A0A087WTJ0_HUMAN Loading...

RecQ like helicase 4

AlphaFold DB , UniProt , Accession A0A087WTJ0, Species HUMAN (Homo sapiens, Human), Gene RECQL4, Length 293 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
1A89.5Confident94.6Very high109 Ų10972.9 Ų72.990%0.90141%0.407SS*.  0-58.9000000111.3E3 T4 L5A1-E3 PolarHBondContact O-N 3.4Å; A1-T4 WeakPolarHBondContact O-CB 3.4Å; A1-T4 PolarHBondContact O-N 3.14Å; A1-L5 PolarHBondContact O-N 3.09Å
2I94.3Very high94.5Very high117 Ų11769.3 Ų69.360%0.638%0.384SS*.Hα-helixtrans-54.3-53.6178.1-63.4172.8000111.5T4 L5 L6 F117I2-T4 VanDerWaalsContact C-N 3.3Å; I2-T4 PolarHBondContact O-N 3.33Å; I2-L5 WeakPolarHBondContact O-CB 3.47Å; I2-L5 PolarHBondContact O-N 3.3Å; I2-L6 HydrophobicContact CG2-CD1 3.98Å; I2-L6 HydrophobicContact CG2-CG 4.31Å; I2-L6 WeakPolarHBondContact O-CG 3.38Å; I2-L6 PolarHBondContact O-N 2.95Å; I2-F117 HydrophobicContact CG2-CD2 4.34Å; I2-F117 HydrophobicContact CG2-CE2 4.05Å
3E94.8Very high94Very high110 Ų11071.5 Ų71.551%0.51440%0.404SS..Hα-helixtrans-50.7-46.2176.6-176.2177.2-147.200112.8A1 L5 L6 C7 F117A1-E3 PolarHBondContact O-N 3.4Å; E3-L5 VanDerWaalsContact C-N 3.31Å; E3-L5 PolarHBondContact O-N 2.94Å; E3-L6 WeakPolarHBondContact O-CB 3.31Å; E3-L6 PolarHBondContact O-N 2.92Å; E3-L6 VanDerWaalsContact O-N 3.13Å; E3-C7 PolarHBondContact O-N 3.1Å; E3-C7 PolarHBondContact O-SG 3.09Å; E3-F117 HydrophobicContact CB-CE1 4.34Å; E3-F117 HydrophobicContact CB-CZ 3.96Å; E3-F117 HydrophobicContact CG-CE1 4.37Å; E3-F117 HydrophobicContact CG-CZ 4.47Å
4T95.5Very high93.5Very high68 Ų6875.6 Ų75.642%0.41742%0.418SS..Hα-helixtrans-59.8-40.1177.6-45.90000112.7A1 I2 Y8A1-T4 WeakPolarHBondContact O-CB 3.4Å; A1-T4 PolarHBondContact O-N 3.14Å; I2-T4 VanDerWaalsContact C-N 3.3Å; I2-T4 PolarHBondContact O-N 3.33Å; T4-Y8 HydrophobicContact CG2-CE1 4.45Å; T4-Y8 HydrophobicContact CG2-CE2 3.95Å; T4-Y8 PolarHBondContact O-N 3.36Å; T4-Y8 VanDerWaalsContact O-N 3.09Å
5L96.3Very high92.8Very high62 Ų6279.5 Ų79.533%0.32543%0.432SS..Hα-helixtrans-68.5-39.5176.7-61.4177.4000111.1A1 I2 E3 Y8 L9 L137 V141A1-L5 PolarHBondContact O-N 3.09Å; I2-L5 WeakPolarHBondContact O-CB 3.47Å; I2-L5 PolarHBondContact O-N 3.3Å; E3-L5 VanDerWaalsContact C-N 3.31Å; E3-L5 PolarHBondContact O-N 2.94Å; L5-Y8 HydrophobicContact CD2-CD2 4.43Å; L5-Y8 PolarHBondContact O-N 2.72Å; L5-L9 WeakPolarHBondContact O-CG 3.43Å; L5-L9 PolarHBondContact O-N 3.41Å; L5-L9 VanDerWaalsContact O-N 3.14Å; L5-L137 HydrophobicContact CB-CD2 4.33Å; L5-L137 HydrophobicContact CD2-CB 4.48Å; L5-L137 HydrophobicContact CD2-CD2 4.15Å; L5-V141 HydrophobicContact CD2-CG2 4.04Å
6L96.1Very high92.5Very high18 Ų1876.4 Ų76.49%0.09441%0.411CS..Hα-helixtrans-61.4-46175.4-64.1172.5000111.1I2 E3 Y8 L9 E10 L17 L19 F117 L119I2-L6 HydrophobicContact CG2-CD1 3.98Å; I2-L6 HydrophobicContact CG2-CG 4.31Å; I2-L6 WeakPolarHBondContact O-CG 3.38Å; I2-L6 PolarHBondContact O-N 2.95Å; E3-L6 WeakPolarHBondContact O-CB 3.31Å; E3-L6 PolarHBondContact O-N 2.92Å; E3-L6 VanDerWaalsContact O-N 3.13Å; L6-Y8 VanDerWaalsContact C-N 3.3Å; L6-Y8 PolarHBondContact O-N 3.05Å; L6-L9 PolarHBondContact O-N 3.15Å; L6-L9 VanDerWaalsContact O-N 3.1Å; L6-E10 PolarHBondContact O-N 3.23Å; L6-L17 HydrophobicContact CD2-CD1 3.77Å; L6-L17 HydrophobicContact CD2-CD2 4.39Å; L6-L19 HydrophobicContact CD1-CD1 4.31Å; L6-F117 HydrophobicContact CD1-CB 4.14Å; L6-F117 HydrophobicContact CD1-CD1 4.31Å; L6-F117 HydrophobicContact CD1-CD2 3.8Å; L6-F117 HydrophobicContact CD1-CE2 4.28Å; L6-F117 HydrophobicContact CD1-CG 3.82Å; L6-L119 HydrophobicContact CD1-CD2 4.03Å; L6-L119 HydrophobicContact CD2-CD1 4Å; L6-L119 HydrophobicContact CD2-CD2 4.14Å
7C94.7Very high92.7Very high41 Ų4172.8 Ų72.828%0.27739%0.392SS..Hα-helixtrans-61.5-36.6175.8-61.50000112.5E3 L9 E10 L11E3-C7 PolarHBondContact O-N 3.1Å; E3-C7 PolarHBondContact O-SG 3.09Å; C7-L9 VanDerWaalsContact C-N 3.32Å; C7-L9 PolarHBondContact O-N 3.41Å; C7-E10 PolarHBondContact O-N 3.48Å; C7-L11 WeakPolarHBondContact O-CB 3.29Å; C7-L11 VanDerWaalsContact O-CG 3.29Å; C7-L11 WeakPolarHBondContact O-CG 3.28Å; C7-L11 PolarHBondContact O-N 3.44Å
8Y95.4Very high92.8Very high47 Ų4773.6 Ų73.618%0.18439%0.393CS..Hα-helixtrans-64.9-34.9174.7-70.9-25.5000112.9T4 L5 L6 H12 F136 L137 R140T4-Y8 HydrophobicContact CG2-CE1 4.45Å; T4-Y8 HydrophobicContact CG2-CE2 3.95Å; T4-Y8 PolarHBondContact O-N 3.36Å; T4-Y8 VanDerWaalsContact O-N 3.09Å; L5-Y8 HydrophobicContact CD2-CD2 4.43Å; L5-Y8 PolarHBondContact O-N 2.72Å; L6-Y8 VanDerWaalsContact C-N 3.3Å; L6-Y8 PolarHBondContact O-N 3.05Å; Y8-H12 PolarHBondContact O-N 3.43Å; Y8-F136 WeakPolarHBondContact O-CE1 3.49Å; Y8-L137 HydrophobicContact CD2-CD2 4.45Å; Y8-R140 HydrophobicContact CD2-CB 4.01Å; Y8-R140 HydrophobicContact CD2-CG 4.43Å; Y8-R140 HydrophobicContact CE2-CB 3.88Å
9L95.6Very high92.9Very high21 Ų2171.6 Ų71.611%0.1138%0.382CS..Hα-helixtrans-71.3-38.8175.9-64.4176.4000112.2L5 L6 C7 H12 W16 L17 I133 F136 L137L5-L9 WeakPolarHBondContact O-CG 3.43Å; L5-L9 PolarHBondContact O-N 3.41Å; L5-L9 VanDerWaalsContact O-N 3.14Å; L6-L9 PolarHBondContact O-N 3.15Å; L6-L9 VanDerWaalsContact O-N 3.1Å; C7-L9 VanDerWaalsContact C-N 3.32Å; C7-L9 PolarHBondContact O-N 3.41Å; L9-H12 VanDerWaalsContact O-CB 3.31Å; L9-H12 WeakPolarHBondContact O-CB 3.33Å; L9-H12 PolarHBondContact O-N 2.98Å; L9-W16 HydrophobicContact CD2-CE3 3.74Å; L9-W16 HydrophobicContact CD2-CZ3 4.27Å; L9-L17 HydrophobicContact CB-CB 4.05Å; L9-L17 HydrophobicContact CD1-CD1 4.41Å; L9-I133 HydrophobicContact CD2-CG2 3.69Å; L9-F136 HydrophobicContact CD2-CD1 4.37Å; L9-L137 HydrophobicContact CD1-CD1 4.29Å; L9-L137 HydrophobicContact CD2-CD1 3.99Å; L9-L137 HydrophobicContact CD2-CD2 3.83Å; L9-L137 HydrophobicContact CD2-CG 3.91Å; L9-L137 HydrophobicContact CG-CD1 4.27Å; L9-L137 HydrophobicContact CG-CD2 4.03Å; L9-L137 HydrophobicContact CG-CG 4.46Å
10E95.1Very high92.8Very high67 Ų6771.6 Ų71.631%0.31338%0.381SS..Hα-helixtrans-67-39.4177.9-178.4170.3-133.300112.5L6 C7 H12 L17 L19L6-E10 PolarHBondContact O-N 3.23Å; C7-E10 PolarHBondContact O-N 3.48Å; E10-H12 PolarHBondContact O-N 3.49Å; E10-L17 WeakPolarHBondContact CA-O 3.38Å; E10-L19 PolarHBondContact OE1-N 3.43Å; E10-L19 WeakPolarHBondContact OE2-CB 3.13Å
11L93.7Very high92.8Very high142 Ų14270.6 Ų70.674%0.74338%0.383SS*.THydrogen-bonded Turntrans-76.3-7.2176.3-66.7175000113.7C7C7-L11 WeakPolarHBondContact O-CB 3.29Å; C7-L11 VanDerWaalsContact O-CG 3.29Å; C7-L11 WeakPolarHBondContact O-CG 3.28Å; C7-L11 PolarHBondContact O-N 3.44Å
12H92.8Very high93Very high29 Ų2969 Ų6913%0.13436%0.363CS..SBendtrans-70.6137.7179.5-164.1-95.3000110.1Y8 L9 E10 H14 H15 W16 F136Y8-H12 PolarHBondContact O-N 3.43Å; L9-H12 VanDerWaalsContact O-CB 3.31Å; L9-H12 WeakPolarHBondContact O-CB 3.33Å; L9-H12 PolarHBondContact O-N 2.98Å; E10-H12 PolarHBondContact O-N 3.49Å; H12-H14 AromaticContact CE1-CD2 3.28Å; H12-H14 PolarHBondContact CE1-CD2 3.32Å; H12-H14 AromaticContact CE1-CG 3.85Å; H12-H14 AromaticContact ND1-CD2 3.67Å; H12-H14 AromaticContact ND1-CG 3.8Å; H12-H14 PolarHBondContact ND1-N 2.8Å; H12-H14 PolarHBondContact O-N 3.06Å; H12-H15 PolarHBondContact O-N 3.13Å; H12-W16 HydrophobicContact CB-CE3 4.39Å; H12-W16 AromaticContact ND1-CE3 3.95Å; H12-F136 AromaticContact CD2-CD2 3.85Å; H12-F136 AromaticContact CD2-CE1 3.91Å; H12-F136 AromaticContact CD2-CE2 3.57Å; H12-F136 AromaticContact CD2-CZ 3.59Å
13P88.3Confident93Very high99 Ų9964.9 Ų64.964%0.64334%0.343SS*.THydrogen-bonded Turntrans-59-24.2-177.922.5-35.3000114.2H15P13-H15 VanDerWaalsContact C-N 3.28Å; P13-H15 PolarHBondContact O-CE1 3.49Å; P13-H15 PolarHBondContact O-N 2.94Å; P13-H15 PolarHBondContact O-ND1 2.66Å
14H86.5Confident93Very high128 Ų12864.9 Ų64.959%0.59334%0.339SS*.THydrogen-bonded Turntrans-79.6-2.1175.1-60.8-40.9000114.6H12 W16H12-H14 AromaticContact CE1-CD2 3.28Å; H12-H14 PolarHBondContact CE1-CD2 3.32Å; H12-H14 AromaticContact CE1-CG 3.85Å; H12-H14 AromaticContact ND1-CD2 3.67Å; H12-H14 AromaticContact ND1-CG 3.8Å; H12-H14 PolarHBondContact ND1-N 2.8Å; H12-H14 PolarHBondContact O-N 3.06Å; H14-W16 VanDerWaalsContact C-N 3.34Å; H14-W16 HydrophobicContact CB-CD2 4.42Å; H14-W16 HydrophobicContact CB-CG 4.4Å; H14-W16 PolarHBondContact O-N 2.62Å
15H83.3Confident92.9Very high135 Ų13562.3 Ų62.363%0.62532%0.323SS*.  trans46.752.1176.4-60.981.7000113.2H12 P13 L17H12-H15 PolarHBondContact O-N 3.13Å; P13-H15 VanDerWaalsContact C-N 3.28Å; P13-H15 PolarHBondContact O-CE1 3.49Å; P13-H15 PolarHBondContact O-N 2.94Å; P13-H15 PolarHBondContact O-ND1 2.66Å; H15-L17 PolarHBondContact O-N 3.48Å; H15-L17 VanDerWaalsContact O-N 3.16Å
16W88.6Confident92.9Very high29 Ų2960.8 Ų60.811%0.1131%0.314CS..  trans-66.9-15.4-176.2-68.5-33.9000113.9L9 H12 H14 P122 I133 F136L9-W16 HydrophobicContact CD2-CE3 3.74Å; L9-W16 HydrophobicContact CD2-CZ3 4.27Å; H12-W16 HydrophobicContact CB-CE3 4.39Å; H12-W16 AromaticContact ND1-CE3 3.95Å; H14-W16 VanDerWaalsContact C-N 3.34Å; H14-W16 HydrophobicContact CB-CD2 4.42Å; H14-W16 HydrophobicContact CB-CG 4.4Å; H14-W16 PolarHBondContact O-N 2.62Å; W16-P122 VanDerWaalsContact O-CD 3.3Å; W16-P122 WeakPolarHBondContact O-CD 3.38Å; W16-I133 HydrophobicContact CB-CD1 4.47Å; W16-I133 HydrophobicContact CD2-CD1 3.99Å; W16-I133 HydrophobicContact CD2-CG1 3.49Å; W16-I133 VanDerWaalsContact CD2-CG1 3.49Å; W16-I133 HydrophobicContact CE3-CB 4.27Å; W16-I133 HydrophobicContact CE3-CD1 4.26Å; W16-I133 HydrophobicContact CE3-CG1 3.36Å; W16-I133 HydrophobicContact CE3-CG2 4.5Å; W16-I133 HydrophobicContact CG-CD1 4.16Å; W16-I133 HydrophobicContact CG-CG1 4.19Å; W16-I133 HydrophobicContact CH2-CB 4.28Å; W16-I133 HydrophobicContact CH2-CG1 3.6Å; W16-I133 HydrophobicContact CZ2-CG1 3.79Å; W16-I133 HydrophobicContact CZ3-CB 3.99Å; W16-I133 HydrophobicContact CZ3-CG1 3.4Å; W16-I133 VanDerWaalsContact CZ3-CG1 3.4Å; W16-I133 HydrophobicContact CZ3-CG2 4.46Å; W16-F136 HydrophobicContact CH2-CB 4.46Å; W16-F136 HydrophobicContact CZ3-CB 4.19Å; W16-F136 AromaticContact CZ3-CD1 3.98Å; W16-F136 HydrophobicContact CZ3-CD1 3.98Å; W16-F136 HydrophobicContact CZ3-CG 4.25Å
17L95.1Very high92.8Very high16 Ų1659.9 Ų59.98%0.08431%0.31CS..  trans-157.1143.8-177.5-177.6146.1000110.3L6 L9 E10 H15 L19 L119 R120L6-L17 HydrophobicContact CD2-CD1 3.77Å; L6-L17 HydrophobicContact CD2-CD2 4.39Å; L9-L17 HydrophobicContact CB-CB 4.05Å; L9-L17 HydrophobicContact CD1-CD1 4.41Å; E10-L17 WeakPolarHBondContact CA-O 3.38Å; H15-L17 PolarHBondContact O-N 3.48Å; H15-L17 VanDerWaalsContact O-N 3.16Å; L17-L19 HydrophobicContact CD2-CB 4.25Å; L17-L119 HydrophobicContact CD1-CB 4.36Å; L17-L119 HydrophobicContact CD1-CD1 4.16Å; L17-L119 HydrophobicContact CD1-CD2 4.24Å; L17-L119 HydrophobicContact CD1-CG 4.48Å; L17-L119 HydrophobicContact CD2-CD2 3.93Å; L17-L119 HydrophobicContact CG-CD2 4.46Å; L17-R120 CarbonylContact C-O 3.59Å; L17-R120 WeakPolarHBondContact CA-O 3.4Å
18E94.6Very high92.8Very high87 Ų8762.4 Ų62.441%0.40731%0.313SS..EExtended strand (participates in β ladder)trans-110.3128.8165.5-59.4176.2173.100109.3L119 R120E18-L119 WeakPolarHBondContact O-CA 3.35Å; E18-R120 HydrophobicContact CB-CB 4.24Å; E18-R120 PolarHBondContact N-O 2.89Å; E18-R120 PolarHBondContact O-N 3.34Å; E18-R120 WeakPolarHBondContact OE2-CD 3.34Å; E18-R120 IonicContact OE2-CZ 3.77Å; E18-R120 IonicContact OE2-NE 3.25Å; E18-R120 IonicContact OE2-NH1 2.81Å; E18-R120 PolarHBondContact OE2-NH1 3.41Å
19L94.8Very high92.7Very high35 Ų3560.1 Ų60.118%0.18330%0.304CS..EExtended strand (participates in β ladder)trans-95.2101.6176.3177.860.5000108.9L6 E10 L17 F117 L119L6-L19 HydrophobicContact CD1-CD1 4.31Å; E10-L19 PolarHBondContact OE1-N 3.43Å; E10-L19 WeakPolarHBondContact OE2-CB 3.13Å; L17-L19 HydrophobicContact CD2-CB 4.25Å; L19-F117 HydrophobicContact CD1-CB 4.13Å; L19-F117 HydrophobicContact CD1-CD1 3.96Å; L19-F117 HydrophobicContact CD1-CG 4.38Å; L19-L119 HydrophobicContact CD1-CD2 3.42Å; L19-L119 VanDerWaalsContact CD1-CD2 3.42Å
20L91.9Very high92.6Very high71 Ų7161.6 Ų61.637%0.37231%0.312SS..EExtended strand (participates in β ladder)trans-77.3-78.6-174.1-58.3175.1000111.7H118 R120L20-H118 HydrophobicContact CB-CB 4.34Å; L20-H118 WeakPolarHBondContact CB-O 3.41Å; L20-H118 VanDerWaalsContact CD1-CE1 3.48Å; L20-H118 WeakPolarHBondContact CD1-CE1 3.41Å; L20-H118 PolarHBondContact N-O 2.91Å; L20-R120 HydrophobicContact CD1-CB 4.45Å
21A91.1Very high92.3Very high51 Ų5158.4 Ų58.442%0.42130%0.298SS..EExtended strand (participates in β ladder)trans-149.3150.8-177.300000111.2H118A21-H118 WeakPolarHBondContact O-CB 3.39Å; A21-H118 PolarHBondContact O-N 3.35Å
22T94.9Very high92Very high76 Ų7656.4 Ų56.447%0.46629%0.293SS..EExtended strand (participates in β ladder)trans-86.4113.4168.5-51.90000108.5L115 A116 F117T22-L115 HydrophobicContact CG2-CD1 3.86Å; T22-L115 HydrophobicContact CG2-CD2 4.17Å; T22-L115 HydrophobicContact CG2-CG 3.87Å; T22-A116 WeakPolarHBondContact CA-O 3.46Å; T22-F117 HydrophobicContact CG2-CD1 4.41Å; T22-F117 HydrophobicContact CG2-CE1 4.44Å; T22-F117 WeakPolarHBondContact OG1-CD1 3.31Å
23T94.1Very high91.6Very high30 Ų3057.4 Ų57.418%0.18431%0.311CS..EExtended strand (participates in β ladder)trans-147.9160-172.5-178.70000111.6T25 L82 A116 H118T23-T25 HydrophobicContact CG2-CG2 4.4Å; T23-T25 PolarHBondContact O-N 3.26Å; T23-L82 HydrophobicContact CG2-CD2 3.53Å; T23-A116 PolarHBondContact N-O 2.98Å; T23-A116 PolarHBondContact O-N 3.4Å; T23-H118 HydrophobicContact CG2-CB 4.2Å
24Y94.9Very high91.6Very high111 Ų11153.2 Ų53.244%0.43529%0.286SS..EExtended strand (participates in β ladder)trans-67.4127.7167.3-62.9-71.4000109.6F112 S113 L115Y24-F112 HydrophobicContact CG-CB 4.28Å; Y24-S113 WeakPolarHBondContact CB-O 3.29Å; Y24-L115 HydrophobicContact CD1-CB 4.21Å; Y24-L115 HydrophobicContact CD1-CD1 4.49Å; Y24-L115 HydrophobicContact CE1-CB 4.03Å; Y24-L115 HydrophobicContact CE1-CD1 4.4Å
25T94.1Very high91.6Very high13 Ų1350.5 Ų50.58%0.0828%0.28CS..EExtended strand (participates in β ladder)trans-109.4-16.5-174.353.70000112.7T23 M71 V72 S113 E114 A116T23-T25 HydrophobicContact CG2-CG2 4.4Å; T23-T25 PolarHBondContact O-N 3.26Å; T25-M71 VanDerWaalsContact O-CB 3.24Å; T25-M71 WeakPolarHBondContact O-CB 3.1Å; T25-M71 WeakPolarHBondContact O-CG 3.43Å; T25-M71 PolarHBondContact O-N 2.85Å; T25-V72 HydrophobicContact CG2-CG2 3.46Å; T25-V72 VanDerWaalsContact CG2-CG2 3.46Å; T25-S113 PolarHBondContact N-O 3.07Å; T25-E114 PolarHBondContact N-O 3.42Å; T25-E114 VanDerWaalsContact N-O 3.1Å; T25-E114 PolarHBondContact OG1-O 2.89Å; T25-E114 VanDerWaalsContact OG1-O 3.14Å; T25-A116 HydrophobicContact CG2-CB 3.76Å
26H94.9Very high91.7Very high30 Ų3047.8 Ų47.814%0.13928%0.281CS..EExtended strand (participates in β ladder)trans-101.7139.8-179.6-153.2101.9000110.9F112 S113 E114H26-F112 VanDerWaalsContact O-CA 3.29Å; H26-F112 WeakPolarHBondContact O-CA 3.23Å; H26-S113 WeakPolarHBondContact CB-O 3.39Å; H26-S113 PolarHBondContact N-O 3.08Å; H26-S113 VanDerWaalsContact N-O 3.11Å; H26-S113 PolarHBondContact O-N 3.02Å; H26-E114 HydrophobicContact CB-CB 3.88Å; H26-E114 HydrophobicContact CB-CG 3.87Å; H26-E114 IonicContact CG-OE2 3.94Å; H26-E114 IonicContact ND1-OE2 2.71Å; H26-E114 PolarHBondContact ND1-OE2 3.22Å; H26-E114 VanDerWaalsContact ND1-OE2 3.07Å
27C95.3Very high91.7Very high0 Ų048.5 Ų48.50%029%0.285CS..EExtended strand (participates in β ladder)trans-123.3132.1174.9-179.30000110.6E68 F69 M71 L89 E111 F112C27-E68 WeakPolarHBondContact O-CA 3.38Å; C27-F69 HydrophobicContact CB-CD2 4.27Å; C27-F69 HydrophobicContact CB-CE2 3.8Å; C27-F69 HydrophobicContact CB-CZ 4.19Å; C27-F69 PolarHBondContact N-O 3.49Å; C27-F69 PolarHBondContact O-N 3.48Å; C27-F69 VanDerWaalsContact O-N 3.09Å; C27-M71 HydrophobicContact CB-CG 3.73Å; C27-M71 HydrophobicContact CB-SD 3.8Å; C27-L89 HydrophobicContact CB-CD1 4.13Å; C27-E111 WeakPolarHBondContact CA-O 3.26Å; C27-F112 HydrophobicContact CB-CD1 4.03Å; C27-F112 HydrophobicContact CB-CE1 4.06Å
28R94.1Very high91.4Very high93 Ų9348.1 Ų48.135%0.35128%0.283SS..EExtended strand (participates in β ladder)trans-113.3125.3170.3-178.2176.6-158.6-152.20.6109.7E68 E111R28-E68 HydrophobicContact CB-CG 3.79Å; R28-E68 WeakPolarHBondContact CD-OE1 3.39Å; R28-E68 HydrophobicContact CG-CG 3.6Å; R28-E68 IonicContact CZ-OE1 3.08Å; R28-E68 IonicContact NE-OE1 2.84Å; R28-E68 PolarHBondContact NE-OE1 3.23Å; R28-E68 IonicContact NH2-OE1 3.3Å; R28-E111 HydrophobicContact CB-CB 4.34Å; R28-E111 PolarHBondContact N-O 3.22Å; R28-E111 PolarHBondContact O-N 3.02Å
29L93Very high91Very high0 Ų049 Ų490%029%0.288CS..EExtended strand (participates in β ladder)trans-108.9125.5173.8-62.3177.3000108.9L48 S66 V67 F69 L89 L92 L109 V110L29-L48 HydrophobicContact CD1-CD1 3.68Å; L29-L48 HydrophobicContact CD1-CD2 4.35Å; L29-S66 CarbonylContact O-C 3.47Å; L29-S66 WeakPolarHBondContact O-CA 3.32Å; L29-S66 WeakPolarHBondContact O-CB 3.47Å; L29-V67 PolarHBondContact N-O 3.45Å; L29-V67 PolarHBondContact O-N 2.89Å; L29-F69 HydrophobicContact CD1-CE1 3.9Å; L29-F69 HydrophobicContact CD1-CZ 4.01Å; L29-F69 HydrophobicContact CG-CE1 4.34Å; L29-F69 HydrophobicContact CG-CZ 4.42Å; L29-L89 HydrophobicContact CD1-CD2 4.17Å; L29-L92 HydrophobicContact CD1-CD1 3.94Å; L29-L92 HydrophobicContact CD2-CD1 4.24Å; L29-L109 WeakPolarHBondContact CA-O 3.47Å; L29-V110 HydrophobicContact CD2-CB 4.02Å; L29-V110 HydrophobicContact CD2-CG1 3.76Å; L29-V110 HydrophobicContact CD2-CG2 3.57Å
30N92.6Very high90.7Very high51 Ų5150.2 Ų50.227%0.27330%0.302SS..EExtended strand (participates in β ladder)trans-118.7122.5173.8-167.54.8000110S65 V108 L109N30-S65 PolarHBondContact OD1-O 3.43Å; N30-V108 WeakPolarHBondContact O-CA 3.48Å; N30-L109 HydrophobicContact CB-CB 4.26Å; N30-L109 PolarHBondContact N-O 3.49Å; N30-L109 PolarHBondContact O-N 3.16Å
31C90.4Very high90.5Very high1 Ų147.3 Ų47.31%0.00729%0.287CS..  trans-112.4106.9-175.8-690000109.9G33 G34 Q37 L38 S65 V108C31-G33 PolarHBondContact O-N 3.3Å; C31-G34 PolarHBondContact O-N 2.96Å; C31-Q37 HydrophobicContact CB-CB 4.43Å; C31-Q37 HydrophobicContact CB-CG 4.45Å; C31-L38 VanDerWaalsContact SG-CD1 3.58Å; C31-S65 PolarHBondContact N-O 2.91Å; C31-V108 HydrophobicContact CB-CG2 4.47Å
32P87.5Confident90.4Very high99 Ų9945.2 Ų45.264%0.64327%0.27SS*.THydrogen-bonded Turntrans-58.9-29.7177.5-24.233.8000113.6G34 G107P32-G34 PolarHBondContact O-N 3.5Å; P32-G107 VanDerWaalsContact CD-O 3.3Å; P32-G107 WeakPolarHBondContact CD-O 3.45Å; P32-G107 VanDerWaalsContact CG-O 3.28Å; P32-G107 WeakPolarHBondContact CG-O 3.31Å
33G84.6Confident89.9Confident50 Ų5049.2 Ų49.252%0.51528%0.283SS..THydrogen-bonded Turntrans-78.69.8174.500000114.5C31 Q37C31-G33 PolarHBondContact O-N 3.3Å; G33-Q37 VanDerWaalsContact CA-OE1 3.32Å
34G87.9Confident89.5Confident12 Ų1253.1 Ų53.112%0.12429%0.294CS..Hα-helixtrans68.5-159.9174.500000114.3C31 P32 A36 Q37 L38C31-G34 PolarHBondContact O-N 2.96Å; P32-G34 PolarHBondContact O-N 3.5Å; G34-A36 VanDerWaalsContact C-N 3.3Å; G34-A36 PolarHBondContact O-N 3.32Å; G34-Q37 PolarHBondContact O-N 3.24Å; G34-L38 PolarHBondContact O-N 2.95Å
35P85.2Confident89.4Confident70 Ų7047.9 Ų47.946%0.45527%0.274SS..Hα-helixtrans-65.3-29.5-173.425.7-35.6000113.5L38 Q39P35-L38 WeakPolarHBondContact O-CB 3.33Å; P35-L38 PolarHBondContact O-N 3.21Å; P35-Q39 PolarHBondContact O-N 3.25Å
36A86.4Confident89.3Confident78 Ų7850.5 Ų50.565%0.64529%0.291SS*.Hα-helixtrans-65.5-40.8177.500000112.1G34 L38 A40G34-A36 VanDerWaalsContact C-N 3.3Å; G34-A36 PolarHBondContact O-N 3.32Å; A36-L38 VanDerWaalsContact C-N 3.35Å; A36-A40 PolarHBondContact O-N 2.73Å; A36-A40 VanDerWaalsContact O-N 3.13Å
37Q88.9Confident89.2Confident44 Ų4449 Ų4921%0.20628%0.284CS..Hα-helixtrans-64-43.2173.7-177.8-179.831.700110.9C31 G33 G34 Q39 A40 L41 T106C31-Q37 HydrophobicContact CB-CB 4.43Å; C31-Q37 HydrophobicContact CB-CG 4.45Å; G33-Q37 VanDerWaalsContact CA-OE1 3.32Å; G34-Q37 PolarHBondContact O-N 3.24Å; Q37-Q39 PolarHBondContact O-N 3.43Å; Q37-A40 PolarHBondContact O-N 3.15Å; Q37-L41 HydrophobicContact CG-CD1 4.18Å; Q37-L41 WeakPolarHBondContact O-CG 3.1Å; Q37-L41 PolarHBondContact O-N 3.04Å; Q37-L41 VanDerWaalsContact O-N 3.08Å; Q37-T106 PolarHBondContact NE2-O 2.71Å
38L87.8Confident89.1Confident8 Ų849 Ų494%0.04228%0.284CS..Hα-helixtrans-61-43.7179.9-170.867.8000111.9C31 G34 P35 A36 L41 A42 L48 L52 V67C31-L38 VanDerWaalsContact SG-CD1 3.58Å; G34-L38 PolarHBondContact O-N 2.95Å; P35-L38 WeakPolarHBondContact O-CB 3.33Å; P35-L38 PolarHBondContact O-N 3.21Å; A36-L38 VanDerWaalsContact C-N 3.35Å; L38-L41 PolarHBondContact O-N 3.39Å; L38-A42 PolarHBondContact O-N 2.73Å; L38-A42 VanDerWaalsContact O-N 3.12Å; L38-L48 HydrophobicContact CD1-CD1 4.08Å; L38-L48 HydrophobicContact CD1-CD2 4.13Å; L38-L52 HydrophobicContact CD2-CD2 3.77Å; L38-L52 HydrophobicContact CG-CD1 4.24Å; L38-L52 HydrophobicContact CG-CD2 4.15Å; L38-V67 HydrophobicContact CD2-CB 4.18Å; L38-V67 HydrophobicContact CD2-CG2 3.48Å; L38-V67 VanDerWaalsContact CD2-CG2 3.48Å
39Q87.5Confident88.9Confident107 Ų10746.5 Ų46.550%0.528%0.283SS..Hα-helixtrans-64.1-40.2176-172.962.328.500112.3P35 Q37 L41 A42P35-Q39 PolarHBondContact O-N 3.25Å; Q37-Q39 PolarHBondContact O-N 3.43Å; Q39-L41 VanDerWaalsContact C-N 3.29Å; Q39-L41 PolarHBondContact O-N 2.69Å; Q39-A42 VanDerWaalsContact O-CB 3.27Å; Q39-A42 WeakPolarHBondContact O-CB 3.41Å; Q39-A42 PolarHBondContact O-N 3.1Å
40A88.2Confident88.8Confident59 Ų5948.9 Ų48.949%0.48830%0.298SS..Hα-helixtrans-62.6-37.6176.800000112.1A36 Q37 A42A36-A40 PolarHBondContact O-N 2.73Å; A36-A40 VanDerWaalsContact O-N 3.13Å; Q37-A40 PolarHBondContact O-N 3.15Å; A40-A42 VanDerWaalsContact C-N 3.34Å
41L87.6Confident88.6Confident10 Ų1046.7 Ų46.75%0.05229%0.286CS..Hα-helixtrans-72.5-26.6177.8-69.3173.8000113.3Q37 L38 Q39 H43 R44 C45 L48 L92 T106 V108Q37-L41 HydrophobicContact CG-CD1 4.18Å; Q37-L41 WeakPolarHBondContact O-CG 3.1Å; Q37-L41 PolarHBondContact O-N 3.04Å; Q37-L41 VanDerWaalsContact O-N 3.08Å; L38-L41 PolarHBondContact O-N 3.39Å; Q39-L41 VanDerWaalsContact C-N 3.29Å; Q39-L41 PolarHBondContact O-N 2.69Å; L41-H43 PolarHBondContact O-N 3.3Å; L41-R44 PolarHBondContact O-N 3.49Å; L41-C45 PolarHBondContact O-N 2.93Å; L41-L48 HydrophobicContact CB-CD2 3.93Å; L41-L92 HydrophobicContact CB-CD2 3.96Å; L41-L92 HydrophobicContact CD2-CD2 4.19Å; L41-L92 HydrophobicContact CG-CD2 4.47Å; L41-T106 HydrophobicContact CD2-CG2 4.37Å; L41-V108 HydrophobicContact CD1-CG2 3.5Å; L41-V108 VanDerWaalsContact CD1-CG2 3.5Å
42A89.1Confident88.5Confident7 Ų748.4 Ų48.46%0.05830%0.295CS..Hα-helixtrans-56.9-37.7175.900000112L38 Q39 A40 R44 C45 L48 A49 L52L38-A42 PolarHBondContact O-N 2.73Å; L38-A42 VanDerWaalsContact O-N 3.12Å; Q39-A42 VanDerWaalsContact O-CB 3.27Å; Q39-A42 WeakPolarHBondContact O-CB 3.41Å; Q39-A42 PolarHBondContact O-N 3.1Å; A40-A42 VanDerWaalsContact C-N 3.34Å; A42-R44 PolarHBondContact O-N 2.9Å; A42-R44 VanDerWaalsContact O-N 3.16Å; A42-C45 PolarHBondContact O-N 3.42Å; A42-L48 HydrophobicContact CB-CG 4.38Å; A42-A49 HydrophobicContact CB-CB 4.35Å; A42-L52 HydrophobicContact CB-CD1 3.64Å
43H84.9Confident88.4Confident160 Ų16047.8 Ų47.874%0.74130%0.298SS*.THydrogen-bonded Turntrans-62.4-22.4175.8-71.3-70.6000113.9L41L41-H43 PolarHBondContact O-N 3.3Å
44R85.6Confident88.3Confident113 Ų11351.4 Ų51.443%0.42630%0.302SS..THydrogen-bonded Turntrans-99.7-14.7-178.1-63.7178.661.9-145.6-10.1113.2L41 A42 W94 D95L41-R44 PolarHBondContact O-N 3.49Å; A42-R44 PolarHBondContact O-N 2.9Å; A42-R44 VanDerWaalsContact O-N 3.16Å; R44-W94 PolarHBondContact NH1-O 3.21Å; R44-W94 PolarHBondContact NH2-O 2.91Å; R44-D95 IonicContact CZ-OD1 3.73Å; R44-D95 VanDerWaalsContact CZ-OD1 3.3Å; R44-D95 IonicContact NE-OD1 2.93Å; R44-D95 VanDerWaalsContact NH1-CG 3.26Å; R44-D95 IonicContact NH1-OD1 3.82Å; R44-D95 PolarHBondContact NH1-OD1 3.25Å; R44-D95 IonicContact NH1-OD2 3.2Å; R44-D95 IonicContact NH2-OD1 3.95Å
45C91.6Very high87.8Confident1 Ų155.2 Ų55.21%0.00732%0.316CS..  trans-132.899.7-173.8-176.80000110.2L41 A42 L48 A49 L92L41-C45 PolarHBondContact O-N 2.93Å; A42-C45 PolarHBondContact O-N 3.42Å; C45-L48 HydrophobicContact CB-CB 3.92Å; C45-L48 WeakPolarHBondContact O-CB 3.31Å; C45-L48 PolarHBondContact O-N 3.42Å; C45-A49 PolarHBondContact O-N 3.15Å; C45-L92 HydrophobicContact CB-CD1 4.3Å; C45-L92 HydrophobicContact CB-CD2 3.52Å; C45-L92 HydrophobicContact CB-CG 4.16Å
46P92.7Very high86.6Confident67 Ų6758.9 Ų58.944%0.43533%0.331SS..Hα-helixtrans-54.4-42179.6-2432.4000114.3L48 A49 V50 W80P46-L48 VanDerWaalsContact C-N 3.33Å; P46-L48 PolarHBondContact O-N 3.39Å; P46-A49 PolarHBondContact O-N 2.93Å; P46-V50 WeakPolarHBondContact O-CG2 3.4Å; P46-V50 PolarHBondContact O-N 2.99Å; P46-V50 VanDerWaalsContact O-N 3.1Å; P46-W80 HydrophobicContact CB-CZ2 4.48Å; P46-W80 HydrophobicContact CG-CH2 4.33Å
47P93.1Very high85.2Confident0 Ų059.9 Ų59.90%033%0.331CS..Hα-helixtrans-54.9-46.4173-25.131.3000112.9A49 V50 C51 M78 W80 V85 A88P47-A49 PolarHBondContact O-N 3.24Å; P47-V50 PolarHBondContact O-N 3.17Å; P47-C51 PolarHBondContact O-N 3.04Å; P47-C51 PolarHBondContact O-SG 3.22Å; P47-M78 HydrophobicContact CB-CE 4.37Å; P47-M78 HydrophobicContact CB-SD 4.44Å; P47-M78 HydrophobicContact CG-CE 3.88Å; P47-M78 HydrophobicContact CG-SD 4.22Å; P47-W80 HydrophobicContact CG-CZ3 4.43Å; P47-V85 HydrophobicContact CB-CG1 4.03Å; P47-V85 HydrophobicContact CG-CG1 4.13Å; P47-V85 HydrophobicContact CG-CG2 4.45Å; P47-A88 HydrophobicContact CG-CB 4.17Å
48L91.6Very high83.5Confident0 Ų066.7 Ų66.70%036%0.363CS..Hα-helixtrans-64.5-40.6179.1178.258.5000111.9L29 L38 L41 A42 C45 P46 V50 C51 L52 L92L29-L48 HydrophobicContact CD1-CD1 3.68Å; L29-L48 HydrophobicContact CD1-CD2 4.35Å; L38-L48 HydrophobicContact CD1-CD1 4.08Å; L38-L48 HydrophobicContact CD1-CD2 4.13Å; L41-L48 HydrophobicContact CB-CD2 3.93Å; A42-L48 HydrophobicContact CB-CG 4.38Å; C45-L48 HydrophobicContact CB-CB 3.92Å; C45-L48 WeakPolarHBondContact O-CB 3.31Å; C45-L48 PolarHBondContact O-N 3.42Å; P46-L48 VanDerWaalsContact C-N 3.33Å; P46-L48 PolarHBondContact O-N 3.39Å; L48-V50 VanDerWaalsContact C-N 3.33Å; L48-V50 PolarHBondContact O-N 2.84Å; L48-C51 WeakPolarHBondContact O-CB 3.23Å; L48-C51 PolarHBondContact O-N 3.49Å; L48-L52 HydrophobicContact CD1-CD1 4.23Å; L48-L52 HydrophobicContact CD1-CD2 4.34Å; L48-L52 HydrophobicContact CD1-CG 4.01Å; L48-L52 HydrophobicContact CG-CD1 4.18Å; L48-L52 HydrophobicContact CG-CG 4.37Å; L48-L52 WeakPolarHBondContact O-CG 3.16Å; L48-L52 PolarHBondContact O-N 3.48Å; L48-L92 HydrophobicContact CD2-CD1 3.83Å
49A91.3Very high81.6Confident40 Ų4072 Ų7233%0.33139%0.392SS..Hα-helixtrans-59.6-43.3176.900000112.3A42 C45 P46 P47 L52 A53A42-A49 HydrophobicContact CB-CB 4.35Å; C45-A49 PolarHBondContact O-N 3.15Å; P46-A49 PolarHBondContact O-N 2.93Å; P47-A49 PolarHBondContact O-N 3.24Å; A49-L52 PolarHBondContact O-N 3.22Å; A49-A53 WeakPolarHBondContact O-CB 3.45Å; A49-A53 PolarHBondContact O-N 3.25Å; A49-A53 VanDerWaalsContact O-N 3.07Å
50V90.8Very high79.7Confident50 Ų5073.2 Ų73.230%0.30341%0.409SS..Hα-helixtrans-64.8-43.3176.4175.40000110.8P46 P47 L48 L52 A53 Q54 L74P46-V50 WeakPolarHBondContact O-CG2 3.4Å; P46-V50 PolarHBondContact O-N 2.99Å; P46-V50 VanDerWaalsContact O-N 3.1Å; P47-V50 PolarHBondContact O-N 3.17Å; L48-V50 VanDerWaalsContact C-N 3.33Å; L48-V50 PolarHBondContact O-N 2.84Å; V50-L52 PolarHBondContact O-N 2.67Å; V50-A53 PolarHBondContact O-N 3.33Å; V50-Q54 HydrophobicContact CG1-CG 4.48Å; V50-Q54 WeakPolarHBondContact O-CG 3.38Å; V50-Q54 PolarHBondContact O-N 3.43Å; V50-Q54 VanDerWaalsContact O-N 3.09Å; V50-L74 HydrophobicContact CG1-CD2 4.15Å
51C88.8Confident77.9Confident4 Ų474 Ų743%0.02742%0.423CS..Hα-helixtrans-56.3-51.2175.5-61.80000112.3P47 L48 A53 Q54 Q55 F69 L74P47-C51 PolarHBondContact O-N 3.04Å; P47-C51 PolarHBondContact O-SG 3.22Å; L48-C51 WeakPolarHBondContact O-CB 3.23Å; L48-C51 PolarHBondContact O-N 3.49Å; C51-A53 VanDerWaalsContact C-N 3.27Å; C51-A53 PolarHBondContact O-N 3.41Å; C51-Q54 PolarHBondContact O-N 3.17Å; C51-Q54 VanDerWaalsContact O-N 3.16Å; C51-Q55 PolarHBondContact O-N 2.93Å; C51-Q55 VanDerWaalsContact O-N 3.13Å; C51-F69 HydrophobicContact CB-CD1 3.98Å; C51-F69 HydrophobicContact CB-CE1 4.22Å; C51-F69 HydrophobicContact CB-CG 4.42Å; C51-F69 VanDerWaalsContact SG-CD1 3.56Å; C51-F69 VanDerWaalsContact SG-CG 3.58Å; C51-L74 WeakPolarHBondContact SG-CD1 3.45Å; C51-L74 VanDerWaalsContact SG-CD2 3.53Å
52L87.6Confident76.1Confident37 Ų3781.6 Ų81.619%0.19446%0.458CS..Hα-helixtrans-65.4-32.9-177.4-65.4179.4000111.9L38 A42 L48 A49 V50 Q54 V67L38-L52 HydrophobicContact CD2-CD2 3.77Å; L38-L52 HydrophobicContact CG-CD1 4.24Å; L38-L52 HydrophobicContact CG-CD2 4.15Å; A42-L52 HydrophobicContact CB-CD1 3.64Å; L48-L52 HydrophobicContact CD1-CD1 4.23Å; L48-L52 HydrophobicContact CD1-CD2 4.34Å; L48-L52 HydrophobicContact CD1-CG 4.01Å; L48-L52 HydrophobicContact CG-CD1 4.18Å; L48-L52 HydrophobicContact CG-CG 4.37Å; L48-L52 WeakPolarHBondContact O-CG 3.16Å; L48-L52 PolarHBondContact O-N 3.48Å; A49-L52 PolarHBondContact O-N 3.22Å; V50-L52 PolarHBondContact O-N 2.67Å; L52-Q54 VanDerWaalsContact C-N 3.34Å; L52-V67 HydrophobicContact CD2-CG2 4.15Å
53A86.4Confident74.7Confident87 Ų8783.7 Ų83.772%0.71948%0.481SS*.Hα-helixtrans-70.3-29.3175.500000113.2A49 V50 C51A49-A53 WeakPolarHBondContact O-CB 3.45Å; A49-A53 PolarHBondContact O-N 3.25Å; A49-A53 VanDerWaalsContact O-N 3.07Å; V50-A53 PolarHBondContact O-N 3.33Å; C51-A53 VanDerWaalsContact C-N 3.27Å; C51-A53 PolarHBondContact O-N 3.41Å
54Q82.4Confident73.9Confident125 Ų12579.2 Ų79.258%0.58447%0.467SS*.Hα-helixtrans-83-24.1179.1-71.4176.44.500113.3V50 C51 L52 L56V50-Q54 HydrophobicContact CG1-CG 4.48Å; V50-Q54 WeakPolarHBondContact O-CG 3.38Å; V50-Q54 PolarHBondContact O-N 3.43Å; V50-Q54 VanDerWaalsContact O-N 3.09Å; C51-Q54 PolarHBondContact O-N 3.17Å; C51-Q54 VanDerWaalsContact O-N 3.16Å; L52-Q54 VanDerWaalsContact C-N 3.34Å; Q54-L56 PolarHBondContact O-N 3.28Å
55Q76Confident73.7Confident92 Ų9276.4 Ų76.443%0.4347%0.465SS..SBendtrans-77.9103.4175.5-69.4-167.8-10.500109.6C51 E68C51-Q55 PolarHBondContact O-N 2.93Å; C51-Q55 VanDerWaalsContact O-N 3.13Å; Q55-E68 PolarHBondContact NE2-O 3.3Å
56L60.6Low73.5Confident147 Ų14777.5 Ų77.577%0.7747%0.472SS*.  trans-63.2133171.7-164.272.1000108.5Q54 E58Q54-L56 PolarHBondContact O-N 3.28Å; L56-E58 PolarHBondContact O-N 3.44Å
57P57.8Low73.4Confident100 Ų10074.8 Ų74.865%0.64945%0.454SS*.  trans-69.299.5178.325.4-29.5000108.8D59P57-D59 PolarHBondContact O-N 3.18Å
58E51.3Low73.4Confident186 Ų18679.2 Ų79.287%0.86948%0.475SS*.SBendtrans-68.4-16.2175.1-70.2-146.4143.400112.3L56L56-E58 PolarHBondContact O-N 3.44Å
59D49.6Very low73.4Confident121 Ų12180.1 Ų80.165%0.64748%0.479SS*.  trans-155.6125.9165.2-100-43.1000111.9P57 G61P57-D59 PolarHBondContact O-N 3.18Å; D59-G61 PolarHBondContact O-N 3.42Å; D59-G61 VanDerWaalsContact O-N 3.15Å
60P47.3Very low73.6Confident131 Ų13180.6 Ų80.685%0.85148%0.476SS*.THydrogen-bonded Turntrans-72.4-3-179.128.4-33.8000114.3
61G50.3Low73.7Confident77 Ų7778.2 Ų78.279%0.79446%0.462SS*.THydrogen-bonded Turntrans-103.4-10.7-174.400000116D59D59-G61 PolarHBondContact O-N 3.42Å; D59-G61 VanDerWaalsContact O-N 3.15Å
62Q49.6Very low74Confident169 Ų16979.8 Ų79.879%0.7947%0.471SS*.  trans-135.768.6-170.5-157.2154.56.100111S64Q62-S64 PolarHBondContact O-N 2.91Å; Q62-S64 VanDerWaalsContact O-N 3.08Å
63G59.7Low74.1Confident51 Ų5185.1 Ų85.153%0.52649%0.493SS..  trans-61.3112.9173.800000110.3
64S68.9Low74.4Confident65 Ų6581.2 Ų81.246%0.45546%0.46SS..  trans-62.9135.8174.6-178.60000110Q62 S66Q62-S64 PolarHBondContact O-N 2.91Å; Q62-S64 VanDerWaalsContact O-N 3.08Å; S64-S66 WeakPolarHBondContact CB-O 3.26Å; S64-S66 PolarHBondContact O-N 3.01Å; S64-S66 PolarHBondContact OG-N 3.5Å; S64-S66 PolarHBondContact OG-O 2.84Å; S64-S66 PolarHBondContact OG-OG 3.42Å
65S81.3Confident74.9Confident54 Ų5476.2 Ų76.238%0.37844%0.438SS..SBendtrans-74.1-7.5171.461.10000112.4N30 C31N30-S65 PolarHBondContact OD1-O 3.43Å; C31-S65 PolarHBondContact N-O 2.91Å
66S87.4Confident75.7Confident24 Ų2478.5 Ų78.517%0.16845%0.453CS..EExtended strand (participates in β ladder)trans-129.8145.2178.261.10000113L29 S64L29-S66 CarbonylContact O-C 3.47Å; L29-S66 WeakPolarHBondContact O-CA 3.32Å; L29-S66 WeakPolarHBondContact O-CB 3.47Å; S64-S66 WeakPolarHBondContact CB-O 3.26Å; S64-S66 PolarHBondContact O-N 3.01Å; S64-S66 PolarHBondContact OG-N 3.5Å; S64-S66 PolarHBondContact OG-O 2.84Å; S64-S66 PolarHBondContact OG-OG 3.42Å
67V90.7Very high77.1Confident10 Ų1074.9 Ų74.96%0.06144%0.44CS..EExtended strand (participates in β ladder)trans-130.4137.6176.6162.50000110L29 L38 L52 F69L29-V67 PolarHBondContact N-O 3.45Å; L29-V67 PolarHBondContact O-N 2.89Å; L38-V67 HydrophobicContact CD2-CB 4.18Å; L38-V67 HydrophobicContact CD2-CG2 3.48Å; L38-V67 VanDerWaalsContact CD2-CG2 3.48Å; L52-V67 HydrophobicContact CD2-CG2 4.15Å; V67-F69 HydrophobicContact CG1-CD1 3.69Å; V67-F69 HydrophobicContact CG1-CE1 3.98Å
68E92.1Very high78.7Confident93 Ų9372.1 Ų72.144%0.43542%0.419SS..EExtended strand (participates in β ladder)trans-125.5136.8-176.7-76.2174.5-151.400109.5C27 R28 Q55C27-E68 WeakPolarHBondContact O-CA 3.38Å; R28-E68 HydrophobicContact CB-CG 3.79Å; R28-E68 WeakPolarHBondContact CD-OE1 3.39Å; R28-E68 HydrophobicContact CG-CG 3.6Å; R28-E68 IonicContact CZ-OE1 3.08Å; R28-E68 IonicContact NE-OE1 2.84Å; R28-E68 PolarHBondContact NE-OE1 3.23Å; R28-E68 IonicContact NH2-OE1 3.3Å; Q55-E68 PolarHBondContact NE2-O 3.3Å
69F92.4Very high80.6Confident19 Ų1966.6 Ų66.68%0.08341%0.412CS..EExtended strand (participates in β ladder)trans-158.7156.617950.1-98000112.9C27 L29 C51 V67 M71 L74 L89C27-F69 HydrophobicContact CB-CD2 4.27Å; C27-F69 HydrophobicContact CB-CE2 3.8Å; C27-F69 HydrophobicContact CB-CZ 4.19Å; C27-F69 PolarHBondContact N-O 3.49Å; C27-F69 PolarHBondContact O-N 3.48Å; C27-F69 VanDerWaalsContact O-N 3.09Å; L29-F69 HydrophobicContact CD1-CE1 3.9Å; L29-F69 HydrophobicContact CD1-CZ 4.01Å; L29-F69 HydrophobicContact CG-CE1 4.34Å; L29-F69 HydrophobicContact CG-CZ 4.42Å; C51-F69 HydrophobicContact CB-CD1 3.98Å; C51-F69 HydrophobicContact CB-CE1 4.22Å; C51-F69 HydrophobicContact CB-CG 4.42Å; C51-F69 VanDerWaalsContact SG-CD1 3.56Å; C51-F69 VanDerWaalsContact SG-CG 3.58Å; V67-F69 HydrophobicContact CG1-CD1 3.69Å; V67-F69 HydrophobicContact CG1-CE1 3.98Å; F69-M71 HydrophobicContact CE2-CG 4.39Å; F69-L74 HydrophobicContact CD2-CD1 3.36Å; F69-L74 HydrophobicContact CD2-CG 4.45Å; F69-L74 HydrophobicContact CE2-CD1 3.53Å; F69-L74 HydrophobicContact CG-CD1 4.21Å; F69-L89 HydrophobicContact CE2-CD1 3.88Å; F69-L89 HydrophobicContact CE2-CD2 4.29Å; F69-L89 HydrophobicContact CZ-CD1 4.12Å; F69-L89 HydrophobicContact CZ-CD2 3.75Å
70D94.1Very high82.7Confident50 Ų5065.8 Ų65.827%0.26740%0.399SS..EExtended strand (participates in β ladder)trans-80.2115.3172.4-179.4-18.5000110.1V72 K73 L74D70-V72 VanDerWaalsContact C-N 3.31Å; D70-V72 PolarHBondContact O-N 2.79Å; D70-V72 WeakPolarHBondContact OD1-CA 3.48Å; D70-V72 WeakPolarHBondContact OD1-CB 3.33Å; D70-V72 PolarHBondContact OD1-N 2.7Å; D70-K73 HydrophobicContact CB-CB 4.25Å; D70-K73 HydrophobicContact CB-CD 3.98Å; D70-K73 HydrophobicContact CB-CG 4.15Å; D70-K73 PolarHBondContact OD1-N 3.29Å; D70-K73 VanDerWaalsContact OD2-CE 3.27Å; D70-K73 WeakPolarHBondContact OD2-CE 3.29Å; D70-K73 WeakPolarHBondContact OD2-CG 3.44Å; D70-L74 PolarHBondContact O-N 2.91Å
71M94.3Very high84.8Confident0 Ų066.1 Ų66.10%039%0.39CS..Hα-helixtrans-69.3-28.2-179.6-61.3175.858.900112.8T25 C27 F69 L74 V75 L82 V85 R86 L89 F112T25-M71 VanDerWaalsContact O-CB 3.24Å; T25-M71 WeakPolarHBondContact O-CB 3.1Å; T25-M71 WeakPolarHBondContact O-CG 3.43Å; T25-M71 PolarHBondContact O-N 2.85Å; C27-M71 HydrophobicContact CB-CG 3.73Å; C27-M71 HydrophobicContact CB-SD 3.8Å; F69-M71 HydrophobicContact CE2-CG 4.39Å; M71-L74 WeakPolarHBondContact O-CB 3.41Å; M71-L74 PolarHBondContact O-N 2.68Å; M71-V75 WeakPolarHBondContact O-CB 3.38Å; M71-V75 WeakPolarHBondContact O-CG2 3.49Å; M71-V75 PolarHBondContact O-N 3.16Å; M71-L82 HydrophobicContact CB-CD1 3.81Å; M71-L82 HydrophobicContact CE-CD1 3.9Å; M71-V85 HydrophobicContact CE-CB 4.4Å; M71-V85 HydrophobicContact CE-CG1 4.01Å; M71-R86 HydrophobicContact CE-CB 3.76Å; M71-R86 HydrophobicContact CE-CG 4.1Å; M71-L89 HydrophobicContact CE-CD1 4.02Å; M71-L89 HydrophobicContact CG-CD1 4.33Å; M71-L89 HydrophobicContact SD-CD1 4.29Å; M71-F112 HydrophobicContact CE-CE1 4.09Å; M71-F112 HydrophobicContact SD-CD1 3.64Å; M71-F112 HydrophobicContact SD-CE1 3.6Å; M71-F112 VanDerWaalsContact SD-CE1 3.6Å
72V93.6Very high86.8Confident38 Ų3863.5 Ų63.523%0.2336%0.358CS..Hα-helixtrans-73.6-39.8-178.2-177.80000109.9T25 D70 L74 V75 D76 L82T25-V72 HydrophobicContact CG2-CG2 3.46Å; T25-V72 VanDerWaalsContact CG2-CG2 3.46Å; D70-V72 VanDerWaalsContact C-N 3.31Å; D70-V72 PolarHBondContact O-N 2.79Å; D70-V72 WeakPolarHBondContact OD1-CA 3.48Å; D70-V72 WeakPolarHBondContact OD1-CB 3.33Å; D70-V72 PolarHBondContact OD1-N 2.7Å; V72-L74 VanDerWaalsContact C-N 3.27Å; V72-L74 PolarHBondContact O-N 3.46Å; V72-V75 WeakPolarHBondContact O-CB 3.38Å; V72-V75 PolarHBondContact O-N 3.03Å; V72-D76 PolarHBondContact O-N 2.75Å; V72-L82 HydrophobicContact CG2-CD1 4.49Å
73K91.4Very high88.9Confident149 Ų14958.2 Ų58.265%0.64834%0.342SS*.Hα-helixtrans-59.7-39.1170.7-72.5178.8-169.4171.90112.2D70 S77D70-K73 HydrophobicContact CB-CB 4.25Å; D70-K73 HydrophobicContact CB-CD 3.98Å; D70-K73 HydrophobicContact CB-CG 4.15Å; D70-K73 PolarHBondContact OD1-N 3.29Å; D70-K73 VanDerWaalsContact OD2-CE 3.27Å; D70-K73 WeakPolarHBondContact OD2-CE 3.29Å; D70-K73 WeakPolarHBondContact OD2-CG 3.44Å; K73-S77 WeakPolarHBondContact O-CB 2.95Å; K73-S77 PolarHBondContact O-N 2.81Å; K73-S77 PolarHBondContact O-OG 2.71Å
74L92Very high90.5Very high4 Ų457 Ų572%0.02133%0.326CS..Hα-helixtrans-62.4-56.4173.5-69170.9000110.2V50 C51 F69 D70 M71 V72 D76 S77 M78V50-L74 HydrophobicContact CG1-CD2 4.15Å; C51-L74 WeakPolarHBondContact SG-CD1 3.45Å; C51-L74 VanDerWaalsContact SG-CD2 3.53Å; F69-L74 HydrophobicContact CD2-CD1 3.36Å; F69-L74 HydrophobicContact CD2-CG 4.45Å; F69-L74 HydrophobicContact CE2-CD1 3.53Å; F69-L74 HydrophobicContact CG-CD1 4.21Å; D70-L74 PolarHBondContact O-N 2.91Å; M71-L74 WeakPolarHBondContact O-CB 3.41Å; M71-L74 PolarHBondContact O-N 2.68Å; V72-L74 VanDerWaalsContact C-N 3.27Å; V72-L74 PolarHBondContact O-N 3.46Å; L74-D76 PolarHBondContact O-N 2.84Å; L74-D76 VanDerWaalsContact O-N 3.14Å; L74-S77 PolarHBondContact O-N 2.7Å; L74-S77 PolarHBondContact O-OG 3.43Å; L74-M78 HydrophobicContact CB-SD 4.49Å; L74-M78 WeakPolarHBondContact O-CG 3.29Å; L74-M78 PolarHBondContact O-N 3.48Å
75V93.3Very high91.7Very high20 Ų2054 Ų5412%0.12131%0.305CS..Hα-helixtrans-43.6-49.1177.2153.20000112M71 V72 G79 W80 L82 V85M71-V75 WeakPolarHBondContact O-CB 3.38Å; M71-V75 WeakPolarHBondContact O-CG2 3.49Å; M71-V75 PolarHBondContact O-N 3.16Å; V72-V75 WeakPolarHBondContact O-CB 3.38Å; V72-V75 PolarHBondContact O-N 3.03Å; V75-G79 WeakPolarHBondContact O-CA 3.36Å; V75-G79 PolarHBondContact O-N 3.39Å; V75-W80 WeakPolarHBondContact CG1-O 3.33Å; V75-W80 PolarHBondContact O-N 3.28Å; V75-L82 VanDerWaalsContact CG2-CA 3.5Å; V75-L82 HydrophobicContact CG2-CB 3.96Å; V75-L82 HydrophobicContact CG2-CD1 3.85Å; V75-V85 HydrophobicContact CG2-CB 4.39Å; V75-V85 HydrophobicContact CG2-CG2 3.77Å
76D92.1Very high92.4Very high141 Ų14155.1 Ų55.175%0.75430%0.301SS*.Hα-helixtrans-62.4-48.7177.9-170.764.2000112.2V72 L74 M78V72-D76 PolarHBondContact O-N 2.75Å; L74-D76 PolarHBondContact O-N 2.84Å; L74-D76 VanDerWaalsContact O-N 3.14Å; D76-M78 PolarHBondContact O-N 3.32Å
77S90.4Very high92.7Very high71 Ų7161.3 Ų61.350%0.49732%0.32SS..Hα-helixtrans-68.8-33.1-178.770.30000115.1K73 L74K73-S77 WeakPolarHBondContact O-CB 2.95Å; K73-S77 PolarHBondContact O-N 2.81Å; K73-S77 PolarHBondContact O-OG 2.71Å; L74-S77 PolarHBondContact O-N 2.7Å; L74-S77 PolarHBondContact O-OG 3.43Å
78M91.6Very high92.8Very high42 Ų4261.8 Ų61.821%0.20733%0.326CS..Hα-helixtrans-94.8-11.8179.737.4163.51300113.6P47 L74 D76 W80 V85P47-M78 HydrophobicContact CB-CE 4.37Å; P47-M78 HydrophobicContact CB-SD 4.44Å; P47-M78 HydrophobicContact CG-CE 3.88Å; P47-M78 HydrophobicContact CG-SD 4.22Å; L74-M78 HydrophobicContact CB-SD 4.49Å; L74-M78 WeakPolarHBondContact O-CG 3.29Å; L74-M78 PolarHBondContact O-N 3.48Å; D76-M78 PolarHBondContact O-N 3.32Å; M78-W80 VanDerWaalsContact C-N 3.26Å; M78-W80 HydrophobicContact CB-CG 4.27Å; M78-W80 HydrophobicContact CE-CB 4.31Å; M78-W80 HydrophobicContact CE-CD2 3.49Å; M78-W80 VanDerWaalsContact CE-CD2 3.49Å; M78-W80 HydrophobicContact CE-CE3 4.03Å; M78-W80 HydrophobicContact CE-CG 3.61Å; M78-W80 HydrophobicContact CE-CZ2 4.26Å; M78-W80 HydrophobicContact CG-CB 4.01Å; M78-W80 HydrophobicContact CG-CG 4.11Å; M78-W80 VanDerWaalsContact O-CD1 3.3Å; M78-W80 PolarHBondContact O-N 3.23Å; M78-W80 HydrophobicContact SD-CB 3.6Å; M78-W80 HydrophobicContact SD-CD2 3.93Å; M78-W80 HydrophobicContact SD-CE3 4.36Å; M78-W80 HydrophobicContact SD-CG 3.59Å; M78-W80 VanDerWaalsContact SD-CG 3.59Å; M78-V85 HydrophobicContact SD-CG2 3.59Å; M78-V85 VanDerWaalsContact SD-CG2 3.59Å
79G91Very high92.9Very high69 Ų6957.4 Ų57.471%0.71131%0.305SS*.THydrogen-bonded Turntrans64.729.2-172.800000113.3V75V75-G79 WeakPolarHBondContact O-CA 3.36Å; V75-G79 PolarHBondContact O-N 3.39Å
80W93.4Very high92.9Very high104 Ų10458.5 Ų58.539%0.39432%0.315SS..  trans-98.2155.4179.6-82.138.5000111.6P46 P47 V75 M78 V85P46-W80 HydrophobicContact CB-CZ2 4.48Å; P46-W80 HydrophobicContact CG-CH2 4.33Å; P47-W80 HydrophobicContact CG-CZ3 4.43Å; V75-W80 WeakPolarHBondContact CG1-O 3.33Å; V75-W80 PolarHBondContact O-N 3.28Å; M78-W80 VanDerWaalsContact C-N 3.26Å; M78-W80 HydrophobicContact CB-CG 4.27Å; M78-W80 HydrophobicContact CE-CB 4.31Å; M78-W80 HydrophobicContact CE-CD2 3.49Å; M78-W80 VanDerWaalsContact CE-CD2 3.49Å; M78-W80 HydrophobicContact CE-CE3 4.03Å; M78-W80 HydrophobicContact CE-CG 3.61Å; M78-W80 HydrophobicContact CE-CZ2 4.26Å; M78-W80 HydrophobicContact CG-CB 4.01Å; M78-W80 HydrophobicContact CG-CG 4.11Å; M78-W80 VanDerWaalsContact O-CD1 3.3Å; M78-W80 PolarHBondContact O-N 3.23Å; M78-W80 HydrophobicContact SD-CB 3.6Å; M78-W80 HydrophobicContact SD-CD2 3.93Å; M78-W80 HydrophobicContact SD-CE3 4.36Å; M78-W80 HydrophobicContact SD-CG 3.59Å; M78-W80 VanDerWaalsContact SD-CG 3.59Å; W80-V85 HydrophobicContact CB-CG2 3.87Å; W80-V85 HydrophobicContact CE3-CG2 4.23Å
81E92.1Very high92.8Very high139 Ų13960.5 Ų60.565%0.6532%0.322SS*.  trans-73.5141.2169.2-64.7178.3173.700111.9A83 S84 V85E81-A83 PolarHBondContact O-N 3.46Å; E81-S84 WeakPolarHBondContact O-CA 3.01Å; E81-S84 WeakPolarHBondContact O-CB 3.31Å; E81-S84 PolarHBondContact O-N 2.93Å; E81-V85 PolarHBondContact O-N 2.84Å
82L92.6Very high92.7Very high22 Ų2260.7 Ų60.712%0.11532%0.324CS..Hα-helixtrans-55.6-38.2178.7-174.365.1000112.9T23 M71 V72 V75 S84 V85 R86T23-L82 HydrophobicContact CG2-CD2 3.53Å; M71-L82 HydrophobicContact CB-CD1 3.81Å; M71-L82 HydrophobicContact CE-CD1 3.9Å; V72-L82 HydrophobicContact CG2-CD1 4.49Å; V75-L82 VanDerWaalsContact CG2-CA 3.5Å; V75-L82 HydrophobicContact CG2-CB 3.96Å; V75-L82 HydrophobicContact CG2-CD1 3.85Å; L82-S84 VanDerWaalsContact C-N 3.3Å; L82-S84 PolarHBondContact O-N 3.09Å; L82-V85 PolarHBondContact O-N 3.44Å; L82-R86 WeakPolarHBondContact O-CB 3.49Å; L82-R86 PolarHBondContact O-N 2.67Å
83A92.3Very high92.6Very high57 Ų5762 Ų6247%0.47133%0.327SS..Hα-helixtrans-64.3-34.217600000112.5E81 R87E81-A83 PolarHBondContact O-N 3.46Å; A83-R87 WeakPolarHBondContact O-CB 3.34Å; A83-R87 VanDerWaalsContact O-CG 3.26Å; A83-R87 WeakPolarHBondContact O-CG 3.4Å; A83-R87 PolarHBondContact O-N 3.4Å; A83-R87 PolarHBondContact O-NE 3.04Å
84S94.3Very high92.5Very high27 Ų2760.1 Ų60.119%0.18932%0.316CS..Hα-helixtrans-72.8-41.9177.9-64.10000111.4E81 L82 R87 A88E81-S84 WeakPolarHBondContact O-CA 3.01Å; E81-S84 WeakPolarHBondContact O-CB 3.31Å; E81-S84 PolarHBondContact O-N 2.93Å; L82-S84 VanDerWaalsContact C-N 3.3Å; L82-S84 PolarHBondContact O-N 3.09Å; S84-R87 PolarHBondContact O-N 3.39Å; S84-R87 PolarHBondContact OG-NH2 2.98Å; S84-A88 WeakPolarHBondContact O-CB 3.48Å; S84-A88 PolarHBondContact O-N 3.08Å
85V94.4Very high92.2Very high0 Ų063.2 Ų63.20%033%0.333CS..Hα-helixtrans-60.6-48.6172.3179.10000110.6P47 M71 V75 M78 W80 E81 L82 R87 A88 L89P47-V85 HydrophobicContact CB-CG1 4.03Å; P47-V85 HydrophobicContact CG-CG1 4.13Å; P47-V85 HydrophobicContact CG-CG2 4.45Å; M71-V85 HydrophobicContact CE-CB 4.4Å; M71-V85 HydrophobicContact CE-CG1 4.01Å; V75-V85 HydrophobicContact CG2-CB 4.39Å; V75-V85 HydrophobicContact CG2-CG2 3.77Å; M78-V85 HydrophobicContact SD-CG2 3.59Å; M78-V85 VanDerWaalsContact SD-CG2 3.59Å; W80-V85 HydrophobicContact CB-CG2 3.87Å; W80-V85 HydrophobicContact CE3-CG2 4.23Å; E81-V85 PolarHBondContact O-N 2.84Å; L82-V85 PolarHBondContact O-N 3.44Å; V85-R87 VanDerWaalsContact C-N 3.35Å; V85-R87 PolarHBondContact O-N 3.29Å; V85-A88 PolarHBondContact O-N 3.38Å; V85-L89 HydrophobicContact CG1-CD1 3.91Å; V85-L89 HydrophobicContact CG1-CG 4.45Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 3.28Å
86R94.3Very high91.5Very high78 Ų7867.4 Ų67.429%0.29435%0.351SS..Hα-helixtrans-58.1-45.7178.5-161.2178.7-133.9-98.11.7112.2M71 L82 L89 C90 F112M71-R86 HydrophobicContact CE-CB 3.76Å; M71-R86 HydrophobicContact CE-CG 4.1Å; L82-R86 WeakPolarHBondContact O-CB 3.49Å; L82-R86 PolarHBondContact O-N 2.67Å; R86-L89 PolarHBondContact O-N 3.18Å; R86-C90 PolarHBondContact O-N 2.58Å; R86-C90 PolarHBondContact O-SG 3.15Å; R86-C90 VanDerWaalsContact O-SG 3.34Å; R86-F112 HydrophobicContact CG-CE1 3.96Å; R86-F112 HydrophobicContact CG-CE2 3.94Å; R86-F112 HydrophobicContact CG-CZ 3.51Å; R86-F112 VanDerWaalsContact NH2-CG 3.27Å
87R94Very high90.8Very high154 Ų15463.5 Ų63.558%0.58133%0.328SS*.Hα-helixtrans-60.1-48.9176.2-78.2-177.9-64.3162.6-1.1111.2A83 S84 V85 L89 C90 Q91A83-R87 WeakPolarHBondContact O-CB 3.34Å; A83-R87 VanDerWaalsContact O-CG 3.26Å; A83-R87 WeakPolarHBondContact O-CG 3.4Å; A83-R87 PolarHBondContact O-N 3.4Å; A83-R87 PolarHBondContact O-NE 3.04Å; S84-R87 PolarHBondContact O-N 3.39Å; S84-R87 PolarHBondContact OG-NH2 2.98Å; V85-R87 VanDerWaalsContact C-N 3.35Å; V85-R87 PolarHBondContact O-N 3.29Å; R87-L89 VanDerWaalsContact C-N 3.3Å; R87-L89 PolarHBondContact O-N 3.2Å; R87-C90 PolarHBondContact O-N 3.03Å; R87-Q91 WeakPolarHBondContact O-CG 3.34Å; R87-Q91 PolarHBondContact O-N 3.42Å
88A93.9Very high90Very high21 Ų2166.5 Ų66.517%0.17435%0.346CS..Hα-helixtrans-58.5-41.5179.900000112.1P47 S84 V85 Q91P47-A88 HydrophobicContact CG-CB 4.17Å; S84-A88 WeakPolarHBondContact O-CB 3.48Å; S84-A88 PolarHBondContact O-N 3.08Å; V85-A88 PolarHBondContact O-N 3.38Å; A88-Q91 PolarHBondContact O-N 2.96Å
89L93.7Very high89.2Confident0 Ų075.8 Ų75.80%038%0.379CS..Hα-helixtrans-66-44.7176.3-65.9170.2000112.1C27 L29 F69 M71 V85 R86 R87 Q91 L92 V110 F112C27-L89 HydrophobicContact CB-CD1 4.13Å; L29-L89 HydrophobicContact CD1-CD2 4.17Å; F69-L89 HydrophobicContact CE2-CD1 3.88Å; F69-L89 HydrophobicContact CE2-CD2 4.29Å; F69-L89 HydrophobicContact CZ-CD1 4.12Å; F69-L89 HydrophobicContact CZ-CD2 3.75Å; M71-L89 HydrophobicContact CE-CD1 4.02Å; M71-L89 HydrophobicContact CG-CD1 4.33Å; M71-L89 HydrophobicContact SD-CD1 4.29Å; V85-L89 HydrophobicContact CG1-CD1 3.91Å; V85-L89 HydrophobicContact CG1-CG 4.45Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 3.28Å; R86-L89 PolarHBondContact O-N 3.18Å; R87-L89 VanDerWaalsContact C-N 3.3Å; R87-L89 PolarHBondContact O-N 3.2Å; L89-Q91 PolarHBondContact O-N 3.17Å; L89-L92 HydrophobicContact CD2-CD1 4.2Å; L89-L92 VanDerWaalsContact O-CB 3.22Å; L89-L92 WeakPolarHBondContact O-CB 3.47Å; L89-L92 WeakPolarHBondContact O-CG 3.45Å; L89-L92 PolarHBondContact O-N 3.29Å; L89-L92 VanDerWaalsContact O-N 3.08Å; L89-V110 HydrophobicContact CB-CG1 4.34Å; L89-F112 HydrophobicContact CD1-CE1 4.48Å
90C93Very high88.5Confident42 Ų4276.6 Ų76.628%0.28437%0.369SS..Hα-helixtrans-63-29.5175.5-680000113.1R86 R87 L92 Q93R86-C90 PolarHBondContact O-N 2.58Å; R86-C90 PolarHBondContact O-SG 3.15Å; R86-C90 VanDerWaalsContact O-SG 3.34Å; R87-C90 PolarHBondContact O-N 3.03Å; C90-L92 PolarHBondContact O-N 3.19Å; C90-Q93 PolarHBondContact O-N 3.06Å
91Q92Very high87.6Confident92 Ų9273.8 Ų73.843%0.4337%0.373SS..Hα-helixtrans-65.1-20.9175.6-68.2-56.7-29.800113R87 A88 L89 Q93 W94R87-Q91 WeakPolarHBondContact O-CG 3.34Å; R87-Q91 PolarHBondContact O-N 3.42Å; A88-Q91 PolarHBondContact O-N 2.96Å; L89-Q91 PolarHBondContact O-N 3.17Å; Q91-Q93 PolarHBondContact O-N 3.29Å; Q91-W94 PolarHBondContact O-N 3.26Å; Q91-W94 VanDerWaalsContact O-O 3.08Å
92L91.5Very high87.1Confident5 Ų571.4 Ų71.43%0.02637%0.368CS..THydrogen-bonded Turntrans-63.2-20.5177.6-65.5178.5000113.4L29 L41 C45 L48 L89 C90 W94 T106L29-L92 HydrophobicContact CD1-CD1 3.94Å; L29-L92 HydrophobicContact CD2-CD1 4.24Å; L41-L92 HydrophobicContact CB-CD2 3.96Å; L41-L92 HydrophobicContact CD2-CD2 4.19Å; L41-L92 HydrophobicContact CG-CD2 4.47Å; C45-L92 HydrophobicContact CB-CD1 4.3Å; C45-L92 HydrophobicContact CB-CD2 3.52Å; C45-L92 HydrophobicContact CB-CG 4.16Å; L48-L92 HydrophobicContact CD2-CD1 3.83Å; L89-L92 HydrophobicContact CD2-CD1 4.2Å; L89-L92 VanDerWaalsContact O-CB 3.22Å; L89-L92 WeakPolarHBondContact O-CB 3.47Å; L89-L92 WeakPolarHBondContact O-CG 3.45Å; L89-L92 PolarHBondContact O-N 3.29Å; L89-L92 VanDerWaalsContact O-N 3.08Å; C90-L92 PolarHBondContact O-N 3.19Å; L92-W94 PolarHBondContact O-N 3.08Å; L92-T106 WeakPolarHBondContact O-CB 3.22Å; L92-T106 VanDerWaalsContact O-CG2 3.29Å; L92-T106 WeakPolarHBondContact O-CG2 3.37Å; L92-T106 PolarHBondContact O-OG1 3.5Å
93Q91.1Very high86.6Confident65 Ų6576.4 Ų76.430%0.30439%0.385SS..THydrogen-bonded Turntrans-68.1-13.2174.4-59.3-176.9-800112.4C90 Q91 G105 T106 V110C90-Q93 PolarHBondContact O-N 3.06Å; Q91-Q93 PolarHBondContact O-N 3.29Å; Q93-G105 WeakPolarHBondContact O-CA 3.46Å; Q93-T106 VanDerWaalsContact C-OG1 3.26Å; Q93-T106 WeakPolarHBondContact CA-OG1 3.38Å; Q93-T106 PolarHBondContact O-N 3.12Å; Q93-T106 PolarHBondContact O-OG1 3.38Å; Q93-V110 HydrophobicContact CG-CB 4.48Å; Q93-V110 HydrophobicContact CG-CG2 3.67Å
94W89.4Confident86.2Confident109 Ų10980.6 Ų80.641%0.41339%0.389SS..EExtended strand (participates in β ladder)trans-125.7140.8-172.4-5599.7000112.2R44 Q91 L92 R103 R104R44-W94 PolarHBondContact NH1-O 3.21Å; R44-W94 PolarHBondContact NH2-O 2.91Å; Q91-W94 PolarHBondContact O-N 3.26Å; Q91-W94 VanDerWaalsContact O-O 3.08Å; L92-W94 PolarHBondContact O-N 3.08Å; W94-R103 HydrophobicContact CB-CG 4.14Å; W94-R103 HydrophobicContact CE3-CG 4.28Å; W94-R104 CarbonylContact C-O 3.6Å
95D85Confident85.8Confident70 Ų7081.5 Ų81.537%0.37440%0.403SS..EExtended strand (participates in β ladder)trans-128.6161.5171.5-153.3-1.3000110.8R44 R103 R104 T106R44-D95 IonicContact CZ-OD1 3.73Å; R44-D95 VanDerWaalsContact CZ-OD1 3.3Å; R44-D95 IonicContact NE-OD1 2.93Å; R44-D95 VanDerWaalsContact NH1-CG 3.26Å; R44-D95 IonicContact NH1-OD1 3.82Å; R44-D95 PolarHBondContact NH1-OD1 3.25Å; R44-D95 IonicContact NH1-OD2 3.2Å; R44-D95 IonicContact NH2-OD1 3.95Å; D95-R103 CarbonylContact O-C 3.53Å; D95-R103 WeakPolarHBondContact O-CA 3.48Å; D95-R104 PolarHBondContact N-O 3.17Å; D95-R104 PolarHBondContact O-N 2.84Å; D95-T106 HydrophobicContact CB-CG2 3.75Å
96H79.7Confident85.4Confident107 Ų10782.8 Ų82.850%0.49541%0.41SS..EExtended strand (participates in β ladder)trans-103128172.5-72.3-83.4000109.5P98 G101H96-P98 WeakPolarHBondContact O-CD 3.27Å; H96-G101 PolarHBondContact ND1-O 3.41Å
97E77.3Confident85.1Confident59 Ų5981.2 Ų81.228%0.27642%0.419SS..  trans-66123.4174.7-177.6164.4-142.700109.9R99 T100 G101 V102 R104E97-R99 PolarHBondContact O-N 2.76Å; E97-T100 WeakPolarHBondContact CB-OG1 3Å; E97-T100 WeakPolarHBondContact CG-OG1 3.33Å; E97-T100 PolarHBondContact O-N 2.87Å; E97-T100 PolarHBondContact OE2-OG1 3.01Å; E97-G101 WeakPolarHBondContact O-CA 3.24Å; E97-G101 PolarHBondContact O-N 3.25Å; E97-V102 PolarHBondContact N-O 3.26Å; E97-R104 IonicContact OE1-CZ 3.53Å; E97-R104 IonicContact OE1-NH1 3.91Å; E97-R104 IonicContact OE1-NH2 2.68Å; E97-R104 PolarHBondContact OE1-NH2 3.48Å; E97-R104 IonicContact OE2-NH2 3.34Å; E97-R104 PolarHBondContact OE2-NH2 3.04Å
98P74.3Confident85Confident134 Ų13474.2 Ų74.287%0.8739%0.393SS*.THydrogen-bonded Turntrans-58.8-23.2-169.6-27.433.6000115.5H96H96-P98 WeakPolarHBondContact O-CD 3.27Å
99R74.6Confident84.9Confident238 Ų23877.5 Ų77.590%0.89841%0.407SS*.THydrogen-bonded Turntrans-97.8-28.7-174.3-65.5-176178.6-179-0.2114E97E97-R99 PolarHBondContact O-N 2.76Å
100T75.1Confident85Confident85 Ų8578.3 Ų78.352%0.52141%0.412SS..THydrogen-bonded Turntrans-120.9-14.1-169.157.90000112.2E97 V102E97-T100 WeakPolarHBondContact CB-OG1 3Å; E97-T100 WeakPolarHBondContact CG-OG1 3.33Å; E97-T100 PolarHBondContact O-N 2.87Å; E97-T100 PolarHBondContact OE2-OG1 3.01Å; T100-V102 PolarHBondContact O-N 3.49Å; T100-V102 VanDerWaalsContact O-N 3.13Å; T100-V102 PolarHBondContact OG1-N 3.13Å
101G74.6Confident85.1Confident46 Ų4681 Ų8147%0.47442%0.421SS..  trans69.3-1.3-173.800000114H96 E97H96-G101 PolarHBondContact ND1-O 3.41Å; E97-G101 WeakPolarHBondContact O-CA 3.24Å; E97-G101 PolarHBondContact O-N 3.25Å
102V82.5Confident85.3Confident88 Ų8878.7 Ų78.753%0.53341%0.409SS..  trans-65.7136.3-177.1177.10000109.5E97 T100 R104E97-V102 PolarHBondContact N-O 3.26Å; T100-V102 PolarHBondContact O-N 3.49Å; T100-V102 VanDerWaalsContact O-N 3.13Å; T100-V102 PolarHBondContact OG1-N 3.13Å; V102-R104 PolarHBondContact O-N 3.49Å
103R81Confident85.5Confident127 Ų12780.7 Ų80.748%0.47942%0.424SS..EExtended strand (participates in β ladder)trans-72.1123.5179.4-136.7-177.2-170.3170.71.8109.7W94 D95W94-R103 HydrophobicContact CB-CG 4.14Å; W94-R103 HydrophobicContact CE3-CG 4.28Å; D95-R103 CarbonylContact O-C 3.53Å; D95-R103 WeakPolarHBondContact O-CA 3.48Å
104R85.5Confident85.7Confident145 Ų14583.4 Ų83.455%0.54744%0.436SS..EExtended strand (participates in β ladder)trans-120143.8176.9-174.5177.5-71179.14.2109.9W94 D95 E97 V102W94-R104 CarbonylContact C-O 3.6Å; D95-R104 PolarHBondContact N-O 3.17Å; D95-R104 PolarHBondContact O-N 2.84Å; E97-R104 IonicContact OE1-CZ 3.53Å; E97-R104 IonicContact OE1-NH1 3.91Å; E97-R104 IonicContact OE1-NH2 2.68Å; E97-R104 PolarHBondContact OE1-NH2 3.48Å; E97-R104 IonicContact OE2-NH2 3.34Å; E97-R104 PolarHBondContact OE2-NH2 3.04Å; V102-R104 PolarHBondContact O-N 3.49Å
105G85.5Confident86Confident47 Ų4783.4 Ų83.449%0.48544%0.444SS..EExtended strand (participates in β ladder)trans-69.3133.8173.700000111.4Q93 G107Q93-G105 WeakPolarHBondContact O-CA 3.46Å; G105-G107 VanDerWaalsContact C-N 3.27Å
106T85.3Confident86.4Confident26 Ų2681.7 Ų81.716%0.1644%0.439CS..  trans-77-16174.255.90000112.6Q37 L41 L92 Q93 D95 V108Q37-T106 PolarHBondContact NE2-O 2.71Å; L41-T106 HydrophobicContact CD2-CG2 4.37Å; L92-T106 WeakPolarHBondContact O-CB 3.22Å; L92-T106 VanDerWaalsContact O-CG2 3.29Å; L92-T106 WeakPolarHBondContact O-CG2 3.37Å; L92-T106 PolarHBondContact O-OG1 3.5Å; Q93-T106 VanDerWaalsContact C-OG1 3.26Å; Q93-T106 WeakPolarHBondContact CA-OG1 3.38Å; Q93-T106 PolarHBondContact O-N 3.12Å; Q93-T106 PolarHBondContact O-OG1 3.38Å; D95-T106 HydrophobicContact CB-CG2 3.75Å; T106-V108 PolarHBondContact O-N 3.2Å; T106-V108 PolarHBondContact OG1-N 3.26Å
107G88.1Confident87.2Confident46 Ų4679.8 Ų79.847%0.47443%0.43SS..  trans77.60.7-171.100000114P32 G105P32-G107 VanDerWaalsContact CD-O 3.3Å; P32-G107 WeakPolarHBondContact CD-O 3.45Å; P32-G107 VanDerWaalsContact CG-O 3.28Å; P32-G107 WeakPolarHBondContact CG-O 3.31Å; G105-G107 VanDerWaalsContact C-N 3.27Å
108V91.3Very high88Confident6 Ų678.4 Ų78.44%0.03642%0.423CS..  trans-71.2134.7175.7176.40000110.4N30 C31 L41 T106 V110N30-V108 WeakPolarHBondContact O-CA 3.48Å; C31-V108 HydrophobicContact CB-CG2 4.47Å; L41-V108 HydrophobicContact CD1-CG2 3.5Å; L41-V108 VanDerWaalsContact CD1-CG2 3.5Å; T106-V108 PolarHBondContact O-N 3.2Å; T106-V108 PolarHBondContact OG1-N 3.26Å; V108-V110 HydrophobicContact CG1-CG2 4.37Å
109L92.8Very high89Confident90 Ų9075.2 Ų75.247%0.47140%0.398SS..EExtended strand (participates in β ladder)trans-99.3131.7174.8-56.1175.2000109.1L29 N30L29-L109 WeakPolarHBondContact CA-O 3.47Å; N30-L109 HydrophobicContact CB-CB 4.26Å; N30-L109 PolarHBondContact N-O 3.49Å; N30-L109 PolarHBondContact O-N 3.16Å
110V95.4Very high89.9Confident17 Ų1770.8 Ų70.810%0.10338%0.382CS..EExtended strand (participates in β ladder)trans-121.2112.6178.1-173.70000107.2L29 L89 Q93 V108 F112L29-V110 HydrophobicContact CD2-CB 4.02Å; L29-V110 HydrophobicContact CD2-CG1 3.76Å; L29-V110 HydrophobicContact CD2-CG2 3.57Å; L89-V110 HydrophobicContact CB-CG1 4.34Å; Q93-V110 HydrophobicContact CG-CB 4.48Å; Q93-V110 HydrophobicContact CG-CG2 3.67Å; V108-V110 HydrophobicContact CG1-CG2 4.37Å; V110-F112 HydrophobicContact CG1-CE1 4.14Å; V110-F112 HydrophobicContact CG1-CE2 4.23Å; V110-F112 HydrophobicContact CG1-CZ 3.78Å
111E95.8Very high90.8Very high100 Ų10070.2 Ų70.247%0.46738%0.381SS..EExtended strand (participates in β ladder)trans-116.4136.3-178.9-65.8174.5179.600109.2C27 R28C27-E111 WeakPolarHBondContact CA-O 3.26Å; R28-E111 HydrophobicContact CB-CB 4.34Å; R28-E111 PolarHBondContact N-O 3.22Å; R28-E111 PolarHBondContact O-N 3.02Å
112F96.3Very high91.6Very high43 Ų4370.6 Ų70.619%0.18938%0.375CS..EExtended strand (participates in β ladder)trans-110.1132.5174.9-58-68.5000109.7Y24 H26 C27 M71 R86 L89 V110Y24-F112 HydrophobicContact CG-CB 4.28Å; H26-F112 VanDerWaalsContact O-CA 3.29Å; H26-F112 WeakPolarHBondContact O-CA 3.23Å; C27-F112 HydrophobicContact CB-CD1 4.03Å; C27-F112 HydrophobicContact CB-CE1 4.06Å; M71-F112 HydrophobicContact CE-CE1 4.09Å; M71-F112 HydrophobicContact SD-CD1 3.64Å; M71-F112 HydrophobicContact SD-CE1 3.6Å; M71-F112 VanDerWaalsContact SD-CE1 3.6Å; R86-F112 HydrophobicContact CG-CE1 3.96Å; R86-F112 HydrophobicContact CG-CE2 3.94Å; R86-F112 HydrophobicContact CG-CZ 3.51Å; R86-F112 VanDerWaalsContact NH2-CG 3.27Å; L89-F112 HydrophobicContact CD1-CE1 4.48Å; V110-F112 HydrophobicContact CG1-CE1 4.14Å; V110-F112 HydrophobicContact CG1-CE2 4.23Å; V110-F112 HydrophobicContact CG1-CZ 3.78Å
113S94.7Very high92Very high47 Ų4770.4 Ų70.433%0.32939%0.392SS..EExtended strand (participates in β ladder)trans-137.4-179.7-176.556.30000110.7Y24 T25 H26Y24-S113 WeakPolarHBondContact CB-O 3.29Å; T25-S113 PolarHBondContact N-O 3.07Å; H26-S113 WeakPolarHBondContact CB-O 3.39Å; H26-S113 PolarHBondContact N-O 3.08Å; H26-S113 VanDerWaalsContact N-O 3.11Å; H26-S113 PolarHBondContact O-N 3.02Å
114E95.3Very high92.5Very high121 Ų12170.9 Ų70.957%0.56540%0.403SS*.EExtended strand (participates in β ladder)trans55.781.9179.4-53.5-172.6156.200113.2T25 H26 A116T25-E114 PolarHBondContact N-O 3.42Å; T25-E114 VanDerWaalsContact N-O 3.1Å; T25-E114 PolarHBondContact OG1-O 2.89Å; T25-E114 VanDerWaalsContact OG1-O 3.14Å; H26-E114 HydrophobicContact CB-CB 3.88Å; H26-E114 HydrophobicContact CB-CG 3.87Å; H26-E114 IonicContact CG-OE2 3.94Å; H26-E114 IonicContact ND1-OE2 2.71Å; H26-E114 PolarHBondContact ND1-OE2 3.22Å; H26-E114 VanDerWaalsContact ND1-OE2 3.07Å; E114-A116 PolarHBondContact O-N 3.18Å
115L95.8Very high92.7Very high109 Ų10965.5 Ų65.557%0.57139%0.385SS*.EExtended strand (participates in β ladder)trans-63.4119.8171.3-172.569.6000109T22 Y24T22-L115 HydrophobicContact CG2-CD1 3.86Å; T22-L115 HydrophobicContact CG2-CD2 4.17Å; T22-L115 HydrophobicContact CG2-CG 3.87Å; Y24-L115 HydrophobicContact CD1-CB 4.21Å; Y24-L115 HydrophobicContact CD1-CD1 4.49Å; Y24-L115 HydrophobicContact CE1-CB 4.03Å; Y24-L115 HydrophobicContact CE1-CD1 4.4Å
116A94.8Very high92.9Very high34 Ų3466.6 Ų66.628%0.28138%0.383SS..EExtended strand (participates in β ladder)trans-135.9163.5-179.800000111.3T22 T23 T25 E114T22-A116 WeakPolarHBondContact CA-O 3.46Å; T23-A116 PolarHBondContact N-O 2.98Å; T23-A116 PolarHBondContact O-N 3.4Å; T25-A116 HydrophobicContact CG2-CB 3.76Å; E114-A116 PolarHBondContact O-N 3.18Å
117F95.5Very high92.9Very high67 Ų6767.7 Ų67.729%0.29440%0.395SS..EExtended strand (participates in β ladder)trans-79.4121.3166.7-62.1-72.3000108.7I2 E3 L6 L19 T22 L119I2-F117 HydrophobicContact CG2-CD2 4.34Å; I2-F117 HydrophobicContact CG2-CE2 4.05Å; E3-F117 HydrophobicContact CB-CE1 4.34Å; E3-F117 HydrophobicContact CB-CZ 3.96Å; E3-F117 HydrophobicContact CG-CE1 4.37Å; E3-F117 HydrophobicContact CG-CZ 4.47Å; L6-F117 HydrophobicContact CD1-CB 4.14Å; L6-F117 HydrophobicContact CD1-CD1 4.31Å; L6-F117 HydrophobicContact CD1-CD2 3.8Å; L6-F117 HydrophobicContact CD1-CE2 4.28Å; L6-F117 HydrophobicContact CD1-CG 3.82Å; L19-F117 HydrophobicContact CD1-CB 4.13Å; L19-F117 HydrophobicContact CD1-CD1 3.96Å; L19-F117 HydrophobicContact CD1-CG 4.38Å; T22-F117 HydrophobicContact CG2-CD1 4.41Å; T22-F117 HydrophobicContact CG2-CE1 4.44Å; T22-F117 WeakPolarHBondContact OG1-CD1 3.31Å; F117-L119 HydrophobicContact CB-CD1 4.46Å; F117-L119 HydrophobicContact CB-CD2 3.9Å; F117-L119 HydrophobicContact CB-CG 4.11Å; F117-L119 PolarHBondContact O-N 2.96Å
118H94.6Very high92.8Very high31 Ų3171.9 Ų71.914%0.14440%0.402CS..EExtended strand (participates in β ladder)trans-82.5114.6170.5-176-160.7000108.4L20 A21 T23L20-H118 HydrophobicContact CB-CB 4.34Å; L20-H118 WeakPolarHBondContact CB-O 3.41Å; L20-H118 VanDerWaalsContact CD1-CE1 3.48Å; L20-H118 WeakPolarHBondContact CD1-CE1 3.41Å; L20-H118 PolarHBondContact N-O 2.91Å; A21-H118 WeakPolarHBondContact O-CB 3.39Å; A21-H118 PolarHBondContact O-N 3.35Å; T23-H118 HydrophobicContact CG2-CB 4.2Å
119L94.6Very high92.7Very high66 Ų6674.9 Ų74.935%0.34642%0.416SS..EExtended strand (participates in β ladder)trans-119.6148.2-172.2-53.2170.5000109.4L6 L17 E18 L19 F117L6-L119 HydrophobicContact CD1-CD2 4.03Å; L6-L119 HydrophobicContact CD2-CD1 4Å; L6-L119 HydrophobicContact CD2-CD2 4.14Å; L17-L119 HydrophobicContact CD1-CB 4.36Å; L17-L119 HydrophobicContact CD1-CD1 4.16Å; L17-L119 HydrophobicContact CD1-CD2 4.24Å; L17-L119 HydrophobicContact CD1-CG 4.48Å; L17-L119 HydrophobicContact CD2-CD2 3.93Å; L17-L119 HydrophobicContact CG-CD2 4.46Å; E18-L119 WeakPolarHBondContact O-CA 3.35Å; L19-L119 HydrophobicContact CD1-CD2 3.42Å; L19-L119 VanDerWaalsContact CD1-CD2 3.42Å; F117-L119 HydrophobicContact CB-CD1 4.46Å; F117-L119 HydrophobicContact CB-CD2 3.9Å; F117-L119 HydrophobicContact CB-CG 4.11Å; F117-L119 PolarHBondContact O-N 2.96Å
120R93Very high92.5Very high145 Ų14575.5 Ų75.555%0.54741%0.414SS..EExtended strand (participates in β ladder)trans-118.9127.7163.7-174.4-178.3-64.5141.8-5.7108.5L17 E18 L20L17-R120 CarbonylContact C-O 3.59Å; L17-R120 WeakPolarHBondContact CA-O 3.4Å; E18-R120 HydrophobicContact CB-CB 4.24Å; E18-R120 PolarHBondContact N-O 2.89Å; E18-R120 PolarHBondContact O-N 3.34Å; E18-R120 WeakPolarHBondContact OE2-CD 3.34Å; E18-R120 IonicContact OE2-CZ 3.77Å; E18-R120 IonicContact OE2-NE 3.25Å; E18-R120 IonicContact OE2-NH1 2.81Å; E18-R120 PolarHBondContact OE2-NH1 3.41Å; L20-R120 HydrophobicContact CD1-CB 4.45Å
121S93.9Very high92.2Very high73 Ų7375.9 Ų75.951%0.5142%0.416SS..  trans-145.7150179.258.50000110.3G123S121-G123 PolarHBondContact O-N 2.87Å
122P91.9Very high91.9Very high54 Ų5475.3 Ų75.335%0.35141%0.413SS..  trans-59135.6171.724.6-31.8000110.9W16 D124 L125W16-P122 VanDerWaalsContact O-CD 3.3Å; W16-P122 WeakPolarHBondContact O-CD 3.38Å; P122-D124 WeakPolarHBondContact CB-OD1 3.41Å; P122-L125 HydrophobicContact CB-CD2 4.46Å; P122-L125 HydrophobicContact CB-CG 4.38Å; P122-L125 HydrophobicContact CG-CD1 4.15Å; P122-L125 HydrophobicContact CG-CD2 3.84Å; P122-L125 HydrophobicContact CG-CG 3.89Å
123G90.5Very high91.8Very high85 Ų8574.3 Ų74.388%0.87641%0.41SS*.SBendtrans-88.6-6.4-17900000114.3S121S121-G123 PolarHBondContact O-N 2.87Å
124D91.5Very high91.6Very high136 Ų13674.7 Ų74.773%0.72741%0.411SS*.  trans-109.710.4-168.461.5-31.2000114.1P122 T126P122-D124 WeakPolarHBondContact CB-OD1 3.41Å; D124-T126 PolarHBondContact O-N 3.31Å
125L90.5Very high91.4Very high32 Ų3272.4 Ų72.417%0.16840%0.403CS..  trans-56126.3177.8-65.8176.4000112.3P122 E129 K130 I133P122-L125 HydrophobicContact CB-CD2 4.46Å; P122-L125 HydrophobicContact CB-CG 4.38Å; P122-L125 HydrophobicContact CG-CD1 4.15Å; P122-L125 HydrophobicContact CG-CD2 3.84Å; P122-L125 HydrophobicContact CG-CG 3.89Å; L125-E129 HydrophobicContact CD2-CB 4.31Å; L125-K130 HydrophobicContact CB-CG 4.19Å; L125-K130 VanDerWaalsContact O-CE 3.24Å; L125-K130 WeakPolarHBondContact O-CE 3.42Å; L125-K130 PolarHBondContact O-NZ 3Å; L125-K130 VanDerWaalsContact O-NZ 3.14Å; L125-I133 HydrophobicContact CD1-CD1 3.83Å
126T89.4Confident91.3Very high71 Ų7169.8 Ų69.844%0.43639%0.387SS..  trans-66.7164.3174.466.40000111.6D124 E128 E129 K130D124-T126 PolarHBondContact O-N 3.31Å; T126-E128 PolarHBondContact O-N 3.35Å; T126-E129 WeakPolarHBondContact CB-OE2 3.31Å; T126-E129 WeakPolarHBondContact CG2-OE2 3.28Å; T126-E129 PolarHBondContact N-OE2 3.34Å; T126-E129 PolarHBondContact O-N 2.91Å; T126-E129 VanDerWaalsContact OG1-CD 3.32Å; T126-E129 VanDerWaalsContact OG1-CG 3.29Å; T126-E129 WeakPolarHBondContact OG1-CG 3.39Å; T126-E129 PolarHBondContact OG1-N 3.46Å; T126-E129 PolarHBondContact OG1-OE2 3.36Å; T126-K130 WeakPolarHBondContact O-CG 3.43Å; T126-K130 PolarHBondContact O-N 3.49Å; T126-K130 VanDerWaalsContact O-N 3.12Å
127A85.4Confident91.3Very high49 Ų4969.4 Ų69.441%0.40538%0.381SS..Hα-helixtrans-62.4-35.1175.700000112.2K130 D131A127-K130 PolarHBondContact O-N 3.3Å; A127-D131 PolarHBondContact O-N 2.78Å; A127-D131 VanDerWaalsContact O-N 3.09Å
128E85.5Confident91.1Very high134 Ų13470.8 Ų70.863%0.62638%0.384SS*.Hα-helixtrans-67.8-45.6178.8-171.6178.7171.200111.6T126 K130 D131 Q132T126-E128 PolarHBondContact O-N 3.35Å; E128-K130 VanDerWaalsContact C-N 3.3Å; E128-K130 PolarHBondContact O-N 3.16Å; E128-D131 WeakPolarHBondContact O-CB 3.24Å; E128-D131 PolarHBondContact O-N 3.27Å; E128-D131 VanDerWaalsContact O-N 3.09Å; E128-Q132 WeakPolarHBondContact O-CG 3.33Å; E128-Q132 PolarHBondContact O-N 3.42Å
129E89.4Confident91Very high69 Ų6970.7 Ų70.732%0.32239%0.392SS..Hα-helixtrans-62.1-38.8176-70.2163.3132.900111.8L125 T126 D131 Q132 I133L125-E129 HydrophobicContact CD2-CB 4.31Å; T126-E129 WeakPolarHBondContact CB-OE2 3.31Å; T126-E129 WeakPolarHBondContact CG2-OE2 3.28Å; T126-E129 PolarHBondContact N-OE2 3.34Å; T126-E129 PolarHBondContact O-N 2.91Å; T126-E129 VanDerWaalsContact OG1-CD 3.32Å; T126-E129 VanDerWaalsContact OG1-CG 3.29Å; T126-E129 WeakPolarHBondContact OG1-CG 3.39Å; T126-E129 PolarHBondContact OG1-N 3.46Å; T126-E129 PolarHBondContact OG1-OE2 3.36Å; E129-D131 VanDerWaalsContact C-N 3.28Å; E129-D131 PolarHBondContact O-N 2.87Å; E129-Q132 PolarHBondContact O-N 3.03Å; E129-I133 VanDerWaalsContact O-CG1 3.27Å; E129-I133 WeakPolarHBondContact O-CG1 3.27Å; E129-I133 PolarHBondContact O-N 3.13Å
130K89.4Confident90.9Very high103 Ų10373.2 Ų73.245%0.44840%0.397SS..Hα-helixtrans-62.6-35.4174.2-72.7170.2-177.4163.10112.4L125 T126 A127 E128 C134L125-K130 HydrophobicContact CB-CG 4.19Å; L125-K130 VanDerWaalsContact O-CE 3.24Å; L125-K130 WeakPolarHBondContact O-CE 3.42Å; L125-K130 PolarHBondContact O-NZ 3Å; L125-K130 VanDerWaalsContact O-NZ 3.14Å; T126-K130 WeakPolarHBondContact O-CG 3.43Å; T126-K130 PolarHBondContact O-N 3.49Å; T126-K130 VanDerWaalsContact O-N 3.12Å; A127-K130 PolarHBondContact O-N 3.3Å; E128-K130 VanDerWaalsContact C-N 3.3Å; E128-K130 PolarHBondContact O-N 3.16Å; K130-C134 PolarHBondContact O-N 3.36Å; K130-C134 VanDerWaalsContact O-N 3.12Å; K130-C134 PolarHBondContact O-SG 3.48Å
131D88.9Confident91Very high24 Ų2469.4 Ų69.413%0.12839%0.39CS..Hα-helixtrans-72-41.4176-76.7-13000111.5A127 E128 E129 I133 C134 D135 S241 R243A127-D131 PolarHBondContact O-N 2.78Å; A127-D131 VanDerWaalsContact O-N 3.09Å; E128-D131 WeakPolarHBondContact O-CB 3.24Å; E128-D131 PolarHBondContact O-N 3.27Å; E128-D131 VanDerWaalsContact O-N 3.09Å; E129-D131 VanDerWaalsContact C-N 3.28Å; E129-D131 PolarHBondContact O-N 2.87Å; D131-I133 VanDerWaalsContact C-N 3.31Å; D131-I133 PolarHBondContact O-N 2.98Å; D131-C134 WeakPolarHBondContact O-CA 3.42Å; D131-C134 WeakPolarHBondContact O-CB 3.39Å; D131-C134 PolarHBondContact O-N 2.94Å; D131-D135 PolarHBondContact O-N 3.44Å; D131-S241 WeakPolarHBondContact OD2-CB 3.17Å; D131-S241 PolarHBondContact OD2-OG 3.05Å; D131-R243 PolarHBondContact O-NH1 2.79Å; D131-R243 WeakPolarHBondContact OD1-CB 3.46Å; D131-R243 VanDerWaalsContact OD1-CD 3.28Å; D131-R243 WeakPolarHBondContact OD1-CD 3.16Å; D131-R243 VanDerWaalsContact OD2-CB 3.29Å; D131-R243 WeakPolarHBondContact OD2-CB 3.49Å
132Q89.8Confident91Very high89 Ų8969.3 Ų69.342%0.41638%0.381SS..Hα-helixtrans-58.8-42173-67.4170.69.600111.8E128 E129 C134 D135 F136E128-Q132 WeakPolarHBondContact O-CG 3.33Å; E128-Q132 PolarHBondContact O-N 3.42Å; E129-Q132 PolarHBondContact O-N 3.03Å; Q132-C134 VanDerWaalsContact C-N 3.31Å; Q132-C134 PolarHBondContact O-N 3.21Å; Q132-D135 PolarHBondContact O-N 3.47Å; Q132-F136 WeakPolarHBondContact O-CB 3.39Å; Q132-F136 PolarHBondContact O-N 2.89Å
133I93.4Very high91Very high22 Ų2268.6 Ų68.611%0.11338%0.38CS..Hα-helixtrans-56.9-46.6172.4-72.3163.2000110.8L9 W16 L125 E129 D131 F136 L137L9-I133 HydrophobicContact CD2-CG2 3.69Å; W16-I133 HydrophobicContact CB-CD1 4.47Å; W16-I133 HydrophobicContact CD2-CD1 3.99Å; W16-I133 HydrophobicContact CD2-CG1 3.49Å; W16-I133 VanDerWaalsContact CD2-CG1 3.49Å; W16-I133 HydrophobicContact CE3-CB 4.27Å; W16-I133 HydrophobicContact CE3-CD1 4.26Å; W16-I133 HydrophobicContact CE3-CG1 3.36Å; W16-I133 HydrophobicContact CE3-CG2 4.5Å; W16-I133 HydrophobicContact CG-CD1 4.16Å; W16-I133 HydrophobicContact CG-CG1 4.19Å; W16-I133 HydrophobicContact CH2-CB 4.28Å; W16-I133 HydrophobicContact CH2-CG1 3.6Å; W16-I133 HydrophobicContact CZ2-CG1 3.79Å; W16-I133 HydrophobicContact CZ3-CB 3.99Å; W16-I133 HydrophobicContact CZ3-CG1 3.4Å; W16-I133 VanDerWaalsContact CZ3-CG1 3.4Å; W16-I133 HydrophobicContact CZ3-CG2 4.46Å; L125-I133 HydrophobicContact CD1-CD1 3.83Å; E129-I133 VanDerWaalsContact O-CG1 3.27Å; E129-I133 WeakPolarHBondContact O-CG1 3.27Å; E129-I133 PolarHBondContact O-N 3.13Å; D131-I133 VanDerWaalsContact C-N 3.31Å; D131-I133 PolarHBondContact O-N 2.98Å; I133-F136 PolarHBondContact O-N 3.32Å; I133-L137 HydrophobicContact CG2-CD1 4.16Å; I133-L137 WeakPolarHBondContact O-CG 3.36Å; I133-L137 PolarHBondContact O-N 3.44Å
134C91.3Very high91.1Very high54 Ų5471 Ų7137%0.36536%0.362SS..Hα-helixtrans-64.2-42.5-179.5-71.80000111.9K130 D131 Q132 Y138K130-C134 PolarHBondContact O-N 3.36Å; K130-C134 VanDerWaalsContact O-N 3.12Å; K130-C134 PolarHBondContact O-SG 3.48Å; D131-C134 WeakPolarHBondContact O-CA 3.42Å; D131-C134 WeakPolarHBondContact O-CB 3.39Å; D131-C134 PolarHBondContact O-N 2.94Å; Q132-C134 VanDerWaalsContact C-N 3.31Å; Q132-C134 PolarHBondContact O-N 3.21Å; C134-Y138 VanDerWaalsContact O-CB 3.23Å; C134-Y138 WeakPolarHBondContact O-CB 3.43Å; C134-Y138 PolarHBondContact O-N 2.88Å
135D89.4Confident91.2Very high74 Ų7470.1 Ų70.140%0.39635%0.354SS..Hα-helixtrans-66-42.7177.8-70.9-36.5000112D131 Q132 Y138 G139 R243D131-D135 PolarHBondContact O-N 3.44Å; Q132-D135 PolarHBondContact O-N 3.47Å; D135-Y138 PolarHBondContact O-N 3.49Å; D135-G139 PolarHBondContact O-N 3.4Å; D135-R243 IonicContact OD1-CZ 3.5Å; D135-R243 IonicContact OD1-NH1 3.84Å; D135-R243 PolarHBondContact OD1-NH1 2.99Å; D135-R243 IonicContact OD1-NH2 2.71Å; D135-R243 PolarHBondContact OD1-NH2 2.94Å; D135-R243 IonicContact OD2-NH1 2.62Å; D135-R243 PolarHBondContact OD2-NH1 3.11Å; D135-R243 VanDerWaalsContact OD2-NH1 3.08Å
136F93.9Very high91.4Very high53 Ų5376.6 Ų76.623%0.23238%0.376CS..Hα-helixtrans-57.3-55173.8166.2-106.1000111.7Y8 L9 H12 W16 Q132 I133 Y138 G139 R140Y8-F136 WeakPolarHBondContact O-CE1 3.49Å; L9-F136 HydrophobicContact CD2-CD1 4.37Å; H12-F136 AromaticContact CD2-CD2 3.85Å; H12-F136 AromaticContact CD2-CE1 3.91Å; H12-F136 AromaticContact CD2-CE2 3.57Å; H12-F136 AromaticContact CD2-CZ 3.59Å; W16-F136 HydrophobicContact CH2-CB 4.46Å; W16-F136 HydrophobicContact CZ3-CB 4.19Å; W16-F136 AromaticContact CZ3-CD1 3.98Å; W16-F136 HydrophobicContact CZ3-CD1 3.98Å; W16-F136 HydrophobicContact CZ3-CG 4.25Å; Q132-F136 WeakPolarHBondContact O-CB 3.39Å; Q132-F136 PolarHBondContact O-N 2.89Å; I133-F136 PolarHBondContact O-N 3.32Å; F136-Y138 VanDerWaalsContact C-N 3.33Å; F136-Y138 PolarHBondContact O-N 2.98Å; F136-G139 PolarHBondContact O-N 3.33Å; F136-R140 HydrophobicContact CD2-CG 4.3Å; F136-R140 HydrophobicContact CE2-CG 3.85Å; F136-R140 HydrophobicContact CZ-CG 3.97Å; F136-R140 WeakPolarHBondContact O-CG 3.24Å; F136-R140 PolarHBondContact O-N 3.42Å
137L94.8Very high91.5Very high27 Ų2778 Ų7814%0.14138%0.378CS..Hα-helixtrans-60.9-44-178-73.2-179.8000111.7L5 Y8 L9 I133 R140 V141L5-L137 HydrophobicContact CB-CD2 4.33Å; L5-L137 HydrophobicContact CD2-CB 4.48Å; L5-L137 HydrophobicContact CD2-CD2 4.15Å; Y8-L137 HydrophobicContact CD2-CD2 4.45Å; L9-L137 HydrophobicContact CD1-CD1 4.29Å; L9-L137 HydrophobicContact CD2-CD1 3.99Å; L9-L137 HydrophobicContact CD2-CD2 3.83Å; L9-L137 HydrophobicContact CD2-CG 3.91Å; L9-L137 HydrophobicContact CG-CD1 4.27Å; L9-L137 HydrophobicContact CG-CD2 4.03Å; L9-L137 HydrophobicContact CG-CG 4.46Å; I133-L137 HydrophobicContact CG2-CD1 4.16Å; I133-L137 WeakPolarHBondContact O-CG 3.36Å; I133-L137 PolarHBondContact O-N 3.44Å; L137-R140 PolarHBondContact O-N 3.43Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.33Å
138Y92.6Very high91.8Very high95 Ų9577.1 Ų77.137%0.37337%0.371SS..Hα-helixtrans-66-41.2179.4-172.3-106.3000112C134 D135 F136 R140 V141 Q142 H278C134-Y138 VanDerWaalsContact O-CB 3.23Å; C134-Y138 WeakPolarHBondContact O-CB 3.43Å; C134-Y138 PolarHBondContact O-N 2.88Å; D135-Y138 PolarHBondContact O-N 3.49Å; F136-Y138 VanDerWaalsContact C-N 3.33Å; F136-Y138 PolarHBondContact O-N 2.98Å; Y138-R140 VanDerWaalsContact C-N 3.31Å; Y138-R140 PolarHBondContact O-N 2.91Å; Y138-V141 WeakPolarHBondContact O-CB 3.39Å; Y138-V141 PolarHBondContact O-N 3.39Å; Y138-V141 VanDerWaalsContact O-N 3.13Å; Y138-Q142 HydrophobicContact CD1-CG 4.09Å; Y138-Q142 HydrophobicContact CE1-CG 3.63Å; Y138-Q142 HydrophobicContact CE2-CG 4.35Å; Y138-Q142 PolarHBondContact O-N 3.24Å; Y138-Q142 PolarHBondContact OH-NE2 3.37Å; Y138-H278 AromaticContact CD1-CE1 3.69Å; Y138-H278 AromaticContact CD1-NE2 3.61Å; Y138-H278 AromaticContact CE1-CE1 3.56Å; Y138-H278 AromaticContact CE1-NE2 2.99Å; Y138-H278 WeakPolarHBondContact CE1-NE2 3.35Å; Y138-H278 AromaticContact CZ-NE2 3.65Å
139G91.4Very high92.2Very high30 Ų3074.4 Ų74.431%0.30936%0.36SS..Hα-helixtrans-57.9-41.5173.900000112.6D135 F136 Q142 A143D135-G139 PolarHBondContact O-N 3.4Å; F136-G139 PolarHBondContact O-N 3.33Å; G139-Q142 PolarHBondContact O-N 3.41Å; G139-A143 WeakPolarHBondContact O-CB 3.36Å; G139-A143 PolarHBondContact O-N 2.95Å
140R93.8Very high92.3Very high118 Ų11873.8 Ų73.845%0.44537%0.366SS..Hα-helixtrans-64-40.6174.5-65.3-68-72.2166.8-6.4112.3Y8 F136 L137 Y138 R144Y8-R140 HydrophobicContact CD2-CB 4.01Å; Y8-R140 HydrophobicContact CD2-CG 4.43Å; Y8-R140 HydrophobicContact CE2-CB 3.88Å; F136-R140 HydrophobicContact CD2-CG 4.3Å; F136-R140 HydrophobicContact CE2-CG 3.85Å; F136-R140 HydrophobicContact CZ-CG 3.97Å; F136-R140 WeakPolarHBondContact O-CG 3.24Å; F136-R140 PolarHBondContact O-N 3.42Å; L137-R140 PolarHBondContact O-N 3.43Å; Y138-R140 VanDerWaalsContact C-N 3.31Å; Y138-R140 PolarHBondContact O-N 2.91Å; R140-R144 WeakPolarHBondContact O-CB 3.48Å; R140-R144 PolarHBondContact O-N 2.84Å
141V94.8Very high92.4Very high65 Ų6574.5 Ų74.539%0.39437%0.366SS..Hα-helixtrans-63.2-49176.2171.90000110.9L5 L137 Y138 A143 R144 E145L5-V141 HydrophobicContact CD2-CG2 4.04Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 3.33Å; Y138-V141 WeakPolarHBondContact O-CB 3.39Å; Y138-V141 PolarHBondContact O-N 3.39Å; Y138-V141 VanDerWaalsContact O-N 3.13Å; V141-A143 PolarHBondContact O-N 3.49Å; V141-R144 WeakPolarHBondContact O-CB 3.23Å; V141-R144 PolarHBondContact O-N 3.15Å; V141-E145 PolarHBondContact O-N 3.26Å
142Q92.6Very high92.6Very high72 Ų7279 Ų7934%0.33639%0.39SS..Hα-helixtrans-64.1-40.1178.8-72-169.4-44.200112.7Y138 G139 R144 E145 R146Y138-Q142 HydrophobicContact CD1-CG 4.09Å; Y138-Q142 HydrophobicContact CE1-CG 3.63Å; Y138-Q142 HydrophobicContact CE2-CG 4.35Å; Y138-Q142 PolarHBondContact O-N 3.24Å; Y138-Q142 PolarHBondContact OH-NE2 3.37Å; G139-Q142 PolarHBondContact O-N 3.41Å; Q142-R144 VanDerWaalsContact C-N 3.32Å; Q142-R144 PolarHBondContact O-N 3.16Å; Q142-E145 PolarHBondContact O-N 3.36Å; Q142-R146 WeakPolarHBondContact O-CB 3.28Å; Q142-R146 WeakPolarHBondContact O-CG 3.2Å; Q142-R146 PolarHBondContact O-N 3.28Å
143A91.9Very high92.8Very high38 Ų3882.8 Ų82.831%0.31440%0.4SS..Hα-helixtrans-61.3-43.117500000111.1G139 V141 E145 R146 Q147G139-A143 WeakPolarHBondContact O-CB 3.36Å; G139-A143 PolarHBondContact O-N 2.95Å; V141-A143 PolarHBondContact O-N 3.49Å; A143-E145 PolarHBondContact O-N 2.77Å; A143-R146 PolarHBondContact O-N 2.77Å; A143-Q147 WeakPolarHBondContact O-CB 3.45Å; A143-Q147 PolarHBondContact O-N 3.17Å
144R93.9Very high92.7Very high136 Ų13687 Ų8751%0.51341%0.414SS..Hα-helixtrans-64.1-41.1177.2-175.657.3167.4-163-6.5112.4R140 V141 Q142 A148R140-R144 WeakPolarHBondContact O-CB 3.48Å; R140-R144 PolarHBondContact O-N 2.84Å; V141-R144 WeakPolarHBondContact O-CB 3.23Å; V141-R144 PolarHBondContact O-N 3.15Å; Q142-R144 VanDerWaalsContact C-N 3.32Å; Q142-R144 PolarHBondContact O-N 3.16Å; R144-A148 WeakPolarHBondContact O-CB 2.99Å; R144-A148 PolarHBondContact O-N 3.3Å
145E93.6Very high92.8Very high117 Ų11787.6 Ų87.655%0.54742%0.417SS..Hα-helixtrans-61.4-51.8175.2-177.6-179.6174.600111.2V141 Q142 A143 Q147 A148 L149V141-E145 PolarHBondContact O-N 3.26Å; Q142-E145 PolarHBondContact O-N 3.36Å; A143-E145 PolarHBondContact O-N 2.77Å; E145-Q147 VanDerWaalsContact C-N 3.33Å; E145-Q147 PolarHBondContact O-N 2.93Å; E145-A148 PolarHBondContact O-N 3.46Å; E145-A148 VanDerWaalsContact O-N 3.13Å; E145-L149 HydrophobicContact CG-CD1 4.21Å; E145-L149 WeakPolarHBondContact O-CG 3.25Å; E145-L149 PolarHBondContact O-N 3.01Å
146R93.8Very high93.1Very high169 Ų16990.4 Ų90.464%0.63843%0.426SS*.Hα-helixtrans-56.9-45.3177.4-74.3-175.8-70.3158.3-2.8111.8Q142 A143 A148 L149 A150Q142-R146 WeakPolarHBondContact O-CB 3.28Å; Q142-R146 WeakPolarHBondContact O-CG 3.2Å; Q142-R146 PolarHBondContact O-N 3.28Å; A143-R146 PolarHBondContact O-N 2.77Å; R146-A148 PolarHBondContact O-N 2.94Å; R146-L149 PolarHBondContact O-N 3.34Å; R146-A150 VanDerWaalsContact O-CB 3.31Å; R146-A150 WeakPolarHBondContact O-CB 3.41Å; R146-A150 PolarHBondContact O-N 2.72Å
147Q92.2Very high93.2Very high100 Ų10093.9 Ų93.947%0.46744%0.443SS..Hα-helixtrans-60.9-44176.6-170.6-170.322.400111.8A143 E145 A150 R151A143-Q147 WeakPolarHBondContact O-CB 3.45Å; A143-Q147 PolarHBondContact O-N 3.17Å; E145-Q147 VanDerWaalsContact C-N 3.33Å; E145-Q147 PolarHBondContact O-N 2.93Å; Q147-A150 PolarHBondContact O-N 3.41Å; Q147-R151 WeakPolarHBondContact O-CB 3.42Å; Q147-R151 PolarHBondContact O-N 3.4Å
148A91.4Very high93.2Very high31 Ų3193.7 Ų93.726%0.25645%0.445SS..Hα-helixtrans-64-42.8178.800000112R144 E145 R146 R151 L152R144-A148 WeakPolarHBondContact O-CB 2.99Å; R144-A148 PolarHBondContact O-N 3.3Å; E145-A148 PolarHBondContact O-N 3.46Å; E145-A148 VanDerWaalsContact O-N 3.13Å; R146-A148 PolarHBondContact O-N 2.94Å; A148-R151 PolarHBondContact O-N 2.86Å; A148-L152 WeakPolarHBondContact O-CG 3.48Å; A148-L152 PolarHBondContact O-N 3.04Å
149L93.9Very high93.3Very high77 Ų7794.4 Ų94.440%0.40345%0.45SS..Hα-helixtrans-65.6-44.2176.1-69.1175.8000112E145 R146 R151 L152 R153E145-L149 HydrophobicContact CG-CD1 4.21Å; E145-L149 WeakPolarHBondContact O-CG 3.25Å; E145-L149 PolarHBondContact O-N 3.01Å; R146-L149 PolarHBondContact O-N 3.34Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.4Å; L149-L152 PolarHBondContact O-N 2.92Å; L149-R153 WeakPolarHBondContact O-CG 3.35Å; L149-R153 PolarHBondContact O-N 3.47Å
150A90.8Very high93.6Very high55 Ų5598.7 Ų98.746%0.45546%0.462SS..Hα-helixtrans-59.1-43.5175.900000111.1R146 Q147 R153 R154R146-A150 VanDerWaalsContact O-CB 3.31Å; R146-A150 WeakPolarHBondContact O-CB 3.41Å; R146-A150 PolarHBondContact O-N 2.72Å; Q147-A150 PolarHBondContact O-N 3.41Å; A150-R153 PolarHBondContact O-N 3.45Å; A150-R154 WeakPolarHBondContact O-CB 3.44Å; A150-R154 PolarHBondContact O-N 3.28Å
151R91.6Very high93.8Very high119 Ų11995.5 Ų95.545%0.44946%0.458SS..Hα-helixtrans-61.4-47175.8-172.5172.462.1-156.3-0.5111.9Q147 A148 L149 R153 R154 T155Q147-R151 WeakPolarHBondContact O-CB 3.42Å; Q147-R151 PolarHBondContact O-N 3.4Å; A148-R151 PolarHBondContact O-N 2.86Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.4Å; R151-R153 VanDerWaalsContact C-N 3.35Å; R151-R153 PolarHBondContact O-N 3.49Å; R151-R154 PolarHBondContact O-N 2.98Å; R151-T155 WeakPolarHBondContact O-CB 3.38Å; R151-T155 PolarHBondContact O-N 3.06Å; R151-T155 PolarHBondContact O-OG1 3.31Å
152L94.6Very high93.9Very high119 Ų11993.3 Ų93.362%0.62344%0.444SS*.Hα-helixtrans-59-44.9176.4-74.1175.2000112.2A148 L149 T155 F156A148-L152 WeakPolarHBondContact O-CG 3.48Å; A148-L152 PolarHBondContact O-N 3.04Å; L149-L152 PolarHBondContact O-N 2.92Å; L152-T155 PolarHBondContact O-N 3.37Å; L152-F156 WeakPolarHBondContact O-CB 3.1Å; L152-F156 PolarHBondContact O-N 3.41Å
153R92.6Very high94Very high168 Ų16892.4 Ų92.463%0.63445%0.449SS*.Hα-helixtrans-61.4-48.2176.9-72.4176.6-178.5173.40.8111.4L149 A150 R151 F156 Q157L149-R153 WeakPolarHBondContact O-CG 3.35Å; L149-R153 PolarHBondContact O-N 3.47Å; A150-R153 PolarHBondContact O-N 3.45Å; R151-R153 VanDerWaalsContact C-N 3.35Å; R151-R153 PolarHBondContact O-N 3.49Å; R153-F156 PolarHBondContact O-N 3.45Å; R153-Q157 WeakPolarHBondContact O-CB 3.38Å; R153-Q157 VanDerWaalsContact O-CG 3.28Å; R153-Q157 WeakPolarHBondContact O-CG 3.42Å; R153-Q157 PolarHBondContact O-N 2.91Å
154R92.4Very high94.1Very high109 Ų10993.3 Ų93.341%0.41145%0.446SS..Hα-helixtrans-61.6-45.2179.1-171.7173.1-178.3173.4-2.3111.4A150 R151 Q157 A158 E192A150-R154 WeakPolarHBondContact O-CB 3.44Å; A150-R154 PolarHBondContact O-N 3.28Å; R151-R154 PolarHBondContact O-N 2.98Å; R154-Q157 PolarHBondContact O-N 3.13Å; R154-A158 WeakPolarHBondContact O-CB 3.48Å; R154-A158 PolarHBondContact O-N 3.03Å; R154-E192 IonicContact CZ-OE2 2.79Å; R154-E192 VanDerWaalsContact CZ-OE2 3.25Å; R154-E192 IonicContact NH1-OE1 3.58Å; R154-E192 IonicContact NH1-OE2 3.7Å; R154-E192 PolarHBondContact NH1-OE2 3.32Å; R154-E192 IonicContact NH2-OE2 3.07Å; R154-E192 PolarHBondContact NH2-OE2 2.96Å
155T93.8Very high94.1Very high67 Ų6793.6 Ų93.641%0.41147%0.465SS..Hα-helixtrans-59.9-48.6175.8-590000111.4R151 L152 Q157 A158 F159R151-T155 WeakPolarHBondContact O-CB 3.38Å; R151-T155 PolarHBondContact O-N 3.06Å; R151-T155 PolarHBondContact O-OG1 3.31Å; L152-T155 PolarHBondContact O-N 3.37Å; T155-Q157 PolarHBondContact O-N 2.95Å; T155-A158 PolarHBondContact O-N 3.38Å; T155-F159 HydrophobicContact CG2-CD2 3.85Å; T155-F159 HydrophobicContact CG2-CE2 3.61Å; T155-F159 WeakPolarHBondContact O-CD2 3.37Å; T155-F159 PolarHBondContact O-N 2.93Å
156F95.1Very high94.1Very high134 Ų13491.5 Ų91.559%0.58846%0.464SS*.Hα-helixtrans-59.8-47.7177.9173.5-99.1000111.9L152 R153 A158 F159 H160L152-F156 WeakPolarHBondContact O-CB 3.1Å; L152-F156 PolarHBondContact O-N 3.41Å; R153-F156 PolarHBondContact O-N 3.45Å; F156-A158 VanDerWaalsContact C-N 3.33Å; F156-A158 PolarHBondContact O-N 2.93Å; F156-F159 PolarHBondContact O-N 3.36Å; F156-H160 HydrophobicContact CE1-CB 4.18Å; F156-H160 HydrophobicContact CE2-CB 4.42Å; F156-H160 HydrophobicContact CZ-CB 4.12Å; F156-H160 AromaticContact CZ-CD2 3.7Å; F156-H160 WeakPolarHBondContact O-CB 3.3Å; F156-H160 PolarHBondContact O-N 2.94Å
157Q95.4Very high94.1Very high126 Ų12687.5 Ų87.559%0.58946%0.461SS*.Hα-helixtrans-60.5-41.6179.6-74.6173.5-8.400112.2R153 R154 T155 S161R153-Q157 WeakPolarHBondContact O-CB 3.38Å; R153-Q157 VanDerWaalsContact O-CG 3.28Å; R153-Q157 WeakPolarHBondContact O-CG 3.42Å; R153-Q157 PolarHBondContact O-N 2.91Å; R154-Q157 PolarHBondContact O-N 3.13Å; T155-Q157 PolarHBondContact O-N 2.95Å; Q157-S161 VanDerWaalsContact O-CB 3.24Å; Q157-S161 WeakPolarHBondContact O-CB 3.4Å; Q157-S161 PolarHBondContact O-N 3.5Å; Q157-S161 PolarHBondContact O-OG 2.86Å
158A94.9Very high94.2Very high22 Ų2284.6 Ų84.618%0.18246%0.458CS..Hα-helixtrans-58.5-53.8177.900000111.3R154 T155 F156 S161 L185R154-A158 WeakPolarHBondContact O-CB 3.48Å; R154-A158 PolarHBondContact O-N 3.03Å; T155-A158 PolarHBondContact O-N 3.38Å; F156-A158 VanDerWaalsContact C-N 3.33Å; F156-A158 PolarHBondContact O-N 2.93Å; A158-S161 PolarHBondContact O-N 3.49Å; A158-S161 PolarHBondContact O-OG 3.22Å; A158-L185 HydrophobicContact CB-CD1 4.34Å
159F95.7Very high94.2Very high110 Ų11087 Ų8748%0.48247%0.471SS..Hα-helixtrans-68.5-42-179.8-70.1-64.2000113T155 F156 S161 V162 A163 L182T155-F159 HydrophobicContact CG2-CD2 3.85Å; T155-F159 HydrophobicContact CG2-CE2 3.61Å; T155-F159 WeakPolarHBondContact O-CD2 3.37Å; T155-F159 PolarHBondContact O-N 2.93Å; F156-F159 PolarHBondContact O-N 3.36Å; F159-S161 VanDerWaalsContact C-N 3.28Å; F159-S161 PolarHBondContact O-N 3.37Å; F159-V162 VanDerWaalsContact O-CG2 3.32Å; F159-V162 WeakPolarHBondContact O-CG2 3.43Å; F159-V162 PolarHBondContact O-N 2.94Å; F159-A163 PolarHBondContact O-N 3.09Å; F159-A163 VanDerWaalsContact O-N 3.15Å; F159-L182 HydrophobicContact CD1-CD1 4.12Å; F159-L182 HydrophobicContact CD1-CD2 4.18Å; F159-L182 HydrophobicContact CE1-CD1 4.18Å; F159-L182 HydrophobicContact CE1-CD2 4.08Å
160H97Very high94Very high120 Ų12085.8 Ų85.856%0.55647%0.469SS*.Hα-helixtrans-63.4-35.2179.7-173.2-84.1000111.9F156 V162 A163F156-H160 HydrophobicContact CE1-CB 4.18Å; F156-H160 HydrophobicContact CE2-CB 4.42Å; F156-H160 HydrophobicContact CZ-CB 4.12Å; F156-H160 AromaticContact CZ-CD2 3.7Å; F156-H160 WeakPolarHBondContact O-CB 3.3Å; F156-H160 PolarHBondContact O-N 2.94Å; H160-V162 PolarHBondContact O-N 3.12Å; H160-V162 VanDerWaalsContact O-N 3.16Å; H160-A163 WeakPolarHBondContact O-CB 3.28Å; H160-A163 PolarHBondContact O-N 3.19Å
161S96.9Very high94.1Very high52 Ų5289.4 Ų89.436%0.36448%0.48SS..Hα-helixtrans-63.4-20.1179.875.90000114.5Q157 A158 F159Q157-S161 VanDerWaalsContact O-CB 3.24Å; Q157-S161 WeakPolarHBondContact O-CB 3.4Å; Q157-S161 PolarHBondContact O-N 3.5Å; Q157-S161 PolarHBondContact O-OG 2.86Å; A158-S161 PolarHBondContact O-N 3.49Å; A158-S161 PolarHBondContact O-OG 3.22Å; F159-S161 VanDerWaalsContact C-N 3.28Å; F159-S161 PolarHBondContact O-N 3.37Å
162V96.8Very high94.1Very high18 Ų1893 Ų9311%0.10950%0.501CS..THydrogen-bonded Turntrans-114.93.4178.2-63.60000112.7F159 H160 R178 R181 L182F159-V162 VanDerWaalsContact O-CG2 3.32Å; F159-V162 WeakPolarHBondContact O-CG2 3.43Å; F159-V162 PolarHBondContact O-N 2.94Å; H160-V162 PolarHBondContact O-N 3.12Å; H160-V162 VanDerWaalsContact O-N 3.16Å; V162-R178 HydrophobicContact CB-CB 4.26Å; V162-R178 WeakPolarHBondContact O-CD 3.3Å; V162-R178 PolarHBondContact O-NH1 3.14Å; V162-R181 HydrophobicContact CG1-CB 4.41Å; V162-R181 HydrophobicContact CG1-CG 4.3Å; V162-L182 HydrophobicContact CG1-CB 4.48Å; V162-L182 HydrophobicContact CG2-CB 4.25Å; V162-L182 HydrophobicContact CG2-CD1 4.25Å; V162-L182 HydrophobicContact CG2-CD2 4.29Å; V162-L182 HydrophobicContact CG2-CG 4.5Å
163A95.3Very high93.8Very high54 Ų5495.2 Ų95.245%0.44651%0.508SS..  trans-72.5148.6-175.400000112.8F159 H160 R178F159-A163 PolarHBondContact O-N 3.09Å; F159-A163 VanDerWaalsContact O-N 3.15Å; H160-A163 WeakPolarHBondContact O-CB 3.28Å; H160-A163 PolarHBondContact O-N 3.19Å; A163-R178 PolarHBondContact O-NH1 3.3Å
164F94.3Very high93.6Very high57 Ų5792.6 Ų92.625%0.2550%0.503CS..  trans-97.6154.8166.4-68.5-77.9000110.4S166 P169 C170 D175 R178F164-S166 WeakPolarHBondContact CB-O 3.3Å; F164-S166 PolarHBondContact O-N 3.12Å; F164-P169 HydrophobicContact CD1-CB 3.71Å; F164-P169 HydrophobicContact CD1-CG 3.81Å; F164-P169 HydrophobicContact CE1-CB 3.62Å; F164-P169 HydrophobicContact CE1-CG 4.2Å; F164-P169 HydrophobicContact CG-CB 4.24Å; F164-P169 HydrophobicContact CG-CG 4.3Å; F164-P169 HydrophobicContact CZ-CB 4.09Å; F164-C170 HydrophobicContact CD2-CB 4.47Å; F164-C170 HydrophobicContact CE2-CB 4.1Å; F164-D175 HydrophobicContact CE2-CB 4.22Å; F164-D175 HydrophobicContact CZ-CB 3.85Å; F164-R178 VanDerWaalsContact CZ-CZ 3.49Å
165P94.3Very high93.7Very high141 Ų14190 Ų9092%0.91650%0.497SS*.SBendtrans-62.7-26.9172.3-22.133.8000113.5
166S94.2Very high93.8Very high74 Ų7491.7 Ų91.752%0.51750%0.501SS..SBendtrans-150167.9174.770.30000109.6F164 G168 P169F164-S166 WeakPolarHBondContact CB-O 3.3Å; F164-S166 PolarHBondContact O-N 3.12Å; S166-G168 PolarHBondContact O-N 3.46Å; S166-P169 WeakPolarHBondContact O-CD 3.29Å
167C93.1Very high93.8Very high84 Ų8493.2 Ų93.257%0.56851%0.51SS*.SBendtrans-74.7-8.6177.9580000114.2C170 L171C167-C170 CarbonylContact O-C 3.6Å; C167-C170 PolarHBondContact O-N 2.9Å; C167-C170 PolarHBondContact O-SG 3.09Å; C167-L171 WeakPolarHBondContact O-CG 3.32Å; C167-L171 PolarHBondContact O-N 3.26Å
168G93.6Very high93.8Very high40 Ų4091 Ų9141%0.41250%0.496SS..G310 helixtrans-48.9-50.5-17600000114.6S166 C170 L171S166-G168 PolarHBondContact O-N 3.46Å; G168-C170 PolarHBondContact O-N 3.05Å; G168-C170 VanDerWaalsContact O-N 3.08Å; G168-L171 PolarHBondContact O-N 2.87Å
169P91.4Very high93.9Very high81 Ų8191.1 Ų91.153%0.52650%0.496SS..G310 helixtrans-61.2-14.6179.4-25.836.5000115.8F164 S166F164-P169 HydrophobicContact CD1-CB 3.71Å; F164-P169 HydrophobicContact CD1-CG 3.81Å; F164-P169 HydrophobicContact CE1-CB 3.62Å; F164-P169 HydrophobicContact CE1-CG 4.2Å; F164-P169 HydrophobicContact CG-CB 4.24Å; F164-P169 HydrophobicContact CG-CG 4.3Å; F164-P169 HydrophobicContact CZ-CB 4.09Å; S166-P169 WeakPolarHBondContact O-CD 3.29Å
170C91.4Very high94Very high52 Ų5289 Ų8935%0.35149%0.492SS..G310 helixtrans-124.420.8-177.763.10000113.7F164 C167 G168 Q173F164-C170 HydrophobicContact CD2-CB 4.47Å; F164-C170 HydrophobicContact CE2-CB 4.1Å; C167-C170 CarbonylContact O-C 3.6Å; C167-C170 PolarHBondContact O-N 2.9Å; C167-C170 PolarHBondContact O-SG 3.09Å; G168-C170 PolarHBondContact O-N 3.05Å; G168-C170 VanDerWaalsContact O-N 3.08Å; C170-Q173 WeakPolarHBondContact CA-O 3.44Å
171L92.3Very high94Very high131 Ų13190.1 Ų90.169%0.68649%0.491SS*.SBendtrans-73.8-37.5177.9-75.1177.2000113.5C167 G168C167-L171 WeakPolarHBondContact O-CG 3.32Å; C167-L171 PolarHBondContact O-N 3.26Å; G168-L171 PolarHBondContact O-N 2.87Å
172E90.8Very high94Very high194 Ų19489.5 Ų89.591%0.90748%0.483SS*.SBendtrans-88.7-46.6-178.3-68.1-174.4174.200112
173Q89.3Confident94Very high165 Ų16594.2 Ų94.277%0.77150%0.502SS*.SBendtrans-142.7148.9177.5-63.6-171.1-300110C170C170-Q173 WeakPolarHBondContact CA-O 3.44Å
174Q88.1Confident94.1Very high113 Ų11395.3 Ų95.353%0.52850%0.501SS..  trans-70.9146.4172.867.6-174.4-2.100110.5E176Q174-E176 WeakPolarHBondContact CG-OE1 3.32Å; Q174-E176 PolarHBondContact NE2-OE1 2.53Å; Q174-E176 PolarHBondContact O-N 3.28Å
175D94.1Very high94.1Very high54 Ų5495.2 Ų95.229%0.28950%0.503SS..  trans-74.6103.1171.1-177.5-36.7000108.8F164 E177 R178 S179F164-D175 HydrophobicContact CE2-CB 4.22Å; F164-D175 HydrophobicContact CZ-CB 3.85Å; D175-E177 VanDerWaalsContact C-N 3.26Å; D175-E177 PolarHBondContact O-N 2.92Å; D175-E177 PolarHBondContact OD1-N 2.82Å; D175-E177 VanDerWaalsContact OD1-N 3.16Å; D175-R178 HydrophobicContact CB-CB 4.09Å; D175-R178 HydrophobicContact CB-CG 4.21Å; D175-R178 PolarHBondContact O-N 3.45Å; D175-R178 PolarHBondContact OD1-N 2.9Å; D175-R178 VanDerWaalsContact OD2-CD 3.26Å; D175-R178 WeakPolarHBondContact OD2-CD 3.45Å; D175-R178 IonicContact OD2-NE 2.7Å; D175-R178 PolarHBondContact OD2-NE 3.3Å; D175-S179 VanDerWaalsContact O-CB 3.3Å; D175-S179 WeakPolarHBondContact O-CB 3.47Å; D175-S179 PolarHBondContact O-N 3.46Å
176E95.4Very high94.1Very high104 Ų10492.1 Ų92.149%0.48648%0.478SS..Hα-helixtrans-63-30.9-175.7-71.7-60.9161.700112.7Q174 T180Q174-E176 WeakPolarHBondContact CG-OE1 3.32Å; Q174-E176 PolarHBondContact NE2-OE1 2.53Å; Q174-E176 PolarHBondContact O-N 3.28Å; E176-T180 VanDerWaalsContact O-CB 3.24Å; E176-T180 WeakPolarHBondContact O-CB 3.5Å; E176-T180 PolarHBondContact O-N 2.81Å; E176-T180 PolarHBondContact O-OG1 3.1Å
177E95.2Very high94.1Very high166 Ų16690 Ų9078%0.77647%0.467SS*.Hα-helixtrans-68.5-47.7176.7-64.1-175.217800110.6D175 S179 T180 R181D175-E177 VanDerWaalsContact C-N 3.26Å; D175-E177 PolarHBondContact O-N 2.92Å; D175-E177 PolarHBondContact OD1-N 2.82Å; D175-E177 VanDerWaalsContact OD1-N 3.16Å; E177-S179 VanDerWaalsContact C-N 3.34Å; E177-S179 PolarHBondContact O-N 3.26Å; E177-T180 PolarHBondContact O-N 3.13Å; E177-R181 VanDerWaalsContact O-CB 3.31Å; E177-R181 WeakPolarHBondContact O-CB 3.39Å; E177-R181 PolarHBondContact O-N 3.43Å
178R95.6Very high94.1Very high80 Ų8092.9 Ų92.930%0.30247%0.466SS..Hα-helixtrans-64-39.8175.9-70.6178.1-175.6-127.41.4112.1V162 A163 F164 D175 L182V162-R178 HydrophobicContact CB-CB 4.26Å; V162-R178 WeakPolarHBondContact O-CD 3.3Å; V162-R178 PolarHBondContact O-NH1 3.14Å; A163-R178 PolarHBondContact O-NH1 3.3Å; F164-R178 VanDerWaalsContact CZ-CZ 3.49Å; D175-R178 HydrophobicContact CB-CB 4.09Å; D175-R178 HydrophobicContact CB-CG 4.21Å; D175-R178 PolarHBondContact O-N 3.45Å; D175-R178 PolarHBondContact OD1-N 2.9Å; D175-R178 VanDerWaalsContact OD2-CD 3.26Å; D175-R178 WeakPolarHBondContact OD2-CD 3.45Å; D175-R178 IonicContact OD2-NE 2.7Å; D175-R178 PolarHBondContact OD2-NE 3.3Å; R178-L182 WeakPolarHBondContact O-CB 3.43Å; R178-L182 PolarHBondContact O-N 3.35Å
179S97.5Very high93.9Very high24 Ų2495 Ų9517%0.16846%0.462CS..Hα-helixtrans-61.3-49.2176-174.90000111.2D175 E177 L182 K183D175-S179 VanDerWaalsContact O-CB 3.3Å; D175-S179 WeakPolarHBondContact O-CB 3.47Å; D175-S179 PolarHBondContact O-N 3.46Å; E177-S179 VanDerWaalsContact C-N 3.34Å; E177-S179 PolarHBondContact O-N 3.26Å; S179-L182 PolarHBondContact O-N 3.19Å; S179-K183 VanDerWaalsContact O-CG 3.28Å; S179-K183 WeakPolarHBondContact O-CG 3.36Å; S179-K183 PolarHBondContact O-N 3.35Å; S179-K183 WeakPolarHBondContact OG-CE 3.39Å; S179-K183 PolarHBondContact OG-NZ 3.13Å
180T97.4Very high93.8Very high66 Ų6698.8 Ų98.841%0.40547%0.471SS..Hα-helixtrans-63-45.6178.1-57.40000110.9E176 E177 L182 K183 D184E176-T180 VanDerWaalsContact O-CB 3.24Å; E176-T180 WeakPolarHBondContact O-CB 3.5Å; E176-T180 PolarHBondContact O-N 2.81Å; E176-T180 PolarHBondContact O-OG1 3.1Å; E177-T180 PolarHBondContact O-N 3.13Å; T180-L182 VanDerWaalsContact C-N 3.34Å; T180-L182 PolarHBondContact O-N 2.98Å; T180-K183 PolarHBondContact O-N 3.4Å; T180-D184 VanDerWaalsContact O-CG 3.27Å; T180-D184 PolarHBondContact O-N 3.21Å
181R96.9Very high93.8Very high143 Ų143103.7 Ų103.754%0.5449%0.489SS..Hα-helixtrans-59.1-42176.8-175.8175.8179.3-178.90.3112.8V162 E177 L185V162-R181 HydrophobicContact CG1-CB 4.41Å; V162-R181 HydrophobicContact CG1-CG 4.3Å; E177-R181 VanDerWaalsContact O-CB 3.31Å; E177-R181 WeakPolarHBondContact O-CB 3.39Å; E177-R181 PolarHBondContact O-N 3.43Å; R181-L185 WeakPolarHBondContact O-CG 3.2Å; R181-L185 PolarHBondContact O-N 2.89Å
182L97.4Very high93.4Very high38 Ų38101 Ų10120%0.19947%0.473CS..Hα-helixtrans-66.8-43.7176.7-178.760.6000111.4F159 V162 R178 S179 T180 D184 L185 L186F159-L182 HydrophobicContact CD1-CD1 4.12Å; F159-L182 HydrophobicContact CD1-CD2 4.18Å; F159-L182 HydrophobicContact CE1-CD1 4.18Å; F159-L182 HydrophobicContact CE1-CD2 4.08Å; V162-L182 HydrophobicContact CG1-CB 4.48Å; V162-L182 HydrophobicContact CG2-CB 4.25Å; V162-L182 HydrophobicContact CG2-CD1 4.25Å; V162-L182 HydrophobicContact CG2-CD2 4.29Å; V162-L182 HydrophobicContact CG2-CG 4.5Å; R178-L182 WeakPolarHBondContact O-CB 3.43Å; R178-L182 PolarHBondContact O-N 3.35Å; S179-L182 PolarHBondContact O-N 3.19Å; T180-L182 VanDerWaalsContact C-N 3.34Å; T180-L182 PolarHBondContact O-N 2.98Å; L182-D184 VanDerWaalsContact C-N 3.3Å; L182-D184 PolarHBondContact O-N 2.76Å; L182-L185 PolarHBondContact O-N 3.17Å; L182-L186 HydrophobicContact CG-CD1 4.35Å; L182-L186 WeakPolarHBondContact O-CG 3.08Å; L182-L186 PolarHBondContact O-N 3.01Å
183K97.2Very high91.9Very high117 Ų11799.1 Ų99.151%0.50946%0.464SS..Hα-helixtrans-58.5-43.1175.8-71.1166-173165.30111.3S179 T180 L185 L186 G187S179-K183 VanDerWaalsContact O-CG 3.28Å; S179-K183 WeakPolarHBondContact O-CG 3.36Å; S179-K183 PolarHBondContact O-N 3.35Å; S179-K183 WeakPolarHBondContact OG-CE 3.39Å; S179-K183 PolarHBondContact OG-NZ 3.13Å; T180-K183 PolarHBondContact O-N 3.4Å; K183-L185 PolarHBondContact O-N 3.18Å; K183-L186 PolarHBondContact O-N 3.04Å; K183-G187 PolarHBondContact O-N 3.24Å
184D95.9Very high90.2Very high77 Ų77100.6 Ų100.641%0.41247%0.471SS..Hα-helixtrans-64.9-39177.2-67-10.3000112.6T180 L182 L186 G187 R188T180-D184 VanDerWaalsContact O-CG 3.27Å; T180-D184 PolarHBondContact O-N 3.21Å; L182-D184 VanDerWaalsContact C-N 3.3Å; L182-D184 PolarHBondContact O-N 2.76Å; D184-L186 VanDerWaalsContact C-N 3.32Å; D184-G187 PolarHBondContact O-N 3.42Å; D184-R188 WeakPolarHBondContact O-CB 3.4Å; D184-R188 WeakPolarHBondContact O-CG 3.43Å; D184-R188 PolarHBondContact O-N 3.16Å; D184-R188 PolarHBondContact O-NE 3.1Å
185L95.1Very high88.3Confident55 Ų5598.6 Ų98.629%0.28848%0.48SS..Hα-helixtrans-63.1-40.2175.1-76.8173.1000111.6A158 R181 L182 K183 Y189A158-L185 HydrophobicContact CB-CD1 4.34Å; R181-L185 WeakPolarHBondContact O-CG 3.2Å; R181-L185 PolarHBondContact O-N 2.89Å; L182-L185 PolarHBondContact O-N 3.17Å; K183-L185 PolarHBondContact O-N 3.18Å; L185-Y189 WeakPolarHBondContact O-CB 3.44Å; L185-Y189 PolarHBondContact O-N 3.25Å; L185-Y189 VanDerWaalsContact O-N 3.16Å
186L95.1Very high85.9Confident77 Ų77102.5 Ų102.540%0.40350%0.497SS..Hα-helixtrans-70-44.3176.9-66.2174.2000111.4L182 K183 D184 R188 Y189 F190L182-L186 HydrophobicContact CG-CD1 4.35Å; L182-L186 WeakPolarHBondContact O-CG 3.08Å; L182-L186 PolarHBondContact O-N 3.01Å; K183-L186 PolarHBondContact O-N 3.04Å; D184-L186 VanDerWaalsContact C-N 3.32Å; L186-R188 PolarHBondContact O-N 3.02Å; L186-Y189 WeakPolarHBondContact O-CB 3.13Å; L186-Y189 PolarHBondContact O-N 3.09Å; L186-F190 WeakPolarHBondContact O-CD2 3.45Å; L186-F190 PolarHBondContact O-N 3.36Å
187G93.3Very high83.4Confident28 Ų28106.1 Ų106.129%0.28951%0.514SS..Hα-helixtrans-55.3-53.5176.300000111.2K183 D184 Y189 F190 E191K183-G187 PolarHBondContact O-N 3.24Å; D184-G187 PolarHBondContact O-N 3.42Å; G187-Y189 VanDerWaalsContact C-N 3.28Å; G187-Y189 PolarHBondContact O-N 3.48Å; G187-F190 PolarHBondContact O-N 2.9Å; G187-F190 VanDerWaalsContact O-N 3.13Å; G187-E191 WeakPolarHBondContact O-CG 3.46Å; G187-E191 PolarHBondContact O-N 3.02Å
188R92.6Very high80.9Confident145 Ų145103.3 Ų103.355%0.54751%0.51SS..Hα-helixtrans-58.6-36.4177.5-72.7-179.8-117.4168.8-7113.6D184 L186 F190 E191 E192D184-R188 WeakPolarHBondContact O-CB 3.4Å; D184-R188 WeakPolarHBondContact O-CG 3.43Å; D184-R188 PolarHBondContact O-N 3.16Å; D184-R188 PolarHBondContact O-NE 3.1Å; L186-R188 PolarHBondContact O-N 3.02Å; R188-F190 VanDerWaalsContact C-N 3.34Å; R188-F190 PolarHBondContact O-N 3.14Å; R188-E191 PolarHBondContact O-N 3.27Å; R188-E192 WeakPolarHBondContact O-CB 3.12Å; R188-E192 PolarHBondContact O-N 2.95Å; R188-E192 VanDerWaalsContact O-N 3.16Å
189Y90.8Very high78.1Confident84 Ų84103.1 Ų103.133%0.32953%0.533SS..Hα-helixtrans-63.6-37.8178.6171.4-92.1000112.7L185 L186 G187L185-Y189 WeakPolarHBondContact O-CB 3.44Å; L185-Y189 PolarHBondContact O-N 3.25Å; L185-Y189 VanDerWaalsContact O-N 3.16Å; L186-Y189 WeakPolarHBondContact O-CB 3.13Å; L186-Y189 PolarHBondContact O-N 3.09Å; G187-Y189 VanDerWaalsContact C-N 3.28Å; G187-Y189 PolarHBondContact O-N 3.48Å
190F89.4Confident75.1Confident162 Ų162105.2 Ų105.271%0.71156%0.559SS**Hα-helixtrans-88.2-17.6-179.9-69.8-71.6000113.6L186 G187 R188L186-F190 WeakPolarHBondContact O-CD2 3.45Å; L186-F190 PolarHBondContact O-N 3.36Å; G187-F190 PolarHBondContact O-N 2.9Å; G187-F190 VanDerWaalsContact O-N 3.13Å; R188-F190 VanDerWaalsContact C-N 3.34Å; R188-F190 PolarHBondContact O-N 3.14Å
191E89.9Confident71.9Confident155 Ų155110.6 Ų110.672%0.72458%0.581SS**Hα-helixtrans-82.7-18.3172.9-70.7168.2-176.400112.9G187 R188 E193G187-E191 WeakPolarHBondContact O-CG 3.46Å; G187-E191 PolarHBondContact O-N 3.02Å; R188-E191 PolarHBondContact O-N 3.27Å; E191-E193 PolarHBondContact O-N 3.04Å
192E83.8Confident69Low74 Ų74112.1 Ų112.135%0.34660%0.595SS.*SBendtrans-71.4118.8175.1-162.6173.9-171.700109.7R154 R188 E194R154-E192 IonicContact CZ-OE2 2.79Å; R154-E192 VanDerWaalsContact CZ-OE2 3.25Å; R154-E192 IonicContact NH1-OE1 3.58Å; R154-E192 IonicContact NH1-OE2 3.7Å; R154-E192 PolarHBondContact NH1-OE2 3.32Å; R154-E192 IonicContact NH2-OE2 3.07Å; R154-E192 PolarHBondContact NH2-OE2 2.96Å; R188-E192 WeakPolarHBondContact O-CB 3.12Å; R188-E192 PolarHBondContact O-N 2.95Å; R188-E192 VanDerWaalsContact O-N 3.16Å; E192-E194 PolarHBondContact O-N 3.48Å
193E60.7Low66Low154 Ų154115.8 Ų115.872%0.7261%0.614SS**  trans-64.6129.2178.2-72.8-167.5162.200110.9E191 G195 Q196E191-E193 PolarHBondContact O-N 3.04Å; E193-G195 PolarHBondContact O-N 3.3Å; E193-Q196 PolarHBondContact O-N 2.68Å
194E53.6Low63Low196 Ų196115.2 Ų115.292%0.91663%0.632SS**THydrogen-bonded Turntrans-6577.5172.9-72.1-169.3151.100110.5E192E192-E194 PolarHBondContact O-N 3.48Å
195G48.1Very low60.3Low71 Ų71115.9 Ų115.973%0.73263%0.632SS**THydrogen-bonded Turntrans173.9-18.9-176.700000114.2E193 E197E193-G195 PolarHBondContact O-N 3.3Å; G195-E197 VanDerWaalsContact C-N 3.28Å; G195-E197 PolarHBondContact O-N 2.94Å
196Q43.4Very low57.5Low137 Ų137116.1 Ų116.164%0.6465%0.647SS**  trans-7590160.4-73.2176.5-4.100107.3E193E193-Q196 PolarHBondContact O-N 2.68Å
197E42.1Very low54.5Low179 Ų179117.2 Ų117.284%0.83666%0.66SS**  trans-48.3127.8154.5-68.8-144.3155.300106.3G195 G199G195-E197 VanDerWaalsContact C-N 3.28Å; G195-E197 PolarHBondContact O-N 2.94Å; E197-G199 VanDerWaalsContact C-N 3.27Å; E197-G199 PolarHBondContact O-N 3.23Å
198P43.3Very low51.8Low108 Ų108121 Ų12170%0.70167%0.67SS**  trans-58.5100.1178.518.6-27.1000107.6G200P198-G200 PolarHBondContact O-N 2.92Å; P198-G200 VanDerWaalsContact O-N 3.09Å
199G36.9Very low49.2Very low75 Ų75120.2 Ų120.277%0.77368%0.683SS**THydrogen-bonded Turntrans-56.2117.7175.500000107.6E197 M201E197-G199 VanDerWaalsContact C-N 3.27Å; E197-G199 PolarHBondContact O-N 3.23Å; G199-M201 PolarHBondContact O-N 3.2Å
200G34.1Very low46.9Very low69 Ų69117.4 Ų117.471%0.71168%0.68SS**THydrogen-bonded Turntrans5946.5160.700000115.7P198 E202P198-G200 PolarHBondContact O-N 2.92Å; P198-G200 VanDerWaalsContact O-N 3.09Å; G200-E202 PolarHBondContact O-N 3.05Å
201M31.1Very low44.6Very low178 Ų178115.5 Ų115.588%0.87767%0.673SS**  trans-83.977.5136.7-74.9-166.6-17400106.5G199 D203G199-M201 PolarHBondContact O-N 3.2Å; M201-D203 PolarHBondContact O-N 3.31Å
202E34.8Very low42.2Very low176 Ų176112 Ų11282%0.82267%0.671SS**  trans-41.2111.9151.9-72.3-179.2156.700106.5G200 A204G200-E202 PolarHBondContact O-N 3.05Å; E202-A204 PolarHBondContact O-N 3.36Å
203D34.8Very low40.5Very low114 Ų114117 Ų11761%0.6169%0.687SS**  trans7.873.6140.3-64.8-34.7000114.7M201 Q205M201-D203 PolarHBondContact O-N 3.31Å; D203-Q205 HydrophobicContact CB-CB 4.05Å; D203-Q205 HydrophobicContact CB-CG 3.63Å; D203-Q205 PolarHBondContact O-N 3.38Å; D203-Q205 VanDerWaalsContact OD1-CD 3.28Å; D203-Q205 WeakPolarHBondContact OD1-CG 3.36Å; D203-Q205 PolarHBondContact OD1-NE2 2.89Å; D203-Q205 PolarHBondContact OD2-NE2 3.38Å; D203-Q205 VanDerWaalsContact OD2-NE2 3.15Å
204A33.8Very low39.9Very low106 Ų106113.9 Ų113.988%0.87668%0.678SS**  trans-70.351.2136.100000107.8E202 G206E202-A204 PolarHBondContact O-N 3.36Å; A204-G206 VanDerWaalsContact C-N 3.31Å; A204-G206 PolarHBondContact O-N 3.34Å
205Q39.6Very low39.6Very low91 Ų91107.7 Ų107.743%0.42566%0.657SS.*  trans-65.499.6161-76.2174.710.600104.5D203 E208D203-Q205 HydrophobicContact CB-CB 4.05Å; D203-Q205 HydrophobicContact CB-CG 3.63Å; D203-Q205 PolarHBondContact O-N 3.38Å; D203-Q205 VanDerWaalsContact OD1-CD 3.28Å; D203-Q205 WeakPolarHBondContact OD1-CG 3.36Å; D203-Q205 PolarHBondContact OD1-NE2 2.89Å; D203-Q205 PolarHBondContact OD2-NE2 3.38Å; D203-Q205 VanDerWaalsContact OD2-NE2 3.15Å; Q205-E208 HydrophobicContact CG-CG 4.22Å
206G35.8Very low39.8Very low59 Ų59106.5 Ų106.561%0.60864%0.64SS**  trans-47.4139.414400000107.1A204 E208A204-G206 VanDerWaalsContact C-N 3.31Å; A204-G206 PolarHBondContact O-N 3.34Å; G206-E208 PolarHBondContact O-N 2.79Å
207P33.5Very low40.3Very low101 Ų101101.9 Ų101.966%0.65662%0.619SS**  trans-47.4113.1-161.618.3-31.8000110
208E35.8Very low41.2Very low108 Ų10899.5 Ų99.551%0.50561%0.608SS.*  trans-48.4137.9170.5-81.9-103.513400107.1Q205 G206 G210 Q211Q205-E208 HydrophobicContact CG-CG 4.22Å; G206-E208 PolarHBondContact O-N 2.79Å; E208-G210 PolarHBondContact O-N 2.99Å; E208-Q211 PolarHBondContact O-N 3.33Å
209P38.6Very low42.7Very low128 Ų128100.6 Ų100.683%0.83161%0.608SS**THydrogen-bonded Turntrans-67.128177.227-31.9000113.4
210G42.2Very low44.8Very low25 Ų25102.3 Ų102.326%0.25859%0.591SS.*THydrogen-bonded Turntrans-119.3-11.7174.700000114.7E208 A212 R213 V214E208-G210 PolarHBondContact O-N 2.99Å; G210-A212 PolarHBondContact O-N 3.24Å; G210-R213 WeakPolarHBondContact O-CA 3.5Å; G210-R213 WeakPolarHBondContact O-CB 3.46Å; G210-R213 PolarHBondContact O-N 3.22Å; G210-V214 PolarHBondContact O-N 3.01Å
211Q40.8Very low47.5Very low121 Ų121102.3 Ų102.357%0.56557%0.573SS**Hα-helixtrans-64.4-26.8177.3-82.3166.8-6.300112.9E208 R213E208-Q211 PolarHBondContact O-N 3.33Å; Q211-R213 VanDerWaalsContact C-N 3.3Å; Q211-R213 PolarHBondContact O-N 3.34Å
212A40.5Very low50.3Low83 Ų83100 Ų10069%0.68656%0.564SS**Hα-helixtrans-74.2-14.516900000114.2G210 S215G210-A212 PolarHBondContact O-N 3.24Å; A212-S215 PolarHBondContact O-OG 3.01Å
213R47.1Very low53.1Low178 Ų17895.9 Ų95.967%0.67254%0.544SS*.Hα-helixtrans-90.6-25.6176.8-72.7176.5139.1-177.6-5.2112.9G210 Q211 A216 L217G210-R213 WeakPolarHBondContact O-CA 3.5Å; G210-R213 WeakPolarHBondContact O-CB 3.46Å; G210-R213 PolarHBondContact O-N 3.22Å; Q211-R213 VanDerWaalsContact C-N 3.3Å; Q211-R213 PolarHBondContact O-N 3.34Å; R213-A216 PolarHBondContact O-N 2.9Å; R213-L217 PolarHBondContact O-N 2.99Å; R213-L217 VanDerWaalsContact O-N 3.17Å
214V47.8Very low55.9Low88 Ų8890.4 Ų90.453%0.53352%0.515SS..Hα-helixtrans-66.1-39.7179.5178.90000111.4G210 A216 L217G210-V214 PolarHBondContact O-N 3.01Å; V214-A216 VanDerWaalsContact C-N 3.33Å; V214-A216 PolarHBondContact O-N 3.08Å; V214-L217 PolarHBondContact O-N 3.47Å
215S48.5Very low58.8Low67 Ų6787.1 Ų87.147%0.46948%0.48SS..Hα-helixtrans-65.6-34.117449.40000113A212 L217A212-S215 PolarHBondContact O-OG 3.01Å; S215-L217 VanDerWaalsContact C-N 3.3Å; S215-L217 PolarHBondContact O-N 2.84Å
216A51.4Low61.4Low46 Ų4686 Ų8638%0.3848%0.482SS..Hα-helixtrans-76-14.9176.600000113.5R213 V214 W220R213-A216 PolarHBondContact O-N 2.9Å; V214-A216 VanDerWaalsContact C-N 3.33Å; V214-A216 PolarHBondContact O-N 3.08Å; A216-W220 VanDerWaalsContact O-CD1 3.25Å
217L54.8Low64.3Low39 Ų3983.5 Ų83.520%0.20445%0.454CS..Hα-helixtrans-75.9-44.1175.4-85.6153.7000110.9R213 V214 S215 D219 W220 E221 L275 A279R213-L217 PolarHBondContact O-N 2.99Å; R213-L217 VanDerWaalsContact O-N 3.17Å; V214-L217 PolarHBondContact O-N 3.47Å; S215-L217 VanDerWaalsContact C-N 3.3Å; S215-L217 PolarHBondContact O-N 2.84Å; L217-D219 PolarHBondContact O-N 3.13Å; L217-W220 PolarHBondContact O-N 3.26Å; L217-E221 WeakPolarHBondContact O-CG 3.46Å; L217-E221 PolarHBondContact O-N 3.34Å; L217-E221 VanDerWaalsContact O-N 3.08Å; L217-L275 HydrophobicContact CD2-CD2 4.07Å; L217-A279 HydrophobicContact CD2-CB 3.73Å
218Q61.2Low67.3Low129 Ų12978.8 Ų78.860%0.60342%0.424SS*.Hα-helixtrans-57.5-34.7179.1-81.3169.3-45.800113.1W220Q218-W220 PolarHBondContact O-N 3.2Å
219D73.1Confident70.1Confident131 Ų13179.3 Ų79.370%0.70142%0.421SS*.Hα-helixtrans-65.3-23178.3-67-25.3000113.7L217L217-D219 PolarHBondContact O-N 3.13Å
220W82.8Confident72.8Confident111 Ų11177 Ų7742%0.4240%0.399SS..Hα-helixtrans-111.4-13.5-175.7-68.584.3000113.7A216 L217 Q218 D222 Q223 V224 Y272 L275A216-W220 VanDerWaalsContact O-CD1 3.25Å; L217-W220 PolarHBondContact O-N 3.26Å; Q218-W220 PolarHBondContact O-N 3.2Å; W220-D222 PolarHBondContact O-N 3.18Å; W220-Q223 PolarHBondContact O-N 3.46Å; W220-V224 HydrophobicContact CB-CG2 4.36Å; W220-V224 WeakPolarHBondContact O-CB 3.44Å; W220-V224 WeakPolarHBondContact O-CG2 3.43Å; W220-V224 PolarHBondContact O-N 3.38Å; W220-Y272 AromaticContact CE3-CE1 3.93Å; W220-Y272 HydrophobicContact CE3-CE1 3.93Å; W220-Y272 HydrophobicContact CZ3-CE1 4.39Å; W220-L275 HydrophobicContact CB-CD1 4.25Å
221E89.8Confident75.3Confident69 Ų6975.9 Ų75.932%0.32239%0.387SS..Hα-helixtrans-53.7-52-175.7-85.2175.6-159.800112.7L217 Q223 V224 R225 L283L217-E221 WeakPolarHBondContact O-CG 3.46Å; L217-E221 PolarHBondContact O-N 3.34Å; L217-E221 VanDerWaalsContact O-N 3.08Å; E221-Q223 VanDerWaalsContact C-N 3.33Å; E221-Q223 PolarHBondContact O-N 3.35Å; E221-V224 PolarHBondContact O-N 3.01Å; E221-R225 WeakPolarHBondContact O-CG 3.48Å; E221-R225 PolarHBondContact O-N 2.87Å; E221-L283 HydrophobicContact CG-CD1 4.23Å; E221-L283 HydrophobicContact CG-CD2 4.15Å
222D90.4Very high77.8Confident129 Ų12971 Ų7169%0.6937%0.365SS*.Hα-helixtrans-62.6-40.7-179.2-73.8-30.2000112.2W220 R225 C226W220-D222 PolarHBondContact O-N 3.18Å; D222-R225 PolarHBondContact O-N 2.94Å; D222-C226 WeakPolarHBondContact O-CB 3.45Å; D222-C226 PolarHBondContact O-N 2.87Å
223Q92.8Very high80.3Confident90 Ų9071.2 Ų71.242%0.42136%0.361SS..Hα-helixtrans-65.8-44.2177.9-173.357.863.700110.7W220 E221 R225 C226 D227W220-Q223 PolarHBondContact O-N 3.46Å; E221-Q223 VanDerWaalsContact C-N 3.33Å; E221-Q223 PolarHBondContact O-N 3.35Å; Q223-R225 PolarHBondContact O-N 3.48Å; Q223-C226 PolarHBondContact O-N 2.82Å; Q223-D227 PolarHBondContact NE2-OD2 3.39Å; Q223-D227 WeakPolarHBondContact O-CB 3.47Å; Q223-D227 PolarHBondContact O-N 2.97Å
224V94.3Very high82.5Confident0 Ų066.8 Ų66.80%035%0.35CS..Hα-helixtrans-60.1-46.2176.4172.80000110.6W220 E221 C226 D227 I228 Y272 L275 L280 L283W220-V224 HydrophobicContact CB-CG2 4.36Å; W220-V224 WeakPolarHBondContact O-CB 3.44Å; W220-V224 WeakPolarHBondContact O-CG2 3.43Å; W220-V224 PolarHBondContact O-N 3.38Å; E221-V224 PolarHBondContact O-N 3.01Å; V224-C226 PolarHBondContact O-N 2.93Å; V224-D227 PolarHBondContact O-N 2.93Å; V224-I228 HydrophobicContact CG1-CD1 3.67Å; V224-I228 HydrophobicContact CG1-CG1 4.34Å; V224-I228 VanDerWaalsContact O-CG1 3.23Å; V224-I228 WeakPolarHBondContact O-CG1 3.39Å; V224-I228 PolarHBondContact O-N 3.26Å; V224-Y272 WeakPolarHBondContact CA-OH 3.49Å; V224-Y272 HydrophobicContact CB-CE2 4.2Å; V224-Y272 HydrophobicContact CG1-CE2 4.27Å; V224-Y272 HydrophobicContact CG2-CD1 3.88Å; V224-Y272 HydrophobicContact CG2-CD2 4.03Å; V224-Y272 HydrophobicContact CG2-CE1 3.52Å; V224-Y272 HydrophobicContact CG2-CE2 3.71Å; V224-Y272 HydrophobicContact CG2-CG 4.12Å; V224-Y272 VanDerWaalsContact CG2-CZ 3.42Å; V224-Y272 PolarHBondContact N-OH 2.7Å; V224-L275 HydrophobicContact CG2-CD1 3.66Å; V224-L280 HydrophobicContact CG1-CD2 3.77Å; V224-L280 HydrophobicContact CG2-CD2 4.38Å; V224-L283 HydrophobicContact CB-CD1 3.93Å; V224-L283 HydrophobicContact CG1-CB 4.35Å; V224-L283 HydrophobicContact CG1-CD1 3.56Å; V224-L283 HydrophobicContact CG2-CD1 4.49Å
225R94.9Very high84.5Confident36 Ų3664.6 Ų64.614%0.13633%0.333CS..Hα-helixtrans-60.8-45.9177-70.3175.7-174-78.71.2112.1E221 D222 Q223 D227 I228 R229 L283 E286 E287E221-R225 WeakPolarHBondContact O-CG 3.48Å; E221-R225 PolarHBondContact O-N 2.87Å; D222-R225 PolarHBondContact O-N 2.94Å; Q223-R225 PolarHBondContact O-N 3.48Å; R225-D227 VanDerWaalsContact C-N 3.31Å; R225-D227 PolarHBondContact O-N 3.5Å; R225-I228 PolarHBondContact O-N 3.23Å; R225-R229 WeakPolarHBondContact O-CG 3.44Å; R225-R229 PolarHBondContact O-N 3.44Å; R225-L283 HydrophobicContact CG-CD2 4.28Å; R225-L283 VanDerWaalsContact CZ-CD2 3.41Å; R225-E286 IonicContact CZ-OE2 2.67Å; R225-E286 IonicContact NH1-OE2 2.76Å; R225-E286 PolarHBondContact NH1-OE2 2.93Å; R225-E286 IonicContact NH2-OE1 3.56Å; R225-E286 IonicContact NH2-OE2 3.59Å; R225-E286 PolarHBondContact NH2-OE2 3.2Å; R225-E287 HydrophobicContact CB-CG 4.25Å; R225-E287 VanDerWaalsContact CD-OE1 3.29Å; R225-E287 WeakPolarHBondContact CD-OE1 3.42Å; R225-E287 HydrophobicContact CG-CG 4.14Å; R225-E287 VanDerWaalsContact CG-OE1 3.28Å; R225-E287 WeakPolarHBondContact CG-OE1 3.34Å; R225-E287 IonicContact CZ-OE1 3.13Å; R225-E287 IonicContact NE-OE1 2.87Å; R225-E287 IonicContact NH1-OE1 2.8Å; R225-E287 PolarHBondContact NH1-OE1 2.92Å
226C94.4Very high86.3Confident69 Ų6966.3 Ų66.347%0.46634%0.342SS..Hα-helixtrans-57.9-46.2176.5-172.70000111.2D222 Q223 V224 I228 R229 Q230D222-C226 WeakPolarHBondContact O-CB 3.45Å; D222-C226 PolarHBondContact O-N 2.87Å; Q223-C226 PolarHBondContact O-N 2.82Å; V224-C226 PolarHBondContact O-N 2.93Å; C226-I228 PolarHBondContact O-N 3.14Å; C226-R229 PolarHBondContact O-N 3.37Å; C226-Q230 WeakPolarHBondContact O-CB 3.17Å; C226-Q230 PolarHBondContact O-N 3.25Å
227D95.7Very high87.9Confident5 Ų572.7 Ų72.73%0.02736%0.364CS..Hα-helixtrans-66.6-35.7178.3-76.5-58.3000112.8Q223 V224 R225 Q230 F231 F249 K271 Y272Q223-D227 PolarHBondContact NE2-OD2 3.39Å; Q223-D227 WeakPolarHBondContact O-CB 3.47Å; Q223-D227 PolarHBondContact O-N 2.97Å; V224-D227 PolarHBondContact O-N 2.93Å; R225-D227 VanDerWaalsContact C-N 3.31Å; R225-D227 PolarHBondContact O-N 3.5Å; D227-Q230 PolarHBondContact O-N 2.9Å; D227-F231 VanDerWaalsContact O-CB 3.26Å; D227-F231 WeakPolarHBondContact O-CB 3.37Å; D227-F231 PolarHBondContact O-N 2.91Å; D227-F249 HydrophobicContact CB-CE1 4Å; D227-F249 HydrophobicContact CB-CZ 4.09Å; D227-K271 IonicContact OD1-NZ 3.95Å; D227-K271 PolarHBondContact OD1-NZ 3.27Å; D227-K271 WeakPolarHBondContact OD2-CE 3.48Å; D227-K271 IonicContact OD2-NZ 3.21Å; D227-K271 PolarHBondContact OD2-NZ 2.86Å; D227-Y272 HydrophobicContact CB-CE2 4.35Å; D227-Y272 PolarHBondContact OD2-OH 2.99Å
228I95.7Very high89.5Confident2 Ų274.4 Ų74.41%0.0137%0.371CS..Hα-helixtrans-63.2-47.3172.6-70.8164.6000110.5V224 R225 C226 Q230 F231 L232 V245 F249 L283 A284 E287V224-I228 HydrophobicContact CG1-CD1 3.67Å; V224-I228 HydrophobicContact CG1-CG1 4.34Å; V224-I228 VanDerWaalsContact O-CG1 3.23Å; V224-I228 WeakPolarHBondContact O-CG1 3.39Å; V224-I228 PolarHBondContact O-N 3.26Å; R225-I228 PolarHBondContact O-N 3.23Å; C226-I228 PolarHBondContact O-N 3.14Å; I228-Q230 VanDerWaalsContact C-N 3.32Å; I228-Q230 PolarHBondContact O-N 3.06Å; I228-F231 WeakPolarHBondContact O-CB 3.34Å; I228-F231 PolarHBondContact O-N 3.4Å; I228-L232 HydrophobicContact CG2-CD1 3.96Å; I228-L232 HydrophobicContact CG2-CG 4.42Å; I228-L232 VanDerWaalsContact O-CG 3.31Å; I228-L232 WeakPolarHBondContact O-CG 3.32Å; I228-L232 PolarHBondContact O-N 3.41Å; I228-V245 HydrophobicContact CG1-CG1 3.95Å; I228-V245 HydrophobicContact CG2-CG1 4.14Å; I228-F249 HydrophobicContact CG1-CD2 4.33Å; I228-F249 HydrophobicContact CG1-CE2 3.73Å; I228-F249 HydrophobicContact CG1-CZ 4.2Å; I228-L283 HydrophobicContact CD1-CB 4.17Å; I228-A284 HydrophobicContact CD1-CB 4.15Å; I228-E287 HydrophobicContact CB-CG 4.42Å; I228-E287 HydrophobicContact CG2-CB 3.75Å; I228-E287 HydrophobicContact CG2-CG 4.07Å
229R94.9Very high90.6Very high119 Ų11977.6 Ų77.645%0.44938%0.383SS..Hα-helixtrans-61.2-42.3176-68.4177.1-167.9154.413111.6R225 C226 F231 L232 S233 E287R225-R229 WeakPolarHBondContact O-CG 3.44Å; R225-R229 PolarHBondContact O-N 3.44Å; C226-R229 PolarHBondContact O-N 3.37Å; R229-F231 VanDerWaalsContact C-N 3.34Å; R229-F231 PolarHBondContact O-N 3.24Å; R229-L232 PolarHBondContact O-N 3.06Å; R229-S233 WeakPolarHBondContact O-CB 3.48Å; R229-S233 PolarHBondContact O-N 2.9Å; R229-S233 PolarHBondContact O-OG 3.24Å; R229-E287 IonicContact CZ-OE2 3.67Å; R229-E287 VanDerWaalsContact CZ-OE2 3.23Å; R229-E287 IonicContact NE-OE2 3.52Å; R229-E287 PolarHBondContact NE-OE2 3.29Å; R229-E287 IonicContact NH2-OE1 3.14Å; R229-E287 PolarHBondContact NH2-OE1 3.47Å; R229-E287 VanDerWaalsContact NH2-OE1 3.14Å; R229-E287 IonicContact NH2-OE2 2.94Å; R229-E287 PolarHBondContact NH2-OE2 2.81Å
230Q95.4Very high91.4Very high80 Ų8072.3 Ų72.337%0.37435%0.354SS..Hα-helixtrans-62.1-44.6176.3-170.8-177.813.300110.8C226 D227 I228 L232 S233 L234 F268C226-Q230 WeakPolarHBondContact O-CB 3.17Å; C226-Q230 PolarHBondContact O-N 3.25Å; D227-Q230 PolarHBondContact O-N 2.9Å; I228-Q230 VanDerWaalsContact C-N 3.32Å; I228-Q230 PolarHBondContact O-N 3.06Å; Q230-L232 PolarHBondContact O-N 2.98Å; Q230-S233 WeakPolarHBondContact CA-OG 3.4Å; Q230-S233 PolarHBondContact O-N 3.01Å; Q230-S233 PolarHBondContact O-OG 3.1Å; Q230-L234 HydrophobicContact CG-CD1 4.4Å; Q230-L234 VanDerWaalsContact O-CG 3.32Å; Q230-L234 WeakPolarHBondContact O-CG 2.84Å; Q230-L234 PolarHBondContact O-N 3.38Å; Q230-F268 HydrophobicContact CB-CE1 4.31Å; Q230-F268 HydrophobicContact CB-CZ 4.48Å; Q230-F268 HydrophobicContact CG-CE1 4.35Å; Q230-F268 HydrophobicContact CG-CZ 4.1Å
231F95.3Very high91.9Very high1 Ų167.9 Ų67.90%0.00434%0.34CS..Hα-helixtrans-58.4-48.8176.8174.4-98.3000112.2D227 I228 R229 L234 F240 V245 I248 F249 F268D227-F231 VanDerWaalsContact O-CB 3.26Å; D227-F231 WeakPolarHBondContact O-CB 3.37Å; D227-F231 PolarHBondContact O-N 2.91Å; I228-F231 WeakPolarHBondContact O-CB 3.34Å; I228-F231 PolarHBondContact O-N 3.4Å; R229-F231 VanDerWaalsContact C-N 3.34Å; R229-F231 PolarHBondContact O-N 3.24Å; F231-L234 PolarHBondContact O-N 3.46Å; F231-F240 AromaticContact CE1-CD1 3.96Å; F231-F240 HydrophobicContact CE1-CD1 3.96Å; F231-F240 HydrophobicContact CE1-CD2 4.01Å; F231-F240 AromaticContact CE1-CE1 3.82Å; F231-F240 HydrophobicContact CE1-CE1 3.82Å; F231-F240 AromaticContact CE1-CE2 3.85Å; F231-F240 HydrophobicContact CE1-CE2 3.85Å; F231-F240 HydrophobicContact CE1-CG 4.05Å; F231-F240 AromaticContact CE1-CZ 3.74Å; F231-F240 HydrophobicContact CE1-CZ 3.74Å; F231-F240 HydrophobicContact CZ-CD1 4.25Å; F231-F240 AromaticContact CZ-CE1 3.71Å; F231-F240 HydrophobicContact CZ-CE1 3.71Å; F231-F240 HydrophobicContact CZ-CE2 4.24Å; F231-F240 AromaticContact CZ-CZ 3.69Å; F231-F240 HydrophobicContact CZ-CZ 3.69Å; F231-V245 HydrophobicContact CD1-CG2 4.48Å; F231-V245 HydrophobicContact CE1-CG2 4.27Å; F231-I248 HydrophobicContact CD2-CG2 4.47Å; F231-I248 HydrophobicContact CE2-CB 4.37Å; F231-I248 HydrophobicContact CE2-CG1 4.28Å; F231-I248 HydrophobicContact CE2-CG2 3.74Å; F231-I248 HydrophobicContact CZ-CB 4.31Å; F231-I248 HydrophobicContact CZ-CG1 3.87Å; F231-I248 HydrophobicContact CZ-CG2 4.17Å; F231-F249 HydrophobicContact CB-CE2 4.26Å; F231-F249 HydrophobicContact CB-CZ 4.09Å; F231-F249 HydrophobicContact CG-CE2 4.35Å; F231-F268 HydrophobicContact CB-CD1 3.87Å; F231-F268 HydrophobicContact CB-CE1 3.87Å; F231-F268 HydrophobicContact CB-CG 4.27Å; F231-F268 HydrophobicContact CB-CZ 4.26Å; F231-F268 HydrophobicContact CD2-CB 3.93Å; F231-F268 HydrophobicContact CD2-CD1 4.1Å; F231-F268 AromaticContact CD2-CD2 3.7Å; F231-F268 HydrophobicContact CD2-CD2 3.7Å; F231-F268 HydrophobicContact CD2-CE2 4.23Å; F231-F268 AromaticContact CD2-CG 3.62Å; F231-F268 HydrophobicContact CD2-CG 3.62Å; F231-F268 HydrophobicContact CE2-CB 4.4Å; F231-F268 HydrophobicContact CE2-CD2 4.45Å; F231-F268 HydrophobicContact CE2-CG 4.47Å; F231-F268 HydrophobicContact CG-CD1 4.47Å; F231-F268 HydrophobicContact CG-CG 4.41Å
232L93.6Very high92Very high20 Ų2065.7 Ų65.711%0.10533%0.332CS..Hα-helixtrans-65.9-41.2-179.8-66.3173.6000111.9I228 R229 Q230 L234 R235 F240 V245 L288 V291I228-L232 HydrophobicContact CG2-CD1 3.96Å; I228-L232 HydrophobicContact CG2-CG 4.42Å; I228-L232 VanDerWaalsContact O-CG 3.31Å; I228-L232 WeakPolarHBondContact O-CG 3.32Å; I228-L232 PolarHBondContact O-N 3.41Å; R229-L232 PolarHBondContact O-N 3.06Å; Q230-L232 PolarHBondContact O-N 2.98Å; L232-L234 VanDerWaalsContact C-N 3.27Å; L232-L234 PolarHBondContact O-N 3.42Å; L232-R235 CarbonylContact O-C 3.29Å; L232-R235 VanDerWaalsContact O-C 3.29Å; L232-R235 PolarHBondContact O-N 3.42Å; L232-F240 HydrophobicContact CD2-CB 4.19Å; L232-F240 HydrophobicContact CD2-CD2 3.79Å; L232-F240 HydrophobicContact CD2-CG 4.31Å; L232-V245 HydrophobicContact CD2-CG2 4.22Å; L232-L288 HydrophobicContact CD1-CD2 3.82Å; L232-L288 HydrophobicContact CD1-CG 4.4Å; L232-L288 HydrophobicContact CD2-CD2 4.02Å; L232-V291 HydrophobicContact CD1-CG2 4.37Å
233S92.6Very high92Very high86 Ų8660.5 Ų60.560%0.60130%0.303SS*.Hα-helixtrans-67.3-25.6179.960.20000113.9R229 Q230 R235R229-S233 WeakPolarHBondContact O-CB 3.48Å; R229-S233 PolarHBondContact O-N 2.9Å; R229-S233 PolarHBondContact O-OG 3.24Å; Q230-S233 WeakPolarHBondContact CA-OG 3.4Å; Q230-S233 PolarHBondContact O-N 3.01Å; Q230-S233 PolarHBondContact O-OG 3.1Å; S233-R235 PolarHBondContact O-N 3.19Å
234L92.9Very high92Very high85 Ų8556.4 Ų56.445%0.44528%0.284SS..THydrogen-bonded Turntrans-74.8-12.8173.4-70.2171.1000113.1Q230 F231 L232 F268Q230-L234 HydrophobicContact CG-CD1 4.4Å; Q230-L234 VanDerWaalsContact O-CG 3.32Å; Q230-L234 WeakPolarHBondContact O-CG 2.84Å; Q230-L234 PolarHBondContact O-N 3.38Å; F231-L234 PolarHBondContact O-N 3.46Å; L232-L234 VanDerWaalsContact C-N 3.27Å; L232-L234 PolarHBondContact O-N 3.42Å; L234-F268 HydrophobicContact CD1-CE2 3.6Å; L234-F268 HydrophobicContact CD1-CZ 3.59Å
235R90.5Very high92.1Very high42 Ų4256.4 Ų56.416%0.15828%0.284CS..  trans-139.661.7-174.7-62.5-176.3-172.8149.62112L232 S233 E237 E238 F240L232-R235 CarbonylContact O-C 3.29Å; L232-R235 VanDerWaalsContact O-C 3.29Å; L232-R235 PolarHBondContact O-N 3.42Å; S233-R235 PolarHBondContact O-N 3.19Å; R235-E237 PolarHBondContact O-N 2.93Å; R235-E238 HydrophobicContact CB-CB 4.28Å; R235-E238 HydrophobicContact CB-CG 4.48Å; R235-E238 PolarHBondContact O-N 3.44Å; R235-F240 HydrophobicContact CB-CE2 3.85Å; R235-F240 HydrophobicContact CB-CZ 4.31Å
236P85.7Confident92.1Very high104 Ų10454.7 Ų54.768%0.67528%0.278SS*.THydrogen-bonded Turntrans-66.7-25.8-175.728.1-35.3000113.4E238P236-E238 VanDerWaalsContact C-N 3.33Å
237E85.2Confident92.1Very high180 Ų18054.9 Ų54.984%0.84127%0.269SS*.THydrogen-bonded Turntrans-80.6-13.6-179-55.1-59.6162.400113.2R235R235-E237 PolarHBondContact O-N 2.93Å
238E87.8Confident92.1Very high75 Ų7554.8 Ų54.835%0.3527%0.268SS..SBendtrans-98.6131.5-177.5-68.6179.9-139.100111.1R235 P236 F240 Y262R235-E238 HydrophobicContact CB-CB 4.28Å; R235-E238 HydrophobicContact CB-CG 4.48Å; R235-E238 PolarHBondContact O-N 3.44Å; P236-E238 VanDerWaalsContact C-N 3.33Å; E238-F240 HydrophobicContact CB-CD2 4.21Å; E238-F240 HydrophobicContact CB-CE2 3.51Å; E238-F240 HydrophobicContact CB-CZ 3.81Å; E238-F240 HydrophobicContact CG-CZ 4.5Å; E238-F240 WeakPolarHBondContact OE2-CZ 3.48Å; E238-Y262 PolarHBondContact OE2-OH 3.18Å
239K85.6Confident92.1Very high196 Ų19654.8 Ų54.885%0.85227%0.268SS*.  trans-92.7104.5175.9-67-173.6179.6-177.40110.5Y257K239-Y257 PolarHBondContact O-OH 3.33Å
240F89.9Confident92.1Very high19 Ų1951 Ų518%0.08326%0.255CS..  trans-93.6139.7175.3-63.2-81.7000112F231 L232 R235 E238 A244 V245 Y257 Y262F231-F240 AromaticContact CE1-CD1 3.96Å; F231-F240 HydrophobicContact CE1-CD1 3.96Å; F231-F240 HydrophobicContact CE1-CD2 4.01Å; F231-F240 AromaticContact CE1-CE1 3.82Å; F231-F240 HydrophobicContact CE1-CE1 3.82Å; F231-F240 AromaticContact CE1-CE2 3.85Å; F231-F240 HydrophobicContact CE1-CE2 3.85Å; F231-F240 HydrophobicContact CE1-CG 4.05Å; F231-F240 AromaticContact CE1-CZ 3.74Å; F231-F240 HydrophobicContact CE1-CZ 3.74Å; F231-F240 HydrophobicContact CZ-CD1 4.25Å; F231-F240 AromaticContact CZ-CE1 3.71Å; F231-F240 HydrophobicContact CZ-CE1 3.71Å; F231-F240 HydrophobicContact CZ-CE2 4.24Å; F231-F240 AromaticContact CZ-CZ 3.69Å; F231-F240 HydrophobicContact CZ-CZ 3.69Å; L232-F240 HydrophobicContact CD2-CB 4.19Å; L232-F240 HydrophobicContact CD2-CD2 3.79Å; L232-F240 HydrophobicContact CD2-CG 4.31Å; R235-F240 HydrophobicContact CB-CE2 3.85Å; R235-F240 HydrophobicContact CB-CZ 4.31Å; E238-F240 HydrophobicContact CB-CD2 4.21Å; E238-F240 HydrophobicContact CB-CE2 3.51Å; E238-F240 HydrophobicContact CB-CZ 3.81Å; E238-F240 HydrophobicContact CG-CZ 4.5Å; E238-F240 WeakPolarHBondContact OE2-CZ 3.48Å; F240-A244 HydrophobicContact CD1-CB 4.24Å; F240-V245 HydrophobicContact CB-CG2 3.77Å; F240-V245 HydrophobicContact CG-CG2 4.37Å; F240-Y257 HydrophobicContact CD1-CD1 4.37Å; F240-Y257 AromaticContact CD1-CE1 3.72Å; F240-Y257 HydrophobicContact CD1-CE1 3.72Å; F240-Y257 AromaticContact CD1-CZ 3.98Å; F240-Y257 AromaticContact CE1-CD1 3.91Å; F240-Y257 HydrophobicContact CE1-CD1 3.91Å; F240-Y257 AromaticContact CE1-CE1 3.55Å; F240-Y257 HydrophobicContact CE1-CE1 3.55Å; F240-Y262 AromaticContact CE1-CE1 3.84Å; F240-Y262 HydrophobicContact CE1-CE1 3.84Å; F240-Y262 HydrophobicContact CZ-CE1 4.03Å
241S91.5Very high92Very high19 Ų1947.6 Ų47.613%0.13324%0.242CC..  trans-85.4161.6161.277.40000110.9D131 R243 A244 V245D131-S241 WeakPolarHBondContact OD2-CB 3.17Å; D131-S241 PolarHBondContact OD2-OG 3.05Å; S241-R243 PolarHBondContact O-N 3.48Å; S241-A244 WeakPolarHBondContact O-CB 3.42Å; S241-A244 PolarHBondContact O-N 3.09Å; S241-A244 PolarHBondContact OG-N 3.26Å; S241-A244 VanDerWaalsContact OG-N 3.15Å; S241-V245 WeakPolarHBondContact O-CG2 3.45Å; S241-V245 PolarHBondContact O-N 3.34Å
242S91.8Very high91.9Very high22 Ų2250.9 Ų50.915%0.15426%0.259CS..Hα-helixtrans-59.8-37.317956.80000111.9V245 A246 T285 L288S242-V245 PolarHBondContact O-N 3.09Å; S242-A246 PolarHBondContact O-N 3.47Å; S242-T285 WeakPolarHBondContact CB-OG1 3.46Å; S242-T285 PolarHBondContact OG-OG1 3.26Å; S242-T285 VanDerWaalsContact OG-OG1 3.1Å; S242-L288 VanDerWaalsContact N-CD1 3.3Å
243R92.4Very high91.7Very high21 Ų2151.4 Ų51.48%0.07927%0.269CS..Hα-helixtrans-66.9-38.4173.9-166.2172.9-1171001.4112.3D131 D135 S241 A246 R247 F277D131-R243 PolarHBondContact O-NH1 2.79Å; D131-R243 WeakPolarHBondContact OD1-CB 3.46Å; D131-R243 VanDerWaalsContact OD1-CD 3.28Å; D131-R243 WeakPolarHBondContact OD1-CD 3.16Å; D131-R243 VanDerWaalsContact OD2-CB 3.29Å; D131-R243 WeakPolarHBondContact OD2-CB 3.49Å; D135-R243 IonicContact OD1-CZ 3.5Å; D135-R243 IonicContact OD1-NH1 3.84Å; D135-R243 PolarHBondContact OD1-NH1 2.99Å; D135-R243 IonicContact OD1-NH2 2.71Å; D135-R243 PolarHBondContact OD1-NH2 2.94Å; D135-R243 IonicContact OD2-NH1 2.62Å; D135-R243 PolarHBondContact OD2-NH1 3.11Å; D135-R243 VanDerWaalsContact OD2-NH1 3.08Å; S241-R243 PolarHBondContact O-N 3.48Å; R243-A246 PolarHBondContact O-N 3.38Å; R243-R247 WeakPolarHBondContact O-CB 3.45Å; R243-R247 VanDerWaalsContact O-CG 3.25Å; R243-R247 WeakPolarHBondContact O-CG 3.49Å; R243-R247 PolarHBondContact O-N 3.13Å; R243-F277 HydrophobicContact CG-CE1 4.09Å; R243-F277 HydrophobicContact CG-CZ 3.83Å
244A92.8Very high91.4Very high3 Ų348.2 Ų48.23%0.02525%0.247CC..Hα-helixtrans-60.6-46.6174.900000111.3F240 S241 R247 I248 Y257F240-A244 HydrophobicContact CD1-CB 4.24Å; S241-A244 WeakPolarHBondContact O-CB 3.42Å; S241-A244 PolarHBondContact O-N 3.09Å; S241-A244 PolarHBondContact OG-N 3.26Å; S241-A244 VanDerWaalsContact OG-N 3.15Å; A244-R247 WeakPolarHBondContact O-CB 3.39Å; A244-R247 PolarHBondContact O-N 3.14Å; A244-I248 WeakPolarHBondContact O-CG1 3.27Å; A244-I248 PolarHBondContact O-N 3.1Å; A244-I248 VanDerWaalsContact O-N 3.09Å; A244-Y257 HydrophobicContact CB-CD2 3.86Å; A244-Y257 HydrophobicContact CB-CE2 3.28Å
245V94.6Very high90.9Very high0 Ų050.4 Ų50.40%027%0.266CS..Hα-helixtrans-58.1-51.71751770000110.3I228 F231 L232 F240 S241 S242 R247 I248 F249 A284I228-V245 HydrophobicContact CG1-CG1 3.95Å; I228-V245 HydrophobicContact CG2-CG1 4.14Å; F231-V245 HydrophobicContact CD1-CG2 4.48Å; F231-V245 HydrophobicContact CE1-CG2 4.27Å; L232-V245 HydrophobicContact CD2-CG2 4.22Å; F240-V245 HydrophobicContact CB-CG2 3.77Å; F240-V245 HydrophobicContact CG-CG2 4.37Å; S241-V245 WeakPolarHBondContact O-CG2 3.45Å; S241-V245 PolarHBondContact O-N 3.34Å; S242-V245 PolarHBondContact O-N 3.09Å; V245-R247 VanDerWaalsContact C-N 3.28Å; V245-R247 PolarHBondContact O-N 3.07Å; V245-I248 WeakPolarHBondContact O-CB 3.41Å; V245-I248 PolarHBondContact O-N 3.16Å; V245-I248 VanDerWaalsContact O-N 3.08Å; V245-F249 HydrophobicContact CG1-CD2 3.74Å; V245-F249 HydrophobicContact CG1-CE2 3.7Å; V245-F249 VanDerWaalsContact O-CD2 3.31Å; V245-F249 WeakPolarHBondContact O-CD2 3.36Å; V245-F249 PolarHBondContact O-N 3.3Å; V245-F249 VanDerWaalsContact O-N 3.12Å; V245-A284 HydrophobicContact CB-CB 3.91Å; V245-A284 HydrophobicContact CG1-CB 3.85Å
246A95.1Very high90.5Very high0 Ų052.8 Ų52.80%029%0.288CS..Hα-helixtrans-57.5-40.2178.400000112.4S242 R243 I248 F249 H250 F277 L280 V281S242-A246 PolarHBondContact O-N 3.47Å; R243-A246 PolarHBondContact O-N 3.38Å; A246-I248 PolarHBondContact O-N 3.33Å; A246-F249 PolarHBondContact O-N 3.01Å; A246-H250 WeakPolarHBondContact O-CB 3.36Å; A246-H250 PolarHBondContact O-N 3Å; A246-F277 HydrophobicContact CB-CD2 4.25Å; A246-F277 HydrophobicContact CB-CE2 3.74Å; A246-F277 HydrophobicContact CB-CZ 3.91Å; A246-L280 HydrophobicContact CB-CB 3.91Å; A246-V281 HydrophobicContact CB-CB 4.44Å; A246-V281 HydrophobicContact CB-CG2 3.51Å
247R94.3Very high90.7Very high74 Ų7449.5 Ų49.528%0.27926%0.263SS..Hα-helixtrans-60.6-41.3175.3-78.7178.282132.95.7112.7R243 A244 V245 H250 G251 I252 G253 S254 F277R243-R247 WeakPolarHBondContact O-CB 3.45Å; R243-R247 VanDerWaalsContact O-CG 3.25Å; R243-R247 WeakPolarHBondContact O-CG 3.49Å; R243-R247 PolarHBondContact O-N 3.13Å; A244-R247 WeakPolarHBondContact O-CB 3.39Å; A244-R247 PolarHBondContact O-N 3.14Å; V245-R247 VanDerWaalsContact C-N 3.28Å; V245-R247 PolarHBondContact O-N 3.07Å; R247-H250 CarbonylContact O-C 3.56Å; R247-H250 PolarHBondContact O-N 3.4Å; R247-G251 CarbonylContact O-C 3.58Å; R247-G251 WeakPolarHBondContact O-CA 3.37Å; R247-G251 PolarHBondContact O-N 3.01Å; R247-I252 HydrophobicContact CB-CB 4.32Å; R247-I252 WeakPolarHBondContact CB-O 3.41Å; R247-I252 HydrophobicContact CG-CB 4.25Å; R247-I252 HydrophobicContact CG-CG2 4.47Å; R247-I252 PolarHBondContact NE-O 3.27Å; R247-I252 PolarHBondContact O-N 3.21Å; R247-G253 PolarHBondContact NH2-O 3.16Å; R247-S254 VanDerWaalsContact CZ-CB 3.49Å; R247-F277 HydrophobicContact CG-CE2 3.92Å; R247-F277 HydrophobicContact CG-CZ 3.92Å
248I96Very high91Very high2 Ų242.9 Ų42.91%0.0124%0.236CC..Hα-helixtrans-61.3-51.4175-62.8-47.9000110.3F231 A244 V245 A246 H250 G251 Y262 F268 W269 R270F231-I248 HydrophobicContact CD2-CG2 4.47Å; F231-I248 HydrophobicContact CE2-CB 4.37Å; F231-I248 HydrophobicContact CE2-CG1 4.28Å; F231-I248 HydrophobicContact CE2-CG2 3.74Å; F231-I248 HydrophobicContact CZ-CB 4.31Å; F231-I248 HydrophobicContact CZ-CG1 3.87Å; F231-I248 HydrophobicContact CZ-CG2 4.17Å; A244-I248 WeakPolarHBondContact O-CG1 3.27Å; A244-I248 PolarHBondContact O-N 3.1Å; A244-I248 VanDerWaalsContact O-N 3.09Å; V245-I248 WeakPolarHBondContact O-CB 3.41Å; V245-I248 PolarHBondContact O-N 3.16Å; V245-I248 VanDerWaalsContact O-N 3.08Å; A246-I248 PolarHBondContact O-N 3.33Å; I248-H250 PolarHBondContact O-N 3.34Å; I248-G251 WeakPolarHBondContact O-CA 3.45Å; I248-G251 PolarHBondContact O-N 3.04Å; I248-Y262 HydrophobicContact CD1-CD1 3.47Å; I248-Y262 VanDerWaalsContact CD1-CD1 3.47Å; I248-Y262 HydrophobicContact CD1-CE1 4.37Å; I248-Y262 HydrophobicContact CD1-CG 3.69Å; I248-Y262 HydrophobicContact CG1-CD1 4.07Å; I248-F268 HydrophobicContact CG2-CB 3.99Å; I248-W269 HydrophobicContact CD1-CE3 4.11Å; I248-W269 HydrophobicContact CD1-CZ3 3.71Å; I248-W269 HydrophobicContact CG2-CE3 4.22Å; I248-W269 WeakPolarHBondContact O-CA 3.24Å; I248-R270 PolarHBondContact O-N 3.21Å
249F96.1Very high91.2Very high2 Ų241.4 Ų41.41%0.00924%0.236CC..Hα-helixtrans-64.7-27.1-177.9-78.6-74.2000113.8D227 I228 F231 V245 A246 F268 R270 K271 Y272 L280D227-F249 HydrophobicContact CB-CE1 4Å; D227-F249 HydrophobicContact CB-CZ 4.09Å; I228-F249 HydrophobicContact CG1-CD2 4.33Å; I228-F249 HydrophobicContact CG1-CE2 3.73Å; I228-F249 HydrophobicContact CG1-CZ 4.2Å; F231-F249 HydrophobicContact CB-CE2 4.26Å; F231-F249 HydrophobicContact CB-CZ 4.09Å; F231-F249 HydrophobicContact CG-CE2 4.35Å; V245-F249 HydrophobicContact CG1-CD2 3.74Å; V245-F249 HydrophobicContact CG1-CE2 3.7Å; V245-F249 VanDerWaalsContact O-CD2 3.31Å; V245-F249 WeakPolarHBondContact O-CD2 3.36Å; V245-F249 PolarHBondContact O-N 3.3Å; V245-F249 VanDerWaalsContact O-N 3.12Å; A246-F249 PolarHBondContact O-N 3.01Å; F249-F268 WeakPolarHBondContact CA-O 3.24Å; F249-F268 HydrophobicContact CD1-CB 4.47Å; F249-F268 WeakPolarHBondContact CD1-O 3.5Å; F249-F268 HydrophobicContact CE1-CB 4.01Å; F249-F268 AromaticContact CE1-CD1 3.8Å; F249-F268 HydrophobicContact CE1-CD1 3.8Å; F249-F268 HydrophobicContact CE1-CG 4.41Å; F249-F268 HydrophobicContact CZ-CB 4.22Å; F249-F268 AromaticContact CZ-CD1 3.72Å; F249-F268 HydrophobicContact CZ-CD1 3.72Å; F249-F268 HydrophobicContact CZ-CG 4.38Å; F249-R270 CarbonylContact O-C 3.3Å; F249-R270 VanDerWaalsContact O-C 3.3Å; F249-R270 VanDerWaalsContact O-CA 3.3Å; F249-R270 WeakPolarHBondContact O-CA 3.4Å; F249-R270 PolarHBondContact O-N 3.24Å; F249-K271 HydrophobicContact CD1-CB 4.26Å; F249-K271 PolarHBondContact O-N 3.38Å; F249-K271 VanDerWaalsContact O-N 3.13Å; F249-Y272 HydrophobicContact CB-CD2 4.03Å; F249-Y272 AromaticContact CD1-CD2 3.37Å; F249-Y272 HydrophobicContact CD1-CD2 3.37Å; F249-Y272 AromaticContact CD1-CE2 3.57Å; F249-Y272 HydrophobicContact CD1-CE2 3.57Å; F249-Y272 HydrophobicContact CE1-CD2 4.07Å; F249-Y272 AromaticContact CE1-CE2 3.76Å; F249-Y272 HydrophobicContact CE1-CE2 3.76Å; F249-Y272 AromaticContact CG-CD2 3.93Å; F249-Y272 HydrophobicContact CG-CD2 3.93Å; F249-Y272 HydrophobicContact CG-CE2 4.41Å; F249-Y272 PolarHBondContact O-N 3.38Å; F249-Y272 VanDerWaalsContact O-N 3.1Å; F249-L280 HydrophobicContact CB-CD1 4.2Å
250H94.4Very high91.6Very high40 Ų4038.9 Ų38.919%0.18523%0.227CC..Hα-helixtrans-89.2-10.2171.9-133.4-96.4000113.5A246 R247 I248 I252 L273 L275 F277A246-H250 WeakPolarHBondContact O-CB 3.36Å; A246-H250 PolarHBondContact O-N 3Å; R247-H250 CarbonylContact O-C 3.56Å; R247-H250 PolarHBondContact O-N 3.4Å; I248-H250 PolarHBondContact O-N 3.34Å; H250-I252 HydrophobicContact CB-CD1 4.04Å; H250-I252 HydrophobicContact CB-CG1 4.17Å; H250-L273 WeakPolarHBondContact O-CD2 3.07Å; H250-L275 PolarHBondContact NE2-O 3.18Å; H250-F277 HydrophobicContact CB-CD2 4.1Å; H250-F277 HydrophobicContact CB-CE2 4.49Å
251G93.2Very high91.7Very high9 Ų942.3 Ų42.39%0.09325%0.25CC..THydrogen-bonded Turntrans69.237.4-179.300000115.6R247 I248 W269R247-G251 CarbonylContact O-C 3.58Å; R247-G251 WeakPolarHBondContact O-CA 3.37Å; R247-G251 PolarHBondContact O-N 3.01Å; I248-G251 WeakPolarHBondContact O-CA 3.45Å; I248-G251 PolarHBondContact O-N 3.04Å; G251-W269 VanDerWaalsContact CA-CZ2 3.5Å; G251-W269 WeakPolarHBondContact O-CZ2 3.22Å
252I93.1Very high91.8Very high69 Ų6942.4 Ų42.435%0.35425%0.247SC..  trans-102.4101.6178.1-57.8171.6000108.7R247 H250 F277R247-I252 HydrophobicContact CB-CB 4.32Å; R247-I252 WeakPolarHBondContact CB-O 3.41Å; R247-I252 HydrophobicContact CG-CB 4.25Å; R247-I252 HydrophobicContact CG-CG2 4.47Å; R247-I252 PolarHBondContact NE-O 3.27Å; R247-I252 PolarHBondContact O-N 3.21Å; H250-I252 HydrophobicContact CB-CD1 4.04Å; H250-I252 HydrophobicContact CB-CG1 4.17Å; I252-F277 HydrophobicContact CD1-CD2 4.27Å; I252-F277 HydrophobicContact CD1-CE2 4.23Å
253G89.8Confident91.8Very high32 Ų3241.8 Ų41.833%0.3325%0.245SC..  trans-64149.5179.200000112.7R247R247-G253 PolarHBondContact NH2-O 3.16Å
254S86.8Confident91.9Very high19 Ų1948.2 Ų48.213%0.13328%0.275CS..  trans-132.5165.1172.477.70000110.2R247 C256 Y257 P258R247-S254 VanDerWaalsContact CZ-CB 3.49Å; S254-C256 VanDerWaalsContact C-N 3.26Å; S254-C256 PolarHBondContact O-N 3.07Å; S254-C256 PolarHBondContact OG-N 3.48Å; S254-Y257 PolarHBondContact N-O 2.99Å; S254-Y257 CarbonylContact O-C 3Å; S254-Y257 PolarHBondContact O-N 2.98Å; S254-Y257 VanDerWaalsContact O-O 3.13Å; S254-Y257 WeakPolarHBondContact OG-CB 3.36Å; S254-Y257 WeakPolarHBondContact OG-CD2 3.45Å; S254-Y257 PolarHBondContact OG-N 2.84Å; S254-P258 WeakPolarHBondContact O-CA 3.26Å; S254-P258 VanDerWaalsContact O-N 3.16Å
255P82.9Confident91.9Very high131 Ų13149.3 Ų49.385%0.85128%0.281SS*.SBendtrans-54.9-40.3175.2-2735.9000113.4
256C81.9Confident91.8Very high92 Ų9258 Ų5862%0.62231%0.314SS*.SBendtrans-76.4-24.9176.5-58.90000113S254S254-C256 VanDerWaalsContact C-N 3.26Å; S254-C256 PolarHBondContact O-N 3.07Å; S254-C256 PolarHBondContact OG-N 3.48Å
257Y88.8Confident91.8Very high34 Ų3464.1 Ų64.113%0.13334%0.337CS..SBendtrans-131.173.4-176.9-46.9-66.9000110.8K239 F240 A244 S254 Y262K239-Y257 PolarHBondContact O-OH 3.33Å; F240-Y257 HydrophobicContact CD1-CD1 4.37Å; F240-Y257 AromaticContact CD1-CE1 3.72Å; F240-Y257 HydrophobicContact CD1-CE1 3.72Å; F240-Y257 AromaticContact CD1-CZ 3.98Å; F240-Y257 AromaticContact CE1-CD1 3.91Å; F240-Y257 HydrophobicContact CE1-CD1 3.91Å; F240-Y257 AromaticContact CE1-CE1 3.55Å; F240-Y257 HydrophobicContact CE1-CE1 3.55Å; A244-Y257 HydrophobicContact CB-CD2 3.86Å; A244-Y257 HydrophobicContact CB-CE2 3.28Å; S254-Y257 PolarHBondContact N-O 2.99Å; S254-Y257 CarbonylContact O-C 3Å; S254-Y257 PolarHBondContact O-N 2.98Å; S254-Y257 VanDerWaalsContact O-O 3.13Å; S254-Y257 WeakPolarHBondContact OG-CB 3.36Å; S254-Y257 WeakPolarHBondContact OG-CD2 3.45Å; S254-Y257 PolarHBondContact OG-N 2.84Å; Y257-Y262 AromaticContact CD1-CE1 3.94Å; Y257-Y262 HydrophobicContact CD1-CE1 3.94Å; Y257-Y262 AromaticContact CD1-CE2 3.99Å; Y257-Y262 HydrophobicContact CD1-CE2 3.99Å; Y257-Y262 AromaticContact CD1-CZ 3.58Å
258P92Very high91.9Very high42 Ų4260.7 Ų60.727%0.27332%0.324SS..  trans-68.6141.7-172.3-20.533.7000112.2S254 Q260 V261 Y262S254-P258 WeakPolarHBondContact O-CA 3.26Å; S254-P258 VanDerWaalsContact O-N 3.16Å; P258-Q260 PolarHBondContact O-N 3.09Å; P258-V261 PolarHBondContact O-N 2.97Å; P258-Y262 PolarHBondContact O-N 3.38Å
259A92.7Very high91.9Very high43 Ų4361.4 Ų61.436%0.35533%0.327SS..Hα-helixtrans-61.6-27.6178.400000112.7V261 G263 W269A259-V261 PolarHBondContact O-N 2.9Å; A259-G263 WeakPolarHBondContact O-CA 3.36Å; A259-G263 PolarHBondContact O-N 2.95Å; A259-W269 HydrophobicContact CB-CH2 3.71Å; A259-W269 HydrophobicContact CB-CZ2 3.52Å
260Q93.3Very high91.8Very high144 Ų14468 Ų6867%0.67335%0.351SS*.Hα-helixtrans-65.6-27.7177.2-62.783.5-13.500112.5P258 Q264P258-Q260 PolarHBondContact O-N 3.09Å; Q260-Q264 WeakPolarHBondContact O-CG 3.33Å; Q260-Q264 PolarHBondContact O-NE2 3.32Å
261V92.8Very high91.9Very high91 Ų9169.6 Ų69.655%0.55236%0.358SS*.Hα-helixtrans-98.6-60.6179.7179.70000109.3P258 A259 G263 Q264P258-V261 PolarHBondContact O-N 2.97Å; A259-V261 PolarHBondContact O-N 2.9Å; V261-G263 VanDerWaalsContact C-N 3.32Å; V261-G263 PolarHBondContact O-N 3.31Å; V261-Q264 WeakPolarHBondContact O-CB 3.43Å; V261-Q264 PolarHBondContact O-N 3.29Å
262Y93.3Very high91.9Very high20 Ų2069.2 Ų69.28%0.07835%0.354CS..Hα-helixtrans-73.8-24.4-173.6-70.6-105.2000112.9E238 F240 I248 Y257 P258 Q264 D265E238-Y262 PolarHBondContact OE2-OH 3.18Å; F240-Y262 AromaticContact CE1-CE1 3.84Å; F240-Y262 HydrophobicContact CE1-CE1 3.84Å; F240-Y262 HydrophobicContact CZ-CE1 4.03Å; I248-Y262 HydrophobicContact CD1-CD1 3.47Å; I248-Y262 VanDerWaalsContact CD1-CD1 3.47Å; I248-Y262 HydrophobicContact CD1-CE1 4.37Å; I248-Y262 HydrophobicContact CD1-CG 3.69Å; I248-Y262 HydrophobicContact CG1-CD1 4.07Å; Y257-Y262 AromaticContact CD1-CE1 3.94Å; Y257-Y262 HydrophobicContact CD1-CE1 3.94Å; Y257-Y262 AromaticContact CD1-CE2 3.99Å; Y257-Y262 HydrophobicContact CD1-CE2 3.99Å; Y257-Y262 AromaticContact CD1-CZ 3.58Å; P258-Y262 PolarHBondContact O-N 3.38Å; Y262-Q264 PolarHBondContact O-N 3.32Å; Y262-D265 PolarHBondContact O-N 3.27Å
263G92.1Very high91.7Very high10 Ų1070.2 Ų70.210%0.10336%0.359CS..THydrogen-bonded Turntrans-75.2-9.1177.200000114.9A259 V261 D265 R266 W269A259-G263 WeakPolarHBondContact O-CA 3.36Å; A259-G263 PolarHBondContact O-N 2.95Å; V261-G263 VanDerWaalsContact C-N 3.32Å; V261-G263 PolarHBondContact O-N 3.31Å; G263-D265 VanDerWaalsContact C-N 3.34Å; G263-R266 PolarHBondContact O-NE 3.28Å; G263-W269 VanDerWaalsContact CA-CD2 3.47Å; G263-W269 VanDerWaalsContact CA-CG 3.46Å
264Q93.4Very high91.6Very high155 Ų15573.7 Ų73.772%0.72437%0.366SS*.THydrogen-bonded Turntrans-70.8-34.4171.3-59.2-17510.300111.1Q260 V261 Y262 R266Q260-Q264 WeakPolarHBondContact O-CG 3.33Å; Q260-Q264 PolarHBondContact O-NE2 3.32Å; V261-Q264 WeakPolarHBondContact O-CB 3.43Å; V261-Q264 PolarHBondContact O-N 3.29Å; Y262-Q264 PolarHBondContact O-N 3.32Å; Q264-R266 PolarHBondContact O-N 3.12Å
265D93.8Very high91.7Very high27 Ų2773.5 Ų73.514%0.14436%0.364CS..  trans-83.683.7177.4-160.9-17.6000111.3Y262 G263 R267 F268 W269Y262-D265 PolarHBondContact O-N 3.27Å; G263-D265 VanDerWaalsContact C-N 3.34Å; D265-R267 PolarHBondContact O-N 3.08Å; D265-R267 VanDerWaalsContact O-N 3.13Å; D265-R267 VanDerWaalsContact OD1-CB 3.27Å; D265-R267 WeakPolarHBondContact OD1-CB 3.43Å; D265-R267 WeakPolarHBondContact OD1-CG 3.43Å; D265-R267 IonicContact OD1-CZ 2.66Å; D265-R267 PolarHBondContact OD1-N 3.24Å; D265-R267 IonicContact OD1-NE 2.68Å; D265-R267 PolarHBondContact OD1-NE 3.41Å; D265-R267 IonicContact OD1-NH2 3.91Å; D265-R267 IonicContact OD2-CZ 3.23Å; D265-R267 IonicContact OD2-NE 3.98Å; D265-R267 IonicContact OD2-NH2 2.94Å; D265-R267 PolarHBondContact OD2-NH2 3.29Å; D265-F268 HydrophobicContact CB-CD2 4.36Å; D265-F268 PolarHBondContact O-N 2.92Å; D265-F268 WeakPolarHBondContact OD2-CD2 3.39Å; D265-F268 WeakPolarHBondContact OD2-CE2 3.29Å; D265-W269 WeakPolarHBondContact O-CB 3.42Å; D265-W269 PolarHBondContact O-N 2.95Å
266R92.4Very high92Very high183 Ų18370.2 Ų70.269%0.69134%0.344SS*.THydrogen-bonded Turntrans-64.4-11.8179.5-61.9-61.5-174.6135.13.6114G263 Q264 F268G263-R266 PolarHBondContact O-NE 3.28Å; Q264-R266 PolarHBondContact O-N 3.12Å; R266-F268 PolarHBondContact O-N 2.83Å
267R94.7Very high92.3Very high128 Ų12867.9 Ų67.948%0.48332%0.324SS..THydrogen-bonded Turntrans-66.7-26.3174.5-60.2175.8-67177.31111.9D265 K271D265-R267 PolarHBondContact O-N 3.08Å; D265-R267 VanDerWaalsContact O-N 3.13Å; D265-R267 VanDerWaalsContact OD1-CB 3.27Å; D265-R267 WeakPolarHBondContact OD1-CB 3.43Å; D265-R267 WeakPolarHBondContact OD1-CG 3.43Å; D265-R267 IonicContact OD1-CZ 2.66Å; D265-R267 PolarHBondContact OD1-N 3.24Å; D265-R267 IonicContact OD1-NE 2.68Å; D265-R267 PolarHBondContact OD1-NE 3.41Å; D265-R267 IonicContact OD1-NH2 3.91Å; D265-R267 IonicContact OD2-CZ 3.23Å; D265-R267 IonicContact OD2-NE 3.98Å; D265-R267 IonicContact OD2-NH2 2.94Å; D265-R267 PolarHBondContact OD2-NH2 3.29Å; R267-K271 WeakPolarHBondContact O-CD 3.38Å
268F95.6Very high92.2Very high2 Ų270.2 Ų70.21%0.00934%0.335CS..THydrogen-bonded Turntrans-119.4-39.5-178.2-49.8-66.6000111.4Q230 F231 L234 I248 F249 D265 R266 R270 K271Q230-F268 HydrophobicContact CB-CE1 4.31Å; Q230-F268 HydrophobicContact CB-CZ 4.48Å; Q230-F268 HydrophobicContact CG-CE1 4.35Å; Q230-F268 HydrophobicContact CG-CZ 4.1Å; F231-F268 HydrophobicContact CB-CD1 3.87Å; F231-F268 HydrophobicContact CB-CE1 3.87Å; F231-F268 HydrophobicContact CB-CG 4.27Å; F231-F268 HydrophobicContact CB-CZ 4.26Å; F231-F268 HydrophobicContact CD2-CB 3.93Å; F231-F268 HydrophobicContact CD2-CD1 4.1Å; F231-F268 AromaticContact CD2-CD2 3.7Å; F231-F268 HydrophobicContact CD2-CD2 3.7Å; F231-F268 HydrophobicContact CD2-CE2 4.23Å; F231-F268 AromaticContact CD2-CG 3.62Å; F231-F268 HydrophobicContact CD2-CG 3.62Å; F231-F268 HydrophobicContact CE2-CB 4.4Å; F231-F268 HydrophobicContact CE2-CD2 4.45Å; F231-F268 HydrophobicContact CE2-CG 4.47Å; F231-F268 HydrophobicContact CG-CD1 4.47Å; F231-F268 HydrophobicContact CG-CG 4.41Å; L234-F268 HydrophobicContact CD1-CE2 3.6Å; L234-F268 HydrophobicContact CD1-CZ 3.59Å; I248-F268 HydrophobicContact CG2-CB 3.99Å; F249-F268 WeakPolarHBondContact CA-O 3.24Å; F249-F268 HydrophobicContact CD1-CB 4.47Å; F249-F268 WeakPolarHBondContact CD1-O 3.5Å; F249-F268 HydrophobicContact CE1-CB 4.01Å; F249-F268 AromaticContact CE1-CD1 3.8Å; F249-F268 HydrophobicContact CE1-CD1 3.8Å; F249-F268 HydrophobicContact CE1-CG 4.41Å; F249-F268 HydrophobicContact CZ-CB 4.22Å; F249-F268 AromaticContact CZ-CD1 3.72Å; F249-F268 HydrophobicContact CZ-CD1 3.72Å; F249-F268 HydrophobicContact CZ-CG 4.38Å; D265-F268 HydrophobicContact CB-CD2 4.36Å; D265-F268 PolarHBondContact O-N 2.92Å; D265-F268 WeakPolarHBondContact OD2-CD2 3.39Å; D265-F268 WeakPolarHBondContact OD2-CE2 3.29Å; R266-F268 PolarHBondContact O-N 2.83Å; F268-R270 PolarHBondContact O-N 2.71Å; F268-K271 WeakPolarHBondContact O-CB 3.27Å; F268-K271 PolarHBondContact O-N 2.91Å
269W96.4Very high92.1Very high17 Ų1769.4 Ų69.46%0.06433%0.332CS..THydrogen-bonded Turntrans-66.2125.6-175.5-170-100000113.2I248 G251 A259 G263 D265 K271I248-W269 HydrophobicContact CD1-CE3 4.11Å; I248-W269 HydrophobicContact CD1-CZ3 3.71Å; I248-W269 HydrophobicContact CG2-CE3 4.22Å; I248-W269 WeakPolarHBondContact O-CA 3.24Å; G251-W269 VanDerWaalsContact CA-CZ2 3.5Å; G251-W269 WeakPolarHBondContact O-CZ2 3.22Å; A259-W269 HydrophobicContact CB-CH2 3.71Å; A259-W269 HydrophobicContact CB-CZ2 3.52Å; G263-W269 VanDerWaalsContact CA-CD2 3.47Å; G263-W269 VanDerWaalsContact CA-CG 3.46Å; D265-W269 WeakPolarHBondContact O-CB 3.42Å; D265-W269 PolarHBondContact O-N 2.95Å; W269-K271 PolarHBondContact O-N 2.89Å
270R94.9Very high92.1Very high139 Ų13967.4 Ų67.453%0.52532%0.316SS..THydrogen-bonded Turntrans59.416.8-179.1-66.8-179.9173.5-172.9-2.8114.9I248 F249 F268 Y272 L273I248-R270 PolarHBondContact O-N 3.21Å; F249-R270 CarbonylContact O-C 3.3Å; F249-R270 VanDerWaalsContact O-C 3.3Å; F249-R270 VanDerWaalsContact O-CA 3.3Å; F249-R270 WeakPolarHBondContact O-CA 3.4Å; F249-R270 PolarHBondContact O-N 3.24Å; F268-R270 PolarHBondContact O-N 2.71Å; R270-Y272 VanDerWaalsContact C-N 3.32Å; R270-Y272 PolarHBondContact O-N 3.37Å; R270-L273 HydrophobicContact CB-CD1 3.87Å; R270-L273 HydrophobicContact CB-CD2 4.45Å; R270-L273 HydrophobicContact CB-CG 4.01Å; R270-L273 HydrophobicContact CG-CD1 4.22Å; R270-L273 HydrophobicContact CG-CD2 4.33Å; R270-L273 HydrophobicContact CG-CG 4.39Å; R270-L273 WeakPolarHBondContact O-CG 3.33Å
271K95Very high92Very high75 Ų7561.3 Ų61.333%0.32629%0.288SS..THydrogen-bonded Turntrans-65.9-33-177.8178163.3169174.10113D227 F249 R267 F268 W269D227-K271 IonicContact OD1-NZ 3.95Å; D227-K271 PolarHBondContact OD1-NZ 3.27Å; D227-K271 WeakPolarHBondContact OD2-CE 3.48Å; D227-K271 IonicContact OD2-NZ 3.21Å; D227-K271 PolarHBondContact OD2-NZ 2.86Å; F249-K271 HydrophobicContact CD1-CB 4.26Å; F249-K271 PolarHBondContact O-N 3.38Å; F249-K271 VanDerWaalsContact O-N 3.13Å; R267-K271 WeakPolarHBondContact O-CD 3.38Å; F268-K271 WeakPolarHBondContact O-CB 3.27Å; F268-K271 PolarHBondContact O-N 2.91Å; W269-K271 PolarHBondContact O-N 2.89Å
272Y93.8Very high91.9Very high1 Ų158.4 Ų58.40%0.00428%0.277CS..THydrogen-bonded Turntrans-119.241.9-174.8-61.8-62000113.9W220 V224 D227 F249 R270 H274 L275 L280W220-Y272 AromaticContact CE3-CE1 3.93Å; W220-Y272 HydrophobicContact CE3-CE1 3.93Å; W220-Y272 HydrophobicContact CZ3-CE1 4.39Å; V224-Y272 WeakPolarHBondContact CA-OH 3.49Å; V224-Y272 HydrophobicContact CB-CE2 4.2Å; V224-Y272 HydrophobicContact CG1-CE2 4.27Å; V224-Y272 HydrophobicContact CG2-CD1 3.88Å; V224-Y272 HydrophobicContact CG2-CD2 4.03Å; V224-Y272 HydrophobicContact CG2-CE1 3.52Å; V224-Y272 HydrophobicContact CG2-CE2 3.71Å; V224-Y272 HydrophobicContact CG2-CG 4.12Å; V224-Y272 VanDerWaalsContact CG2-CZ 3.42Å; V224-Y272 PolarHBondContact N-OH 2.7Å; D227-Y272 HydrophobicContact CB-CE2 4.35Å; D227-Y272 PolarHBondContact OD2-OH 2.99Å; F249-Y272 HydrophobicContact CB-CD2 4.03Å; F249-Y272 AromaticContact CD1-CD2 3.37Å; F249-Y272 HydrophobicContact CD1-CD2 3.37Å; F249-Y272 AromaticContact CD1-CE2 3.57Å; F249-Y272 HydrophobicContact CD1-CE2 3.57Å; F249-Y272 HydrophobicContact CE1-CD2 4.07Å; F249-Y272 AromaticContact CE1-CE2 3.76Å; F249-Y272 HydrophobicContact CE1-CE2 3.76Å; F249-Y272 AromaticContact CG-CD2 3.93Å; F249-Y272 HydrophobicContact CG-CD2 3.93Å; F249-Y272 HydrophobicContact CG-CE2 4.41Å; F249-Y272 PolarHBondContact O-N 3.38Å; F249-Y272 VanDerWaalsContact O-N 3.1Å; R270-Y272 VanDerWaalsContact C-N 3.32Å; R270-Y272 PolarHBondContact O-N 3.37Å; Y272-H274 AromaticContact CD1-CE1 3.95Å; Y272-H274 PolarHBondContact O-N 3.08Å; Y272-L275 HydrophobicContact CD1-CD1 3.76Å; Y272-L275 HydrophobicContact CD1-CG 4.39Å; Y272-L275 HydrophobicContact CG-CD1 4.06Å; Y272-L275 PolarHBondContact O-N 3.48Å; Y272-L280 HydrophobicContact CD2-CD2 4.15Å; Y272-L280 HydrophobicContact CG-CD2 4.19Å
273L90Very high91.9Very high90 Ų9058.1 Ų58.147%0.47128%0.277SS..THydrogen-bonded Turntrans-58.7-28.9177.1-75.4172.9000114.2H250 R270 L275H250-L273 WeakPolarHBondContact O-CD2 3.07Å; R270-L273 HydrophobicContact CB-CD1 3.87Å; R270-L273 HydrophobicContact CB-CD2 4.45Å; R270-L273 HydrophobicContact CB-CG 4.01Å; R270-L273 HydrophobicContact CG-CD1 4.22Å; R270-L273 HydrophobicContact CG-CD2 4.33Å; R270-L273 HydrophobicContact CG-CG 4.39Å; R270-L273 WeakPolarHBondContact O-CG 3.33Å; L273-L275 VanDerWaalsContact C-N 3.34Å
274H87.1Confident92Very high104 Ų10457.6 Ų57.648%0.48127%0.272SS..THydrogen-bonded Turntrans-79.6-18-177.961-83.1000113Y272Y272-H274 AromaticContact CD1-CE1 3.95Å; Y272-H274 PolarHBondContact O-N 3.08Å
275L89.3Confident91.9Very high16 Ų1652.9 Ų52.98%0.08425%0.253CS..SBendtrans-86.2154.2176.8-58.3-175.4000110.5L217 W220 V224 H250 Y272 L273 L280L217-L275 HydrophobicContact CD2-CD2 4.07Å; W220-L275 HydrophobicContact CB-CD1 4.25Å; V224-L275 HydrophobicContact CG2-CD1 3.66Å; H250-L275 PolarHBondContact NE2-O 3.18Å; Y272-L275 HydrophobicContact CD1-CD1 3.76Å; Y272-L275 HydrophobicContact CD1-CG 4.39Å; Y272-L275 HydrophobicContact CG-CD1 4.06Å; Y272-L275 PolarHBondContact O-N 3.48Å; L273-L275 VanDerWaalsContact C-N 3.34Å; L275-L280 HydrophobicContact CB-CD2 4.4Å; L275-L280 HydrophobicContact CB-CG 4.35Å; L275-L280 HydrophobicContact CD1-CD2 4.08Å
276S88.8Confident91.9Very high62 Ų6255.9 Ų55.943%0.43427%0.266SS..  trans-67.8138.8175.977.90000109.7H278 A279 L280S276-H278 PolarHBondContact O-N 3.15Å; S276-A279 PolarHBondContact O-N 2.78Å; S276-A279 WeakPolarHBondContact OG-CB 3.22Å; S276-A279 PolarHBondContact OG-N 3.21Å; S276-L280 PolarHBondContact O-N 3Å
277F88.5Confident91.9Very high43 Ų4347.2 Ų47.219%0.18923%0.234CC..Hα-helixtrans-57.6-39.7177.8-176.4-96.2000111.3R243 A246 R247 H250 I252 L280 V281R243-F277 HydrophobicContact CG-CE1 4.09Å; R243-F277 HydrophobicContact CG-CZ 3.83Å; A246-F277 HydrophobicContact CB-CD2 4.25Å; A246-F277 HydrophobicContact CB-CE2 3.74Å; A246-F277 HydrophobicContact CB-CZ 3.91Å; R247-F277 HydrophobicContact CG-CE2 3.92Å; R247-F277 HydrophobicContact CG-CZ 3.92Å; H250-F277 HydrophobicContact CB-CD2 4.1Å; H250-F277 HydrophobicContact CB-CE2 4.49Å; I252-F277 HydrophobicContact CD1-CD2 4.27Å; I252-F277 HydrophobicContact CD1-CE2 4.23Å; F277-L280 PolarHBondContact O-N 3.24Å; F277-V281 HydrophobicContact CD1-CG2 3.91Å; F277-V281 HydrophobicContact CE1-CG2 3.56Å; F277-V281 HydrophobicContact CZ-CG2 4.05Å; F277-V281 WeakPolarHBondContact O-CG2 3.38Å; F277-V281 PolarHBondContact O-N 2.64Å
278H86.3Confident91.7Very high82 Ų8243.1 Ų43.138%0.3822%0.221SC..Hα-helixtrans-65.9-37.1177.4-72.3-73.4000113.8Y138 S276 L280 V281 G282Y138-H278 AromaticContact CD1-CE1 3.69Å; Y138-H278 AromaticContact CD1-NE2 3.61Å; Y138-H278 AromaticContact CE1-CE1 3.56Å; Y138-H278 AromaticContact CE1-NE2 2.99Å; Y138-H278 WeakPolarHBondContact CE1-NE2 3.35Å; Y138-H278 AromaticContact CZ-NE2 3.65Å; S276-H278 PolarHBondContact O-N 3.15Å; H278-L280 VanDerWaalsContact C-N 3.32Å; H278-L280 PolarHBondContact O-N 2.98Å; H278-V281 PolarHBondContact O-N 2.93Å; H278-G282 PolarHBondContact O-N 2.99Å
279A89.1Confident91.3Very high25 Ų2548.4 Ų48.421%0.20725%0.249CC..Hα-helixtrans-62.7-42.7173.900000110.8L217 S276 V281 G282 L283L217-A279 HydrophobicContact CD2-CB 3.73Å; S276-A279 PolarHBondContact O-N 2.78Å; S276-A279 WeakPolarHBondContact OG-CB 3.22Å; S276-A279 PolarHBondContact OG-N 3.21Å; A279-V281 PolarHBondContact O-N 3.18Å; A279-G282 PolarHBondContact O-N 2.94Å; A279-L283 WeakPolarHBondContact O-CG 3.29Å; A279-L283 PolarHBondContact O-N 3.08Å
280L92.7Very high90.8Very high2 Ų252.2 Ų52.21%0.0127%0.268CS..Hα-helixtrans-62.9-40.4175.3-65.5176.7000112.5V224 A246 F249 Y272 L275 S276 F277 H278 A284V224-L280 HydrophobicContact CG1-CD2 3.77Å; V224-L280 HydrophobicContact CG2-CD2 4.38Å; A246-L280 HydrophobicContact CB-CB 3.91Å; F249-L280 HydrophobicContact CB-CD1 4.2Å; Y272-L280 HydrophobicContact CD2-CD2 4.15Å; Y272-L280 HydrophobicContact CG-CD2 4.19Å; L275-L280 HydrophobicContact CB-CD2 4.4Å; L275-L280 HydrophobicContact CB-CG 4.35Å; L275-L280 HydrophobicContact CD1-CD2 4.08Å; S276-L280 PolarHBondContact O-N 3Å; F277-L280 PolarHBondContact O-N 3.24Å; H278-L280 VanDerWaalsContact C-N 3.32Å; H278-L280 PolarHBondContact O-N 2.98Å; L280-A284 VanDerWaalsContact O-CB 3.23Å; L280-A284 WeakPolarHBondContact O-CB 3.46Å; L280-A284 PolarHBondContact O-N 3.25Å
281V92.1Very high89.7Confident15 Ų1549.9 Ų49.99%0.09127%0.268CS..Hα-helixtrans-62.1-43.4174.3173.30000110.8A246 F277 H278 A279 A284 T285A246-V281 HydrophobicContact CB-CB 4.44Å; A246-V281 HydrophobicContact CB-CG2 3.51Å; F277-V281 HydrophobicContact CD1-CG2 3.91Å; F277-V281 HydrophobicContact CE1-CG2 3.56Å; F277-V281 HydrophobicContact CZ-CG2 4.05Å; F277-V281 WeakPolarHBondContact O-CG2 3.38Å; F277-V281 PolarHBondContact O-N 2.64Å; H278-V281 PolarHBondContact O-N 2.93Å; A279-V281 PolarHBondContact O-N 3.18Å; V281-A284 PolarHBondContact O-N 3.27Å; V281-T285 WeakPolarHBondContact O-CB 3.36Å; V281-T285 PolarHBondContact O-N 3.24Å; V281-T285 PolarHBondContact O-OG1 3.31Å
282G91Very high88Confident31 Ų3150.6 Ų50.632%0.3229%0.288SS..Hα-helixtrans-59-53.9177.300000112H278 A279 A284 T285 E286H278-G282 PolarHBondContact O-N 2.99Å; A279-G282 PolarHBondContact O-N 2.94Å; G282-A284 VanDerWaalsContact C-N 3.34Å; G282-A284 PolarHBondContact O-N 3.13Å; G282-T285 WeakPolarHBondContact O-CB 3.41Å; G282-T285 PolarHBondContact O-N 3.46Å; G282-T285 VanDerWaalsContact O-N 3.15Å; G282-E286 PolarHBondContact O-N 2.8Å; G282-E286 VanDerWaalsContact O-N 3.13Å
283L93.4Very high85.9Confident13 Ų1363.8 Ų63.87%0.06834%0.338CS..Hα-helixtrans-58.9-44.2177.4-65.3173.6000111.9E221 V224 R225 I228 A279 T285 E286 E287E221-L283 HydrophobicContact CG-CD1 4.23Å; E221-L283 HydrophobicContact CG-CD2 4.15Å; V224-L283 HydrophobicContact CB-CD1 3.93Å; V224-L283 HydrophobicContact CG1-CB 4.35Å; V224-L283 HydrophobicContact CG1-CD1 3.56Å; V224-L283 HydrophobicContact CG2-CD1 4.49Å; R225-L283 HydrophobicContact CG-CD2 4.28Å; R225-L283 VanDerWaalsContact CZ-CD2 3.41Å; I228-L283 HydrophobicContact CD1-CB 4.17Å; A279-L283 WeakPolarHBondContact O-CG 3.29Å; A279-L283 PolarHBondContact O-N 3.08Å; L283-T285 VanDerWaalsContact C-N 3.32Å; L283-T285 PolarHBondContact O-N 2.94Å; L283-E286 PolarHBondContact O-N 3.37Å; L283-E287 WeakPolarHBondContact O-CG 3.37Å; L283-E287 PolarHBondContact O-N 3.46Å
284A93.7Very high85.7Confident0 Ų062.5 Ų62.50%033%0.331CS..Hα-helixtrans-64.8-35.5178.100000112.9I228 V245 L280 V281 G282 E287 L288I228-A284 HydrophobicContact CD1-CB 4.15Å; V245-A284 HydrophobicContact CB-CB 3.91Å; V245-A284 HydrophobicContact CG1-CB 3.85Å; L280-A284 VanDerWaalsContact O-CB 3.23Å; L280-A284 WeakPolarHBondContact O-CB 3.46Å; L280-A284 PolarHBondContact O-N 3.25Å; V281-A284 PolarHBondContact O-N 3.27Å; G282-A284 VanDerWaalsContact C-N 3.34Å; G282-A284 PolarHBondContact O-N 3.13Å; A284-E287 PolarHBondContact O-N 2.89Å; A284-L288 WeakPolarHBondContact O-CB 3.35Å; A284-L288 VanDerWaalsContact O-CG 3.29Å; A284-L288 WeakPolarHBondContact O-CG 3.3Å; A284-L288 PolarHBondContact O-N 2.98Å
285T92.2Very high85.6Confident55 Ų5560.3 Ų60.334%0.33732%0.323SS..Hα-helixtrans-62.3-47.3176-58.40000110.4S242 V281 G282 L283 E287 L288 L289S242-T285 WeakPolarHBondContact CB-OG1 3.46Å; S242-T285 PolarHBondContact OG-OG1 3.26Å; S242-T285 VanDerWaalsContact OG-OG1 3.1Å; V281-T285 WeakPolarHBondContact O-CB 3.36Å; V281-T285 PolarHBondContact O-N 3.24Å; V281-T285 PolarHBondContact O-OG1 3.31Å; G282-T285 WeakPolarHBondContact O-CB 3.41Å; G282-T285 PolarHBondContact O-N 3.46Å; G282-T285 VanDerWaalsContact O-N 3.15Å; L283-T285 VanDerWaalsContact C-N 3.32Å; L283-T285 PolarHBondContact O-N 2.94Å; T285-E287 PolarHBondContact O-N 3.43Å; T285-L288 PolarHBondContact O-N 3.29Å; T285-L289 HydrophobicContact CG2-CD1 4.3Å; T285-L289 VanDerWaalsContact O-CG 3.31Å; T285-L289 WeakPolarHBondContact O-CG 3.28Å; T285-L289 PolarHBondContact O-N 3.26Å; T285-L289 VanDerWaalsContact O-N 3.1Å
286E92.6Very high85.4Confident90 Ų9062.7 Ų62.742%0.42134%0.337SS..Hα-helixtrans-63.4-41.7178.9-67.1176.7-156.500112.8R225 G282 L283 L289 Q290R225-E286 IonicContact CZ-OE2 2.67Å; R225-E286 IonicContact NH1-OE2 2.76Å; R225-E286 PolarHBondContact NH1-OE2 2.93Å; R225-E286 IonicContact NH2-OE1 3.56Å; R225-E286 IonicContact NH2-OE2 3.59Å; R225-E286 PolarHBondContact NH2-OE2 3.2Å; G282-E286 PolarHBondContact O-N 2.8Å; G282-E286 VanDerWaalsContact O-N 3.13Å; L283-E286 PolarHBondContact O-N 3.37Å; E286-L289 PolarHBondContact O-N 2.91Å; E286-Q290 WeakPolarHBondContact O-CG 3.48Å; E286-Q290 PolarHBondContact O-N 2.92Å
287E93.6Very high85.2Confident1 Ų162.8 Ų62.81%0.00533%0.331CS..Hα-helixtrans-68.3-39.3178.4-66-53.3138.100112.3R225 I228 R229 L283 A284 T285 L289 Q290 V291R225-E287 HydrophobicContact CB-CG 4.25Å; R225-E287 VanDerWaalsContact CD-OE1 3.29Å; R225-E287 WeakPolarHBondContact CD-OE1 3.42Å; R225-E287 HydrophobicContact CG-CG 4.14Å; R225-E287 VanDerWaalsContact CG-OE1 3.28Å; R225-E287 WeakPolarHBondContact CG-OE1 3.34Å; R225-E287 IonicContact CZ-OE1 3.13Å; R225-E287 IonicContact NE-OE1 2.87Å; R225-E287 IonicContact NH1-OE1 2.8Å; R225-E287 PolarHBondContact NH1-OE1 2.92Å; I228-E287 HydrophobicContact CB-CG 4.42Å; I228-E287 HydrophobicContact CG2-CB 3.75Å; I228-E287 HydrophobicContact CG2-CG 4.07Å; R229-E287 IonicContact CZ-OE2 3.67Å; R229-E287 VanDerWaalsContact CZ-OE2 3.23Å; R229-E287 IonicContact NE-OE2 3.52Å; R229-E287 PolarHBondContact NE-OE2 3.29Å; R229-E287 IonicContact NH2-OE1 3.14Å; R229-E287 PolarHBondContact NH2-OE1 3.47Å; R229-E287 VanDerWaalsContact NH2-OE1 3.14Å; R229-E287 IonicContact NH2-OE2 2.94Å; R229-E287 PolarHBondContact NH2-OE2 2.81Å; L283-E287 WeakPolarHBondContact O-CG 3.37Å; L283-E287 PolarHBondContact O-N 3.46Å; A284-E287 PolarHBondContact O-N 2.89Å; T285-E287 PolarHBondContact O-N 3.43Å; E287-L289 VanDerWaalsContact C-N 3.32Å; E287-L289 PolarHBondContact O-N 2.8Å; E287-Q290 PolarHBondContact O-N 3.3Å; E287-Q290 VanDerWaalsContact O-N 3.15Å; E287-V291 WeakPolarHBondContact O-CG2 3.45Å; E287-V291 PolarHBondContact O-N 3.13Å
288L89.9Confident85Confident42 Ų4264 Ų6422%0.2234%0.34CS..Hα-helixtrans-64.1-37.3176-76.5167.4000112.1L232 S242 A284 T285 Q290 V291 A292L232-L288 HydrophobicContact CD1-CD2 3.82Å; L232-L288 HydrophobicContact CD1-CG 4.4Å; L232-L288 HydrophobicContact CD2-CD2 4.02Å; S242-L288 VanDerWaalsContact N-CD1 3.3Å; A284-L288 WeakPolarHBondContact O-CB 3.35Å; A284-L288 VanDerWaalsContact O-CG 3.29Å; A284-L288 WeakPolarHBondContact O-CG 3.3Å; A284-L288 PolarHBondContact O-N 2.98Å; T285-L288 PolarHBondContact O-N 3.29Å; L288-Q290 VanDerWaalsContact C-N 3.26Å; L288-Q290 PolarHBondContact O-N 3.44Å; L288-V291 PolarHBondContact O-N 2.95Å; L288-A292 WeakPolarHBondContact O-CB 3.42Å; L288-A292 PolarHBondContact O-N 3.34Å; L288-A292 VanDerWaalsContact O-N 3.09Å
289L87.6Confident84.9Confident114 Ų11462.8 Ų62.860%0.59734%0.337SS*.Hα-helixtrans-66.3-28174.9-70.6172.7000112.9T285 E286 E287T285-L289 HydrophobicContact CG2-CD1 4.3Å; T285-L289 VanDerWaalsContact O-CG 3.31Å; T285-L289 WeakPolarHBondContact O-CG 3.28Å; T285-L289 PolarHBondContact O-N 3.26Å; T285-L289 VanDerWaalsContact O-N 3.1Å; E286-L289 PolarHBondContact O-N 2.91Å; E287-L289 VanDerWaalsContact C-N 3.32Å; E287-L289 PolarHBondContact O-N 2.8Å
290Q84.8Confident84.6Confident97 Ų9765.5 Ų65.545%0.45335%0.347SS..Hα-helixtrans-78.3-35.7175.6-70175.431.100112.3E286 E287 L288E286-Q290 WeakPolarHBondContact O-CG 3.48Å; E286-Q290 PolarHBondContact O-N 2.92Å; E287-Q290 PolarHBondContact O-N 3.3Å; E287-Q290 VanDerWaalsContact O-N 3.15Å; L288-Q290 VanDerWaalsContact C-N 3.26Å; L288-Q290 PolarHBondContact O-N 3.44Å
291V72.3Confident84Confident89 Ų8970.4 Ų70.454%0.53937%0.373SS..Hα-helixtrans-75.7-24.6178.9175.10000112.5L232 E287 L288 R293L232-V291 HydrophobicContact CD1-CG2 4.37Å; E287-V291 WeakPolarHBondContact O-CG2 3.45Å; E287-V291 PolarHBondContact O-N 3.13Å; L288-V291 PolarHBondContact O-N 2.95Å; V291-R293 PolarHBondContact O-N 2.68Å
292A60.6Low83.3Confident90 Ų9075 Ų7574%0.74440%0.396SS*.THydrogen-bonded Turntrans-77.2-3.9176.500000114.5L288L288-A292 WeakPolarHBondContact O-CB 3.42Å; L288-A292 PolarHBondContact O-N 3.34Å; L288-A292 VanDerWaalsContact O-N 3.09Å
293R47.9Very low82.6Confident278 Ų27879 Ų79100%1.04940%0.403SS*.  trans-97.70175.3-71.4-178.1177.2179.80.5111.1V291V291-R293 PolarHBondContact O-N 2.68Å

Retrieved 293 of 293 residues in 173.6 ms (Link to these results)

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