-76-28.9177-65.6-172.6-176.200112.9S117 I118 F123 P124 A125S117-M121 PolarHBondContact O-N 3.33Å; I118-M121 PolarHBondContact O-N 3.41Å; M121-F123 VanDerWaalsContact C-N 3.28Å; M121-F123 PolarHBondContact O-N 2.91Å; M121-P124 VanDerWaalsContact O-CD 3.25Å; M121-P124 WeakPolarHBondContact O-CD 3.34Å; M121-P124 WeakPolarHBondContact O-CG 3.39Å; M121-A125 WeakPolarHBondContact O-CB 3.38Å; M121-A125 PolarHBondContact O-N 3.36Å
122M88.9Confident89.2Confident27 Ų2775.9 Ų75.913%0.13344%0.435CS..Hα-helixtrans-63.7-32.5177.9-76.8-66.4-62.200112.7I118 P119 R126 T155 I158 L159I118-M122 HydrophobicContact CG2-CG 4.12Å; I118-M122 WeakPolarHBondContact O-CB 3.31Å; I118-M122 WeakPolarHBondContact O-CG 3.36Å; I118-M122 PolarHBondContact O-N 3.35Å; P119-M122 PolarHBondContact O-N 3.4Å; M122-R126 WeakPolarHBondContact O-CB 3.34Å; M122-R126 PolarHBondContact O-N 2.8Å; M122-T155 HydrophobicContact CE-CG2 3.78Å; M122-I158 HydrophobicContact CE-CB 3.78Å; M122-I158 HydrophobicContact CE-CD1 4.21Å; M122-I158 HydrophobicContact CE-CG2 3.58Å; M122-I158 HydrophobicContact SD-CB 4.42Å; M122-I158 HydrophobicContact SD-CG2 3.55Å; M122-I158 VanDerWaalsContact SD-CG2 3.55Å; M122-L159 HydrophobicContact CE-CD2 4.14Å; M122-L159 HydrophobicContact CE-CG 3.97Å; M122-L159 HydrophobicContact SD-CD2 4.08Å
123F86.4Confident88.6Confident133 Ų13376 Ų7658%0.58344%0.435SS*.Hα-helixtrans-60.1-58.2-179.9-179.9-94.3000113.5P119 M121 A125 R126 T127P119-F123 PolarHBondContact O-N 3Å; M121-F123 VanDerWaalsContact C-N 3.28Å; M121-F123 PolarHBondContact O-N 2.91Å; F123-A125 PolarHBondContact O-N 3.4Å; F123-R126 PolarHBondContact O-N 3.22Å; F123-T127 PolarHBondContact O-N 3.31Å; F123-T127 VanDerWaalsContact O-N 3.16Å; F123-T127 PolarHBondContact O-OG1 3.22Å
124P87.4Confident87.6Confident74 Ų7476.8 Ų76.848%0.48143%0.433SS..Hα-helixtrans-65.9-35.9177.125.8-34.1000112.5L120 M121 R126 T127 A128L120-P124 WeakPolarHBondContact O-CD 3.39Å; M121-P124 VanDerWaalsContact O-CD 3.25Å; M121-P124 WeakPolarHBondContact O-CD 3.34Å; M121-P124 WeakPolarHBondContact O-CG 3.39Å; P124-R126 VanDerWaalsContact C-N 3.34Å; P124-R126 PolarHBondContact O-N 3.35Å; P124-T127 PolarHBondContact O-N 2.91Å; P124-A128 WeakPolarHBondContact O-CB 3.47Å; P124-A128 PolarHBondContact O-N 3.4Å
125A87.6Confident86.3Confident46 Ų4681.7 Ų81.738%0.3845%0.447SS..Hα-helixtrans-59.8-45.2177.400000111.8M121 F123 A128 L129M121-A125 WeakPolarHBondContact O-CB 3.38Å; M121-A125 PolarHBondContact O-N 3.36Å; F123-A125 PolarHBondContact O-N 3.4Å; A125-A128 PolarHBondContact O-N 2.91Å; A125-L129 WeakPolarHBondContact O-CB 2.9Å; A125-L129 PolarHBondContact O-N 3.01Å
126R88.3Confident84.7Confident55 Ų5585 Ų8521%0.20846%0.457CS..Hα-helixtrans-62.7-45.5176.5-175.3-173.267.2173.7-0.6111.8M122 F123 P124 A128 L129 F130 L154 I158M122-R126 WeakPolarHBondContact O-CB 3.34Å; M122-R126 PolarHBondContact O-N 2.8Å; F123-R126 PolarHBondContact O-N 3.22Å; P124-R126 VanDerWaalsContact C-N 3.34Å; P124-R126 PolarHBondContact O-N 3.35Å; R126-A128 VanDerWaalsContact C-N 3.34Å; R126-A128 PolarHBondContact O-N 3.29Å; R126-L129 PolarHBondContact O-N 3.44Å; R126-F130 WeakPolarHBondContact O-CB 3.3Å; R126-F130 PolarHBondContact O-N 3.17Å; R126-L154 HydrophobicContact CG-CB 4.39Å; R126-L154 HydrophobicContact CG-CD2 3.57Å; R126-L154 HydrophobicContact CG-CG 4.03Å; R126-L154 WeakPolarHBondContact O-CD2 3.47Å; R126-I158 HydrophobicContact CB-CD1 4.31Å
127T84.4Confident82.9Confident64 Ų6490.7 Ų90.739%0.39348%0.475SS..Hα-helixtrans-62.3-42.9178.3-58.70000111.3F123 P124 F130 C131F123-T127 PolarHBondContact O-N 3.31Å; F123-T127 VanDerWaalsContact O-N 3.16Å; F123-T127 PolarHBondContact O-OG1 3.22Å; P124-T127 PolarHBondContact O-N 2.91Å; T127-F130 PolarHBondContact O-N 2.86Å; T127-C131 WeakPolarHBondContact O-CB 3.47Å; T127-C131 PolarHBondContact O-N 3.42Å; T127-C131 PolarHBondContact O-SG 2.94Å; T127-C131 VanDerWaalsContact O-SG 3.37Å
128A86.7Confident80.8Confident63 Ų6397.2 Ų97.252%0.52150%0.501SS..Hα-helixtrans-61.5-45.3176.200000111.8P124 A125 R126 C131 L132P124-A128 WeakPolarHBondContact O-CB 3.47Å; P124-A128 PolarHBondContact O-N 3.4Å; A125-A128 PolarHBondContact O-N 2.91Å; R126-A128 VanDerWaalsContact C-N 3.34Å; R126-A128 PolarHBondContact O-N 3.29Å; A128-C131 PolarHBondContact O-N 3.06Å; A128-L132 WeakPolarHBondContact O-CB 3.32Å; A128-L132 PolarHBondContact O-N 2.93Å
129L85.9Confident78.7Confident49 Ų4997.6 Ų97.626%0.25751%0.511SS..Hα-helixtrans-67.3-40.7179.7-168.361.3000112.2A125 R126 L132 I133 L154 I158A125-L129 WeakPolarHBondContact O-CB 2.9Å; A125-L129 PolarHBondContact O-N 3.01Å; R126-L129 PolarHBondContact O-N 3.44Å; L129-L132 PolarHBondContact O-N 3.21Å; L129-I133 HydrophobicContact CD1-CD1 3.51Å; L129-I133 HydrophobicContact CD1-CG1 4.06Å; L129-I133 HydrophobicContact CG-CD1 3.84Å; L129-I133 HydrophobicContact CG-CG1 4.49Å; L129-I133 PolarHBondContact O-N 3.29Å; L129-L154 HydrophobicContact CB-CD1 4.34Å; L129-L154 HydrophobicContact CB-CD2 4.45Å; L129-L154 HydrophobicContact CD2-CD1 3.39Å; L129-L154 HydrophobicContact CD2-CG 4.15Å; L129-L154 HydrophobicContact CG-CD1 3.78Å; L129-I158 HydrophobicContact CD2-CD1 3.84Å; L129-I158 HydrophobicContact CD2-CG1 3.67Å
130F84.2Confident76.7Confident32 Ų32101.4 Ų101.414%0.1453%0.525CS..Hα-helixtrans-58.5-48.7173.1177.6-100.4000111.1R126 T127 L132 L134 R135 V144 L146 L154R126-F130 WeakPolarHBondContact O-CB 3.3Å; R126-F130 PolarHBondContact O-N 3.17Å; T127-F130 PolarHBondContact O-N 2.86Å; F130-L132 PolarHBondContact O-N 3.48Å; F130-L134 HydrophobicContact CD2-CB 3.73Å; F130-L134 HydrophobicContact CD2-CD1 3.46Å; F130-L134 VanDerWaalsContact CD2-CD1 3.46Å; F130-L134 HydrophobicContact CD2-CG 4.22Å; F130-L134 HydrophobicContact CE2-CB 3.44Å; F130-L134 VanDerWaalsContact CE2-CB 3.44Å; F130-L134 HydrophobicContact CE2-CD1 3.68Å; F130-L134 HydrophobicContact CE2-CG 4.14Å; F130-L134 HydrophobicContact CZ-CB 4.1Å; F130-L134 WeakPolarHBondContact O-CB 3.34Å; F130-L134 PolarHBondContact O-N 3.24Å; F130-R135 PolarHBondContact O-N 3.36Å; F130-V144 HydrophobicContact CE1-CG1 4.24Å; F130-V144 HydrophobicContact CE1-CG2 4.38Å; F130-V144 HydrophobicContact CZ-CG1 3.76Å; F130-L146 HydrophobicContact CD2-CD1 4.29Å; F130-L146 HydrophobicContact CD2-CD2 3.44Å; F130-L146 VanDerWaalsContact CD2-CD2 3.44Å; F130-L146 HydrophobicContact CE2-CD1 3.29Å; F130-L146 HydrophobicContact CE2-CD2 3.27Å; F130-L146 HydrophobicContact CE2-CG 3.9Å; F130-L146 HydrophobicContact CG-CD2 4.24Å; F130-L146 HydrophobicContact CZ-CD1 3.63Å; F130-L146 HydrophobicContact CZ-CD2 3.92Å; F130-L146 HydrophobicContact CZ-CG 4.33Å; F130-L154 HydrophobicContact CB-CD2 3.86Å
131C82.8Confident74.5Confident45 Ų45100.8 Ų100.830%0.30453%0.527SS..Hα-helixtrans-65.8-22177.8-72.70000114.2T127 A128 R135T127-C131 WeakPolarHBondContact O-CB 3.47Å; T127-C131 PolarHBondContact O-N 3.42Å; T127-C131 PolarHBondContact O-SG 2.94Å; T127-C131 VanDerWaalsContact O-SG 3.37Å; A128-C131 PolarHBondContact O-N 3.06Å; C131-R135 WeakPolarHBondContact O-CB 3.48Å
132L83.4Confident72.4Confident141 Ų141102.6 Ų102.674%0.73853%0.533SS*.Hα-helixtrans-85.2-42.4179.2-175.266.5000112.4A128 L129 F130A128-L132 WeakPolarHBondContact O-CB 3.32Å; A128-L132 PolarHBondContact O-N 2.93Å; L129-L132 PolarHBondContact O-N 3.21Å; F130-L132 PolarHBondContact O-N 3.48Å
133I81Confident70.3Confident117 Ų117106.9 Ų106.960%0.656%0.561SS**Hα-helixtrans-95.3-41-171.7-60.1179.6000112.2L129L129-I133 HydrophobicContact CD1-CD1 3.51Å; L129-I133 HydrophobicContact CD1-CG1 4.06Å; L129-I133 HydrophobicContact CG-CD1 3.84Å; L129-I133 HydrophobicContact CG-CG1 4.49Å; L129-I133 PolarHBondContact O-N 3.29Å
134L74.2Confident68.6Low86 Ų86105.1 Ų105.145%0.4556%0.561SS.*THydrogen-bonded Turntrans-109.4-7.7-165.7-73.4152.5000113.4F130 D136 T150F130-L134 HydrophobicContact CD2-CB 3.73Å; F130-L134 HydrophobicContact CD2-CD1 3.46Å; F130-L134 VanDerWaalsContact CD2-CD1 3.46Å; F130-L134 HydrophobicContact CD2-CG 4.22Å; F130-L134 HydrophobicContact CE2-CB 3.44Å; F130-L134 VanDerWaalsContact CE2-CB 3.44Å; F130-L134 HydrophobicContact CE2-CD1 3.68Å; F130-L134 HydrophobicContact CE2-CG 4.14Å; F130-L134 HydrophobicContact CZ-CB 4.1Å; F130-L134 WeakPolarHBondContact O-CB 3.34Å; F130-L134 PolarHBondContact O-N 3.24Å; L134-D136 PolarHBondContact O-N 3.44Å; L134-T150 HydrophobicContact CD1-CG2 3.89Å
135R66.9Low66.8Low176 Ų176109 Ų10966%0.66458%0.578SS**  trans-76.8108178.4-176152.865.9162.73.9110.5F130 C131F130-R135 PolarHBondContact O-N 3.36Å; C131-R135 WeakPolarHBondContact O-CB 3.48Å
136D58.5Low65.2Low121 Ų121108.2 Ų108.265%0.64757%0.567SS**  trans-71141.8167.4-155.4-7.3000110.7L134 E138L134-D136 PolarHBondContact O-N 3.44Å; D136-E138 VanDerWaalsContact C-N 3.26Å; D136-E138 PolarHBondContact O-N 3.17Å
137K57Low64Low206 Ų206112.2 Ų112.290%0.89659%0.588SS**THydrogen-bonded Turntrans-73.9-12.4-170.6-76.9179177.9172.90113.8
138E51.2Low63.3Low179 Ų179117.2 Ų117.284%0.83660%0.604SS**THydrogen-bonded Turntrans-106-8.9-174.4-72.3-164.6147.800115.8D136 I140D136-E138 VanDerWaalsContact C-N 3.26Å; D136-E138 PolarHBondContact O-N 3.17Å; E138-I140 PolarHBondContact O-N 3.39Å; E138-I140 VanDerWaalsContact O-N 3.15Å
139S47Very low62.8Low90 Ų90120.8 Ų120.863%0.62961%0.608SS**  trans-90.483-178.7-1760000112T141S139-T141 PolarHBondContact O-N 3.01Å
140I49.2Very low62.4Low162 Ų162120.1 Ų120.183%0.83161%0.606SS**  trans-87.952.7164.9-47178.4000108.4E138E138-I140 PolarHBondContact O-N 3.39Å; E138-I140 VanDerWaalsContact O-N 3.15Å
141T42.3Very low62.1Low115 Ų115121.7 Ų121.771%0.70661%0.613SS**  trans-140.5129171.5-39.10000110.3S139S139-T141 PolarHBondContact O-N 3.01Å
142H47.2Very low62.2Low174 Ų174125.9 Ų125.981%0.80663%0.628SS**SBendtrans-51.2159.6-176.3-85.3-113.1000114.1
143T44Very low62.4Low117 Ų117123 Ų12372%0.71861%0.613SS**  trans68.375.2175.669.80000113.9D145T143-D145 PolarHBondContact O-N 2.97Å
144V51.5Low62.7Low96 Ų96118.2 Ų118.258%0.58259%0.588SS**  trans-6586.1151.6-155.40000106.1F130 L146F130-V144 HydrophobicContact CE1-CG1 4.24Å; F130-V144 HydrophobicContact CE1-CG2 4.38Å; F130-V144 HydrophobicContact CZ-CG1 3.76Å; V144-L146 HydrophobicContact CB-CB 4.36Å; V144-L146 HydrophobicContact CG1-CB 3.62Å; V144-L146 HydrophobicContact CG1-CD1 3.62Å; V144-L146 HydrophobicContact CG1-CG 4.18Å; V144-L146 PolarHBondContact O-N 2.97Å
145D49.2Very low63.4Low155 Ų155116.1 Ų116.183%0.82958%0.579SS**  trans-65.269.6154.3-84-34.4000106.3T143 E147T143-D145 PolarHBondContact O-N 2.97Å; D145-E147 PolarHBondContact O-N 3.43Å; D145-E147 VanDerWaalsContact O-N 3.14Å
146L54.9Low64.5Low29 Ų29110.3 Ų110.315%0.15257%0.569CS.*  trans-72.5113.7179.9-165.173.4000105.1F130 V144 K148 T150 F151F130-L146 HydrophobicContact CD2-CD1 4.29Å; F130-L146 HydrophobicContact CD2-CD2 3.44Å; F130-L146 VanDerWaalsContact CD2-CD2 3.44Å; F130-L146 HydrophobicContact CE2-CD1 3.29Å; F130-L146 HydrophobicContact CE2-CD2 3.27Å; F130-L146 HydrophobicContact CE2-CG 3.9Å; F130-L146 HydrophobicContact CG-CD2 4.24Å; F130-L146 HydrophobicContact CZ-CD1 3.63Å; F130-L146 HydrophobicContact CZ-CD2 3.92Å; F130-L146 HydrophobicContact CZ-CG 4.33Å; V144-L146 HydrophobicContact CB-CB 4.36Å; V144-L146 HydrophobicContact CG1-CB 3.62Å; V144-L146 HydrophobicContact CG1-CD1 3.62Å; V144-L146 HydrophobicContact CG1-CG 4.18Å; V144-L146 PolarHBondContact O-N 2.97Å; L146-K148 PolarHBondContact O-N 3.11Å; L146-K148 VanDerWaalsContact O-N 3.14Å; L146-T150 HydrophobicContact CD1-CG2 4.2Å; L146-T150 HydrophobicContact CD2-CG2 3.99Å; L146-T150 HydrophobicContact CG-CG2 4.14Å; L146-F151 HydrophobicContact CB-CD2 4.06Å; L146-F151 HydrophobicContact CB-CE2 3.45Å; L146-F151 VanDerWaalsContact CB-CE2 3.45Å; L146-F151 HydrophobicContact CB-CZ 3.78Å; L146-F151 HydrophobicContact CD2-CD1 4.1Å; L146-F151 HydrophobicContact CD2-CD2 4.11Å; L146-F151 HydrophobicContact CD2-CE1 3.87Å; L146-F151 HydrophobicContact CD2-CE2 3.95Å; L146-F151 HydrophobicContact CD2-CG 4.22Å; L146-F151 HydrophobicContact CD2-CZ 3.79Å; L146-F151 HydrophobicContact CG-CD2 4.34Å; L146-F151 HydrophobicContact CG-CE2 4.13Å; L146-F151 HydrophobicContact CG-CZ 4.38Å; L146-F151 VanDerWaalsContact O-CD2 3.3Å; L146-F151 WeakPolarHBondContact O-CD2 3.33Å; L146-F151 WeakPolarHBondContact O-CE2 3.2Å
147E62.8Low66.1Low139 Ų139108.6 Ų108.665%0.6556%0.562SS**  trans-36.3121.7176-146.4171-17000108.8D145 F149 T150D145-E147 PolarHBondContact O-N 3.43Å; D145-E147 VanDerWaalsContact O-N 3.14Å; E147-F149 HydrophobicContact CG-CB 4.3Å; E147-F149 CarbonylContact O-C 3.55Å; E147-F149 PolarHBondContact O-N 3.07Å; E147-T150 PolarHBondContact O-N 3.03Å
148K69.8Low67.7Low170 Ų17099.8 Ų99.874%0.73953%0.525SS*.Hα-helixtrans-44.9-31.6-179.6-67.5174.8-177.91760110.7L146 F151 H152L146-K148 PolarHBondContact O-N 3.11Å; L146-K148 VanDerWaalsContact O-N 3.14Å; K148-F151 WeakPolarHBondContact O-CB 3.44Å; K148-F151 PolarHBondContact O-N 3.35Å; K148-H152 PolarHBondContact O-N 3.19Å; K148-H152 VanDerWaalsContact O-N 3.07Å; K148-H152 PolarHBondContact O-ND1 3.31Å
149F74.8Confident69.7Low138 Ų13894.9 Ų94.961%0.60550%0.504SS*.Hα-helixtrans-56.1-49.8173.9-164-114.5000115E147 F151 H152 I153E147-F149 HydrophobicContact CG-CB 4.3Å; E147-F149 CarbonylContact O-C 3.55Å; E147-F149 PolarHBondContact O-N 3.07Å; F149-F151 VanDerWaalsContact C-N 3.26Å; F149-F151 PolarHBondContact O-N 3.09Å; F149-H152 PolarHBondContact O-N 3.19Å; F149-H152 VanDerWaalsContact O-N 3.14Å; F149-I153 HydrophobicContact CD1-CD1 3.58Å; F149-I153 HydrophobicContact CD1-CG1 4.46Å; F149-I153 HydrophobicContact CE1-CD1 3.22Å; F149-I153 HydrophobicContact CE1-CG1 4.26Å; F149-I153 HydrophobicContact CE2-CD1 4.37Å; F149-I153 HydrophobicContact CG-CD1 4.31Å; F149-I153 HydrophobicContact CZ-CD1 3.66Å; F149-I153 HydrophobicContact CZ-CG1 4.36Å; F149-I153 WeakPolarHBondContact O-CG1 3.44Å; F149-I153 PolarHBondContact O-N 3.35Å
150T78.4Confident71.9Confident34 Ų3495.9 Ų95.921%0.20950%0.502CS..Hα-helixtrans-61.2-37.3177-46.50000111.4L134 L146 E147 I153 L154L134-T150 HydrophobicContact CD1-CG2 3.89Å; L146-T150 HydrophobicContact CD1-CG2 4.2Å; L146-T150 HydrophobicContact CD2-CG2 3.99Å; L146-T150 HydrophobicContact CG-CG2 4.14Å; E147-T150 PolarHBondContact O-N 3.03Å; T150-I153 PolarHBondContact O-N 2.92Å; T150-L154 WeakPolarHBondContact O-CB 3.39Å; T150-L154 PolarHBondContact O-N 3.37Å
151F78.9Confident73.9Confident65 Ų6593.8 Ų93.829%0.28549%0.487SS..Hα-helixtrans-64.1-41.2175.1-77.3-68.2000112.9L146 K148 F149 T155L146-F151 HydrophobicContact CB-CD2 4.06Å; L146-F151 HydrophobicContact CB-CE2 3.45Å; L146-F151 VanDerWaalsContact CB-CE2 3.45Å; L146-F151 HydrophobicContact CB-CZ 3.78Å; L146-F151 HydrophobicContact CD2-CD1 4.1Å; L146-F151 HydrophobicContact CD2-CD2 4.11Å; L146-F151 HydrophobicContact CD2-CE1 3.87Å; L146-F151 HydrophobicContact CD2-CE2 3.95Å; L146-F151 HydrophobicContact CD2-CG 4.22Å; L146-F151 HydrophobicContact CD2-CZ 3.79Å; L146-F151 HydrophobicContact CG-CD2 4.34Å; L146-F151 HydrophobicContact CG-CE2 4.13Å; L146-F151 HydrophobicContact CG-CZ 4.38Å; L146-F151 VanDerWaalsContact O-CD2 3.3Å; L146-F151 WeakPolarHBondContact O-CD2 3.33Å; L146-F151 WeakPolarHBondContact O-CE2 3.2Å; K148-F151 WeakPolarHBondContact O-CB 3.44Å; K148-F151 PolarHBondContact O-N 3.35Å; F149-F151 VanDerWaalsContact C-N 3.26Å; F149-F151 PolarHBondContact O-N 3.09Å; F151-T155 WeakPolarHBondContact O-CB 3.35Å; F151-T155 PolarHBondContact O-N 3.25Å; F151-T155 PolarHBondContact O-OG1 3.49Å
152H84.1Confident76.3Confident133 Ų13392.4 Ų92.462%0.61648%0.475SS*.Hα-helixtrans-69.2-43.1177-71.191.9000111.2K148 F149 L154 T155 A156K148-H152 PolarHBondContact O-N 3.19Å; K148-H152 VanDerWaalsContact O-N 3.07Å; K148-H152 PolarHBondContact O-ND1 3.31Å; F149-H152 PolarHBondContact O-N 3.19Å; F149-H152 VanDerWaalsContact O-N 3.14Å; H152-L154 PolarHBondContact O-N 2.94Å; H152-T155 PolarHBondContact O-N 3.47Å; H152-A156 WeakPolarHBondContact O-CB 3.34Å; H152-A156 PolarHBondContact O-N 2.62Å
153I87.8Confident78.4Confident81 Ų8187.9 Ų87.942%0.41546%0.46SS..Hα-helixtrans-59.4-49.2176.6-71.4174.9000110.7F149 T150 T155 A156 V157F149-I153 HydrophobicContact CD1-CD1 3.58Å; F149-I153 HydrophobicContact CD1-CG1 4.46Å; F149-I153 HydrophobicContact CE1-CD1 3.22Å; F149-I153 HydrophobicContact CE1-CG1 4.26Å; F149-I153 HydrophobicContact CE2-CD1 4.37Å; F149-I153 HydrophobicContact CG-CD1 4.31Å; F149-I153 HydrophobicContact CZ-CD1 3.66Å; F149-I153 HydrophobicContact CZ-CG1 4.36Å; F149-I153 WeakPolarHBondContact O-CG1 3.44Å; F149-I153 PolarHBondContact O-N 3.35Å; T150-I153 PolarHBondContact O-N 2.92Å; I153-T155 VanDerWaalsContact C-N 3.29Å; I153-T155 PolarHBondContact O-N 3.01Å; I153-A156 PolarHBondContact O-N 3.04Å; I153-A156 VanDerWaalsContact O-N 3.15Å; I153-V157 HydrophobicContact CG2-CG2 4.22Å; I153-V157 WeakPolarHBondContact O-CG2 3.48Å; I153-V157 PolarHBondContact O-N 2.96Å
154L86.3Confident80.7Confident17 Ų1786.2 Ų86.29%0.08945%0.446CS..Hα-helixtrans-61.8-41.1-177.2-166.961.3000111.7R126 L129 F130 T150 H152 V157 I158R126-L154 HydrophobicContact CG-CB 4.39Å; R126-L154 HydrophobicContact CG-CD2 3.57Å; R126-L154 HydrophobicContact CG-CG 4.03Å; R126-L154 WeakPolarHBondContact O-CD2 3.47Å; L129-L154 HydrophobicContact CB-CD1 4.34Å; L129-L154 HydrophobicContact CB-CD2 4.45Å; L129-L154 HydrophobicContact CD2-CD1 3.39Å; L129-L154 HydrophobicContact CD2-CG 4.15Å; L129-L154 HydrophobicContact CG-CD1 3.78Å; F130-L154 HydrophobicContact CB-CD2 3.86Å; T150-L154 WeakPolarHBondContact O-CB 3.39Å; T150-L154 PolarHBondContact O-N 3.37Å; H152-L154 PolarHBondContact O-N 2.94Å; L154-V157 PolarHBondContact O-N 3.4Å; L154-I158 HydrophobicContact CG-CD1 4.34Å; L154-I158 WeakPolarHBondContact O-CD1 3.42Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.4Å; L154-I158 PolarHBondContact O-N 3.01Å; L154-I158 VanDerWaalsContact O-N 3.08Å
155T89.3Confident82.5Confident41 Ų4185 Ų8525%0.25244%0.436SS..Hα-helixtrans-65-43.8175.9-52.30000111M122 F151 H152 I153 I158 L159M122-T155 HydrophobicContact CE-CG2 3.78Å; F151-T155 WeakPolarHBondContact O-CB 3.35Å; F151-T155 PolarHBondContact O-N 3.25Å; F151-T155 PolarHBondContact O-OG1 3.49Å; H152-T155 PolarHBondContact O-N 3.47Å; I153-T155 VanDerWaalsContact C-N 3.29Å; I153-T155 PolarHBondContact O-N 3.01Å; T155-I158 PolarHBondContact O-N 3.45Å; T155-L159 HydrophobicContact CG2-CD1 4.16Å; T155-L159 WeakPolarHBondContact O-CB 3.28Å; T155-L159 WeakPolarHBondContact O-CG 3.32Å; T155-L159 PolarHBondContact O-N 3.18Å
156A90.8Very high84.4Confident55 Ų5580.7 Ų80.746%0.45542%0.421SS..Hα-helixtrans-62.6-42.7177.800000112H152 I153 L159 L160H152-A156 WeakPolarHBondContact O-CB 3.34Å; H152-A156 PolarHBondContact O-N 2.62Å; I153-A156 PolarHBondContact O-N 3.04Å; I153-A156 VanDerWaalsContact O-N 3.15Å; A156-L159 PolarHBondContact O-N 2.92Å; A156-L160 WeakPolarHBondContact O-CB 3.48Å; A156-L160 PolarHBondContact O-N 2.92Å
157V91Very high86.1Confident84 Ų8485.5 Ų85.551%0.50945%0.446SS..Hα-helixtrans-62.7-46.9177.2170.50000111.1I153 L154 L160 F161I153-V157 HydrophobicContact CG2-CG2 4.22Å; I153-V157 WeakPolarHBondContact O-CG2 3.48Å; I153-V157 PolarHBondContact O-N 2.96Å; L154-V157 PolarHBondContact O-N 3.4Å; V157-L160 PolarHBondContact O-N 2.86Å; V157-F161 VanDerWaalsContact O-CB 3.29Å; V157-F161 WeakPolarHBondContact O-CB 3.46Å; V157-F161 PolarHBondContact O-N 3.3Å
158I91.1Very high87.3Confident21 Ų2184.9 Ų84.911%0.10845%0.446CS..Hα-helixtrans-61.8-47.7178.2-65.5163.9000110.4M122 R126 L129 L154 T155 F161 N162M122-I158 HydrophobicContact CE-CB 3.78Å; M122-I158 HydrophobicContact CE-CD1 4.21Å; M122-I158 HydrophobicContact CE-CG2 3.58Å; M122-I158 HydrophobicContact SD-CB 4.42Å; M122-I158 HydrophobicContact SD-CG2 3.55Å; M122-I158 VanDerWaalsContact SD-CG2 3.55Å; R126-I158 HydrophobicContact CB-CD1 4.31Å; L129-I158 HydrophobicContact CD2-CD1 3.84Å; L129-I158 HydrophobicContact CD2-CG1 3.67Å; L154-I158 HydrophobicContact CG-CD1 4.34Å; L154-I158 WeakPolarHBondContact O-CD1 3.42Å; L154-I158 VanDerWaalsContact O-CG1 3.26Å; L154-I158 WeakPolarHBondContact O-CG1 3.4Å; L154-I158 PolarHBondContact O-N 3.01Å; L154-I158 VanDerWaalsContact O-N 3.08Å; T155-I158 PolarHBondContact O-N 3.45Å; I158-F161 PolarHBondContact O-N 3.27Å; I158-N162 WeakPolarHBondContact CG2-ND2 3.29Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.24Å
159L92.8Very high88Confident76 Ų7678.3 Ų78.340%0.39842%0.42SS..Hα-helixtrans-64.6-45.4-179.7-73.3176.8000111.8M122 T155 A156 F161 N162 T163M122-L159 HydrophobicContact CE-CD2 4.14Å; M122-L159 HydrophobicContact CE-CG 3.97Å; M122-L159 HydrophobicContact SD-CD2 4.08Å; T155-L159 HydrophobicContact CG2-CD1 4.16Å; T155-L159 WeakPolarHBondContact O-CB 3.28Å; T155-L159 WeakPolarHBondContact O-CG 3.32Å; T155-L159 PolarHBondContact O-N 3.18Å; A156-L159 PolarHBondContact O-N 2.92Å; L159-F161 VanDerWaalsContact C-N 3.32Å; L159-F161 PolarHBondContact O-N 3.19Å; L159-N162 PolarHBondContact O-N 3.08Å; L159-T163 WeakPolarHBondContact O-CB 3.25Å; L159-T163 PolarHBondContact O-N 3.37Å; L159-T163 PolarHBondContact O-OG1 2.84Å
160L93.6Very high88.3Confident111 Ų11177.3 Ų77.358%0.58143%0.428SS*.Hα-helixtrans-61.5-41.8179.1-175145.4000111.3A156 V157 T163 I164A156-L160 WeakPolarHBondContact O-CB 3.48Å; A156-L160 PolarHBondContact O-N 2.92Å; V157-L160 PolarHBondContact O-N 2.86Å; L160-T163 PolarHBondContact O-N 3.35Å; L160-I164 HydrophobicContact CD2-CD1 3.46Å; L160-I164 VanDerWaalsContact CD2-CD1 3.46Å; L160-I164 HydrophobicContact CD2-CG1 4.37Å; L160-I164 HydrophobicContact CG-CD1 4.28Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 3.31Å
161F92Very high88.6Confident119 Ų11978.2 Ų78.252%0.52243%0.431SS..Hα-helixtrans-61-48.3174.2176.9-103.2000112.3V157 I158 L159 T163 I164 L165V157-F161 VanDerWaalsContact O-CB 3.29Å; V157-F161 WeakPolarHBondContact O-CB 3.46Å; V157-F161 PolarHBondContact O-N 3.3Å; I158-F161 PolarHBondContact O-N 3.27Å; L159-F161 VanDerWaalsContact C-N 3.32Å; L159-F161 PolarHBondContact O-N 3.19Å; F161-T163 VanDerWaalsContact C-N 3.34Å; F161-T163 PolarHBondContact O-N 3.38Å; F161-I164 PolarHBondContact O-N 2.86Å; F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.38Å; F161-L165 HydrophobicContact CE1-CG 4.26Å; F161-L165 HydrophobicContact CE2-CD1 4.25Å; F161-L165 HydrophobicContact CE2-CG 4.38Å; F161-L165 HydrophobicContact CZ-CD1 3.52Å; F161-L165 HydrophobicContact CZ-CD2 4.49Å; F161-L165 HydrophobicContact CZ-CG 4.13Å; F161-L165 WeakPolarHBondContact O-CG 3.41Å; F161-L165 PolarHBondContact O-N 2.87Å
162N91.9Very high88.9Confident85 Ų8578.6 Ų78.646%0.45544%0.439SS..Hα-helixtrans-62.9-39.4177.3-78.1-78000112.1I158 L159 L165 A166I158-N162 WeakPolarHBondContact CG2-ND2 3.29Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.24Å; L159-N162 PolarHBondContact O-N 3.08Å; N162-L165 PolarHBondContact O-N 3.49Å; N162-A166 WeakPolarHBondContact O-CB 3.31Å; N162-A166 PolarHBondContact O-N 3.08Å
163T91.8Very high89.1Confident80 Ų8075.9 Ų75.949%0.49143%0.426SS..Hα-helixtrans-64.3-43.2176.8-60.20000111.6L159 L160 F161 A166 I167L159-T163 WeakPolarHBondContact O-CB 3.25Å; L159-T163 PolarHBondContact O-N 3.37Å; L159-T163 PolarHBondContact O-OG1 2.84Å; L160-T163 PolarHBondContact O-N 3.35Å; F161-T163 VanDerWaalsContact C-N 3.34Å; F161-T163 PolarHBondContact O-N 3.38Å; T163-A166 PolarHBondContact O-N 2.96Å; T163-I167 HydrophobicContact CG2-CD1 3.97Å; T163-I167 WeakPolarHBondContact O-CG1 3.42Å; T163-I167 PolarHBondContact O-N 3.36Å
164I92.9Very high89.1Confident82 Ų8273.4 Ų73.442%0.42141%0.413SS..Hα-helixtrans-61.4-46.3176-70.9171.3000110.4L160 F161 A166 I167 L168L160-I164 HydrophobicContact CD2-CD1 3.46Å; L160-I164 VanDerWaalsContact CD2-CD1 3.46Å; L160-I164 HydrophobicContact CD2-CG1 4.37Å; L160-I164 HydrophobicContact CG-CD1 4.28Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 3.31Å; F161-I164 PolarHBondContact O-N 2.86Å; I164-A166 VanDerWaalsContact C-N 3.32Å; I164-A166 PolarHBondContact O-N 3.32Å; I164-I167 PolarHBondContact O-N 2.88Å; I164-L168 HydrophobicContact CG2-CD1 3.68Å; I164-L168 HydrophobicContact CG2-CG 4.22Å; I164-L168 WeakPolarHBondContact O-CB 3.38Å; I164-L168 VanDerWaalsContact O-CG 3.3Å; I164-L168 WeakPolarHBondContact O-CG 3.43Å; I164-L168 PolarHBondContact O-N 3.42Å
165L88.9Confident89.3Confident71 Ų7175.7 Ų75.737%0.37242%0.424SS..Hα-helixtrans-60.1-41.8176.7-72.4-179.3000112.3F161 N162 I167 L168 T169F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.38Å; F161-L165 HydrophobicContact CE1-CG 4.26Å; F161-L165 HydrophobicContact CE2-CD1 4.25Å; F161-L165 HydrophobicContact CE2-CG 4.38Å; F161-L165 HydrophobicContact CZ-CD1 3.52Å; F161-L165 HydrophobicContact CZ-CD2 4.49Å; F161-L165 HydrophobicContact CZ-CG 4.13Å; F161-L165 WeakPolarHBondContact O-CG 3.41Å; F161-L165 PolarHBondContact O-N 2.87Å; N162-L165 PolarHBondContact O-N 3.49Å; L165-I167 VanDerWaalsContact C-N 3.31Å; L165-I167 PolarHBondContact O-N 3.16Å; L165-L168 PolarHBondContact O-N 3.38Å; L165-T169 PolarHBondContact O-N 2.83Å
166A89.3Confident89.3Confident63 Ų6377.5 Ų77.552%0.52143%0.432SS..Hα-helixtrans-64.4-35.3178.400000112.6N162 T163 I164N162-A166 WeakPolarHBondContact O-CB 3.31Å; N162-A166 PolarHBondContact O-N 3.08Å; T163-A166 PolarHBondContact O-N 2.96Å; I164-A166 VanDerWaalsContact C-N 3.32Å; I164-A166 PolarHBondContact O-N 3.32Å
167I90Very high89.3Confident131 Ų13174.9 Ų74.967%0.67241%0.411SS*.Hα-helixtrans-73.2-38.9176-67.2166.9000111.2T163 I164 L165T163-I167 HydrophobicContact CG2-CD1 3.97Å; T163-I167 WeakPolarHBondContact O-CG1 3.42Å; T163-I167 PolarHBondContact O-N 3.36Å; I164-I167 PolarHBondContact O-N 2.88Å; L165-I167 VanDerWaalsContact C-N 3.31Å; L165-I167 PolarHBondContact O-N 3.16Å
168L87.6Confident89.3Confident125 Ų12573.3 Ų73.365%0.65440%0.399SS*.Hα-helixtrans-74.3-27.9-177.8-71175.6000113.3I164 L165I164-L168 HydrophobicContact CG2-CD1 3.68Å; I164-L168 HydrophobicContact CG2-CG 4.22Å; I164-L168 WeakPolarHBondContact O-CB 3.38Å; I164-L168 VanDerWaalsContact O-CG 3.3Å; I164-L168 WeakPolarHBondContact O-CG 3.43Å; I164-L168 PolarHBondContact O-N 3.42Å; L165-L168 PolarHBondContact O-N 3.38Å
169T85.1Confident89.3Confident33 Ų3374.3 Ų74.320%0.20241%0.406CS..  trans-134.887-173.6-510000111.2L165 N171 F174 I175L165-T169 PolarHBondContact O-N 2.83Å; T169-N171 HydrophobicContact CG2-CB 4.47Å; T169-N171 PolarHBondContact O-N 2.75Å; T169-F174 HydrophobicContact CG2-CD1 3.42Å; T169-F174 VanDerWaalsContact CG2-CD1 3.42Å; T169-F174 HydrophobicContact CG2-CE1 3.93Å; T169-F174 HydrophobicContact CG2-CG 4.28Å; T169-I175 HydrophobicContact CG2-CD1 4.41Å; T169-I175 HydrophobicContact CG2-CG1 4.1Å
170P80.5Confident89.2Confident117 Ų11770.7 Ų70.776%0.7639%0.387SS*.  trans-7929.7179.434.7-36.7000113
171N84.9Confident89.1Confident53 Ų5365.4 Ų65.428%0.28336%0.359SS..  trans-119.6105.3179.2-172-26.4000110.3T169 E173 F174 I175 E246T169-N171 HydrophobicContact CG2-CB 4.47Å; T169-N171 PolarHBondContact O-N 2.75Å; N171-E173 VanDerWaalsContact C-N 3.32Å; N171-E173 PolarHBondContact O-N 3.33Å; N171-E173 WeakPolarHBondContact OD1-CB 3.17Å; N171-E173 PolarHBondContact OD1-N 3Å; N171-F174 HydrophobicContact CB-CB 3.95Å; N171-F174 PolarHBondContact O-N 3.28Å; N171-F174 PolarHBondContact OD1-N 3.25Å; N171-F174 VanDerWaalsContact OD1-N 3.09Å; N171-I175 PolarHBondContact O-N 3.39Å; N171-E246 PolarHBondContact ND2-OE1 3.23Å
172V86Confident89.1Confident73 Ų7364.2 Ų64.244%0.44235%0.354SS..Hα-helixtrans-66.4-33.7-179.6-630000112.5D92 I175 L176D92-V172 HydrophobicContact CB-CG2 3.98Å; V172-I175 PolarHBondContact O-N 3.42Å; V172-L176 VanDerWaalsContact O-CB 3.31Å; V172-L176 WeakPolarHBondContact O-CB 3.46Å; V172-L176 WeakPolarHBondContact O-CG 3.28Å; V172-L176 PolarHBondContact O-N 2.88Å
173E87.3Confident89Confident76 Ų7665 Ų6536%0.35536%0.357SS..Hα-helixtrans-66.1-44178.3-180-177.8160.600110.6I32 G91 N171 L176 G177I32-E173 HydrophobicContact CD1-CG 4Å; G91-E173 WeakPolarHBondContact CA-OE2 3.04Å; N171-E173 VanDerWaalsContact C-N 3.32Å; N171-E173 PolarHBondContact O-N 3.33Å; N171-E173 WeakPolarHBondContact OD1-CB 3.17Å; N171-E173 PolarHBondContact OD1-N 3Å; E173-L176 PolarHBondContact O-N 3.2Å; E173-G177 PolarHBondContact O-N 3.45Å
174F87.9Confident88.8Confident29 Ų2961.3 Ų61.313%0.12734%0.336CS..Hα-helixtrans-60.3-48176175.2-96.4000111.8T169 N171 G177 L178 I242 L243 E246T169-F174 HydrophobicContact CG2-CD1 3.42Å; T169-F174 VanDerWaalsContact CG2-CD1 3.42Å; T169-F174 HydrophobicContact CG2-CE1 3.93Å; T169-F174 HydrophobicContact CG2-CG 4.28Å; N171-F174 HydrophobicContact CB-CB 3.95Å; N171-F174 PolarHBondContact O-N 3.28Å; N171-F174 PolarHBondContact OD1-N 3.25Å; N171-F174 VanDerWaalsContact OD1-N 3.09Å; F174-G177 PolarHBondContact O-N 2.93Å; F174-L178 HydrophobicContact CE1-CD2 4.12Å; F174-L178 HydrophobicContact CZ-CD2 4.16Å; F174-L178 VanDerWaalsContact O-CB 3.3Å; F174-L178 WeakPolarHBondContact O-CB 3.35Å; F174-L178 PolarHBondContact O-N 3.45Å; F174-I242 HydrophobicContact CD2-CG2 3.35Å; F174-I242 HydrophobicContact CE2-CG2 3.51Å; F174-I242 HydrophobicContact CG-CG2 4.36Å; F174-L243 HydrophobicContact CE2-CD2 4.28Å; F174-L243 HydrophobicContact CZ-CD2 4.35Å; F174-E246 HydrophobicContact CB-CG 4.48Å; F174-E246 HydrophobicContact CD2-CG 3.22Å; F174-E246 HydrophobicContact CE2-CG 3.53Å; F174-E246 HydrophobicContact CG-CG 3.99Å; F174-E246 HydrophobicContact CZ-CG 4.48Å
175I90Very high88.7Confident65 Ų6557.6 Ų57.633%0.33332%0.317SS..Hα-helixtrans-64-44.4-179.9-66.8-177.1000110.9T169 N171 V172 T179T169-I175 HydrophobicContact CG2-CD1 4.41Å; T169-I175 HydrophobicContact CG2-CG1 4.1Å; N171-I175 PolarHBondContact O-N 3.39Å; V172-I175 PolarHBondContact O-N 3.42Å; I175-T179 WeakPolarHBondContact O-CB 3.2Å; I175-T179 PolarHBondContact O-N 2.96Å; I175-T179 PolarHBondContact O-OG1 3.07Å
176L90.1Very high88.8Confident78 Ų7858 Ų5841%0.40832%0.319SS..Hα-helixtrans-65.1-41.5178-72.1172.2000111.6I32 M35 V172 E173 G180I32-L176 HydrophobicContact CG1-CB 4.37Å; I32-L176 HydrophobicContact CG2-CB 4.48Å; M35-L176 HydrophobicContact CE-CD2 4.36Å; M35-L176 HydrophobicContact SD-CD2 4.38Å; V172-L176 VanDerWaalsContact O-CB 3.31Å; V172-L176 WeakPolarHBondContact O-CB 3.46Å; V172-L176 WeakPolarHBondContact O-CG 3.28Å; V172-L176 PolarHBondContact O-N 2.88Å; E173-L176 PolarHBondContact O-N 3.2Å; L176-G180 PolarHBondContact O-N 2.69Å
177G91.1Very high88.8Confident1 Ų156.9 Ų56.91%0.0131%0.306CS..Hα-helixtrans-62.2-50.517600000111.6E173 F174 G180 A181 I242E173-G177 PolarHBondContact O-N 3.45Å; F174-G177 PolarHBondContact O-N 2.93Å; G177-G180 PolarHBondContact O-N 3.42Å; G177-A181 WeakPolarHBondContact O-CB 3.46Å; G177-A181 PolarHBondContact O-N 3.47Å; G177-I242 VanDerWaalsContact O-CD1 3.25Å; G177-I242 WeakPolarHBondContact O-CD1 3.49Å
178L90.9Very high88.6Confident51 Ų5152.2 Ų52.227%0.26729%0.286SS..Hα-helixtrans-64.3-45.3-178.6-172.668.9000111F174 G180 A181 F182 T239F174-L178 HydrophobicContact CE1-CD2 4.12Å; F174-L178 HydrophobicContact CZ-CD2 4.16Å; F174-L178 VanDerWaalsContact O-CB 3.3Å; F174-L178 WeakPolarHBondContact O-CB 3.35Å; F174-L178 PolarHBondContact O-N 3.45Å; L178-G180 VanDerWaalsContact C-N 3.31Å; L178-G180 PolarHBondContact O-N 2.87Å; L178-A181 PolarHBondContact O-N 3.18Å; L178-F182 HydrophobicContact CD1-CD2 3.86Å; L178-F182 HydrophobicContact CD1-CE2 3.69Å; L178-F182 HydrophobicContact CG-CD2 4.19Å; L178-F182 HydrophobicContact CG-CE2 4.41Å; L178-F182 WeakPolarHBondContact O-CD2 3.41Å; L178-F182 PolarHBondContact O-N 3.36Å; L178-T239 HydrophobicContact CD1-CG2 4.25Å
179T90.9Very high88.5Confident41 Ų4147.5 Ų47.525%0.25226%0.263SS..Hα-helixtrans-62.7-40.9178.1-55.70000111M35 I175 I183 G184M35-T179 HydrophobicContact CE-CG2 3.47Å; M35-T179 VanDerWaalsContact CE-CG2 3.47Å; M35-T179 HydrophobicContact SD-CG2 3.77Å; I175-T179 WeakPolarHBondContact O-CB 3.2Å; I175-T179 PolarHBondContact O-N 2.96Å; I175-T179 PolarHBondContact O-OG1 3.07Å; T179-I183 HydrophobicContact CG2-CB 4.41Å; T179-I183 HydrophobicContact CG2-CD1 3.59Å; T179-I183 HydrophobicContact CG2-CG1 4.21Å; T179-I183 WeakPolarHBondContact O-CA 3.22Å; T179-I183 VanDerWaalsContact O-CB 3.31Å; T179-I183 WeakPolarHBondContact O-CB 3.25Å; T179-I183 PolarHBondContact O-N 3.15Å; T179-G184 PolarHBondContact O-N 3.35Å
180G90.9Very high88.8Confident0 Ų047 Ų470%026%0.258CS..Iπ-helixtrans-67.2-40.7175.800000113.8P31 L176 G177 L178 F182 G184 S185P31-G180 WeakPolarHBondContact O-CA 3.48Å; L176-G180 PolarHBondContact O-N 2.69Å; G177-G180 PolarHBondContact O-N 3.42Å; L178-G180 VanDerWaalsContact C-N 3.31Å; L178-G180 PolarHBondContact O-N 2.87Å; G180-F182 PolarHBondContact O-N 3.17Å; G180-G184 WeakPolarHBondContact O-CA 3.33Å; G180-G184 PolarHBondContact O-N 2.81Å; G180-S185 PolarHBondContact O-N 3.14Å
181A91.8Very high89.3Confident0 Ų046.1 Ų46.10%025%0.247CC..Iπ-helixtrans-62.6-44.5177.600000110.7P31 G177 L178 S185 L235 I242P31-A181 HydrophobicContact CB-CB 3.92Å; P31-A181 VanDerWaalsContact CB-N 3.34Å; G177-A181 WeakPolarHBondContact O-CB 3.46Å; G177-A181 PolarHBondContact O-N 3.47Å; L178-A181 PolarHBondContact O-N 3.18Å; A181-S185 WeakPolarHBondContact O-CB 3.34Å; A181-S185 PolarHBondContact O-OG 3.48Å; A181-L235 WeakPolarHBondContact O-CD1 3.41Å; A181-I242 HydrophobicContact CB-CD1 4.14Å
182F91.9Very high89.5Confident95 Ų9546.4 Ų46.442%0.41725%0.252SS..Iπ-helixtrans-77.5-71.1177.8-84.7-90.3000112.9L178 G180 L186 L235 T239L178-F182 HydrophobicContact CD1-CD2 3.86Å; L178-F182 HydrophobicContact CD1-CE2 3.69Å; L178-F182 HydrophobicContact CG-CD2 4.19Å; L178-F182 HydrophobicContact CG-CE2 4.41Å; L178-F182 WeakPolarHBondContact O-CD2 3.41Å; L178-F182 PolarHBondContact O-N 3.36Å; G180-F182 PolarHBondContact O-N 3.17Å; F182-L186 WeakPolarHBondContact O-CB 3.4Å; F182-L186 WeakPolarHBondContact O-CD1 3.44Å; F182-L186 WeakPolarHBondContact O-CG 3.34Å; F182-L186 PolarHBondContact O-N 3.22Å; F182-L235 HydrophobicContact CD1-CD1 4.04Å; F182-L235 HydrophobicContact CE1-CD1 4.38Å; F182-L235 HydrophobicContact CG-CD1 4.14Å; F182-T239 HydrophobicContact CE2-CG2 3.78Å; F182-T239 HydrophobicContact CZ-CG2 4.3Å
183I89.6Confident89.6Confident101 Ų10143.3 Ų43.352%0.51823%0.233SC..Iπ-helixtrans-70.4-42.2-169.9-58.7178.5000110.2T179 L186 V187T179-I183 HydrophobicContact CG2-CB 4.41Å; T179-I183 HydrophobicContact CG2-CD1 3.59Å; T179-I183 HydrophobicContact CG2-CG1 4.21Å; T179-I183 WeakPolarHBondContact O-CA 3.22Å; T179-I183 VanDerWaalsContact O-CB 3.31Å; T179-I183 WeakPolarHBondContact O-CB 3.25Å; T179-I183 PolarHBondContact O-N 3.15Å; I183-L186 PolarHBondContact O-N 3.4Å; I183-V187 HydrophobicContact CG2-CG2 4.08Å; I183-V187 WeakPolarHBondContact O-CB 3.4Å; I183-V187 WeakPolarHBondContact O-CG2 3.35Å; I183-V187 PolarHBondContact O-N 3.42Å
184G87.6Confident89.6Confident3 Ų342.9 Ų42.93%0.03124%0.236CC..Iπ-helixtrans-59.8-53177.600000111.6T179 G180 L186 A188T179-G184 PolarHBondContact O-N 3.35Å; G180-G184 WeakPolarHBondContact O-CA 3.33Å; G180-G184 PolarHBondContact O-N 2.81Å; G184-L186 PolarHBondContact O-N 3.13Å; G184-A188 WeakPolarHBondContact O-CA 3.39Å; G184-A188 WeakPolarHBondContact O-CB 3.44Å; G184-A188 PolarHBondContact O-N 3.14Å
185S89.9Confident89.7Confident4 Ų445.6 Ų45.63%0.02825%0.251CS..Hα-helixtrans-62.7-43178.2-50.40000112.3G180 A181 T189 I190 I234G180-S185 PolarHBondContact O-N 3.14Å; A181-S185 WeakPolarHBondContact O-CB 3.34Å; A181-S185 PolarHBondContact O-OG 3.48Å; S185-T189 PolarHBondContact O-N 3.49Å; S185-T189 PolarHBondContact O-OG1 3.5Å; S185-I190 PolarHBondContact O-N 2.9Å; S185-I234 WeakPolarHBondContact OG-CG2 3.43Å
186L90.8Very high89.4Confident78 Ų7847 Ų4741%0.40825%0.253SS..Iπ-helixtrans-62.6-51.2-179.5-76.7169.6000112.2F182 I183 G184 I190 L191F182-L186 WeakPolarHBondContact O-CB 3.4Å; F182-L186 WeakPolarHBondContact O-CD1 3.44Å; F182-L186 WeakPolarHBondContact O-CG 3.34Å; F182-L186 PolarHBondContact O-N 3.22Å; I183-L186 PolarHBondContact O-N 3.4Å; G184-L186 PolarHBondContact O-N 3.13Å; L186-I190 HydrophobicContact CD2-CB 4.47Å; L186-I190 HydrophobicContact CD2-CD1 3.92Å; L186-I190 HydrophobicContact CD2-CG2 4.42Å; L186-I190 HydrophobicContact CG-CD1 4.5Å; L186-I190 PolarHBondContact O-N 2.94Å; L186-L191 WeakPolarHBondContact O-CB 3.3Å; L186-L191 PolarHBondContact O-N 3.24Å
187V89.7Confident89.2Confident41 Ų4145.3 Ų45.325%0.24824%0.244CC..Iπ-helixtrans-80.2-39.6-173.8176.40000111.7Q40 T41 I183 P192Q40-V187 HydrophobicContact CB-CG1 3.97Å; T41-V187 HydrophobicContact CG2-CG1 4.1Å; I183-V187 HydrophobicContact CG2-CG2 4.08Å; I183-V187 WeakPolarHBondContact O-CB 3.4Å; I183-V187 WeakPolarHBondContact O-CG2 3.35Å; I183-V187 PolarHBondContact O-N 3.42Å; V187-P192 WeakPolarHBondContact O-CD 3.39Å
188A85.7Confident89Confident32 Ų3247.7 Ų47.726%0.26426%0.263SS..Iπ-helixtrans-77.7-34.3-174.300000113.3G184 P192G184-A188 WeakPolarHBondContact O-CA 3.39Å; G184-A188 WeakPolarHBondContact O-CB 3.44Å; G184-A188 PolarHBondContact O-N 3.14Å; A188-P192 WeakPolarHBondContact O-CG 3.4Å
189T86.1Confident88.6Confident26 Ų2650.5 Ų50.516%0.1628%0.278CS..Iπ-helixtrans-125.8-51.1-17062.60000113.1S185 S193 G231S185-T189 PolarHBondContact O-N 3.49Å; S185-T189 PolarHBondContact O-OG1 3.5Å; T189-S193 WeakPolarHBondContact O-CB 3.36Å; T189-S193 PolarHBondContact O-N 3.35Å; T189-S193 PolarHBondContact O-OG 3.09Å; T189-G231 WeakPolarHBondContact OG1-CA 3.09Å
190I91.5Very high88Confident22 Ų2249.9 Ų49.911%0.11327%0.273CS..Iπ-helixtrans-69.2-56-171.4-62.6169.5000110.6S185 L186 S193 T194 L232 L235S185-I190 PolarHBondContact O-N 2.9Å; L186-I190 HydrophobicContact CD2-CB 4.47Å; L186-I190 HydrophobicContact CD2-CD1 3.92Å; L186-I190 HydrophobicContact CD2-CG2 4.42Å; L186-I190 HydrophobicContact CG-CD1 4.5Å; L186-I190 PolarHBondContact O-N 2.94Å; I190-S193 PolarHBondContact O-N 3.4Å; I190-T194 WeakPolarHBondContact O-CB 3.27Å; I190-T194 PolarHBondContact O-N 3.47Å; I190-T194 PolarHBondContact O-OG1 2.88Å; I190-L232 HydrophobicContact CD1-CD2 4.2Å; I190-L235 HydrophobicContact CD1-CD2 4.11Å
191L90.4Very high87.1Confident100 Ų10052.4 Ų52.452%0.52429%0.29SS..Hα-helixtrans-59-52.6-176.4-170.4125.2000113.2L186 S193 T194 I195L186-L191 WeakPolarHBondContact O-CB 3.3Å; L186-L191 PolarHBondContact O-N 3.24Å; L191-S193 VanDerWaalsContact C-N 3.34Å; L191-S193 PolarHBondContact O-N 2.66Å; L191-T194 PolarHBondContact O-N 3.49Å; L191-I195 HydrophobicContact CD2-CD1 3.57Å; L191-I195 HydrophobicContact CG-CD1 3.88Å; L191-I195 VanDerWaalsContact O-CG1 3.28Å; L191-I195 WeakPolarHBondContact O-CG1 3.47Å; L191-I195 PolarHBondContact O-N 3.47Å
192P88.6Confident86.3Confident58 Ų5854.6 Ų54.638%0.37731%0.308SS..Hα-helixtrans-61.9-40177.722-32.2000112.4V187 A188 T194 I195 Y196V187-P192 WeakPolarHBondContact O-CD 3.39Å; A188-P192 WeakPolarHBondContact O-CG 3.4Å; P192-T194 PolarHBondContact O-N 2.86Å; P192-I195 PolarHBondContact O-N 3.4Å; P192-Y196 WeakPolarHBondContact O-CB 3.39Å; P192-Y196 PolarHBondContact O-N 3.32Å
193S88.3Confident85.2Confident8 Ų852.5 Ų52.56%0.05631%0.306CS..Hα-helixtrans-63.6-42.5177.1-60.40000112.1T189 I190 L191 Y196 I197 A224 C227T189-S193 WeakPolarHBondContact O-CB 3.36Å; T189-S193 PolarHBondContact O-N 3.35Å; T189-S193 PolarHBondContact O-OG 3.09Å; I190-S193 PolarHBondContact O-N 3.4Å; L191-S193 VanDerWaalsContact C-N 3.34Å; L191-S193 PolarHBondContact O-N 2.66Å; S193-Y196 PolarHBondContact O-N 3.06Å; S193-I197 WeakPolarHBondContact O-CB 3.23Å; S193-I197 WeakPolarHBondContact O-CD1 3.46Å; S193-I197 VanDerWaalsContact O-CG1 3.25Å; S193-I197 WeakPolarHBondContact O-CG1 3.48Å; S193-I197 PolarHBondContact O-N 3.4Å; S193-A224 WeakPolarHBondContact CB-O 3.37Å; S193-A224 PolarHBondContact OG-O 3.01Å; S193-C227 WeakPolarHBondContact OG-CB 3.3Å
194T88.6Confident84.2Confident68 Ų6852 Ų5242%0.41730%0.304SS..Hα-helixtrans-67.5-42.9-179.5-41.30000110.9I190 L191 P192 I197 A198I190-T194 WeakPolarHBondContact O-CB 3.27Å; I190-T194 PolarHBondContact O-N 3.47Å; I190-T194 PolarHBondContact O-OG1 2.88Å; L191-T194 PolarHBondContact O-N 3.49Å; P192-T194 PolarHBondContact O-N 2.86Å; T194-I197 PolarHBondContact O-N 3.23Å; T194-A198 VanDerWaalsContact O-CB 3.27Å; T194-A198 WeakPolarHBondContact O-CB 3.21Å; T194-A198 PolarHBondContact O-N 2.88Å
195I88.5Confident83.1Confident85 Ų8558.9 Ų58.944%0.43633%0.333SS..Hα-helixtrans-62.2-44.1176-67.8167.8000110.5L191 P192 A198 N199L191-I195 HydrophobicContact CD2-CD1 3.57Å; L191-I195 HydrophobicContact CG-CD1 3.88Å; L191-I195 VanDerWaalsContact O-CG1 3.28Å; L191-I195 WeakPolarHBondContact O-CG1 3.47Å; L191-I195 PolarHBondContact O-N 3.47Å; P192-I195 PolarHBondContact O-N 3.4Å; I195-A198 PolarHBondContact O-N 2.97Å; I195-N199 WeakPolarHBondContact O-CB 3.14Å; I195-N199 PolarHBondContact O-N 3.21Å; I195-N199 PolarHBondContact O-ND2 2.95Å
196Y85.6Confident82Confident95 Ų9565.1 Ų65.137%0.37337%0.365SS..Hα-helixtrans-62.1-48.1178.7-174.1-91.2000112P192 S193 A198 N199 Q200 T220 A224P192-Y196 WeakPolarHBondContact O-CB 3.39Å; P192-Y196 PolarHBondContact O-N 3.32Å; S193-Y196 PolarHBondContact O-N 3.06Å; Y196-A198 PolarHBondContact O-N 2.91Å; Y196-N199 PolarHBondContact O-N 3.24Å; Y196-Q200 WeakPolarHBondContact O-CB 3.47Å; Y196-Q200 PolarHBondContact O-N 3.48Å; Y196-T220 HydrophobicContact CE1-CG2 4.17Å; Y196-T220 HydrophobicContact CE2-CG2 4.49Å; Y196-T220 WeakPolarHBondContact OH-CB 3.14Å; Y196-T220 WeakPolarHBondContact OH-CG2 3.14Å; Y196-A224 HydrophobicContact CD1-CB 3.63Å; Y196-A224 HydrophobicContact CE1-CB 4.23Å; Y196-A224 HydrophobicContact CG-CB 4.44Å
197I85.3Confident80.7Confident43 Ų4365.2 Ų65.222%0.22137%0.366CS..Hα-helixtrans-62.9-42.3177.7-67.5164.8000110.9S193 T194 Q200 S201 A224 K225 L228S193-I197 WeakPolarHBondContact O-CB 3.23Å; S193-I197 WeakPolarHBondContact O-CD1 3.46Å; S193-I197 VanDerWaalsContact O-CG1 3.25Å; S193-I197 WeakPolarHBondContact O-CG1 3.48Å; S193-I197 PolarHBondContact O-N 3.4Å; T194-I197 PolarHBondContact O-N 3.23Å; I197-Q200 PolarHBondContact O-N 3.29Å; I197-S201 WeakPolarHBondContact O-CB 3.36Å; I197-S201 PolarHBondContact O-N 2.99Å; I197-S201 PolarHBondContact O-OG 3.25Å; I197-A224 HydrophobicContact CD1-CB 4.37Å; I197-A224 HydrophobicContact CG1-CB 4.05Å; I197-K225 HydrophobicContact CD1-CG 3.84Å; I197-K225 HydrophobicContact CG1-CG 4.46Å; I197-L228 HydrophobicContact CD1-CD1 4.09Å
198A86.3Confident79.1Confident51 Ų5172.7 Ų72.742%0.42139%0.39SS..Hα-helixtrans-61.5-47.3177.700000111.4T194 I195 Y196 Q200 S201 A202T194-A198 VanDerWaalsContact O-CB 3.27Å; T194-A198 WeakPolarHBondContact O-CB 3.21Å; T194-A198 PolarHBondContact O-N 2.88Å; I195-A198 PolarHBondContact O-N 2.97Å; Y196-A198 PolarHBondContact O-N 2.91Å; A198-Q200 PolarHBondContact O-N 2.86Å; A198-S201 PolarHBondContact O-N 2.62Å; A198-S201 PolarHBondContact O-OG 3.43Å; A198-A202 PolarHBondContact O-N 3.4Å
199N83.1Confident77.7Confident109 Ų10975.8 Ų75.858%0.58342%0.415SS*.Hα-helixtrans-63.4-41.9177.7-78.1-21.4000112.4I195 Y196 A202 S203I195-N199 WeakPolarHBondContact O-CB 3.14Å; I195-N199 PolarHBondContact O-N 3.21Å; I195-N199 PolarHBondContact O-ND2 2.95Å; Y196-N199 PolarHBondContact O-N 3.24Å; N199-A202 PolarHBondContact O-N 3.47Å; N199-S203 WeakPolarHBondContact O-CB 3.35Å; N199-S203 PolarHBondContact O-N 3.33Å
200Q77.4Confident76.3Confident28 Ų2879.9 Ų79.913%0.13144%0.44CS..Hα-helixtrans-63.9-44.5175.8-171.4173.24000111.1Y196 I197 A198 A202 S203 D204 A217 S221Y196-Q200 WeakPolarHBondContact O-CB 3.47Å; Y196-Q200 PolarHBondContact O-N 3.48Å; I197-Q200 PolarHBondContact O-N 3.29Å; A198-Q200 PolarHBondContact O-N 2.86Å; Q200-A202 VanDerWaalsContact C-N 3.27Å; Q200-A202 PolarHBondContact O-N 2.82Å; Q200-S203 CarbonylContact O-C 3.6Å; Q200-S203 PolarHBondContact O-N 3.48Å; Q200-S203 VanDerWaalsContact O-N 3.14Å; Q200-D204 WeakPolarHBondContact O-CB 3.44Å; Q200-D204 VanDerWaalsContact O-CG 3.26Å; Q200-D204 PolarHBondContact O-N 2.94Å; Q200-A217 PolarHBondContact NE2-O 2.94Å; Q200-A217 VanDerWaalsContact NE2-O 3.08Å; Q200-S221 PolarHBondContact OE1-OG 3.35Å
201S73.6Confident74.5Confident53 Ų5389.8 Ų89.837%0.37148%0.476SS..Hα-helixtrans-63.9-31.3178.477.70000113.3I197 A198 K205I197-S201 WeakPolarHBondContact O-CB 3.36Å; I197-S201 PolarHBondContact O-N 2.99Å; I197-S201 PolarHBondContact O-OG 3.25Å; A198-S201 PolarHBondContact O-N 2.62Å; A198-S201 PolarHBondContact O-OG 3.43Å; S201-K205 WeakPolarHBondContact O-CG 2.99Å; S201-K205 PolarHBondContact O-N 2.98Å
202A74.8Confident72.5Confident46 Ų4694.6 Ų94.638%0.3849%0.493SS..Hα-helixtrans-72.2-44.1172.900000111.1A198 N199 Q200 K205 I206A198-A202 PolarHBondContact O-N 3.4Å; N199-A202 PolarHBondContact O-N 3.47Å; Q200-A202 VanDerWaalsContact C-N 3.27Å; Q200-A202 PolarHBondContact O-N 2.82Å; A202-K205 PolarHBondContact O-N 3.48Å; A202-I206 WeakPolarHBondContact O-CG1 3.48Å; A202-I206 PolarHBondContact O-N 3.39Å
203S68.9Low70.9Confident52 Ų5297.8 Ų97.836%0.36451%0.511SS..Hα-helixtrans-63.2-40.4176.3-159.50000112.2N199 Q200 K205 I206 N207N199-S203 WeakPolarHBondContact O-CB 3.35Å; N199-S203 PolarHBondContact O-N 3.33Å; Q200-S203 CarbonylContact O-C 3.6Å; Q200-S203 PolarHBondContact O-N 3.48Å; Q200-S203 VanDerWaalsContact O-N 3.14Å; S203-K205 VanDerWaalsContact C-N 3.3Å; S203-K205 PolarHBondContact O-N 3.23Å; S203-I206 PolarHBondContact O-N 3.47Å; S203-I206 VanDerWaalsContact O-N 3.11Å; S203-N207 VanDerWaalsContact O-CB 3.28Å; S203-N207 WeakPolarHBondContact O-CB 3.31Å; S203-N207 PolarHBondContact O-N 2.9Å; S203-N207 PolarHBondContact O-ND2 3.05Å; S203-N207 PolarHBondContact OG-ND2 3.43Å
204D67.3Low69.2Low90 Ų90102.3 Ų102.348%0.48153%0.534SS..Hα-helixtrans-67-27.2177.4-73.7-19.8000113Q200 R208Q200-D204 WeakPolarHBondContact O-CB 3.44Å; Q200-D204 VanDerWaalsContact O-CG 3.26Å; Q200-D204 PolarHBondContact O-N 2.94Å; D204-R208 WeakPolarHBondContact O-CG 3.2Å
205K65.4Low67.5Low148 Ų148107.9 Ų107.964%0.64356%0.555SS**Hα-helixtrans-71.2-36.3171.5-74.1171.9-173.9178.50111.5S201 A202 S203S201-K205 WeakPolarHBondContact O-CG 2.99Å; S201-K205 PolarHBondContact O-N 2.98Å; A202-K205 PolarHBondContact O-N 3.48Å; S203-K205 VanDerWaalsContact C-N 3.3Å; S203-K205 PolarHBondContact O-N 3.23Å
206I66.3Low65.8Low135 Ų135107 Ų10769%0.69256%0.561SS**Hα-helixtrans-78.1-40179.9-63.8167.3000111A202 S203 R208A202-I206 WeakPolarHBondContact O-CG1 3.48Å; A202-I206 PolarHBondContact O-N 3.39Å; S203-I206 PolarHBondContact O-N 3.47Å; S203-I206 VanDerWaalsContact O-N 3.11Å; I206-R208 PolarHBondContact O-N 3.46Å
207N63.8Low64.3Low80 Ų80104 Ų10443%0.42856%0.555SS.*G310 helixtrans-89.710.4-170.5-71.8-32.1000115.5S203 A209 T210S203-N207 VanDerWaalsContact O-CB 3.28Å; S203-N207 WeakPolarHBondContact O-CB 3.31Å; S203-N207 PolarHBondContact O-N 2.9Å; S203-N207 PolarHBondContact O-ND2 3.05Å; S203-N207 PolarHBondContact OG-ND2 3.43Å; N207-A209 PolarHBondContact O-N 3.45Å; N207-T210 PolarHBondContact O-N 3.22Å
208R55.8Low62.7Low198 Ų198105 Ų10575%0.74757%0.571SS**G310 helixtrans-59.1-17.2175.2-60.5-166.2-173.1-170.81.7113.7D204 I206D204-R208 WeakPolarHBondContact O-CG 3.2Å; I206-R208 PolarHBondContact O-N 3.46Å
209A56.8Low61.3Low96 Ų96105.4 Ų105.479%0.79357%0.574SS**G310 helixtrans-80.1-18174.900000114.5N207N207-A209 PolarHBondContact O-N 3.45Å
210T56.2Low60.4Low112 Ų112103.4 Ų103.469%0.68757%0.566SS**  trans-128.959.5-173.3-43.30000110.7N207 K212N207-T210 PolarHBondContact O-N 3.22Å; T210-K212 PolarHBondContact O-N 3.49Å
211R52.9Low60Low231 Ų231103 Ų10387%0.87257%0.566SS**  trans-90.369.8-174.3-174.2-171.9147.2-178.4-4.8111.8
212K49.4Very low60.2Low201 Ų201103.7 Ų103.787%0.87457%0.571SS**  trans-15440.2166.1-79.1-157.4-178.7176.60113.9T210T210-K212 PolarHBondContact O-N 3.49Å
213V53.9Low60.5Low124 Ų124106 Ų10675%0.75258%0.581SS**  trans-150.3135.7161.5-151.60000108.3
214N54.1Low61.1Low103 Ų103104.1 Ų104.155%0.55157%0.568SS**  trans118.869.4155.5-57.2-18.7000117.5A216 A217 A218N214-A216 PolarHBondContact O-N 3.07Å; N214-A217 HydrophobicContact CB-CB 3.42Å; N214-A217 VanDerWaalsContact CB-CB 3.42Å; N214-A217 PolarHBondContact O-N 3.35Å; N214-A218 PolarHBondContact O-N 3.22Å
215E53Low62Low185 Ų185105.2 Ų105.286%0.86457%0.568SS**Hα-helixtrans-57.8-30.2150.1-72.1171.8160.900111.4A217 A218 A219E215-A217 PolarHBondContact O-N 2.95Å; E215-A218 PolarHBondContact O-N 2.69Å; E215-A219 PolarHBondContact O-N 3.26Å
216A52.1Low63.1Low68 Ų68103.1 Ų103.156%0.56256%0.562SS**Hα-helixtrans-66-31.417400000114.2N214 T220N214-A216 PolarHBondContact O-N 3.07Å; A216-T220 PolarHBondContact O-N 3.2Å; A216-T220 PolarHBondContact O-OG1 2.92Å
217A53.3Low64.1Low30 Ų3098.8 Ų98.825%0.24854%0.543CS..Hα-helixtrans-77.6-28.4177.100000112.1Q200 N214 E215 S221Q200-A217 PolarHBondContact NE2-O 2.94Å; Q200-A217 VanDerWaalsContact NE2-O 3.08Å; N214-A217 HydrophobicContact CB-CB 3.42Å; N214-A217 VanDerWaalsContact CB-CB 3.42Å; N214-A217 PolarHBondContact O-N 3.35Å; E215-A217 PolarHBondContact O-N 2.95Å; A217-S221 WeakPolarHBondContact O-CB 3.41Å; A217-S221 PolarHBondContact O-N 2.89Å
218A52.9Low65.4Low66 Ų6697 Ų9755%0.54553%0.533SS..Hα-helixtrans-70.8-41.417400000111.7N214 E215 S221 S222N214-A218 PolarHBondContact O-N 3.22Å; E215-A218 PolarHBondContact O-N 2.69Å; A218-S221 WeakPolarHBondContact O-CB 3.46Å; A218-S221 PolarHBondContact O-N 3.41Å; A218-S222 PolarHBondContact O-N 3.17Å; A218-S222 VanDerWaalsContact O-N 3.15Å
219A56Low67.1Low58 Ų5892.5 Ų92.548%0.47952%0.523SS..Hα-helixtrans-60.9-46.1174.200000111.7E215 S221 S222 T223E215-A219 PolarHBondContact O-N 3.26Å; A219-S221 VanDerWaalsContact C-N 3.32Å; A219-S221 PolarHBondContact O-N 3.46Å; A219-S222 PolarHBondContact O-N 3.2Å; A219-T223 PolarHBondContact O-N 3.46Å; A219-T223 VanDerWaalsContact O-N 3.14Å; A219-T223 PolarHBondContact O-OG1 3.04Å; A219-T223 VanDerWaalsContact O-OG1 3.13Å
220T65.5Low68.7Low68 Ų6892 Ų9242%0.41751%0.506SS..Hα-helixtrans-67.8-31.5179.7-420000112.5Y196 A216 T223 A224Y196-T220 HydrophobicContact CE1-CG2 4.17Å; Y196-T220 HydrophobicContact CE2-CG2 4.49Å; Y196-T220 WeakPolarHBondContact OH-CB 3.14Å; Y196-T220 WeakPolarHBondContact OH-CG2 3.14Å; A216-T220 PolarHBondContact O-N 3.2Å; A216-T220 PolarHBondContact O-OG1 2.92Å; T220-T223 PolarHBondContact O-N 3.48Å; T220-A224 PolarHBondContact O-N 3.16Å; T220-A224 VanDerWaalsContact O-N 3.14Å
221S68.1Low70.3Confident19 Ų1986.7 Ų86.713%0.13347%0.473CS..Hα-helixtrans-65.3-40.3173.1-164.40000112.6Q200 A217 A218 A219 A224 K225Q200-S221 PolarHBondContact OE1-OG 3.35Å; A217-S221 WeakPolarHBondContact O-CB 3.41Å; A217-S221 PolarHBondContact O-N 2.89Å; A218-S221 WeakPolarHBondContact O-CB 3.46Å; A218-S221 PolarHBondContact O-N 3.41Å; A219-S221 VanDerWaalsContact C-N 3.32Å; A219-S221 PolarHBondContact O-N 3.46Å; S221-A224 PolarHBondContact O-N 3.38Å; S221-K225 WeakPolarHBondContact O-CG 3.11Å; S221-K225 PolarHBondContact O-N 2.99Å
222S76.8Confident72.1Confident68 Ų6879.2 Ų79.248%0.47645%0.45SS..Hα-helixtrans-65.9-43.1177.2-175.60000111A218 A219 A224 K225 M226A218-S222 PolarHBondContact O-N 3.17Å; A218-S222 VanDerWaalsContact O-N 3.15Å; A219-S222 PolarHBondContact O-N 3.2Å; S222-A224 PolarHBondContact O-N 2.73Å; S222-K225 PolarHBondContact O-N 2.92Å; S222-M226 WeakPolarHBondContact O-CG 3.12Å; S222-M226 PolarHBondContact O-N 2.97Å
223T81.1Confident74.1Confident95 Ų9575.8 Ų75.858%0.58344%0.436SS*.Hα-helixtrans-59.9-42.4176.5-52.30000112.5A219 T220 K225 M226 C227A219-T223 PolarHBondContact O-N 3.46Å; A219-T223 VanDerWaalsContact O-N 3.14Å; A219-T223 PolarHBondContact O-OG1 3.04Å; A219-T223 VanDerWaalsContact O-OG1 3.13Å; T220-T223 PolarHBondContact O-N 3.48Å; T223-K225 PolarHBondContact O-N 3.11Å; T223-M226 PolarHBondContact O-N 3.45Å; T223-C227 WeakPolarHBondContact O-CB 3.44Å; T223-C227 PolarHBondContact O-N 3.44Å
224A82.7Confident75.8Confident11 Ų1171.1 Ų71.19%0.09141%0.406CS..Hα-helixtrans-64.3-40.3177.200000112.5S193 Y196 I197 T220 S221 S222 C227 L228S193-A224 WeakPolarHBondContact CB-O 3.37Å; S193-A224 PolarHBondContact OG-O 3.01Å; Y196-A224 HydrophobicContact CD1-CB 3.63Å; Y196-A224 HydrophobicContact CE1-CB 4.23Å; Y196-A224 HydrophobicContact CG-CB 4.44Å; I197-A224 HydrophobicContact CD1-CB 4.37Å; I197-A224 HydrophobicContact CG1-CB 4.05Å; T220-A224 PolarHBondContact O-N 3.16Å; T220-A224 VanDerWaalsContact O-N 3.14Å; S221-A224 PolarHBondContact O-N 3.38Å; S222-A224 PolarHBondContact O-N 2.73Å; A224-C227 PolarHBondContact O-N 3.38Å; A224-L228 PolarHBondContact O-N 3.28Å
225K85.4Confident77.6Confident114 Ų11467.6 Ų67.650%0.49639%0.387SS..Hα-helixtrans-66-41.4175.5-69173.6-173.1176.40112I197 S221 S222 T223 L228 I229I197-K225 HydrophobicContact CD1-CG 3.84Å; I197-K225 HydrophobicContact CG1-CG 4.46Å; S221-K225 WeakPolarHBondContact O-CG 3.11Å; S221-K225 PolarHBondContact O-N 2.99Å; S222-K225 PolarHBondContact O-N 2.92Å; T223-K225 PolarHBondContact O-N 3.11Å; K225-L228 PolarHBondContact O-N 3.29Å; K225-I229 WeakPolarHBondContact O-CG1 3.19Å; K225-I229 PolarHBondContact O-N 2.99Å
226M88.9Confident79.5Confident104 Ų10464 Ų6451%0.51237%0.373SS..Hα-helixtrans-62-44.2174.9-71.3-62.9-68.600111.3S222 T223 L228 I229 I230S222-M226 WeakPolarHBondContact O-CG 3.12Å; S222-M226 PolarHBondContact O-N 2.97Å; T223-M226 PolarHBondContact O-N 3.45Å; M226-L228 VanDerWaalsContact C-N 3.3Å; M226-L228 PolarHBondContact O-N 3.42Å; M226-I229 PolarHBondContact O-N 3.5Å; M226-I230 WeakPolarHBondContact O-CB 3.34Å; M226-I230 WeakPolarHBondContact O-CD1 3.33Å; M226-I230 VanDerWaalsContact O-CG1 3.24Å; M226-I230 WeakPolarHBondContact O-CG1 3.12Å; M226-I230 PolarHBondContact O-N 2.81Å
227C87.9Confident81.3Confident43 Ų4361.7 Ų61.729%0.29135%0.354SS..Hα-helixtrans-61.2-38.6176.9-169.40000112.1S193 T223 A224 I230 G231S193-C227 WeakPolarHBondContact OG-CB 3.3Å; T223-C227 WeakPolarHBondContact O-CB 3.44Å; T223-C227 PolarHBondContact O-N 3.44Å; A224-C227 PolarHBondContact O-N 3.38Å; C227-I230 PolarHBondContact O-N 2.89Å; C227-G231 PolarHBondContact O-N 3.4Å
228L90.7Very high83.1Confident42 Ų4260.2 Ų60.222%0.2234%0.342CS..Hα-helixtrans-63.3-46.6174.4-169.6158.6000111.9I197 A224 K225 M226 G231 L232I197-L228 HydrophobicContact CD1-CD1 4.09Å; A224-L228 PolarHBondContact O-N 3.28Å; K225-L228 PolarHBondContact O-N 3.29Å; M226-L228 VanDerWaalsContact C-N 3.3Å; M226-L228 PolarHBondContact O-N 3.42Å; L228-G231 PolarHBondContact O-N 3.09Å; L228-L232 HydrophobicContact CD2-CD1 3.52Å; L228-L232 HydrophobicContact CD2-CG 4.19Å; L228-L232 PolarHBondContact O-N 3.1Å
229I91.1Very high84.9Confident104 Ų10458 Ų5853%0.53332%0.321SS..Hα-helixtrans-62.8-44.7178.4-65.8165.6000110.5K225 M226 G231 L232 F233K225-I229 WeakPolarHBondContact O-CG1 3.19Å; K225-I229 PolarHBondContact O-N 2.99Å; M226-I229 PolarHBondContact O-N 3.5Å; I229-G231 VanDerWaalsContact C-N 3.34Å; I229-G231 PolarHBondContact O-N 3.12Å; I229-L232 PolarHBondContact O-N 3.19Å; I229-F233 WeakPolarHBondContact O-CB 3.29Å; I229-F233 PolarHBondContact O-N 3.27Å
230I89.6Confident86.6Confident86 Ų8658.1 Ų58.144%0.44132%0.318SS..Hα-helixtrans-60.6-44.8176.3-68.9162.5000110.3M226 C227 L232 F233 I234M226-I230 WeakPolarHBondContact O-CB 3.34Å; M226-I230 WeakPolarHBondContact O-CD1 3.33Å; M226-I230 VanDerWaalsContact O-CG1 3.24Å; M226-I230 WeakPolarHBondContact O-CG1 3.12Å; M226-I230 PolarHBondContact O-N 2.81Å; C227-I230 PolarHBondContact O-N 2.89Å; I230-L232 PolarHBondContact O-N 2.99Å; I230-F233 PolarHBondContact O-N 3.32Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.35Å; I230-I234 VanDerWaalsContact O-CG1 3.29Å; I230-I234 WeakPolarHBondContact O-CG1 3.39Å; I230-I234 PolarHBondContact O-N 2.91Å
231G90Very high87.7Confident0 Ų056 Ų560%031%0.307CS..Hα-helixtrans-59.9-43.7176.700000113.4T189 C227 L228 I229 I234 L235T189-G231 WeakPolarHBondContact OG1-CA 3.09Å; C227-G231 PolarHBondContact O-N 3.4Å; L228-G231 PolarHBondContact O-N 3.09Å; I229-G231 VanDerWaalsContact C-N 3.34Å; I229-G231 PolarHBondContact O-N 3.12Å; G231-I234 PolarHBondContact O-N 3.27Å; G231-L235 WeakPolarHBondContact O-CB 3.23Å; G231-L235 PolarHBondContact O-N 2.87Å
232L91.8Very high88.6Confident74 Ų7455.6 Ų55.639%0.38730%0.303SS..Hα-helixtrans-65.2-40.4174.6-76.8172.8000112.2I190 L228 I229 I230 L235 I236I190-L232 HydrophobicContact CD1-CD2 4.2Å; L228-L232 HydrophobicContact CD2-CD1 3.52Å; L228-L232 HydrophobicContact CD2-CG 4.19Å; L228-L232 PolarHBondContact O-N 3.1Å; I229-L232 PolarHBondContact O-N 3.19Å; I230-L232 PolarHBondContact O-N 2.99Å; L232-L235 PolarHBondContact O-N 3.45Å; L232-I236 WeakPolarHBondContact O-CG1 3.44Å; L232-I236 PolarHBondContact O-N 2.86Å
233F90.9Very high89.1Confident129 Ų12956.4 Ų56.457%0.56630%0.302SS*.Hα-helixtrans-62.4-48.4176.1176.4-96.9000111I229 I230 L235 I236 A237I229-F233 WeakPolarHBondContact O-CB 3.29Å; I229-F233 PolarHBondContact O-N 3.27Å; I230-F233 PolarHBondContact O-N 3.32Å; F233-L235 VanDerWaalsContact C-N 3.32Å; F233-L235 PolarHBondContact O-N 3.46Å; F233-I236 PolarHBondContact O-N 2.9Å; F233-A237 HydrophobicContact CD1-CB 4.49Å; F233-A237 HydrophobicContact CD2-CB 4.46Å; F233-A237 HydrophobicContact CE1-CB 4.15Å; F233-A237 HydrophobicContact CE2-CB 4.12Å; F233-A237 HydrophobicContact CZ-CB 3.96Å; F233-A237 WeakPolarHBondContact O-CB 3.5Å; F233-A237 PolarHBondContact O-N 2.99Å
234I89Confident89.2Confident27 Ų2758.3 Ų58.314%0.13831%0.306CS..Hα-helixtrans-59.6-45.1176.9-67.1166.8000110.1L30 S185 I230 G231 I236 S238L30-I234 HydrophobicContact CD2-CB 4.28Å; L30-I234 HydrophobicContact CD2-CD1 4.02Å; L30-I234 HydrophobicContact CD2-CG1 3.84Å; L30-I234 HydrophobicContact CD2-CG2 3.47Å; L30-I234 VanDerWaalsContact CD2-CG2 3.47Å; S185-I234 WeakPolarHBondContact OG-CG2 3.43Å; I230-I234 HydrophobicContact CG2-CD1 3.71Å; I230-I234 HydrophobicContact CG2-CG1 4.35Å; I230-I234 VanDerWaalsContact O-CG1 3.29Å; I230-I234 WeakPolarHBondContact O-CG1 3.39Å; I230-I234 PolarHBondContact O-N 2.91Å; G231-I234 PolarHBondContact O-N 3.27Å; I234-I236 PolarHBondContact O-N 3.46Å; I234-S238 WeakPolarHBondContact O-CB 3.26Å; I234-S238 PolarHBondContact O-N 2.89Å; I234-S238 PolarHBondContact O-OG 3.07Å
235L92.5Very high88.6Confident29 Ų2959.4 Ų59.415%0.15232%0.318CS..Hα-helixtrans-57.2-51.1178.3176.764.3000111.7A181 F182 I190 G231 L232 F233 T239A181-L235 WeakPolarHBondContact O-CD1 3.41Å; F182-L235 HydrophobicContact CD1-CD1 4.04Å; F182-L235 HydrophobicContact CE1-CD1 4.38Å; F182-L235 HydrophobicContact CG-CD1 4.14Å; I190-L235 HydrophobicContact CD1-CD2 4.11Å; G231-L235 WeakPolarHBondContact O-CB 3.23Å; G231-L235 PolarHBondContact O-N 2.87Å; L232-L235 PolarHBondContact O-N 3.45Å; F233-L235 VanDerWaalsContact C-N 3.32Å; F233-L235 PolarHBondContact O-N 3.46Å; L235-T239 WeakPolarHBondContact O-CB 3.42Å; L235-T239 PolarHBondContact O-N 3.28Å; L235-T239 PolarHBondContact O-OG1 3.06Å
236I92.7Very high87.7Confident109 Ų10957 Ų5756%0.55931%0.309SS*.Hα-helixtrans-74.3-53.3-175.6-62.5166.6000110.8L232 F233 I234 S238 T239 C240L232-I236 WeakPolarHBondContact O-CG1 3.44Å; L232-I236 PolarHBondContact O-N 2.86Å; F233-I236 PolarHBondContact O-N 2.9Å; I234-I236 PolarHBondContact O-N 3.46Å; I236-S238 PolarHBondContact O-N 2.93Å; I236-T239 PolarHBondContact O-N 2.72Å; I236-C240 WeakPolarHBondContact O-CB 3.44Å; I236-C240 PolarHBondContact O-N 3.03Å; I236-C240 PolarHBondContact O-SG 3.47Å; I236-C240 VanDerWaalsContact O-SG 3.35Å
237A90.9Very high86Confident19 Ų1960 Ų6016%0.15732%0.319CS..Hα-helixtrans-63.9-42.8-174.400000111.8L27 F233 A241L27-A237 HydrophobicContact CD2-CB 4.49Å; F233-A237 HydrophobicContact CD1-CB 4.49Å; F233-A237 HydrophobicContact CD2-CB 4.46Å; F233-A237 HydrophobicContact CE1-CB 4.15Å; F233-A237 HydrophobicContact CE2-CB 4.12Å; F233-A237 HydrophobicContact CZ-CB 3.96Å; F233-A237 WeakPolarHBondContact O-CB 3.5Å; F233-A237 PolarHBondContact O-N 2.99Å; A237-A241 VanDerWaalsContact O-CB 3.32Å; A237-A241 WeakPolarHBondContact O-CB 3.35Å; A237-A241 PolarHBondContact O-N 3.45Å
238S90.3Very high83.9Confident0 Ų066.5 Ų66.50%034%0.342CS..Hα-helixtrans-71.2-40.7-179.9-43.70000111.2L27 I234 I236 C240 A241 I242L27-S238 WeakPolarHBondContact O-CB 3.45Å; I234-S238 WeakPolarHBondContact O-CB 3.26Å; I234-S238 PolarHBondContact O-N 2.89Å; I234-S238 PolarHBondContact O-OG 3.07Å; I236-S238 PolarHBondContact O-N 2.93Å; S238-C240 PolarHBondContact O-N 3.24Å; S238-A241 PolarHBondContact O-N 2.66Å; S238-I242 WeakPolarHBondContact O-CB 3.38Å; S238-I242 VanDerWaalsContact O-CD1 3.32Å; S238-I242 WeakPolarHBondContact O-CD1 3.47Å; S238-I242 WeakPolarHBondContact O-CG1 3.19Å; S238-I242 PolarHBondContact O-N 3.08Å
239T91.9Very high81.6Confident19 Ų1968.8 Ų68.812%0.11736%0.358CS..Hα-helixtrans-61.9-44.5176-590000111.3L178 F182 L235 I236 I242 L243L178-T239 HydrophobicContact CD1-CG2 4.25Å; F182-T239 HydrophobicContact CE2-CG2 3.78Å; F182-T239 HydrophobicContact CZ-CG2 4.3Å; L235-T239 WeakPolarHBondContact O-CB 3.42Å; L235-T239 PolarHBondContact O-N 3.28Å; L235-T239 PolarHBondContact O-OG1 3.06Å; I236-T239 PolarHBondContact O-N 2.72Å; T239-I242 PolarHBondContact O-N 3.5Å; T239-L243 HydrophobicContact CG2-CD1 3.96Å; T239-L243 HydrophobicContact CG2-CG 4.48Å; T239-L243 WeakPolarHBondContact O-CB 3.33Å; T239-L243 VanDerWaalsContact O-CG 3.28Å; T239-L243 WeakPolarHBondContact O-CG 3.28Å; T239-L243 PolarHBondContact O-N 3.19Å
240C89.9Confident78.8Confident61 Ų6168.6 Ų68.641%0.41237%0.366SS..Hα-helixtrans-61.5-43.7174.6-720000112I236 S238 L243 M244I236-C240 WeakPolarHBondContact O-CB 3.44Å; I236-C240 PolarHBondContact O-N 3.03Å; I236-C240 PolarHBondContact O-SG 3.47Å; I236-C240 VanDerWaalsContact O-SG 3.35Å; S238-C240 PolarHBondContact O-N 3.24Å; C240-L243 PolarHBondContact O-N 2.67Å; C240-M244 WeakPolarHBondContact O-CB 3.25Å; C240-M244 VanDerWaalsContact O-CG 3.29Å; C240-M244 WeakPolarHBondContact O-CG 3.28Å; C240-M244 PolarHBondContact O-N 3.25Å
241A89.3Confident76.3Confident23 Ų2369.5 Ų69.519%0.1938%0.375CS..Hα-helixtrans-62.1-44.3178.900000112.3L27 T28 A237 S238 M244 G245L27-A241 HydrophobicContact CB-CB 3.78Å; T28-A241 HydrophobicContact CG2-CB 4.03Å; A237-A241 VanDerWaalsContact O-CB 3.32Å; A237-A241 WeakPolarHBondContact O-CB 3.35Å; A237-A241 PolarHBondContact O-N 3.45Å; S238-A241 PolarHBondContact O-N 2.66Å; A241-M244 PolarHBondContact O-N 3.21Å; A241-G245 PolarHBondContact O-N 3.06Å
242I88.3Confident73.7Confident10 Ų1074 Ų745%0.05140%0.402CS..Hα-helixtrans-64-44.7178.8-67.8159000110.8T28 P31 F174 G177 A181 S238 T239 M244 G245 E246T28-I242 HydrophobicContact CG2-CG1 4.18Å; P31-I242 HydrophobicContact CG-CD1 3.93Å; F174-I242 HydrophobicContact CD2-CG2 3.35Å; F174-I242 HydrophobicContact CE2-CG2 3.51Å; F174-I242 HydrophobicContact CG-CG2 4.36Å; G177-I242 VanDerWaalsContact O-CD1 3.25Å; G177-I242 WeakPolarHBondContact O-CD1 3.49Å; A181-I242 HydrophobicContact CB-CD1 4.14Å; S238-I242 WeakPolarHBondContact O-CB 3.38Å; S238-I242 VanDerWaalsContact O-CD1 3.32Å; S238-I242 WeakPolarHBondContact O-CD1 3.47Å; S238-I242 WeakPolarHBondContact O-CG1 3.19Å; S238-I242 PolarHBondContact O-N 3.08Å; T239-I242 PolarHBondContact O-N 3.5Å; I242-M244 PolarHBondContact O-N 2.75Å; I242-G245 PolarHBondContact O-N 3.44Å; I242-E246 PolarHBondContact O-N 3.31Å
243L86.6Confident71.2Confident86 Ų8678.9 Ų78.945%0.4542%0.423SS..Hα-helixtrans-68.5-33178.7-69.7173000113.3F174 T239 C240F174-L243 HydrophobicContact CE2-CD2 4.28Å; F174-L243 HydrophobicContact CZ-CD2 4.35Å; T239-L243 HydrophobicContact CG2-CD1 3.96Å; T239-L243 HydrophobicContact CG2-CG 4.48Å; T239-L243 WeakPolarHBondContact O-CB 3.33Å; T239-L243 VanDerWaalsContact O-CG 3.28Å; T239-L243 WeakPolarHBondContact O-CG 3.28Å; T239-L243 PolarHBondContact O-N 3.19Å; C240-L243 PolarHBondContact O-N 2.67Å
244M82.9Confident68.6Low135 Ų13579.7 Ų79.767%0.66543%0.426SS*.Hα-helixtrans-75.2-30.8174.4-72.9-176.8178.700112.1C240 A241 I242C240-M244 WeakPolarHBondContact O-CB 3.25Å; C240-M244 VanDerWaalsContact O-CG 3.29Å; C240-M244 WeakPolarHBondContact O-CG 3.28Å; C240-M244 PolarHBondContact O-N 3.25Å; A241-M244 PolarHBondContact O-N 3.21Å; I242-M244 PolarHBondContact O-N 2.75Å
245G70.9Confident66Low33 Ų3382.4 Ų82.434%0.3445%0.446SS..Hα-helixtrans-63-47.9175.200000112.7A241 I242 K247 K248 T249A241-G245 PolarHBondContact O-N 3.06Å; I242-G245 PolarHBondContact O-N 3.44Å; G245-K247 VanDerWaalsContact C-N 3.29Å; G245-K247 PolarHBondContact O-N 3.05Å; G245-K248 PolarHBondContact O-N 3.48Å; G245-T249 PolarHBondContact O-N 3Å
246E66.4Low63.3Low65 Ų6588.5 Ų88.530%0.30447%0.471SS..Hα-helixtrans-58.5-36.7178.3-85.2-95.4137.200113.6N171 F174 I242 K248 T249 S250N171-E246 PolarHBondContact ND2-OE1 3.23Å; F174-E246 HydrophobicContact CB-CG 4.48Å; F174-E246 HydrophobicContact CD2-CG 3.22Å; F174-E246 HydrophobicContact CE2-CG 3.53Å; F174-E246 HydrophobicContact CG-CG 3.99Å; F174-E246 HydrophobicContact CZ-CG 4.48Å; I242-E246 PolarHBondContact O-N 3.31Å; E246-K248 PolarHBondContact O-N 2.86Å; E246-T249 WeakPolarHBondContact CA-OG1 3.19Å; E246-T249 PolarHBondContact O-N 3.44Å; E246-T249 PolarHBondContact O-OG1 3.32Å; E246-T249 VanDerWaalsContact O-OG1 3.07Å; E246-S250 PolarHBondContact O-N 2.91Å
247K52.9Low60.6Low166 Ų16686 Ų8672%0.72247%0.467SS*.Hα-helixtrans-65.4-20.2178.8-70.4-176.7-178.2-1760113.3G245G245-K247 VanDerWaalsContact C-N 3.29Å; G245-K247 PolarHBondContact O-N 3.05Å
248K44.2Very low58Low179 Ų17994.8 Ų94.878%0.77850%0.501SS*.Hα-helixtrans-87.3-29.1174.6-86.9-176.4173.2-176.10112.8G245 E246G245-K248 PolarHBondContact O-N 3.48Å; E246-K248 PolarHBondContact O-N 2.86Å
249T42.4Very low55.4Low91 Ų91100.9 Ų100.956%0.55853%0.534SS*.Hα-helixtrans-87-11.4-178.149.10000113.8G245 E246 V251G245-T249 PolarHBondContact O-N 3Å; E246-T249 WeakPolarHBondContact CA-OG1 3.19Å; E246-T249 PolarHBondContact O-N 3.44Å; E246-T249 PolarHBondContact O-OG1 3.32Å; E246-T249 VanDerWaalsContact O-OG1 3.07Å; T249-V251 PolarHBondContact O-N 2.86Å
250S31.2Very low52.9Low99 Ų99107.5 Ų107.569%0.69257%0.569SS**THydrogen-bonded Turntrans-77.27.3173.983.50000114.2E246E246-S250 PolarHBondContact O-N 2.91Å
251V37.3Very low50.4Low105 Ų105107.9 Ų107.964%0.63657%0.572SS**SBendtrans-96.893.4169.6-176.30000107.5T249T249-V251 PolarHBondContact O-N 2.86Å
252V35.6Very low48.4Very low94 Ų94109.7 Ų109.757%0.5759%0.593SS**  trans62.399.8166.7-1680000116K254V252-K254 PolarHBondContact O-N 3.37Å
253E38.4Very low46.2Very low177 Ų177117.8 Ų117.883%0.82763%0.631SS**PPolyproline II helixtrans-57.8118.4158.9-95179.8145.100109.6P255E253-P255 WeakPolarHBondContact O-CD 3.39Å
254K37.5Very low44.1Very low146 Ų146120.7 Ų120.764%0.63565%0.645SS**PPolyproline II helixtrans-61.3121.2169.5-73177.2-179.1170.50108.8V252 K256V252-K254 PolarHBondContact O-N 3.37Å; K254-K256 PolarHBondContact O-N 2.8Å
255P34.8Very low42.3Very low84 Ų84118.4 Ų118.455%0.54563%0.629SS.*PPolyproline II helixtrans-63.3123.117123.8-30000109.1E253 A257E253-P255 WeakPolarHBondContact O-CD 3.39Å; P255-A257 PolarHBondContact O-N 3.43Å
256K35.9Very low41.4Very low158 Ų158123.7 Ų123.769%0.68765%0.645SS**PPolyproline II helixtrans-66.7123-178.5-147.8176.1-173.2-176.90109.8V95 K254V95-K256 PolarHBondContact O-NZ 3.16Å; V95-K256 VanDerWaalsContact O-NZ 3.16Å; K254-K256 PolarHBondContact O-N 2.8Å
257A35.1Very low40.6Very low57 Ų57128.6 Ų128.647%0.47167%0.668SS.*PPolyproline II helixtrans-66.4131.217100000110.6P255P255-A257 PolarHBondContact O-N 3.43Å
258K35.7Very low40.4Very low202 Ų202124.6 Ų124.688%0.87865%0.651SS**  trans-88.8115.5158.7-163.3174.8-177.9-1790105.9D260K258-D260 PolarHBondContact O-N 2.69Å
259D36.7Very low40.8Very low128 Ų128120.6 Ų120.668%0.68464%0.638SS**  trans-80.3111.3-171.5-49.7-43000110
260D39Very low41.4Very low159 Ų159123.5 Ų123.585%0.8564%0.643SS**  -169.990.7127.5-1455.3000110.3K258K258-D260 PolarHBondContact O-N 2.69Å
261S36.8Very low42.6Very low68 Ų68121.3 Ų121.348%0.47663%0.628SS.*  trans177.198.4157.653.90000107.8R265S261-R265 PolarHBondContact O-NE 3.1Å; S261-R265 VanDerWaalsContact O-NE 3.16Å; S261-R265 PolarHBondContact O-NH2 3.34Å
262G48.1Very low43.2Very low62 Ų62118.7 Ų118.764%0.63961%0.61SS**  trans-67.9162.8172.400000112.2I264G262-I264 PolarHBondContact O-N 3.2Å
263E40.8Very low44.2Very low179 Ų179120 Ų12084%0.83661%0.61SS**SBendtrans79.5-48.7172.3-62.5-173.1140.500118.4R265E263-R265 PolarHBondContact O-N 3.42Å
264I43.1Very low45.3Very low147 Ų147113.9 Ų113.975%0.75459%0.586SS**THydrogen-bonded Turntrans-76.8-22.6-173.5-54.4175.6000113.1G262G262-I264 PolarHBondContact O-N 3.2Å
265R45.9Very low46.3Very low88 Ų88108.5 Ų108.533%0.33257%0.565SS.*THydrogen-bonded Turntrans-81-10.4-179.6-68.5-177.4-68.9161.92.1114.5S261 E263 L269S261-R265 PolarHBondContact O-NE 3.1Å; S261-R265 VanDerWaalsContact O-NE 3.16Å; S261-R265 PolarHBondContact O-NH2 3.34Å; E263-R265 PolarHBondContact O-N 3.42Å; R265-L269 HydrophobicContact CB-CD1 4.46Å; R265-L269 WeakPolarHBondContact O-CB 3.14Å; R265-L269 PolarHBondContact O-N 2.99Å; R265-L269 VanDerWaalsContact O-N 3.12Å
266H50.8Low47.3Very low143 Ų143109.5 Ų109.566%0.66256%0.562SS**Hα-helixtrans-73-36.3-171.5-109.4-58.3000113.3K270H266-K270 WeakPolarHBondContact O-CB 3.21Å; H266-K270 PolarHBondContact O-N 3.01Å; H266-K270 VanDerWaalsContact O-N 3.11Å
267E51.1Low48.6Very low168 Ų168108 Ų10879%0.78556%0.557SS**Hα-helixtrans-71.4-40.6178.6-81.9-145.2151.400112.9K270 S271E267-K270 PolarHBondContact O-N 3.29Å; E267-S271 PolarHBondContact O-N 3.44Å
268E48.3Very low49.8Very low82 Ų82111.6 Ų111.638%0.38356%0.562SS.*Hα-helixtrans-75.2-30.5-180-67.2-17015700112.6S271 L272E268-S271 WeakPolarHBondContact CA-OG 3.47Å; E268-S271 PolarHBondContact O-OG 3.06Å; E268-L272 WeakPolarHBondContact O-CB 3.4Å; E268-L272 PolarHBondContact O-N 3.41Å
269L51.7Low50.8Low96 Ų96102.8 Ų102.850%0.50353%0.526SS..Hα-helixtrans-65.9-41.3167.4-108.284.6000111.5R265 S271 L272 E273R265-L269 HydrophobicContact CB-CD1 4.46Å; R265-L269 WeakPolarHBondContact O-CB 3.14Å; R265-L269 PolarHBondContact O-N 2.99Å; R265-L269 VanDerWaalsContact O-N 3.12Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.19Å; L269-L272 WeakPolarHBondContact O-CB 3.31Å; L269-L272 PolarHBondContact O-N 2.9Å; L269-E273 PolarHBondContact O-N 3.41Å
270K55.6Low51.6Low151 Ų151101.9 Ų101.966%0.65752%0.52SS*.Hα-helixtrans-65.9-36.8178.9-138.5175-172.6179.70111.6H266 E267 S274H266-K270 WeakPolarHBondContact O-CB 3.21Å; H266-K270 PolarHBondContact O-N 3.01Å; H266-K270 VanDerWaalsContact O-N 3.11Å; E267-K270 PolarHBondContact O-N 3.29Å; K270-S274 VanDerWaalsContact O-CB 3.28Å; K270-S274 WeakPolarHBondContact O-CB 3.09Å; K270-S274 PolarHBondContact O-N 3.42Å; K270-S274 PolarHBondContact O-OG 2.91Å
271S55.7Low52.6Low54 Ų5499 Ų9938%0.37851%0.505SS..Hα-helixtrans-68.5-38.8175.573.10000111.1E267 E268 L269 S274 L275E267-S271 PolarHBondContact O-N 3.44Å; E268-S271 WeakPolarHBondContact CA-OG 3.47Å; E268-S271 PolarHBondContact O-OG 3.06Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.19Å; S271-S274 PolarHBondContact O-OG 3.31Å; S271-L275 VanDerWaalsContact O-CB 3.27Å; S271-L275 WeakPolarHBondContact O-CB 3.39Å; S271-L275 PolarHBondContact O-N 2.91Å
272L50.5Low53.5Low49 Ų4997.2 Ų97.226%0.25749%0.494SS..Hα-helixtrans-62.6-48.9171.9-104.4160.2000112.7E268 L269 S274 L275 E276E268-L272 WeakPolarHBondContact O-CB 3.4Å; E268-L272 PolarHBondContact O-N 3.41Å; L269-L272 WeakPolarHBondContact O-CB 3.31Å; L269-L272 PolarHBondContact O-N 2.9Å; L272-S274 PolarHBondContact O-N 2.92Å; L272-L275 PolarHBondContact O-N 3.46Å; L272-L275 VanDerWaalsContact O-N 3.13Å; L272-E276 WeakPolarHBondContact O-CB 3.27Å; L272-E276 PolarHBondContact O-N 3.38Å
273E57.2Low53.8Low123 Ų12397.6 Ų97.658%0.57548%0.481SS*.Hα-helixtrans-59.9-45.2176.1-78179.7164.500111.4L269 L275 E276 E277L269-E273 PolarHBondContact O-N 3.41Å; E273-L275 PolarHBondContact O-N 3.41Å; E273-E276 PolarHBondContact O-N 2.95Å; E273-E277 WeakPolarHBondContact O-CB 3.42Å; E273-E277 PolarHBondContact O-N 2.91Å
274S61.2Low54.5Low47 Ų4794.3 Ų94.333%0.32947%0.469SS..Hα-helixtrans-65.1-26.1177.978.80000113.2K270 S271 L272 K278K270-S274 VanDerWaalsContact O-CB 3.28Å; K270-S274 WeakPolarHBondContact O-CB 3.09Å; K270-S274 PolarHBondContact O-N 3.42Å; K270-S274 PolarHBondContact O-OG 2.91Å; S271-S274 PolarHBondContact O-OG 3.31Å; L272-S274 PolarHBondContact O-N 2.92Å; S274-K278 WeakPolarHBondContact O-CD 3.44Å; S274-K278 WeakPolarHBondContact O-CG 3.48Å; S274-K278 PolarHBondContact O-N 3.01Å
275L58.2Low55.4Low34 Ų3491.1 Ų91.118%0.17845%0.454CS..Hα-helixtrans-84.3-35.4178.5-159.564.1000110.7S271 L272 E273 K278 V279 L322 Q326S271-L275 VanDerWaalsContact O-CB 3.27Å; S271-L275 WeakPolarHBondContact O-CB 3.39Å; S271-L275 PolarHBondContact O-N 2.91Å; L272-L275 PolarHBondContact O-N 3.46Å; L272-L275 VanDerWaalsContact O-N 3.13Å; E273-L275 PolarHBondContact O-N 3.41Å; L275-K278 PolarHBondContact O-N 3.44Å; L275-V279 VanDerWaalsContact O-CG2 3.25Å; L275-V279 WeakPolarHBondContact O-CG2 3.33Å; L275-V279 PolarHBondContact O-N 3.48Å; L275-L322 HydrophobicContact CD1-CD2 4.22Å; L275-Q326 HydrophobicContact CD2-CG 3.62Å; L275-Q326 HydrophobicContact CG-CG 4.46Å
276E56.5Low55.9Low104 Ų10488 Ų8849%0.48644%0.443SS..Hα-helixtrans-65.4-43.1172.5-166.4177.2168.100111.4L272 E273 K278 V279 L280L272-E276 WeakPolarHBondContact O-CB 3.27Å; L272-E276 PolarHBondContact O-N 3.38Å; E273-E276 PolarHBondContact O-N 2.95Å; E276-K278 PolarHBondContact O-N 2.92Å; E276-V279 PolarHBondContact O-N 3.16Å; E276-L280 WeakPolarHBondContact O-CB 3.4Å; E276-L280 PolarHBondContact O-N 3.33Å
277E62.1Low56.1Low127 Ų12784.4 Ų84.459%0.59344%0.435SS*.Hα-helixtrans-59.5-45173.3-171175.8-166.100111.2E273 V279 L280 D281E273-E277 WeakPolarHBondContact O-CB 3.42Å; E273-E277 PolarHBondContact O-N 2.91Å; E277-V279 VanDerWaalsContact C-N 3.34Å; E277-V279 PolarHBondContact O-N 3.26Å; E277-L280 PolarHBondContact O-N 2.87Å; E277-D281 WeakPolarHBondContact O-CB 3.43Å; E277-D281 PolarHBondContact O-N 3.42Å
278K60.5Low56.6Low132 Ų13278.8 Ų78.857%0.57442%0.417SS*.Hα-helixtrans-63.5-36.4175.4-75.9171.1-175.3173.10113.3S274 L275 E276 A282S274-K278 WeakPolarHBondContact O-CD 3.44Å; S274-K278 WeakPolarHBondContact O-CG 3.48Å; S274-K278 PolarHBondContact O-N 3.01Å; L275-K278 PolarHBondContact O-N 3.44Å; E276-K278 PolarHBondContact O-N 2.92Å; K278-A282 VanDerWaalsContact O-CB 3.32Å; K278-A282 WeakPolarHBondContact O-CB 3.29Å; K278-A282 PolarHBondContact O-N 2.97Å
279V56.9Low57.2Low18 Ų1877.7 Ų77.711%0.10941%0.411CS..Hα-helixtrans-71.9-36.4176.6169.60000110.8L275 E276 E277 N283L275-V279 VanDerWaalsContact O-CG2 3.25Å; L275-V279 WeakPolarHBondContact O-CG2 3.33Å; L275-V279 PolarHBondContact O-N 3.48Å; E276-V279 PolarHBondContact O-N 3.16Å; E277-V279 VanDerWaalsContact C-N 3.34Å; E277-V279 PolarHBondContact O-N 3.26Å; V279-N283 WeakPolarHBondContact O-CB 3.45Å; V279-N283 PolarHBondContact O-N 3.39Å
280L53.2Low57.4Low109 Ų10977.5 Ų77.557%0.57141%0.41SS*.Hα-helixtrans-67.7-44.6176.4-171.466.5000111.7E276 E277 A282 N283 L284E276-L280 WeakPolarHBondContact O-CB 3.4Å; E276-L280 PolarHBondContact O-N 3.33Å; E277-L280 PolarHBondContact O-N 2.87Å; L280-A282 VanDerWaalsContact C-N 3.35Å; L280-N283 PolarHBondContact O-N 2.93Å; L280-L284 PolarHBondContact O-N 3.5Å
281D60.8Low57.4Low98 Ų9875.6 Ų75.652%0.52441%0.407SS..Hα-helixtrans-63.1-40.4174.9-82.6-14.7000111.9E277 N283 L284 N285E277-D281 WeakPolarHBondContact O-CB 3.43Å; E277-D281 PolarHBondContact O-N 3.42Å; D281-N283 VanDerWaalsContact C-N 3.35Å; D281-N283 PolarHBondContact O-N 3.37Å; D281-L284 PolarHBondContact O-N 3.47Å; D281-N285 WeakPolarHBondContact O-CB 3.23Å; D281-N285 PolarHBondContact O-N 3.49Å
282A55.5Low57.7Low31 Ų3177.2 Ų77.226%0.25641%0.411SS..Hα-helixtrans-62.1-41.2173.400000111.8K278 L280 N285 I286K278-A282 VanDerWaalsContact O-CB 3.32Å; K278-A282 WeakPolarHBondContact O-CB 3.29Å; K278-A282 PolarHBondContact O-N 2.97Å; L280-A282 VanDerWaalsContact C-N 3.35Å; A282-N285 PolarHBondContact O-N 3.4Å; A282-I286 WeakPolarHBondContact O-CB 3.29Å; A282-I286 WeakPolarHBondContact O-CD1 3.4Å; A282-I286 WeakPolarHBondContact O-CG1 3.48Å; A282-I286 PolarHBondContact O-N 3.46Å
283N53.6Low58.1Low69 Ų6975.7 Ų75.737%0.36940%0.403SS..Hα-helixtrans-66.5-37.7177-90.4-29.6000113.3V279 L280 D281 S287 Q319V279-N283 WeakPolarHBondContact O-CB 3.45Å; V279-N283 PolarHBondContact O-N 3.39Å; L280-N283 PolarHBondContact O-N 2.93Å; D281-N283 VanDerWaalsContact C-N 3.35Å; D281-N283 PolarHBondContact O-N 3.37Å; N283-S287 PolarHBondContact O-N 2.94Å; N283-S287 PolarHBondContact O-OG 3.43Å; N283-Q319 PolarHBondContact OD1-NE2 3.32Å
284L57.1Low58Low110 Ų11073.3 Ų73.358%0.57640%0.4SS*.Hα-helixtrans-65.5-42174.2-79.1164.4000111.2L280 D281 S287 A288L280-L284 PolarHBondContact O-N 3.5Å; D281-L284 PolarHBondContact O-N 3.47Å; L284-S287 PolarHBondContact O-N 3.46Å; L284-A288 PolarHBondContact O-N 2.98Å
285N60.9Low57.9Low81 Ų8176.3 Ų76.343%0.43341%0.409SS..Hα-helixtrans-67.7-37.4177.2-162.46.3000112.2D281 A282 A288 K289D281-N285 WeakPolarHBondContact O-CB 3.23Å; D281-N285 PolarHBondContact O-N 3.49Å; A282-N285 PolarHBondContact O-N 3.4Å; N285-A288 PolarHBondContact O-N 3.32Å; N285-K289 WeakPolarHBondContact O-CB 3.46Å; N285-K289 WeakPolarHBondContact O-CG 3.31Å; N285-K289 PolarHBondContact O-N 3.43Å
286I57.5Low57.9Low21 Ų2176.7 Ų76.711%0.10841%0.411CS..Hα-helixtrans-64.9-41.4173.8-71.4166.5000111.2A282 L290 M312A282-I286 WeakPolarHBondContact O-CB 3.29Å; A282-I286 WeakPolarHBondContact O-CD1 3.4Å; A282-I286 WeakPolarHBondContact O-CG1 3.48Å; A282-I286 PolarHBondContact O-N 3.46Å; I286-L290 WeakPolarHBondContact O-CB 3.41Å; I286-L290 PolarHBondContact O-N 3.28Å; I286-M312 HydrophobicContact CG2-CE 3.69Å
287S54Low57.9Low69 Ų6974.5 Ų74.548%0.48341%0.411SS..Hα-helixtrans-65.4-43.3175.3-73.20000112.1N283 L284 K289 L290 D291N283-S287 PolarHBondContact O-N 2.94Å; N283-S287 PolarHBondContact O-OG 3.43Å; L284-S287 PolarHBondContact O-N 3.46Å; S287-K289 PolarHBondContact O-N 3Å; S287-L290 PolarHBondContact O-N 2.82Å; S287-L290 VanDerWaalsContact O-N 3.16Å; S287-D291 PolarHBondContact O-N 2.88Å
288A62.5Low57.7Low50 Ų5072.7 Ų72.741%0.41342%0.417SS..Hα-helixtrans-61.3-44.5177.100000111.9L284 N285 L290 D291 D292L284-A288 PolarHBondContact O-N 2.98Å; N285-A288 PolarHBondContact O-N 3.32Å; A288-L290 VanDerWaalsContact C-N 3.3Å; A288-L290 PolarHBondContact O-N 2.97Å; A288-D291 PolarHBondContact O-N 3.48Å; A288-D292 PolarHBondContact O-N 2.79Å
289K60Low57.6Low58 Ų5873.4 Ų73.425%0.25242%0.42SS..Hα-helixtrans-64.6-32.1174.6-75.1-168173.5-162.50112.9N285 S287 I293 E311N285-K289 WeakPolarHBondContact O-CB 3.46Å; N285-K289 WeakPolarHBondContact O-CG 3.31Å; N285-K289 PolarHBondContact O-N 3.43Å; S287-K289 PolarHBondContact O-N 3Å; K289-I293 WeakPolarHBondContact O-CD1 3.41Å; K289-I293 WeakPolarHBondContact O-CG1 3.41Å; K289-I293 PolarHBondContact O-N 3.43Å; K289-E311 IonicContact NZ-OE2 2.86Å
290L56.6Low57.5Low93 Ų9375.2 Ų75.249%0.48744%0.443SS..Hα-helixtrans-71-36.4177.2-169.166.1000111.9I286 S287 A288 I293 S294 M312I286-L290 WeakPolarHBondContact O-CB 3.41Å; I286-L290 PolarHBondContact O-N 3.28Å; S287-L290 PolarHBondContact O-N 2.82Å; S287-L290 VanDerWaalsContact O-N 3.16Å; A288-L290 VanDerWaalsContact C-N 3.3Å; A288-L290 PolarHBondContact O-N 2.97Å; L290-I293 PolarHBondContact O-N 3.02Å; L290-S294 PolarHBondContact O-N 3.14Å; L290-M312 HydrophobicContact CB-CE 4.17Å; L290-M312 HydrophobicContact CD1-CE 4.14Å
291D55.8Low57.7Low110 Ų11073.5 Ų73.559%0.58843%0.434SS*.Hα-helixtrans-65.8-42.9172.9-76.3-17.5000111S287 A288 I293 S294 E295S287-D291 PolarHBondContact O-N 2.88Å; A288-D291 PolarHBondContact O-N 3.48Å; D291-I293 PolarHBondContact O-N 2.79Å; D291-S294 WeakPolarHBondContact O-CB 3.33Å; D291-S294 PolarHBondContact O-N 3.31Å; D291-S294 VanDerWaalsContact O-N 3.15Å; D291-S294 PolarHBondContact O-OG 3.4Å; D291-E295 PolarHBondContact O-N 3.3Å
292D61.4Low57.6Low89 Ų8974.4 Ų74.448%0.47644%0.439SS..Hα-helixtrans-63.8-38.5175.3-76.7-18.9000112.8A288 S294 E295 L296A288-D292 PolarHBondContact O-N 2.79Å; D292-S294 VanDerWaalsContact C-N 3.32Å; D292-E295 PolarHBondContact O-N 2.98Å; D292-L296 WeakPolarHBondContact O-CB 3.35Å; D292-L296 WeakPolarHBondContact O-CG 3.3Å; D292-L296 PolarHBondContact O-N 2.91Å
293I57.6Low57.8Low16 Ų1678.3 Ų78.38%0.08246%0.46CS..Hα-helixtrans-65.6-37174.3-68.8162.2000110.7K289 L290 D291 E295 L296 A297 A305 M308 M312K289-I293 WeakPolarHBondContact O-CD1 3.41Å; K289-I293 WeakPolarHBondContact O-CG1 3.41Å; K289-I293 PolarHBondContact O-N 3.43Å; L290-I293 PolarHBondContact O-N 3.02Å; D291-I293 PolarHBondContact O-N 2.79Å; I293-E295 VanDerWaalsContact C-N 3.3Å; I293-E295 PolarHBondContact O-N 2.76Å; I293-L296 PolarHBondContact O-N 2.59Å; I293-A297 VanDerWaalsContact O-CB 3.25Å; I293-A297 WeakPolarHBondContact O-CB 3.41Å; I293-A297 PolarHBondContact O-N 2.86Å; I293-A305 HydrophobicContact CG2-CB 4.44Å; I293-M308 HydrophobicContact CD1-CB 3.8Å; I293-M308 HydrophobicContact CG1-CB 3.97Å; I293-M308 HydrophobicContact CG1-CE 4.48Å; I293-M308 HydrophobicContact CG1-SD 4.06Å; I293-M312 HydrophobicContact CD1-SD 3.36Å; I293-M312 WeakPolarHBondContact CD1-SD 3.39Å
294S56.1Low58.2Low74 Ų7480 Ų8052%0.51747%0.465SS..Hα-helixtrans-65.2-35.7175.684.80000111.9L290 D291 D292 A298L290-S294 PolarHBondContact O-N 3.14Å; D291-S294 WeakPolarHBondContact O-CB 3.33Å; D291-S294 PolarHBondContact O-N 3.31Å; D291-S294 VanDerWaalsContact O-N 3.15Å; D291-S294 PolarHBondContact O-OG 3.4Å; D292-S294 VanDerWaalsContact C-N 3.32Å; S294-A298 PolarHBondContact O-N 2.95Å
295E59.5Low58.2Low110 Ų11075.2 Ų75.251%0.51444%0.442SS..Hα-helixtrans-73.7-37.6176.5-159.2-170.4141.900112.3D291 D292 I293 A298 K299D291-E295 PolarHBondContact O-N 3.3Å; D292-E295 PolarHBondContact O-N 2.98Å; I293-E295 VanDerWaalsContact C-N 3.3Å; I293-E295 PolarHBondContact O-N 2.76Å; E295-A298 WeakPolarHBondContact O-CB 3.46Å; E295-A298 PolarHBondContact O-N 2.88Å; E295-K299 PolarHBondContact O-N 3.3Å; E295-K299 IonicContact OE1-NZ 2.79Å; E295-K299 PolarHBondContact OE1-NZ 3.24Å
296L57.7Low58Low42 Ų4275.6 Ų75.622%0.2245%0.447CS..Hα-helixtrans-73.4-35.5177-78163.2000112.9D292 I293 A298 K299 G300 M308D292-L296 WeakPolarHBondContact O-CB 3.35Å; D292-L296 WeakPolarHBondContact O-CG 3.3Å; D292-L296 PolarHBondContact O-N 2.91Å; I293-L296 PolarHBondContact O-N 2.59Å; L296-A298 VanDerWaalsContact C-N 3.27Å; L296-A298 PolarHBondContact O-N 2.81Å; L296-K299 PolarHBondContact O-N 3.33Å; L296-G300 PolarHBondContact O-N 3.23Å; L296-M308 HydrophobicContact CD1-CE 3.34Å
297A55.8Low58.4Low58 Ų5881.4 Ų81.448%0.47947%0.472SS..Hα-helixtrans-64.1-33.2171.800000111.8I293 K299 G300I293-A297 VanDerWaalsContact O-CB 3.25Å; I293-A297 WeakPolarHBondContact O-CB 3.41Å; I293-A297 PolarHBondContact O-N 2.86Å; A297-K299 PolarHBondContact O-N 3Å; A297-G300 PolarHBondContact O-N 3.49Å
298A58.3Low58.7Low88 Ų8880 Ų8073%0.72746%0.458SS*.Hα-helixtrans-67.8-22.4172.400000113.3S294 E295 L296S294-A298 PolarHBondContact O-N 2.95Å; E295-A298 WeakPolarHBondContact O-CB 3.46Å; E295-A298 PolarHBondContact O-N 2.88Å; L296-A298 VanDerWaalsContact C-N 3.27Å; L296-A298 PolarHBondContact O-N 2.81Å
299K59.2Low58.4Low147 Ų14781.9 Ų81.964%0.63946%0.461SS*.THydrogen-bonded Turntrans-93-3.5177.1-74.4172.8-175.21520114.1E295 L296 A297E295-K299 PolarHBondContact O-N 3.3Å; E295-K299 IonicContact OE1-NZ 2.79Å; E295-K299 PolarHBondContact OE1-NZ 3.24Å; L296-K299 PolarHBondContact O-N 3.33Å; A297-K299 PolarHBondContact O-N 3Å
300G54.1Low58.5Low57 Ų5783.3 Ų83.359%0.58847%0.474SS*.THydrogen-bonded Turntrans75.624.8171.300000116L296 A297L296-G300 PolarHBondContact O-N 3.23Å; A297-G300 PolarHBondContact O-N 3.49Å
301N58Low59Low73 Ų7382.7 Ų82.739%0.3947%0.469SS..  trans-102.881.3177.2-164.314.9000111.5T303 E304N301-T303 VanDerWaalsContact C-N 3.25Å; N301-T303 PolarHBondContact O-N 2.92Å; N301-E304 PolarHBondContact ND2-OE2 3.35Å
302D59.3Low59Low116 Ų11678.3 Ų78.362%0.6245%0.445SS*.Hα-helixtrans-68.6-17.6-168.3-61.1-33.5000114.5V306D302-V306 VanDerWaalsContact O-CG2 3.23Å; D302-V306 WeakPolarHBondContact O-CG2 3.4Å; D302-V306 PolarHBondContact O-N 3.21Å
303T59.2Low58.6Low114 Ų11481.1 Ų81.170%0.69945%0.453SS*.Hα-helixtrans-81.3-36.2-171.5-44.90000112.7N301 K307N301-T303 VanDerWaalsContact C-N 3.25Å; N301-T303 PolarHBondContact O-N 2.92Å; T303-K307 PolarHBondContact O-N 2.89Å
304E60.7Low58.9Low103 Ų10386.4 Ų86.448%0.48148%0.477SS..Hα-helixtrans-75.4-36.9175.3-82.3177.7150.500112.2N301 V306 K307 M308N301-E304 PolarHBondContact ND2-OE2 3.35Å; E304-V306 VanDerWaalsContact C-N 3.3Å; E304-V306 PolarHBondContact O-N 3.37Å; E304-K307 PolarHBondContact O-N 3.42Å; E304-M308 PolarHBondContact O-N 3.25Å
305A57.1Low59Low11 Ų1186.6 Ų86.69%0.09147%0.47CS..Hα-helixtrans-59.9-40.4175.100000111.7I293 M308 L309I293-A305 HydrophobicContact CG2-CB 4.44Å; A305-M308 PolarHBondContact O-N 3.49Å; A305-L309 VanDerWaalsContact O-CG 3.31Å; A305-L309 WeakPolarHBondContact O-CG 3.41Å; A305-L309 PolarHBondContact O-N 3.18Å
306V58Low58.7Low88 Ų8886.1 Ų86.153%0.53347%0.468SS..Hα-helixtrans-66.3-38.5176172.10000111.8D302 E304 L309 V310D302-V306 VanDerWaalsContact O-CG2 3.23Å; D302-V306 WeakPolarHBondContact O-CG2 3.4Å; D302-V306 PolarHBondContact O-N 3.21Å; E304-V306 VanDerWaalsContact C-N 3.3Å; E304-V306 PolarHBondContact O-N 3.37Å; V306-L309 PolarHBondContact O-N 3Å; V306-V310 WeakPolarHBondContact O-CG2 3.06Å; V306-V310 PolarHBondContact O-N 3.27Å; V306-V310 VanDerWaalsContact O-N 3.12Å
307K66.4Low58.7Low144 Ų14491.6 Ų91.663%0.62649%0.49SS*.Hα-helixtrans-65.7-42.6177.4-166.8-179.5177-170.10111.6T303 E304 V310 E311T303-K307 PolarHBondContact O-N 2.89Å; E304-K307 PolarHBondContact O-N 3.42Å; K307-V310 PolarHBondContact O-N 3.04Å; K307-E311 PolarHBondContact O-N 2.73Å; K307-E311 VanDerWaalsContact O-N 3.12Å
308M58.7Low59Low40 Ų4093.2 Ų93.220%0.19749%0.489CS..Hα-helixtrans-66.5-35.5174.6-80.7-169-97.600113.1I293 L296 E304 A305 V310 E311 M312I293-M308 HydrophobicContact CD1-CB 3.8Å; I293-M308 HydrophobicContact CG1-CB 3.97Å; I293-M308 HydrophobicContact CG1-CE 4.48Å; I293-M308 HydrophobicContact CG1-SD 4.06Å; L296-M308 HydrophobicContact CD1-CE 3.34Å; E304-M308 PolarHBondContact O-N 3.25Å; A305-M308 PolarHBondContact O-N 3.49Å; M308-V310 VanDerWaalsContact C-N 3.29Å; M308-V310 PolarHBondContact O-N 3.46Å; M308-E311 PolarHBondContact O-N 2.91Å; M308-M312 WeakPolarHBondContact O-CB 3.36Å; M308-M312 VanDerWaalsContact O-CG 3.29Å; M308-M312 WeakPolarHBondContact O-CG 3.25Å; M308-M312 PolarHBondContact O-N 3.49Å
309L55.9Low58.6Low89 Ų8990.4 Ų90.447%0.46646%0.461SS..Hα-helixtrans-64.1-32.7173.4-76.6171.8000113.1A305 V306 K313A305-L309 VanDerWaalsContact O-CG 3.31Å; A305-L309 WeakPolarHBondContact O-CG 3.41Å; A305-L309 PolarHBondContact O-N 3.18Å; V306-L309 PolarHBondContact O-N 3Å; L309-K313 PolarHBondContact O-N 3.43Å; L309-K313 VanDerWaalsContact O-N 3.11Å
310V64.1Low58.1Low88 Ų8889.9 Ų89.953%0.53346%0.461SS..Hα-helixtrans-69.3-45.3174.1172.80000110.5V306 K307 M308 M312 K313 E314V306-V310 WeakPolarHBondContact O-CG2 3.06Å; V306-V310 PolarHBondContact O-N 3.27Å; V306-V310 VanDerWaalsContact O-N 3.12Å; K307-V310 PolarHBondContact O-N 3.04Å; M308-V310 VanDerWaalsContact C-N 3.29Å; M308-V310 PolarHBondContact O-N 3.46Å; V310-M312 VanDerWaalsContact C-N 3.33Å; V310-M312 PolarHBondContact O-N 3.01Å; V310-K313 PolarHBondContact O-N 3.35Å; V310-E314 PolarHBondContact O-N 3.03Å; V310-E314 VanDerWaalsContact O-N 3.14Å
311E65.4Low58.4Low80 Ų8092.5 Ų92.537%0.37446%0.458SS..Hα-helixtrans-61.4-39.6174.7-74179.3-166.900112.3K289 K307 M308 K313 E314 Q315K289-E311 IonicContact NZ-OE2 2.86Å; K307-E311 PolarHBondContact O-N 2.73Å; K307-E311 VanDerWaalsContact O-N 3.12Å; M308-E311 PolarHBondContact O-N 2.91Å; E311-K313 PolarHBondContact O-N 3.29Å; E311-E314 PolarHBondContact O-N 3.04Å; E311-Q315 WeakPolarHBondContact O-CG 3.47Å; E311-Q315 PolarHBondContact O-N 3.48Å
312M56.9Low58.3Low18 Ų1891.6 Ų91.69%0.08945%0.453CS..Hα-helixtrans-64.1-38.7175.7-73.3-178.385.500112.4I286 L290 I293 M308 V310 E314 Q315 Q316I286-M312 HydrophobicContact CG2-CE 3.69Å; L290-M312 HydrophobicContact CB-CE 4.17Å; L290-M312 HydrophobicContact CD1-CE 4.14Å; I293-M312 HydrophobicContact CD1-SD 3.36Å; I293-M312 WeakPolarHBondContact CD1-SD 3.39Å; M308-M312 WeakPolarHBondContact O-CB 3.36Å; M308-M312 VanDerWaalsContact O-CG 3.29Å; M308-M312 WeakPolarHBondContact O-CG 3.25Å; M308-M312 PolarHBondContact O-N 3.49Å; V310-M312 VanDerWaalsContact C-N 3.33Å; V310-M312 PolarHBondContact O-N 3.01Å; M312-E314 VanDerWaalsContact C-N 3.28Å; M312-E314 PolarHBondContact O-N 3.31Å; M312-Q315 PolarHBondContact O-N 2.92Å; M312-Q316 WeakPolarHBondContact O-CB 3.19Å; M312-Q316 WeakPolarHBondContact O-CG 3.48Å; M312-Q316 PolarHBondContact O-N 3.39Å
313K53.5Low58Low147 Ų14789.3 Ų89.364%0.63944%0.44SS*.Hα-helixtrans-64.8-33.5174.5-87.9-174.2176.81780112.5L309 V310 E311 K317L309-K313 PolarHBondContact O-N 3.43Å; L309-K313 VanDerWaalsContact O-N 3.11Å; V310-K313 PolarHBondContact O-N 3.35Å; E311-K313 PolarHBondContact O-N 3.29Å; K313-K317 PolarHBondContact O-N 3.38Å; K313-K317 VanDerWaalsContact O-N 3.17Å
314E63.5Low58.3Low127 Ų12787.1 Ų87.159%0.59343%0.426SS*.Hα-helixtrans-72.6-41.4177-165.8149.9-154.500111.2V310 E311 M312 Q316 K317 I318V310-E314 PolarHBondContact O-N 3.03Å; V310-E314 VanDerWaalsContact O-N 3.14Å; E311-E314 PolarHBondContact O-N 3.04Å; M312-E314 VanDerWaalsContact C-N 3.28Å; M312-E314 PolarHBondContact O-N 3.31Å; E314-Q316 PolarHBondContact O-N 2.94Å; E314-K317 WeakPolarHBondContact O-CB 3.16Å; E314-K317 PolarHBondContact O-N 2.92Å; E314-I318 WeakPolarHBondContact O-CG1 3.43Å; E314-I318 PolarHBondContact O-N 3.24Å; E314-I318 VanDerWaalsContact O-N 3.16Å
315Q58.3Low58.1Low78 Ų7889 Ų8936%0.36443%0.429SS..Hα-helixtrans-62.5-40.5171.7-68.5-119.6-50.100112.6E311 M312 K317 I318 Q319E311-Q315 WeakPolarHBondContact O-CG 3.47Å; E311-Q315 PolarHBondContact O-N 3.48Å; M312-Q315 PolarHBondContact O-N 2.92Å; Q315-K317 VanDerWaalsContact C-N 3.32Å; Q315-K317 PolarHBondContact O-N 3.02Å; Q315-I318 PolarHBondContact O-N 3.36Å; Q315-Q319 WeakPolarHBondContact O-CB 3.29Å; Q315-Q319 PolarHBondContact O-N 3.3Å
316Q53.5Low57.6Low100 Ų10089.6 Ų89.647%0.46743%0.43SS..Hα-helixtrans-62.4-36.8175.1-79.2-178.8-17.800112.6M312 E314 Q319 Q320M312-Q316 WeakPolarHBondContact O-CB 3.19Å; M312-Q316 WeakPolarHBondContact O-CG 3.48Å; M312-Q316 PolarHBondContact O-N 3.39Å; E314-Q316 PolarHBondContact O-N 2.94Å; Q316-Q319 PolarHBondContact O-N 3.42Å; Q316-Q320 WeakPolarHBondContact O-CB 3.46Å; Q316-Q320 PolarHBondContact O-N 3.37Å
317K57.5Low57.6Low157 Ų15791.6 Ų91.668%0.68343%0.433SS*.Hα-helixtrans-64.1-45.9174.4-84.8-177.5175.5179.80112K313 E314 Q315 Q319 Q320 E321K313-K317 PolarHBondContact O-N 3.38Å; K313-K317 VanDerWaalsContact O-N 3.17Å; E314-K317 WeakPolarHBondContact O-CB 3.16Å; E314-K317 PolarHBondContact O-N 2.92Å; Q315-K317 VanDerWaalsContact C-N 3.32Å; Q315-K317 PolarHBondContact O-N 3.02Å; K317-Q319 VanDerWaalsContact C-N 3.29Å; K317-Q319 PolarHBondContact O-N 2.8Å; K317-Q320 PolarHBondContact O-N 3.28Å; K317-E321 PolarHBondContact O-N 2.99Å
318I61.7Low57.4Low92 Ų9290.4 Ų90.447%0.47243%0.43SS..Hα-helixtrans-61.8-42177.3-64.6168.1000109.9E314 Q315 Q320 E321 L322E314-I318 WeakPolarHBondContact O-CG1 3.43Å; E314-I318 PolarHBondContact O-N 3.24Å; E314-I318 VanDerWaalsContact O-N 3.16Å; Q315-I318 PolarHBondContact O-N 3.36Å; I318-Q320 PolarHBondContact O-N 3.36Å; I318-E321 WeakPolarHBondContact O-CB 3.44Å; I318-E321 PolarHBondContact O-N 3.42Å; I318-L322 HydrophobicContact CG2-CD1 4.34Å; I318-L322 WeakPolarHBondContact O-CG 3.43Å; I318-L322 PolarHBondContact O-N 3.33Å
319Q50.1Low57.5Low30 Ų3091.2 Ų91.214%0.1444%0.435CS..Hα-helixtrans-62.9-42.6176.9-168.6175.9600112.1N283 Q315 Q316 K317 E321 L322 I323N283-Q319 PolarHBondContact OD1-NE2 3.32Å; Q315-Q319 WeakPolarHBondContact O-CB 3.29Å; Q315-Q319 PolarHBondContact O-N 3.3Å; Q316-Q319 PolarHBondContact O-N 3.42Å; K317-Q319 VanDerWaalsContact C-N 3.29Å; K317-Q319 PolarHBondContact O-N 2.8Å; Q319-E321 VanDerWaalsContact C-N 3.29Å; Q319-E321 PolarHBondContact O-N 3.11Å; Q319-L322 PolarHBondContact O-N 3.45Å; Q319-I323 HydrophobicContact CG-CD1 4.38Å; Q319-I323 WeakPolarHBondContact O-CG1 3.17Å; Q319-I323 PolarHBondContact O-N 3.34Å
320Q48.2Very low57.6Low135 Ų13588.7 Ų88.763%0.63142%0.423SS*.Hα-helixtrans-65.9-34.6177.5-157.2156.48.100111.6Q316 K317 I318 I323 V324Q316-Q320 WeakPolarHBondContact O-CB 3.46Å; Q316-Q320 PolarHBondContact O-N 3.37Å; K317-Q320 PolarHBondContact O-N 3.28Å; I318-Q320 PolarHBondContact O-N 3.36Å; Q320-I323 PolarHBondContact O-N 3.15Å; Q320-V324 VanDerWaalsContact O-CG2 3.31Å; Q320-V324 WeakPolarHBondContact O-CG2 3.4Å; Q320-V324 PolarHBondContact O-N 3.24Å; Q320-V324 VanDerWaalsContact O-N 3.09Å
321E60.5Low57.4Low113 Ų11387.2 Ų87.253%0.52842%0.42SS..Hα-helixtrans-67.4-37.7172.9-161.4178.5167.500112.5K317 I318 Q319 V324 R325K317-E321 PolarHBondContact O-N 2.99Å; I318-E321 WeakPolarHBondContact O-CB 3.44Å; I318-E321 PolarHBondContact O-N 3.42Å; Q319-E321 VanDerWaalsContact C-N 3.29Å; Q319-E321 PolarHBondContact O-N 3.11Å; E321-V324 PolarHBondContact O-N 3.28Å; E321-R325 PolarHBondContact O-N 3.16Å
322L54.6Low57.1Low54 Ų5490.2 Ų90.228%0.28343%0.434SS..Hα-helixtrans-67.2-39.2175.2-69.8173000112.5L275 I318 Q319 R325 Q326L275-L322 HydrophobicContact CD1-CD2 4.22Å; I318-L322 HydrophobicContact CG2-CD1 4.34Å; I318-L322 WeakPolarHBondContact O-CG 3.43Å; I318-L322 PolarHBondContact O-N 3.33Å; Q319-L322 PolarHBondContact O-N 3.45Å; L322-R325 PolarHBondContact O-N 3.46Å; L322-Q326 PolarHBondContact O-N 3.13Å
323I54.7Low56.7Low68 Ų6892.2 Ų92.235%0.34944%0.444SS..Hα-helixtrans-63.4-45175-67.5164.7000110.4Q319 Q320 R325 Q326 E327Q319-I323 HydrophobicContact CG-CD1 4.38Å; Q319-I323 WeakPolarHBondContact O-CG1 3.17Å; Q319-I323 PolarHBondContact O-N 3.34Å; Q320-I323 PolarHBondContact O-N 3.15Å; I323-R325 VanDerWaalsContact C-N 3.28Å; I323-R325 PolarHBondContact O-N 3.44Å; I323-Q326 WeakPolarHBondContact O-CB 3.48Å; I323-Q326 PolarHBondContact O-N 3.37Å; I323-Q326 VanDerWaalsContact O-N 3.11Å; I323-E327 PolarHBondContact O-N 3.19Å
324V64.4Low57Low67 Ų6788.9 Ų88.941%0.40643%0.434SS..Hα-helixtrans-61.1-37.6175.8170.80000111.4Q320 E321 E327 Q328Q320-V324 VanDerWaalsContact O-CG2 3.31Å; Q320-V324 WeakPolarHBondContact O-CG2 3.4Å; Q320-V324 PolarHBondContact O-N 3.24Å; Q320-V324 VanDerWaalsContact O-N 3.09Å; E321-V324 PolarHBondContact O-N 3.28Å; V324-E327 PolarHBondContact O-N 3.02Å; V324-Q328 WeakPolarHBondContact O-CG 3.41Å; V324-Q328 PolarHBondContact O-N 3.5Å; V324-Q328 VanDerWaalsContact O-N 3.07Å
325R57.8Low57.1Low143 Ų14389.6 Ų89.654%0.5444%0.435SS..Hα-helixtrans-66.4-38.7173.7-76.2-166.5-172.3-169.95.7112.7E321 L322 I323 Q328 I329E321-R325 PolarHBondContact O-N 3.16Å; L322-R325 PolarHBondContact O-N 3.46Å; I323-R325 VanDerWaalsContact C-N 3.28Å; I323-R325 PolarHBondContact O-N 3.44Å; R325-Q328 PolarHBondContact O-N 2.78Å; R325-I329 VanDerWaalsContact O-CG1 3.32Å; R325-I329 WeakPolarHBondContact O-CG1 3.42Å; R325-I329 PolarHBondContact O-N 3.04Å
326Q46.3Very low57.1Low24 Ų2491.8 Ų91.811%0.11244%0.443CS..Hα-helixtrans-61.3-45173.9-79.6-176.3-19.400111.4L275 L322 I323 Q328 I329 V330L275-Q326 HydrophobicContact CD2-CG 3.62Å; L275-Q326 HydrophobicContact CG-CG 4.46Å; L322-Q326 PolarHBondContact O-N 3.13Å; I323-Q326 WeakPolarHBondContact O-CB 3.48Å; I323-Q326 PolarHBondContact O-N 3.37Å; I323-Q326 VanDerWaalsContact O-N 3.11Å; Q326-Q328 VanDerWaalsContact C-N 3.29Å; Q326-Q328 PolarHBondContact O-N 3.31Å; Q326-I329 PolarHBondContact O-N 2.92Å; Q326-V330 WeakPolarHBondContact O-CG2 3.33Å; Q326-V330 PolarHBondContact O-N 3.42Å
327E57.6Low57.2Low129 Ų12990.1 Ų90.160%0.60344%0.443SS*.Hα-helixtrans-58.9-41.1176-71.7-179.716700112I323 V324 V330 A331I323-E327 PolarHBondContact O-N 3.19Å; V324-E327 PolarHBondContact O-N 3.02Å; E327-V330 PolarHBondContact O-N 3.42Å; E327-A331 WeakPolarHBondContact O-CB 3.48Å; E327-A331 PolarHBondContact O-N 2.96Å
328Q62.8Low57.2Low119 Ų11988.8 Ų88.856%0.55644%0.439SS*.Hα-helixtrans-64.9-42176.6-74.2177.3-12.100112.6V324 R325 Q326 A331 Q332V324-Q328 WeakPolarHBondContact O-CG 3.41Å; V324-Q328 PolarHBondContact O-N 3.5Å; V324-Q328 VanDerWaalsContact O-N 3.07Å; R325-Q328 PolarHBondContact O-N 2.78Å; Q326-Q328 VanDerWaalsContact C-N 3.29Å; Q326-Q328 PolarHBondContact O-N 3.31Å; Q328-A331 PolarHBondContact O-N 3.24Å; Q328-Q332 WeakPolarHBondContact O-CG 3.42Å; Q328-Q332 PolarHBondContact O-N 3.02Å
329I59.8Low57.2Low58 Ų5889.5 Ų89.530%0.29744%0.443SS..Hα-helixtrans-65.3-44.7177.8-69.3166.2000110.3R325 Q326 A331 Q332 L333R325-I329 VanDerWaalsContact O-CG1 3.32Å; R325-I329 WeakPolarHBondContact O-CG1 3.42Å; R325-I329 PolarHBondContact O-N 3.04Å; Q326-I329 PolarHBondContact O-N 2.92Å; I329-A331 VanDerWaalsContact C-N 3.33Å; I329-A331 PolarHBondContact O-N 3.33Å; I329-Q332 PolarHBondContact O-N 3.45Å; I329-L333 HydrophobicContact CG2-CD1 3.84Å; I329-L333 PolarHBondContact O-N 2.94Å
330V57.2Low57.2Low36 Ų3693.3 Ų93.322%0.21846%0.463CS..Hα-helixtrans-62-41.3176.2171.80000111.3Q326 E327 Q332 L333 N334Q326-V330 WeakPolarHBondContact O-CG2 3.33Å; Q326-V330 PolarHBondContact O-N 3.42Å; E327-V330 PolarHBondContact O-N 3.42Å; V330-Q332 VanDerWaalsContact C-N 3.34Å; V330-Q332 PolarHBondContact O-N 3.45Å; V330-L333 PolarHBondContact O-N 3.39Å; V330-N334 WeakPolarHBondContact O-CB 3.26Å; V330-N334 PolarHBondContact O-N 3.49Å
331A61.8Low57.2Low57 Ų5789.5 Ų89.547%0.47146%0.455SS..Hα-helixtrans-63.9-38.4175.400000112.3E327 Q328 I329 K335E327-A331 WeakPolarHBondContact O-CB 3.48Å; E327-A331 PolarHBondContact O-N 2.96Å; Q328-A331 PolarHBondContact O-N 3.24Å; I329-A331 VanDerWaalsContact C-N 3.33Å; I329-A331 PolarHBondContact O-N 3.33Å; A331-K335 VanDerWaalsContact O-CB 3.31Å; A331-K335 WeakPolarHBondContact O-CB 3.29Å; A331-K335 PolarHBondContact O-N 3.39Å
332Q57.2Low56.6Low143 Ų14389.3 Ų89.367%0.66846%0.457SS*.Hα-helixtrans-65.9-42.6174.2-74.8-169.1-7.100112Q328 I329 V330 K335 K336Q328-Q332 WeakPolarHBondContact O-CG 3.42Å; Q328-Q332 PolarHBondContact O-N 3.02Å; I329-Q332 PolarHBondContact O-N 3.45Å; V330-Q332 VanDerWaalsContact C-N 3.34Å; V330-Q332 PolarHBondContact O-N 3.45Å; Q332-K335 PolarHBondContact O-N 2.95Å; Q332-K336 VanDerWaalsContact O-CB 3.25Å; Q332-K336 WeakPolarHBondContact O-CB 3.45Å; Q332-K336 PolarHBondContact O-N 2.84Å
333L50.4Low56.4Low59 Ų5989.5 Ų89.531%0.30947%0.467SS..Hα-helixtrans-61.9-45.1175.4-92.5143.8000111.9I329 V330 K336 S337I329-L333 HydrophobicContact CG2-CD1 3.84Å; I329-L333 PolarHBondContact O-N 2.94Å; V330-L333 PolarHBondContact O-N 3.39Å; L333-K336 PolarHBondContact O-N 3.47Å; L333-S337 WeakPolarHBondContact O-CB 3.46Å; L333-S337 PolarHBondContact O-N 3.28Å
334N58.9Low55.9Low78 Ų7891.2 Ų91.242%0.41748%0.481SS..Hα-helixtrans-62.8-46.8176.7-78.5-16.9000111.3V330 K336 S337 E338V330-N334 WeakPolarHBondContact O-CB 3.26Å; V330-N334 PolarHBondContact O-N 3.49Å; N334-K336 VanDerWaalsContact C-N 3.33Å; N334-K336 PolarHBondContact O-N 2.91Å; N334-S337 PolarHBondContact O-N 3.16Å; N334-S337 PolarHBondContact O-OG 3.44Å; N334-E338 PolarHBondContact O-N 3.45Å
335K65.3Low54.9Low141 Ų14191.9 Ų91.961%0.61349%0.493SS*.Hα-helixtrans-63.3-38.7177.9-166.1174.2-175.31770112.2A331 Q332 E338 I339A331-K335 VanDerWaalsContact O-CB 3.31Å; A331-K335 WeakPolarHBondContact O-CB 3.29Å; A331-K335 PolarHBondContact O-N 3.39Å; Q332-K335 PolarHBondContact O-N 2.95Å; K335-E338 PolarHBondContact O-N 2.91Å; K335-I339 HydrophobicContact CG-CD1 4.21Å; K335-I339 WeakPolarHBondContact O-CD1 3.14Å; K335-I339 WeakPolarHBondContact O-CG1 3.33Å; K335-I339 PolarHBondContact O-N 2.97Å
336K59.2Low53.9Low124 Ų12492.8 Ų92.854%0.53950%0.503SS..Hα-helixtrans-68.7-37.4175.7-164.1175.6-178.2-176.50111.1Q332 L333 N334 I339 L340Q332-K336 VanDerWaalsContact O-CB 3.25Å; Q332-K336 WeakPolarHBondContact O-CB 3.45Å; Q332-K336 PolarHBondContact O-N 2.84Å; L333-K336 PolarHBondContact O-N 3.47Å; N334-K336 VanDerWaalsContact C-N 3.33Å; N334-K336 PolarHBondContact O-N 2.91Å; K336-I339 PolarHBondContact O-N 3.16Å; K336-L340 WeakPolarHBondContact O-CB 3.34Å; K336-L340 PolarHBondContact O-N 2.96Å
337S54.7Low53.3Low66 Ų6694.5 Ų94.546%0.46253%0.527SS..Hα-helixtrans-65.6-38.2173.881.40000112.4L333 N334 L340 A341L333-S337 WeakPolarHBondContact O-CB 3.46Å; L333-S337 PolarHBondContact O-N 3.28Å; N334-S337 PolarHBondContact O-N 3.16Å; N334-S337 PolarHBondContact O-OG 3.44Å; S337-L340 PolarHBondContact O-N 3.41Å; S337-A341 WeakPolarHBondContact O-CB 3.33Å; S337-A341 PolarHBondContact O-N 3.19Å
338E57.9Low52.1Low129 Ų12997.8 Ų97.860%0.60354%0.543SS*.Hα-helixtrans-68.8-41.4174.8-78-176.5152.300112N334 K335 L340 A341 N342N334-E338 PolarHBondContact O-N 3.45Å; K335-E338 PolarHBondContact O-N 2.91Å; E338-L340 VanDerWaalsContact C-N 3.32Å; E338-A341 PolarHBondContact O-N 3.34Å; E338-N342 WeakPolarHBondContact O-CB 3.2Å; E338-N342 PolarHBondContact O-N 3.37Å
339I60.7Low50.5Low107 Ų10796.3 Ų96.355%0.54955%0.551SS.*Hα-helixtrans-63.5-41.6175.2-68.8163.4000110.4K335 K336 N342 A343K335-I339 HydrophobicContact CG-CD1 4.21Å; K335-I339 WeakPolarHBondContact O-CD1 3.14Å; K335-I339 WeakPolarHBondContact O-CG1 3.33Å; K335-I339 PolarHBondContact O-N 2.97Å; K336-I339 PolarHBondContact O-N 3.16Å; I339-N342 PolarHBondContact O-N 2.96Å; I339-A343 WeakPolarHBondContact O-CB 3.2Å; I339-A343 PolarHBondContact O-N 3.45Å
340L51.5Low48.9Very low109 Ų10998 Ų9857%0.57157%0.574SS**Hα-helixtrans-70.2-38178.6-142.3136.5000111.1K336 S337 E338 A343 T344K336-L340 WeakPolarHBondContact O-CB 3.34Å; K336-L340 PolarHBondContact O-N 2.96Å; S337-L340 PolarHBondContact O-N 3.41Å; E338-L340 VanDerWaalsContact C-N 3.32Å; L340-A343 PolarHBondContact O-N 3Å; L340-T344 PolarHBondContact O-N 3.27Å; L340-T344 PolarHBondContact O-OG1 3.08Å
341A47.8Very low47.4Very low55 Ų55101.8 Ų101.846%0.45560%0.601SS.*Hα-helixtrans-62.4-43.6172.900000112.2S337 E338 T344 A345S337-A341 WeakPolarHBondContact O-CB 3.33Å; S337-A341 PolarHBondContact O-N 3.19Å; E338-A341 PolarHBondContact O-N 3.34Å; A341-T344 WeakPolarHBondContact CA-OG1 3.3Å; A341-T344 PolarHBondContact O-N 3.33Å; A341-T344 PolarHBondContact O-OG1 3.49Å; A341-A345 PolarHBondContact O-N 3.5Å; A341-A345 VanDerWaalsContact O-N 3.1Å
342N48.5Very low45.7Very low109 Ų109107.9 Ų107.958%0.58362%0.62SS**Hα-helixtrans-68.7-35.1175.3-75.2-8.9000112.2E338 I339 A345 E346E338-N342 WeakPolarHBondContact O-CB 3.2Å; E338-N342 PolarHBondContact O-N 3.37Å; I339-N342 PolarHBondContact O-N 2.96Å; N342-A345 WeakPolarHBondContact O-CB 3.44Å; N342-A345 PolarHBondContact O-N 2.84Å; N342-A345 VanDerWaalsContact O-N 3.12Å; N342-E346 PolarHBondContact O-N 3.44Å; N342-E346 VanDerWaalsContact O-N 3.09Å
343A50.6Low44.2Very low58 Ų58105.7 Ų105.748%0.47963%0.626SS.*Hα-helixtrans-66.4-35.4173.200000112.5I339 L340 A345 E346 G347I339-A343 WeakPolarHBondContact O-CB 3.2Å; I339-A343 PolarHBondContact O-N 3.45Å; L340-A343 PolarHBondContact O-N 3Å; A343-A345 VanDerWaalsContact C-N 3.31Å; A343-E346 PolarHBondContact O-N 2.87Å; A343-G347 PolarHBondContact O-N 2.99Å; A343-G347 VanDerWaalsContact O-N 3.08Å
344T43.9Very low42.9Very low105 Ų105107.4 Ų107.464%0.64465%0.649SS**Hα-helixtrans-70.5-23.5169.624.30000113.6L340 A341L340-T344 PolarHBondContact O-N 3.27Å; L340-T344 PolarHBondContact O-OG1 3.08Å; A341-T344 WeakPolarHBondContact CA-OG1 3.3Å; A341-T344 PolarHBondContact O-N 3.33Å; A341-T344 PolarHBondContact O-OG1 3.49Å
345A42.2Very low41.3Very low80 Ų80113.3 Ų113.366%0.66167%0.671SS**Hα-helixtrans-79.2-26.6175.100000112.9A341 N342 A343A341-A345 PolarHBondContact O-N 3.5Å; A341-A345 VanDerWaalsContact O-N 3.1Å; N342-A345 WeakPolarHBondContact O-CB 3.44Å; N342-A345 PolarHBondContact O-N 2.84Å; N342-A345 VanDerWaalsContact O-N 3.12Å; A343-A345 VanDerWaalsContact C-N 3.31Å
346E37.4Very low39.6Very low162 Ų162114.2 Ų114.276%0.75768%0.681SS**Hα-helixtrans-94.9-6.2175.1-67.3-174.4159.300113.3N342 A343 E348 A349N342-E346 PolarHBondContact O-N 3.44Å; N342-E346 VanDerWaalsContact O-N 3.09Å; A343-E346 PolarHBondContact O-N 2.87Å; E346-E348 PolarHBondContact O-N 2.86Å; E346-A349 PolarHBondContact O-N 2.72Å
347G34.2Very low38.1Very low60 Ų60114.1 Ų114.162%0.61969%0.693SS**THydrogen-bonded Turntrans-78.8-2.5-175.600000117.2A343A343-G347 PolarHBondContact O-N 2.99Å; A343-G347 VanDerWaalsContact O-N 3.08Å
348E31.3Very low36.7Very low199 Ų199118.2 Ų118.293%0.9371%0.705SS**THydrogen-bonded Turntrans-90.13.2171-89.5-172.4155.500113.8E346E346-E348 PolarHBondContact O-N 2.86Å
349A29.9Very low35.2Very low87 Ų87120.4 Ų120.472%0.71971%0.713SS**SBendtrans-141.864.9-179.600000113.8E346E346-A349 PolarHBondContact O-N 2.72Å
350A26.5Very low33.5Very low95 Ų95123.9 Ų123.979%0.78573%0.731SS**  trans163.6109.2137.200000111.2
351S26.2Very low32.4Very low114 Ų114122.6 Ų122.680%0.79774%0.736SS**  trans-69.9145.2152.6173.70000109.1
352E26.4Very low31.5Very low186 Ų186125.8 Ų125.887%0.86975%0.753SS**  trans89.792.8154.7-148.6165.2-161.100118.1
353A23.8Very low30.5Very low96 Ų96126.2 Ų126.279%0.79376%0.761SS**  -179.7106129.600000113.5
354A24.8Very low29.7Very low96 Ų96132 Ų13279%0.79378%0.778SS**  trans59131.8133.200000123.7
355K24Very low29.3Very low202 Ų202132.8 Ų132.888%0.87878%0.778SS**  trans89.7108.6141.2-98.7174176.5178.50120.1
356I30.2Very low29Very low160 Ų160134.7 Ų134.782%0.82178%0.782SS**  trans-61.7144.1151.5-58.5164.1000109.3
357P27.5Very low28.9Very low121 Ų121134.3 Ų134.379%0.78678%0.78SS**  -133.8132.112831.8-16.8000114.8
358E25.9Very low28.9Very low153 Ų153135.5 Ų135.572%0.71578%0.775SS**  trans0.7138.1146.9-148.4178.7155.800122.5
359K26.6Very low29.1Very low175 Ų175133.1 Ų133.176%0.76177%0.766SS**  trans63.4120.4150-92.8172.8-179.6158.60121.2
360L24.5Very low29.5Very low180 Ų180134.3 Ų134.394%0.94276%0.757SS**  trans-142.3131.4136.1-142.275.6000109.8
361A27.4Very low30Very low82 Ų82137.3 Ų137.368%0.67875%0.752SS**PPolyproline II helixtrans-64.6156.9-172.100000113.9
362P28.7Very low30.5Very low122 Ų122138.8 Ų138.879%0.79275%0.746SS**PPolyproline II helixtrans-68.7136.5171.228.1-31.4000110.1E364P362-E364 PolarHBondContact O-N 3.39Å
363P29.4Very low31.1Very low118 Ų118132 Ų13277%0.76673%0.727SS**PPolyproline II helixtrans-70.7123.8172.725.9-29.3000110.6N365P363-N365 PolarHBondContact O-N 3.2Å
364E33.8Very low31.8Very low178 Ų178133.9 Ų133.983%0.83272%0.717SS**SBendtrans-37.7124.6153.5-86.9170.4125.800110P362P362-E364 PolarHBondContact O-N 3.39Å
365N34.5Very low32.4Very low122 Ų122132.2 Ų132.265%0.65270%0.703SS**  trans162.22.5152.6-80.7-22.4000113.3P363P363-N365 PolarHBondContact O-N 3.2Å
366V36Very low33.1Very low121 Ų121125.1 Ų125.173%0.73368%0.682SS**Hα-helixtrans-77.1-29.2176.5-175.30000112.3
367E35.2Very low33.6Very low154 Ų154120.1 Ų120.172%0.7267%0.665SS**Hα-helixtrans-80.1-19.7-178.4-72-171.2160.100114.5
368T34.9Very low34.3Very low84 Ų84121.5 Ų121.552%0.51566%0.661SS.*Hα-helixtrans-81.8-33.7-176-10.30000112.1E372T368-E372 PolarHBondContact O-N 3.15Å
369M34.2Very low34.9Very low150 Ų150117.9 Ų117.974%0.73965%0.652SS**Hα-helixtrans-78.7-25.9177-70.7-168.9174.100113.3K371 E372 G373M369-K371 VanDerWaalsContact C-N 3.28Å; M369-K371 PolarHBondContact O-N 3.49Å; M369-E372 PolarHBondContact O-N 2.94Å; M369-G373 PolarHBondContact O-N 3.35Å; M369-G373 VanDerWaalsContact O-N 3.09Å
370E38.4Very low35.7Very low112 Ų112116.3 Ų116.352%0.52365%0.648SS.*Hα-helixtrans-70.3-26.9175.5-133.2-160.3125.800112.4K374E370-K374 PolarHBondContact O-N 3.38Å; E370-K374 IonicContact OE1-NZ 3.5Å; E370-K374 PolarHBondContact OE1-NZ 2.95Å
371K37.7Very low36.5Very low157 Ų157115.6 Ų115.668%0.68364%0.637SS**Hα-helixtrans-79.6-35.3175.7-75.9-180179.81700112.9M369 A375M369-K371 VanDerWaalsContact C-N 3.28Å; M369-K371 PolarHBondContact O-N 3.49Å; K371-A375 PolarHBondContact O-N 3.48Å
372E36.3Very low37.1Very low145 Ų145119.6 Ų119.668%0.67864%0.639SS**Hα-helixtrans-72.7-36.8175.7-72.1-174.5155.200112.1T368 M369 A375 A376T368-E372 PolarHBondContact O-N 3.15Å; M369-E372 PolarHBondContact O-N 2.94Å; E372-A375 PolarHBondContact O-N 2.91Å; E372-A376 PolarHBondContact O-N 2.89Å
373G38.7Very low37.8Very low45 Ų45117 Ų11746%0.46463%0.628SS.*Hα-helixtrans-66.9-36.5174.800000114.1M369 A377M369-G373 PolarHBondContact O-N 3.35Å; M369-G373 VanDerWaalsContact O-N 3.09Å; G373-A377 PolarHBondContact O-N 3.14Å
374K39Very low38.5Very low135 Ų135116.6 Ų116.659%0.58762%0.623SS**Hα-helixtrans-72.1-33175.8-82170175.6152.80112.7E370 E378E370-K374 PolarHBondContact O-N 3.38Å; E370-K374 IonicContact OE1-NZ 3.5Å; E370-K374 PolarHBondContact OE1-NZ 2.95Å; K374-E378 PolarHBondContact O-N 3.32Å
375A37.6Very low38.8Very low60 Ų60114.5 Ų114.550%0.49662%0.617SS.*Hα-helixtrans-71.2-34.2176.400000113K371 E372 S379K371-A375 PolarHBondContact O-N 3.48Å; E372-A375 PolarHBondContact O-N 2.91Å; A375-S379 PolarHBondContact O-N 3.15Å
376A38.8Very low39.2Very low54 Ų54114.3 Ų114.345%0.44662%0.621SS.*Hα-helixtrans-71-37.5174.700000112.5E372 E378 S379 E380E372-A376 PolarHBondContact O-N 2.89Å; A376-E378 VanDerWaalsContact C-N 3.31Å; A376-E378 PolarHBondContact O-N 2.68Å; A376-S379 PolarHBondContact O-N 3.32Å; A376-S379 PolarHBondContact O-OG 3.07Å; A376-E380 PolarHBondContact O-N 2.83Å
377A40.7Very low39.6Very low55 Ų55117 Ų11746%0.45563%0.626SS.*Hα-helixtrans-70.1-24.5176.900000113.7G373G373-A377 PolarHBondContact O-N 3.14Å
378E42Very low39.8Very low149 Ų149119.1 Ų119.170%0.69665%0.649SS**Hα-helixtrans-81.7-28175.3-106.8-176.1164.900113.5K374 A376 K382K374-E378 PolarHBondContact O-N 3.32Å; A376-E378 VanDerWaalsContact C-N 3.31Å; A376-E378 PolarHBondContact O-N 2.68Å; E378-K382 PolarHBondContact O-N 2.84Å
379S39.1Very low40Very low77 Ų77120.9 Ų120.954%0.53866%0.656SS.*Hα-helixtrans-73.7-33.5174.468.10000111.8A375 A376 K382 A383A375-S379 PolarHBondContact O-N 3.15Å; A376-S379 PolarHBondContact O-N 3.32Å; A376-S379 PolarHBondContact O-OG 3.07Å; S379-K382 PolarHBondContact O-N 2.76Å; S379-A383 PolarHBondContact O-N 3.33Å; S379-A383 VanDerWaalsContact O-N 3.17Å
380E43Very low40.3Very low142 Ų142119.4 Ų119.466%0.66465%0.652SS**Hα-helixtrans-69.5-37177.6-140.2174.7154.500112.5A376 K382 A383 V384A376-E380 PolarHBondContact O-N 2.83Å; E380-K382 PolarHBondContact O-N 3.3Å; E380-A383 PolarHBondContact O-N 3.19Å; E380-V384 WeakPolarHBondContact O-CG2 3.45Å; E380-V384 PolarHBondContact O-N 3.14Å
381K41.4Very low40.4Very low165 Ų165119.8 Ų119.872%0.71766%0.659SS**Hα-helixtrans-71-24.7174.2-82.5-177.7177.5177.80114.3
382K40.1Very low40.6Very low166 Ų166117.6 Ų117.672%0.72266%0.658SS**Hα-helixtrans-80.9-31.6174-91.4-178.4176.6174.60112.7E378 S379 E380 T386E378-K382 PolarHBondContact O-N 2.84Å; S379-K382 PolarHBondContact O-N 2.76Å; E380-K382 PolarHBondContact O-N 3.3Å; K382-T386 PolarHBondContact O-OG1 2.81Å
383A42.6Very low40.9Very low68 Ų68115.9 Ų115.956%0.56266%0.656SS**Hα-helixtrans-68.2-3817700000112.3S379 E380 N385S379-A383 PolarHBondContact O-N 3.33Å; S379-A383 VanDerWaalsContact O-N 3.17Å; E380-A383 PolarHBondContact O-N 3.19Å; A383-N385 PolarHBondContact O-N 3.14Å
384V43.8Very low41Very low109 Ų109120.6 Ų120.666%0.66167%0.669SS**Hα-helixtrans-72.6-24.9-179.3174.80000113.6E380E380-V384 WeakPolarHBondContact O-CG2 3.45Å; E380-V384 PolarHBondContact O-N 3.14Å
385N40.5Very low41.1Very low134 Ų134119.6 Ų119.672%0.71768%0.675SS**THydrogen-bonded Turntrans-91.86.1-179.7-88.6-1000114.7A383A383-N385 PolarHBondContact O-N 3.14Å
386T42.7Very low41.4Very low119 Ų119124.2 Ų124.273%0.7369%0.689SS**THydrogen-bonded Turntrans-109.2-0.1178.7-31.30000113.1K382K382-T386 PolarHBondContact O-OG1 2.81Å
387E43.9Very low41.6Very low178 Ų178130 Ų13083%0.83271%0.709SS**  trans-119.170.1170-70-172.8151.500109.9
388T39.8Very low41.7Very low198 Ų198136.8 Ų136.8100%1.21573%0.732SS**  trans-137.60153.58.60000110.1

Retrieved 388 of 388 residues in 69.8 ms (Link to these results)