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BAG family molecular chaperone regulator 5

Co-chaperone for HSP/HSP70 proteins. It functions as a nucleotide-exchange factor promoting the release of ADP from HSP70, thereby activating HSP70-mediated protein refolding. Has an essential role in maintaining proteostasis at junctional membrane complexes (JMC), where it may function as a scaffold between the HSPA8 chaperone and JMC proteins enabling correct, HSPA8-dependent JMC protein folding. Inhibits both auto-ubiquitination of PRKN and ubiquitination of target proteins by PRKN.

AlphaFold DB (Q9UL15), UniProt , Accession A0A024R6M6, Species HUMAN (Homo sapiens, Human), Gene BAG5, Length 447 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
1M36.2Very low69Low244 Ų244103.6 Ų103.6100%1.20257%0.569SS**  0125.30-72.8176.8178.400105.9M3M1-M3 PolarHBondContact O-N 2.96Å
2D43.9Very low71Confident163 Ų163102.3 Ų102.387%0.87255%0.549SS*.  trans-40.3130.5-179.7-85.1-46.7000111.4G4D2-G4 PolarHBondContact O-N 3.26Å
3M46.2Very low72.9Confident189 Ų18994.5 Ų94.593%0.93151%0.507SS*.  trans-68.763.7160.7-68.7-79-78.600107M1 N5M1-M3 PolarHBondContact O-N 2.96Å; M3-N5 PolarHBondContact O-N 2.82Å; M3-N5 VanDerWaalsContact O-N 3.15Å
4G50.4Low74.4Confident50 Ų5092.6 Ų92.652%0.51549%0.494SS..  trans-52.4122.6-165.400000108.9D2 Q6D2-G4 PolarHBondContact O-N 3.26Å; G4-Q6 PolarHBondContact O-N 2.93Å
5N58.6Low75.7Confident167 Ų16792.7 Ų92.789%0.89349%0.49SS*.  trans-34.1104171.5-86.5-16.3000109.1M3 H7M3-N5 PolarHBondContact O-N 2.82Å; M3-N5 VanDerWaalsContact O-N 3.15Å; N5-H7 PolarHBondContact O-N 3.44Å
6Q71.8Confident76.8Confident108 Ų10886.9 Ų86.951%0.50546%0.459SS..  trans-57.3136.8171.1-86.2-176.7-11.100107.2G4 S11G4-Q6 PolarHBondContact O-N 2.93Å; Q6-S11 WeakPolarHBondContact CB-OG 3.31Å; Q6-S11 PolarHBondContact OE1-OG 3.39Å
7H84.8Confident77.9Confident39 Ų3985.1 Ų85.118%0.18145%0.448CS..  trans-55.9134176.2-163.2-86.7000109.6N5 S9 I10 S11 E59 K61 I64N5-H7 PolarHBondContact O-N 3.44Å; H7-S9 PolarHBondContact CE1-OG 3.01Å; H7-S9 VanDerWaalsContact CE1-OG 3.28Å; H7-S9 WeakPolarHBondContact ND1-CB 3.43Å; H7-S9 PolarHBondContact ND1-N 2.87Å; H7-S9 PolarHBondContact ND1-OG 3.19Å; H7-S9 VanDerWaalsContact ND1-OG 3.13Å; H7-S9 PolarHBondContact O-N 3.38Å; H7-S9 VanDerWaalsContact O-N 3.13Å; H7-I10 HydrophobicContact CB-CB 4.19Å; H7-I10 HydrophobicContact CB-CG1 3.92Å; H7-I10 WeakPolarHBondContact O-CA 3.44Å; H7-I10 WeakPolarHBondContact O-CB 3.26Å; H7-I10 PolarHBondContact O-N 3.14Å; H7-S11 PolarHBondContact O-N 2.63Å; H7-E59 IonicContact CE1-OE1 3.05Å; H7-E59 PolarHBondContact CE1-OE1 3.17Å; H7-E59 VanDerWaalsContact CE1-OE1 3.28Å; H7-E59 IonicContact CE1-OE2 3.16Å; H7-E59 IonicContact NE2-OE1 2.72Å; H7-E59 PolarHBondContact NE2-OE1 3.27Å; H7-E59 IonicContact NE2-OE2 3.57Å; H7-E59 PolarHBondContact NE2-OE2 3.22Å; H7-K61 PolarHBondContact CD2-NZ 2.81Å; H7-K61 VanDerWaalsContact CD2-NZ 3.25Å; H7-K61 PolarHBondContact NE2-NZ 3.16Å; H7-I64 HydrophobicContact CB-CD1 4.3Å; H7-I64 VanDerWaalsContact ND1-CD1 3.33Å; H7-I64 WeakPolarHBondContact ND1-CD1 3.43Å
8P90Very high78.9Confident101 Ų10188.7 Ų88.766%0.65646%0.459SS*.Hα-helixtrans-50.5-41.5179.5-29.335.1000113.3I10 S11 R12P8-I10 PolarHBondContact O-N 3.02Å; P8-S11 PolarHBondContact O-N 2.68Å; P8-R12 WeakPolarHBondContact O-CB 3.43Å; P8-R12 PolarHBondContact O-N 3.45Å
9S92.4Very high79.7Confident16 Ų1688.3 Ų88.311%0.11246%0.455CS..Hα-helixtrans-60.5-38.8174.2-46.70000113.9H7 L13 D57H7-S9 PolarHBondContact CE1-OG 3.01Å; H7-S9 VanDerWaalsContact CE1-OG 3.28Å; H7-S9 WeakPolarHBondContact ND1-CB 3.43Å; H7-S9 PolarHBondContact ND1-N 2.87Å; H7-S9 PolarHBondContact ND1-OG 3.19Å; H7-S9 VanDerWaalsContact ND1-OG 3.13Å; H7-S9 PolarHBondContact O-N 3.38Å; H7-S9 VanDerWaalsContact O-N 3.13Å; S9-L13 VanDerWaalsContact O-CG 3.3Å; S9-L13 WeakPolarHBondContact O-CG 3.36Å; S9-L13 PolarHBondContact O-N 3.11Å; S9-D57 WeakPolarHBondContact CB-O 3.3Å; S9-D57 PolarHBondContact OG-O 3.37Å
10I92.7Very high80.5Confident28 Ų2883.9 Ų83.914%0.14443%0.432CS..Hα-helixtrans-69.7-44.9177.8-67.7-66.6000110.1H7 P8 R12 L13 Q14 I64 A67H7-I10 HydrophobicContact CB-CB 4.19Å; H7-I10 HydrophobicContact CB-CG1 3.92Å; H7-I10 WeakPolarHBondContact O-CA 3.44Å; H7-I10 WeakPolarHBondContact O-CB 3.26Å; H7-I10 PolarHBondContact O-N 3.14Å; P8-I10 PolarHBondContact O-N 3.02Å; I10-R12 VanDerWaalsContact C-N 3.28Å; I10-R12 PolarHBondContact O-N 2.9Å; I10-L13 PolarHBondContact O-N 3.27Å; I10-Q14 WeakPolarHBondContact O-CG 3.37Å; I10-Q14 PolarHBondContact O-N 3.01Å; I10-I64 HydrophobicContact CD1-CB 4.2Å; I10-I64 HydrophobicContact CD1-CG1 3.89Å; I10-I64 HydrophobicContact CD1-CG2 4.29Å; I10-I64 HydrophobicContact CG1-CG1 3.99Å; I10-A67 HydrophobicContact CD1-CB 3.77Å
11S92.5Very high81.2Confident35 Ų3586.6 Ų86.625%0.24544%0.441CS..Hα-helixtrans-60.5-41.2176.1-59.10000111.1Q6 H7 P8 Q14 E15Q6-S11 WeakPolarHBondContact CB-OG 3.31Å; Q6-S11 PolarHBondContact OE1-OG 3.39Å; H7-S11 PolarHBondContact O-N 2.63Å; P8-S11 PolarHBondContact O-N 2.68Å; S11-Q14 WeakPolarHBondContact O-CB 3.39Å; S11-Q14 PolarHBondContact O-N 3.09Å; S11-E15 WeakPolarHBondContact O-CG 3.26Å; S11-E15 PolarHBondContact O-N 2.92Å
12R92.9Very high84Confident87 Ų8778.8 Ų78.833%0.32841%0.41SS..Hα-helixtrans-62.2-45.1175.3-176.958.6-175.7154.44.4112.8P8 I10 Q14 E15 I16 E52 V56P8-R12 WeakPolarHBondContact O-CB 3.43Å; P8-R12 PolarHBondContact O-N 3.45Å; I10-R12 VanDerWaalsContact C-N 3.28Å; I10-R12 PolarHBondContact O-N 2.9Å; R12-Q14 VanDerWaalsContact C-N 3.29Å; R12-Q14 PolarHBondContact O-N 3.05Å; R12-E15 IonicContact NH1-OE2 3.73Å; R12-E15 PolarHBondContact NH1-OE2 2.97Å; R12-E15 VanDerWaalsContact NH1-OE2 3.09Å; R12-E15 WeakPolarHBondContact O-CB 3.45Å; R12-E15 PolarHBondContact O-N 3.33Å; R12-I16 HydrophobicContact CG-CD1 4.19Å; R12-I16 WeakPolarHBondContact O-CG1 3.27Å; R12-I16 PolarHBondContact O-N 3.31Å; R12-I16 VanDerWaalsContact O-N 3.07Å; R12-E52 IonicContact CZ-OE2 2.94Å; R12-E52 IonicContact NH2-OE2 3.7Å; R12-E52 PolarHBondContact NH2-OE2 3.42Å; R12-V56 HydrophobicContact CG-CG2 4.35Å
13L94.8Very high86.5Confident2 Ų271.5 Ų71.51%0.0137%0.371CS..Hα-helixtrans-61.3-38.5175.5-74167.7000111.9S9 I10 I16 Q17 I53 V56 I64 A67 R68 A71S9-L13 VanDerWaalsContact O-CG 3.3Å; S9-L13 WeakPolarHBondContact O-CG 3.36Å; S9-L13 PolarHBondContact O-N 3.11Å; I10-L13 PolarHBondContact O-N 3.27Å; L13-I16 PolarHBondContact O-N 2.9Å; L13-Q17 WeakPolarHBondContact O-CB 3.31Å; L13-Q17 VanDerWaalsContact O-CG 3.31Å; L13-Q17 WeakPolarHBondContact O-CG 3.48Å; L13-Q17 PolarHBondContact O-N 3.11Å; L13-I53 HydrophobicContact CD2-CG1 4.38Å; L13-I53 HydrophobicContact CD2-CG2 4.08Å; L13-V56 HydrophobicContact CD1-CG1 4.2Å; L13-V56 HydrophobicContact CD2-CB 4.29Å; L13-V56 HydrophobicContact CD2-CG1 4.44Å; L13-V56 HydrophobicContact CD2-CG2 3.85Å; L13-V56 HydrophobicContact CG-CB 4.49Å; L13-V56 HydrophobicContact CG-CG1 4.11Å; L13-V56 HydrophobicContact CG-CG2 4.14Å; L13-I64 HydrophobicContact CD1-CG2 4.22Å; L13-A67 HydrophobicContact CD1-CB 3.83Å; L13-R68 HydrophobicContact CD1-CB 4.07Å; L13-R68 HydrophobicContact CD2-CB 4.25Å; L13-R68 HydrophobicContact CD2-CG 4.3Å; L13-A71 HydrophobicContact CD2-CB 4.31Å
14Q94Very high88.8Confident68 Ų6864.3 Ų64.332%0.31834%0.336SS..Hα-helixtrans-67.2-36176.6-71.8174.2700112.6I10 S11 R12 K18I10-Q14 WeakPolarHBondContact O-CG 3.37Å; I10-Q14 PolarHBondContact O-N 3.01Å; S11-Q14 WeakPolarHBondContact O-CB 3.39Å; S11-Q14 PolarHBondContact O-N 3.09Å; R12-Q14 VanDerWaalsContact C-N 3.29Å; R12-Q14 PolarHBondContact O-N 3.05Å; Q14-K18 WeakPolarHBondContact O-CG 3.41Å; Q14-K18 PolarHBondContact O-N 3.49Å; Q14-K18 VanDerWaalsContact O-N 3.09Å
15E94.3Very high90.8Very high93 Ų9368.2 Ų68.244%0.43534%0.34SS..Hα-helixtrans-62.7-50.2172.6-71.9170.1-177.500111.3S11 R12 Q17 K18 E19S11-E15 WeakPolarHBondContact O-CG 3.26Å; S11-E15 PolarHBondContact O-N 2.92Å; R12-E15 IonicContact NH1-OE2 3.73Å; R12-E15 PolarHBondContact NH1-OE2 2.97Å; R12-E15 VanDerWaalsContact NH1-OE2 3.09Å; R12-E15 WeakPolarHBondContact O-CB 3.45Å; R12-E15 PolarHBondContact O-N 3.33Å; E15-Q17 VanDerWaalsContact C-N 3.3Å; E15-Q17 PolarHBondContact O-N 3.35Å; E15-K18 WeakPolarHBondContact O-CB 3.43Å; E15-K18 PolarHBondContact O-N 2.98Å; E15-E19 PolarHBondContact O-N 3.5Å; E15-E19 VanDerWaalsContact O-N 3.12Å
16I93.9Very high92.5Very high0 Ų065.2 Ų65.20%032%0.321CS..Hα-helixtrans-58.2-44.5177.3-65.9163.9000110.5R12 L13 K18 E19 V20 Q49 E52 I53R12-I16 HydrophobicContact CG-CD1 4.19Å; R12-I16 WeakPolarHBondContact O-CG1 3.27Å; R12-I16 PolarHBondContact O-N 3.31Å; R12-I16 VanDerWaalsContact O-N 3.07Å; L13-I16 PolarHBondContact O-N 2.9Å; I16-K18 VanDerWaalsContact C-N 3.29Å; I16-K18 PolarHBondContact O-N 3.42Å; I16-E19 WeakPolarHBondContact O-CB 3.41Å; I16-E19 PolarHBondContact O-N 2.93Å; I16-V20 HydrophobicContact CG2-CG2 4.21Å; I16-V20 WeakPolarHBondContact O-CG2 3.5Å; I16-V20 PolarHBondContact O-N 2.9Å; I16-Q49 HydrophobicContact CG2-CB 3.98Å; I16-Q49 HydrophobicContact CG2-CG 4.42Å; I16-E52 HydrophobicContact CD1-CB 3.8Å; I16-E52 HydrophobicContact CG1-CB 4.42Å; I16-I53 HydrophobicContact CB-CG1 4.43Å; I16-I53 HydrophobicContact CD1-CG1 4.18Å; I16-I53 HydrophobicContact CG2-CD1 3.77Å; I16-I53 HydrophobicContact CG2-CG1 3.57Å
17Q95.2Very high93.6Very high57 Ų5760 Ų6027%0.26630%0.297SS..Hα-helixtrans-60.8-34.6176.3-77.9-178.5-3600113.3L13 E15 K21 A71L13-Q17 WeakPolarHBondContact O-CB 3.31Å; L13-Q17 VanDerWaalsContact O-CG 3.31Å; L13-Q17 WeakPolarHBondContact O-CG 3.48Å; L13-Q17 PolarHBondContact O-N 3.11Å; E15-Q17 VanDerWaalsContact C-N 3.3Å; E15-Q17 PolarHBondContact O-N 3.35Å; Q17-K21 WeakPolarHBondContact O-CB 3.38Å; Q17-K21 PolarHBondContact O-N 3.32Å; Q17-A71 HydrophobicContact CG-CB 3.93Å
18K95.2Very high94Very high149 Ų14960.7 Ų60.765%0.64830%0.301SS*.Hα-helixtrans-65.2-40.8173.3-71.8168.8-175.3173.50111.3Q14 E15 I16 K21 S22Q14-K18 WeakPolarHBondContact O-CG 3.41Å; Q14-K18 PolarHBondContact O-N 3.49Å; Q14-K18 VanDerWaalsContact O-N 3.09Å; E15-K18 WeakPolarHBondContact O-CB 3.43Å; E15-K18 PolarHBondContact O-N 2.98Å; I16-K18 VanDerWaalsContact C-N 3.29Å; I16-K18 PolarHBondContact O-N 3.42Å; K18-K21 PolarHBondContact O-N 3.12Å; K18-S22 PolarHBondContact O-N 3.46Å
19E94.4Very high94.1Very high81 Ų8156.7 Ų56.738%0.37928%0.278SS..Hα-helixtrans-65.1-46.4176-66.2-175.5-158.900111.4E15 I16 K21 S22 Q49E15-E19 PolarHBondContact O-N 3.5Å; E15-E19 VanDerWaalsContact O-N 3.12Å; I16-E19 WeakPolarHBondContact O-CB 3.41Å; I16-E19 PolarHBondContact O-N 2.93Å; E19-K21 VanDerWaalsContact C-N 3.35Å; E19-K21 PolarHBondContact O-N 3.02Å; E19-S22 WeakPolarHBondContact O-CB 3.44Å; E19-S22 PolarHBondContact O-N 3.42Å; E19-S22 VanDerWaalsContact O-N 3.11Å; E19-S22 PolarHBondContact O-OG 2.92Å; E19-Q49 PolarHBondContact OE2-NE2 3.35Å
20V95.8Very high94.2Very high1 Ų156.6 Ų56.61%0.00628%0.276CS..Hα-helixtrans-57.8-46.7175.1173.80000111.1I16 S22 V23 E24 L46 Q49 T75 L78I16-V20 HydrophobicContact CG2-CG2 4.21Å; I16-V20 WeakPolarHBondContact O-CG2 3.5Å; I16-V20 PolarHBondContact O-N 2.9Å; V20-S22 PolarHBondContact O-N 3Å; V20-V23 WeakPolarHBondContact O-CG2 3.43Å; V20-V23 PolarHBondContact O-N 3.32Å; V20-V23 VanDerWaalsContact O-N 3.15Å; V20-E24 PolarHBondContact O-N 3.21Å; V20-E24 VanDerWaalsContact O-N 3.14Å; V20-L46 HydrophobicContact CG1-CD2 4.47Å; V20-Q49 HydrophobicContact CG2-CB 3.8Å; V20-Q49 HydrophobicContact CG2-CG 3.87Å; V20-T75 HydrophobicContact CG2-CG2 4.47Å; V20-L78 HydrophobicContact CG1-CD1 3.49Å; V20-L78 VanDerWaalsContact CG1-CD1 3.49Å
21K95.1Very high94.2Very high141 Ų14156.5 Ų56.561%0.61328%0.277SS*.Hα-helixtrans-63.2-29.2177.6-170169.7-173.8172.40113.1Q17 K18 E19 V23Q17-K21 WeakPolarHBondContact O-CB 3.38Å; Q17-K21 PolarHBondContact O-N 3.32Å; K18-K21 PolarHBondContact O-N 3.12Å; E19-K21 VanDerWaalsContact C-N 3.35Å; E19-K21 PolarHBondContact O-N 3.02Å; K21-V23 VanDerWaalsContact C-N 3.27Å; K21-V23 PolarHBondContact O-N 3.02Å
22S95.5Very high94.3Very high80 Ų8055.2 Ų55.256%0.55927%0.27SS*.Hα-helixtrans-68.5-25.2177.480.20000113.4K18 E19 V20K18-S22 PolarHBondContact O-N 3.46Å; E19-S22 WeakPolarHBondContact O-CB 3.44Å; E19-S22 PolarHBondContact O-N 3.42Å; E19-S22 VanDerWaalsContact O-N 3.11Å; E19-S22 PolarHBondContact O-OG 2.92Å; V20-S22 PolarHBondContact O-N 3Å
23V95.2Very high94.4Very high9 Ų952.5 Ų52.56%0.05526%0.261CS..Hα-helixtrans-101.7-11.8178.8-62.10000113.8V20 K21 Q25 Q26 V27 L42 I45 L46V20-V23 WeakPolarHBondContact O-CG2 3.43Å; V20-V23 PolarHBondContact O-N 3.32Å; V20-V23 VanDerWaalsContact O-N 3.15Å; K21-V23 VanDerWaalsContact C-N 3.27Å; K21-V23 PolarHBondContact O-N 3.02Å; V23-Q25 VanDerWaalsContact C-N 3.32Å; V23-Q25 PolarHBondContact O-N 3.01Å; V23-Q26 WeakPolarHBondContact O-CB 3.46Å; V23-Q26 PolarHBondContact O-N 3.35Å; V23-V27 PolarHBondContact O-N 3.49Å; V23-V27 VanDerWaalsContact O-N 3.09Å; V23-L42 HydrophobicContact CB-CD2 4.29Å; V23-I45 HydrophobicContact CG1-CD1 4.42Å; V23-I45 HydrophobicContact CG1-CG2 4.16Å; V23-I45 HydrophobicContact CG2-CG2 4.39Å; V23-L46 HydrophobicContact CG2-CD2 3.86Å
24E95.9Very high94.4Very high39 Ų3954.7 Ų54.718%0.18228%0.277CS..Hα-helixtrans-49.7-47.8-179.8174.6174.9-151.700112.9V20 Q26 V27 I28 L78V20-E24 PolarHBondContact O-N 3.21Å; V20-E24 VanDerWaalsContact O-N 3.14Å; E24-Q26 VanDerWaalsContact C-N 3.3Å; E24-Q26 PolarHBondContact O-N 2.98Å; E24-V27 WeakPolarHBondContact O-CB 3.4Å; E24-V27 PolarHBondContact O-N 3.11Å; E24-V27 VanDerWaalsContact O-N 3.16Å; E24-I28 HydrophobicContact CG-CD1 3.74Å; E24-I28 HydrophobicContact CG-CG1 4.48Å; E24-I28 WeakPolarHBondContact O-CG1 3.36Å; E24-I28 PolarHBondContact O-N 3.11Å; E24-L78 HydrophobicContact CB-CD1 4.22Å; E24-L78 HydrophobicContact CB-CD2 4.36Å; E24-L78 HydrophobicContact CG-CD2 3.96Å
25Q92.7Very high94.3Very high132 Ų13256.2 Ų56.262%0.61729%0.287SS*.Hα-helixtrans-66.1-32.2-179.8-64.7-57.5-47.500112.9V23 V27 G29V23-Q25 VanDerWaalsContact C-N 3.32Å; V23-Q25 PolarHBondContact O-N 3.01Å; Q25-V27 VanDerWaalsContact C-N 3.33Å; Q25-G29 PolarHBondContact O-N 3.36Å
26Q93.4Very high94.3Very high103 Ų10354.7 Ų54.748%0.48128%0.282SS..Hα-helixtrans-69.8-33.4175.9-64.7174.858.100111.4V23 E24 F30 L42V23-Q26 WeakPolarHBondContact O-CB 3.46Å; V23-Q26 PolarHBondContact O-N 3.35Å; E24-Q26 VanDerWaalsContact C-N 3.3Å; E24-Q26 PolarHBondContact O-N 2.98Å; Q26-F30 WeakPolarHBondContact O-CA 3.32Å; Q26-F30 WeakPolarHBondContact O-CB 3.4Å; Q26-F30 PolarHBondContact O-N 3.34Å; Q26-F30 VanDerWaalsContact O-N 3.07Å; Q26-L42 HydrophobicContact CB-CD1 4.28Å; Q26-L42 HydrophobicContact CB-CD2 3.86Å
27V95.9Very high94.4Very high0 Ų063.5 Ų63.50%032%0.321CS..Hα-helixtrans-70.6-49.5175.7170.70000111.2V23 E24 Q25 G29 F30 L42 L46 L78 E81 L82 N85V23-V27 PolarHBondContact O-N 3.49Å; V23-V27 VanDerWaalsContact O-N 3.09Å; E24-V27 WeakPolarHBondContact O-CB 3.4Å; E24-V27 PolarHBondContact O-N 3.11Å; E24-V27 VanDerWaalsContact O-N 3.16Å; Q25-V27 VanDerWaalsContact C-N 3.33Å; V27-G29 VanDerWaalsContact C-N 3.27Å; V27-G29 PolarHBondContact O-N 3.37Å; V27-F30 VanDerWaalsContact O-CB 3.28Å; V27-F30 WeakPolarHBondContact O-CB 3.41Å; V27-F30 PolarHBondContact O-N 3.42Å; V27-F30 VanDerWaalsContact O-N 3.12Å; V27-L42 HydrophobicContact CG2-CD1 4.46Å; V27-L46 HydrophobicContact CG2-CD1 3.9Å; V27-L78 HydrophobicContact CB-CD2 4.44Å; V27-L78 HydrophobicContact CG1-CB 4.3Å; V27-L78 HydrophobicContact CG1-CD2 4.17Å; V27-L78 VanDerWaalsContact CG1-O 3.29Å; V27-L78 WeakPolarHBondContact CG1-O 3.42Å; V27-E81 HydrophobicContact CG1-CB 4.13Å; V27-E81 HydrophobicContact CG1-CG 4.31Å; V27-L82 HydrophobicContact CG1-CB 3.93Å; V27-N85 PolarHBondContact O-ND2 3.46Å
28I92.6Very high94.3Very high52 Ų5265.9 Ų65.927%0.26734%0.335SS..Hα-helixtrans-61.5-39.4179.4-66.2168.9000110.8E24 F30E24-I28 HydrophobicContact CG-CD1 3.74Å; E24-I28 HydrophobicContact CG-CG1 4.48Å; E24-I28 WeakPolarHBondContact O-CG1 3.36Å; E24-I28 PolarHBondContact O-N 3.11Å; I28-F30 VanDerWaalsContact C-N 3.35Å
29G91Very high94.4Very high17 Ų1759.7 Ų59.718%0.17531%0.308CS..THydrogen-bonded Turntrans-87.66.2177.800000114.9Q25 V27 S31Q25-G29 PolarHBondContact O-N 3.36Å; V27-G29 VanDerWaalsContact C-N 3.27Å; V27-G29 PolarHBondContact O-N 3.37Å; G29-S31 PolarHBondContact O-N 3.38Å
30F94.5Very high94.6Very high15 Ų1559.8 Ų59.87%0.06631%0.307CS..  trans-67.8116.3-176.6-177.1-99.4000110.6Q26 V27 I28 G32 D36 N38 Y39 L42 L82 N85 A86 S144Q26-F30 WeakPolarHBondContact O-CA 3.32Å; Q26-F30 WeakPolarHBondContact O-CB 3.4Å; Q26-F30 PolarHBondContact O-N 3.34Å; Q26-F30 VanDerWaalsContact O-N 3.07Å; V27-F30 VanDerWaalsContact O-CB 3.28Å; V27-F30 WeakPolarHBondContact O-CB 3.41Å; V27-F30 PolarHBondContact O-N 3.42Å; V27-F30 VanDerWaalsContact O-N 3.12Å; I28-F30 VanDerWaalsContact C-N 3.35Å; F30-G32 VanDerWaalsContact CE1-O 3.27Å; F30-G32 WeakPolarHBondContact CE1-O 3.38Å; F30-D36 HydrophobicContact CZ-CB 4.46Å; F30-N38 HydrophobicContact CE2-CB 4.19Å; F30-Y39 HydrophobicContact CD1-CD2 4.48Å; F30-Y39 AromaticContact CE1-CD2 3.82Å; F30-Y39 HydrophobicContact CE1-CD2 3.82Å; F30-Y39 HydrophobicContact CZ-CD2 4.05Å; F30-Y39 HydrophobicContact CZ-CG 4.3Å; F30-L42 HydrophobicContact CD2-CD1 3.89Å; F30-L42 HydrophobicContact CG-CD1 4.49Å; F30-L82 HydrophobicContact CB-CD1 3.76Å; F30-L82 HydrophobicContact CD1-CD1 3.64Å; F30-L82 HydrophobicContact CD2-CD1 4.03Å; F30-L82 HydrophobicContact CE1-CD1 4.3Å; F30-L82 HydrophobicContact CG-CD1 3.5Å; F30-L82 VanDerWaalsContact CG-CD1 3.5Å; F30-N85 HydrophobicContact CD1-CB 4.36Å; F30-A86 HydrophobicContact CE1-CB 3.99Å; F30-S144 WeakPolarHBondContact O-CB 3.29Å
31S93.6Very high94.6Very high25 Ų2565.4 Ų65.418%0.17533%0.331CS..  trans-112.27.8-176.960.70000113.5G29 R91 S144G29-S31 PolarHBondContact O-N 3.38Å; S31-R91 PolarHBondContact O-NE 2.98Å; S31-R91 PolarHBondContact O-NH2 3.42Å; S31-S144 WeakPolarHBondContact CB-O 3.39Å
32G93.8Very high94.8Very high8 Ų859 Ų598%0.08230%0.304CS..SBendtrans-87.1-170.8-177.700000113.9F30 D36 R91F30-G32 VanDerWaalsContact CE1-O 3.27Å; F30-G32 WeakPolarHBondContact CE1-O 3.38Å; G32-D36 WeakPolarHBondContact CA-OD2 3.44Å; G32-R91 PolarHBondContact O-NE 3.39Å
33L95.6Very high94.9Very high30 Ų3058.5 Ų58.516%0.15729%0.293CS..  trans-104170.5171.2-65.7174.8000111D35 D36 Y39 R91 Q95L33-D35 VanDerWaalsContact C-N 3.28Å; L33-D35 WeakPolarHBondContact CB-OD1 3.4Å; L33-D35 PolarHBondContact O-N 3.35Å; L33-D36 PolarHBondContact N-OD2 3.09Å; L33-D36 WeakPolarHBondContact O-CB 3.33Å; L33-D36 PolarHBondContact O-N 3.27Å; L33-Y39 VanDerWaalsContact O-CB 3.29Å; L33-Y39 WeakPolarHBondContact O-CB 3.19Å; L33-R91 HydrophobicContact CD2-CG 4.13Å; L33-Q95 HydrophobicContact CD1-CB 4.49Å; L33-Q95 HydrophobicContact CD1-CG 3.82Å
34S94.5Very high95Very high49 Ų4966.5 Ų66.534%0.34332%0.322SS..THydrogen-bonded Turntrans-70.7-21.5-177.553.20000113.8Y39S34-Y39 WeakPolarHBondContact O-CD1 3.36Å
35D93.4Very high95.1Very high99 Ų9967 Ų6753%0.52933%0.325SS..THydrogen-bonded Turntrans-82-15.2175.664.4-36.8000113.3L33 K40L33-D35 VanDerWaalsContact C-N 3.28Å; L33-D35 WeakPolarHBondContact CB-OD1 3.4Å; L33-D35 PolarHBondContact O-N 3.35Å; D35-K40 WeakPolarHBondContact O-CE 3.49Å; D35-K40 PolarHBondContact O-NZ 3.26Å
36D93.9Very high95.3Very high61 Ų6160.7 Ų60.733%0.32630%0.296SS..SBendtrans-59.9143.9179.9-75.2-25.9000112.6F30 G32 L33 N38 Y39 K40F30-D36 HydrophobicContact CZ-CB 4.46Å; G32-D36 WeakPolarHBondContact CA-OD2 3.44Å; L33-D36 PolarHBondContact N-OD2 3.09Å; L33-D36 WeakPolarHBondContact O-CB 3.33Å; L33-D36 PolarHBondContact O-N 3.27Å; D36-N38 PolarHBondContact O-N 3.1Å; D36-Y39 WeakPolarHBondContact O-CB 3.35Å; D36-Y39 PolarHBondContact O-N 3.18Å; D36-K40 PolarHBondContact O-N 2.67Å; D36-K40 VanDerWaalsContact O-N 3.13Å
37K94.9Very high95.5Very high185 Ų18558.1 Ų58.180%0.80429%0.287SS*.Hα-helixtrans-59.2-36.4176-66.4-179.5-176.7173.10112.1K41K37-K41 WeakPolarHBondContact O-CB 3.33Å; K37-K41 PolarHBondContact O-N 3.11Å
38N93.4Very high95.6Very high108 Ų10863.8 Ų63.858%0.57831%0.312SS*.Hα-helixtrans-70.9-38.5179.8-73.7-20.1000112.1F30 D36 K41 L42F30-N38 HydrophobicContact CE2-CB 4.19Å; D36-N38 PolarHBondContact O-N 3.1Å; N38-K41 PolarHBondContact O-N 3.49Å; N38-L42 WeakPolarHBondContact O-CG 3.41Å; N38-L42 PolarHBondContact O-N 3.36Å
39Y97.5Very high95.8Very high18 Ų1861.5 Ų61.57%0.07130%0.3CS..Hα-helixtrans-56.5-56171.2178.7-88.9000110.2F30 L33 S34 D36 K41 L42 E43 L82 A86F30-Y39 HydrophobicContact CD1-CD2 4.48Å; F30-Y39 AromaticContact CE1-CD2 3.82Å; F30-Y39 HydrophobicContact CE1-CD2 3.82Å; F30-Y39 HydrophobicContact CZ-CD2 4.05Å; F30-Y39 HydrophobicContact CZ-CG 4.3Å; L33-Y39 VanDerWaalsContact O-CB 3.29Å; L33-Y39 WeakPolarHBondContact O-CB 3.19Å; S34-Y39 WeakPolarHBondContact O-CD1 3.36Å; D36-Y39 WeakPolarHBondContact O-CB 3.35Å; D36-Y39 PolarHBondContact O-N 3.18Å; Y39-K41 PolarHBondContact O-N 2.89Å; Y39-L42 PolarHBondContact O-N 3.37Å; Y39-E43 HydrophobicContact CE1-CB 4.24Å; Y39-E43 HydrophobicContact CE1-CG 4.46Å; Y39-E43 WeakPolarHBondContact CE1-OE1 3.45Å; Y39-E43 WeakPolarHBondContact O-CB 3.05Å; Y39-E43 PolarHBondContact O-N 3.21Å; Y39-E43 PolarHBondContact OH-OE1 2.69Å; Y39-L82 HydrophobicContact CD2-CD1 4.01Å; Y39-L82 HydrophobicContact CD2-CD2 4.19Å; Y39-L82 HydrophobicContact CD2-CG 3.8Å; Y39-L82 HydrophobicContact CE2-CD1 4.34Å; Y39-L82 HydrophobicContact CE2-CD2 4.13Å; Y39-L82 HydrophobicContact CE2-CG 3.67Å; Y39-A86 HydrophobicContact CD2-CB 3.77Å; Y39-A86 HydrophobicContact CE2-CB 3.64Å
40K97.8Very high96.1Very high83 Ų8362.1 Ų62.136%0.36130%0.299SS..Hα-helixtrans-58.9-34.1-179.2-66.9171.9-179.2156.50112.1D35 D36 R44D35-K40 WeakPolarHBondContact O-CE 3.49Å; D35-K40 PolarHBondContact O-NZ 3.26Å; D36-K40 PolarHBondContact O-N 2.67Å; D36-K40 VanDerWaalsContact O-N 3.13Å; K40-R44 VanDerWaalsContact O-CB 3.29Å; K40-R44 WeakPolarHBondContact O-CB 3.21Å; K40-R44 VanDerWaalsContact O-CD 3.3Å; K40-R44 WeakPolarHBondContact O-CD 3.47Å; K40-R44 WeakPolarHBondContact O-CG 3.37Å; K40-R44 PolarHBondContact O-N 3.28Å
41K97.6Very high96.2Very high119 Ų11967.9 Ų67.952%0.51732%0.324SS..Hα-helixtrans-66.3-50.4174.7-178.1-176174.3-171.90111.4K37 N38 Y39 R44 I45K37-K41 WeakPolarHBondContact O-CB 3.33Å; K37-K41 PolarHBondContact O-N 3.11Å; N38-K41 PolarHBondContact O-N 3.49Å; Y39-K41 PolarHBondContact O-N 2.89Å; K41-R44 PolarHBondContact O-N 3.45Å; K41-I45 HydrophobicContact CG-CD1 4.08Å; K41-I45 VanDerWaalsContact O-CG1 3.29Å; K41-I45 WeakPolarHBondContact O-CG1 3.48Å; K41-I45 PolarHBondContact O-N 3.25Å
42L97.6Very high96.4Very high7 Ų768.9 Ų68.94%0.03733%0.326CS..Hα-helixtrans-63.8-45179.6-69.4172.7000111.5V23 Q26 V27 F30 N38 Y39 R44 I45 L46 L82V23-L42 HydrophobicContact CB-CD2 4.29Å; Q26-L42 HydrophobicContact CB-CD1 4.28Å; Q26-L42 HydrophobicContact CB-CD2 3.86Å; V27-L42 HydrophobicContact CG2-CD1 4.46Å; F30-L42 HydrophobicContact CD2-CD1 3.89Å; F30-L42 HydrophobicContact CG-CD1 4.49Å; N38-L42 WeakPolarHBondContact O-CG 3.41Å; N38-L42 PolarHBondContact O-N 3.36Å; Y39-L42 PolarHBondContact O-N 3.37Å; L42-R44 PolarHBondContact O-N 2.83Å; L42-I45 PolarHBondContact O-N 2.89Å; L42-L46 WeakPolarHBondContact O-CG 3.3Å; L42-L46 PolarHBondContact O-N 3.01Å; L42-L82 HydrophobicContact CB-CD1 4.41Å; L42-L82 HydrophobicContact CB-CD2 3.7Å; L42-L82 HydrophobicContact CD1-CD1 3.94Å
43E98Very high96.5Very high69 Ų6968.5 Ų68.532%0.32232%0.322SS..Hα-helixtrans-57.5-47.2176.3-178.8-177-121.700111.3Y39 I45 L46 T47 L79 L82Y39-E43 HydrophobicContact CE1-CB 4.24Å; Y39-E43 HydrophobicContact CE1-CG 4.46Å; Y39-E43 WeakPolarHBondContact CE1-OE1 3.45Å; Y39-E43 WeakPolarHBondContact O-CB 3.05Å; Y39-E43 PolarHBondContact O-N 3.21Å; Y39-E43 PolarHBondContact OH-OE1 2.69Å; E43-I45 PolarHBondContact O-N 3.22Å; E43-L46 PolarHBondContact O-N 3.2Å; E43-T47 WeakPolarHBondContact O-CB 3.31Å; E43-T47 PolarHBondContact O-N 3.34Å; E43-T47 PolarHBondContact O-OG1 3.43Å; E43-L79 HydrophobicContact CG-CD2 4.33Å; E43-L82 HydrophobicContact CB-CD2 4.2Å
44R97.7Very high96.5Very high177 Ų17771.3 Ų71.367%0.66834%0.338SS*.Hα-helixtrans-61.4-42176.2-76169.7-167.2174.62.8112.6K40 K41 L42 K48K40-R44 VanDerWaalsContact O-CB 3.29Å; K40-R44 WeakPolarHBondContact O-CB 3.21Å; K40-R44 VanDerWaalsContact O-CD 3.3Å; K40-R44 WeakPolarHBondContact O-CD 3.47Å; K40-R44 WeakPolarHBondContact O-CG 3.37Å; K40-R44 PolarHBondContact O-N 3.28Å; K41-R44 PolarHBondContact O-N 3.45Å; L42-R44 PolarHBondContact O-N 2.83Å; R44-K48 VanDerWaalsContact O-CB 3.23Å; R44-K48 WeakPolarHBondContact O-CB 3.4Å; R44-K48 PolarHBondContact O-N 3.22Å
45I97.4Very high96.5Very high50 Ų5073.7 Ų73.726%0.25635%0.354SS..Hα-helixtrans-61.5-54.3177.8-69164.3000109.4V23 K41 L42 E43 T47 K48 Q49V23-I45 HydrophobicContact CG1-CD1 4.42Å; V23-I45 HydrophobicContact CG1-CG2 4.16Å; V23-I45 HydrophobicContact CG2-CG2 4.39Å; K41-I45 HydrophobicContact CG-CD1 4.08Å; K41-I45 VanDerWaalsContact O-CG1 3.29Å; K41-I45 WeakPolarHBondContact O-CG1 3.48Å; K41-I45 PolarHBondContact O-N 3.25Å; L42-I45 PolarHBondContact O-N 2.89Å; E43-I45 PolarHBondContact O-N 3.22Å; I45-T47 PolarHBondContact O-N 2.9Å; I45-K48 WeakPolarHBondContact O-CB 3.33Å; I45-K48 PolarHBondContact O-N 3.48Å; I45-Q49 WeakPolarHBondContact O-CG 3.45Å; I45-Q49 PolarHBondContact O-N 3.47Å
46L97.9Very high96.6Very high0 Ų069.5 Ų69.50%033%0.332CS..Hα-helixtrans-63.6-41.9-177.5-68.1170.4000112.4V20 V23 V27 L42 E43 K48 Q49 L50 T75 L78 L79 L82V20-L46 HydrophobicContact CG1-CD2 4.47Å; V23-L46 HydrophobicContact CG2-CD2 3.86Å; V27-L46 HydrophobicContact CG2-CD1 3.9Å; L42-L46 WeakPolarHBondContact O-CG 3.3Å; L42-L46 PolarHBondContact O-N 3.01Å; E43-L46 PolarHBondContact O-N 3.2Å; L46-K48 VanDerWaalsContact C-N 3.33Å; L46-K48 PolarHBondContact O-N 2.93Å; L46-Q49 PolarHBondContact O-N 2.86Å; L46-L50 PolarHBondContact O-N 3.25Å; L46-T75 HydrophobicContact CB-CG2 4.26Å; L46-T75 HydrophobicContact CD2-CG2 4.23Å; L46-T75 VanDerWaalsContact O-CG2 3.31Å; L46-T75 WeakPolarHBondContact O-CG2 3.4Å; L46-L78 HydrophobicContact CD1-CB 4.04Å; L46-L78 HydrophobicContact CD2-CB 4.08Å; L46-L78 HydrophobicContact CD2-CD1 4.15Å; L46-L79 HydrophobicContact CB-CD1 4.28Å; L46-L79 HydrophobicContact CB-CD2 3.6Å; L46-L79 HydrophobicContact CB-CG 3.7Å; L46-L79 HydrophobicContact CD1-CD2 3.93Å; L46-L79 HydrophobicContact CD1-CG 4.02Å; L46-L79 HydrophobicContact CG-CD2 4.44Å; L46-L82 HydrophobicContact CD1-CD2 4.47Å
47T97.4Very high96.5Very high48 Ų4871.6 Ų71.629%0.29434%0.344SS..Hα-helixtrans-62-42.6176.8-59.90000111.2E43 I45 L50 F51E43-T47 WeakPolarHBondContact O-CB 3.31Å; E43-T47 PolarHBondContact O-N 3.34Å; E43-T47 PolarHBondContact O-OG1 3.43Å; I45-T47 PolarHBondContact O-N 2.9Å; T47-L50 PolarHBondContact O-N 2.93Å; T47-F51 HydrophobicContact CG2-CD2 3.85Å; T47-F51 HydrophobicContact CG2-CE2 3.48Å; T47-F51 VanDerWaalsContact CG2-CE2 3.48Å; T47-F51 WeakPolarHBondContact O-CD2 3.27Å; T47-F51 PolarHBondContact O-N 3.41Å
48K97.6Very high96.3Very high120 Ų12063.4 Ų63.452%0.52231%0.309SS..Hα-helixtrans-60.3-46.6173.9179.1-175.8166.2-171.30111.1R44 I45 L46 L50 F51 E52R44-K48 VanDerWaalsContact O-CB 3.23Å; R44-K48 WeakPolarHBondContact O-CB 3.4Å; R44-K48 PolarHBondContact O-N 3.22Å; I45-K48 WeakPolarHBondContact O-CB 3.33Å; I45-K48 PolarHBondContact O-N 3.48Å; L46-K48 VanDerWaalsContact C-N 3.33Å; L46-K48 PolarHBondContact O-N 2.93Å; K48-L50 VanDerWaalsContact C-N 3.3Å; K48-L50 PolarHBondContact O-N 3.03Å; K48-F51 PolarHBondContact O-N 2.99Å; K48-E52 WeakPolarHBondContact CE-OE1 3.32Å; K48-E52 IonicContact NZ-OE1 2.65Å; K48-E52 WeakPolarHBondContact O-CG 3.47Å; K48-E52 PolarHBondContact O-N 3.4Å
49Q97.1Very high96.1Very high4 Ų463.4 Ų63.42%0.01931%0.305CS..Hα-helixtrans-61.3-39177.4-62.8-50.4-35.900112.1I16 E19 V20 I45 L46 E52 I53 T75I16-Q49 HydrophobicContact CG2-CB 3.98Å; I16-Q49 HydrophobicContact CG2-CG 4.42Å; E19-Q49 PolarHBondContact OE2-NE2 3.35Å; V20-Q49 HydrophobicContact CG2-CB 3.8Å; V20-Q49 HydrophobicContact CG2-CG 3.87Å; I45-Q49 WeakPolarHBondContact O-CG 3.45Å; I45-Q49 PolarHBondContact O-N 3.47Å; L46-Q49 PolarHBondContact O-N 2.86Å; Q49-E52 PolarHBondContact O-N 2.91Å; Q49-I53 WeakPolarHBondContact O-CD1 3.45Å; Q49-I53 VanDerWaalsContact O-CG1 3.23Å; Q49-I53 WeakPolarHBondContact O-CG1 3.48Å; Q49-I53 PolarHBondContact O-N 2.79Å; Q49-T75 HydrophobicContact CB-CG2 4.36Å
50L97.3Very high95.7Very high29 Ų2965.3 Ų65.315%0.15233%0.33CS..Hα-helixtrans-61.9-46.9177-172.161.2000111.7L46 T47 K48 E52 I53 D54 A72 T75 E76 L79L46-L50 PolarHBondContact O-N 3.25Å; T47-L50 PolarHBondContact O-N 2.93Å; K48-L50 VanDerWaalsContact C-N 3.3Å; K48-L50 PolarHBondContact O-N 3.03Å; L50-E52 VanDerWaalsContact C-N 3.3Å; L50-E52 PolarHBondContact O-N 3.27Å; L50-I53 WeakPolarHBondContact O-CB 3.48Å; L50-I53 PolarHBondContact O-N 3.46Å; L50-D54 PolarHBondContact O-N 3.36Å; L50-A72 HydrophobicContact CD1-CB 4.04Å; L50-T75 HydrophobicContact CB-CG2 4.07Å; L50-E76 HydrophobicContact CD1-CG 4.06Å; L50-E76 HydrophobicContact CD2-CG 4.14Å; L50-L79 HydrophobicContact CD2-CD1 4.2Å
51F96.9Very high95.4Very high137 Ų13765.3 Ų65.360%0.60133%0.33SS*.Hα-helixtrans-60.3-38.9174.2-77.7-61.3000112.9T47 K48 D54 S55T47-F51 HydrophobicContact CG2-CD2 3.85Å; T47-F51 HydrophobicContact CG2-CE2 3.48Å; T47-F51 VanDerWaalsContact CG2-CE2 3.48Å; T47-F51 WeakPolarHBondContact O-CD2 3.27Å; T47-F51 PolarHBondContact O-N 3.41Å; K48-F51 PolarHBondContact O-N 2.99Å; F51-D54 PolarHBondContact O-N 3.41Å; F51-S55 WeakPolarHBondContact O-CB 3.48Å; F51-S55 PolarHBondContact O-N 2.87Å; F51-S55 PolarHBondContact O-OG 2.93Å
52E96.5Very high95.1Very high45 Ų4561.9 Ų61.921%0.2133%0.329CS..Hα-helixtrans-66.8-38.9176.8-71.3-176.8-169.100112.1R12 I16 K48 Q49 L50 S55 V56R12-E52 IonicContact CZ-OE2 2.94Å; R12-E52 IonicContact NH2-OE2 3.7Å; R12-E52 PolarHBondContact NH2-OE2 3.42Å; I16-E52 HydrophobicContact CD1-CB 3.8Å; I16-E52 HydrophobicContact CG1-CB 4.42Å; K48-E52 WeakPolarHBondContact CE-OE1 3.32Å; K48-E52 IonicContact NZ-OE1 2.65Å; K48-E52 WeakPolarHBondContact O-CG 3.47Å; K48-E52 PolarHBondContact O-N 3.4Å; Q49-E52 PolarHBondContact O-N 2.91Å; L50-E52 VanDerWaalsContact C-N 3.3Å; L50-E52 PolarHBondContact O-N 3.27Å; E52-S55 PolarHBondContact O-N 3.05Å; E52-V56 WeakPolarHBondContact O-CG2 3.49Å; E52-V56 PolarHBondContact O-N 3.12Å
53I96.7Very high94.9Very high0 Ų066.5 Ų66.50%035%0.354CS..Hα-helixtrans-62.3-47174.1-69.2158.9000110.5L13 I16 Q49 L50 S55 V56 R68 A71 A72 T75L13-I53 HydrophobicContact CD2-CG1 4.38Å; L13-I53 HydrophobicContact CD2-CG2 4.08Å; I16-I53 HydrophobicContact CB-CG1 4.43Å; I16-I53 HydrophobicContact CD1-CG1 4.18Å; I16-I53 HydrophobicContact CG2-CD1 3.77Å; I16-I53 HydrophobicContact CG2-CG1 3.57Å; Q49-I53 WeakPolarHBondContact O-CD1 3.45Å; Q49-I53 VanDerWaalsContact O-CG1 3.23Å; Q49-I53 WeakPolarHBondContact O-CG1 3.48Å; Q49-I53 PolarHBondContact O-N 2.79Å; L50-I53 WeakPolarHBondContact O-CB 3.48Å; L50-I53 PolarHBondContact O-N 3.46Å; I53-S55 PolarHBondContact O-N 3.43Å; I53-V56 WeakPolarHBondContact O-CB 3.47Å; I53-V56 PolarHBondContact O-N 3.13Å; I53-V56 VanDerWaalsContact O-N 3.12Å; I53-R68 HydrophobicContact CG2-CG 3.6Å; I53-R68 WeakPolarHBondContact CG2-O 3.33Å; I53-R68 VanDerWaalsContact O-CD 3.29Å; I53-R68 WeakPolarHBondContact O-CD 3.41Å; I53-R68 WeakPolarHBondContact O-CG 3.3Å; I53-A71 HydrophobicContact CD1-CB 3.85Å; I53-A71 HydrophobicContact CG1-CB 4.1Å; I53-A71 HydrophobicContact CG2-CB 4.17Å; I53-A72 HydrophobicContact CG2-CB 3.95Å; I53-T75 WeakPolarHBondContact CD1-OG1 3.33Å
54D94.8Very high94.6Very high90 Ų9063.2 Ų63.248%0.48134%0.338SS..Hα-helixtrans-65.8-29.7-178.8-73.7-24.4000112.6L50 F51 V56L50-D54 PolarHBondContact O-N 3.36Å; F51-D54 PolarHBondContact O-N 3.41Å; D54-V56 PolarHBondContact O-N 2.8Å
55S95.1Very high94.5Very high99 Ų9959 Ų5969%0.69233%0.326SS*.THydrogen-bonded Turntrans-75.7-7.2176.5-57.50000113.7F51 E52 I53 D57F51-S55 WeakPolarHBondContact O-CB 3.48Å; F51-S55 PolarHBondContact O-N 2.87Å; F51-S55 PolarHBondContact O-OG 2.93Å; E52-S55 PolarHBondContact O-N 3.05Å; I53-S55 PolarHBondContact O-N 3.43Å; S55-D57 PolarHBondContact O-N 3.38Å
56V94.6Very high94.4Very high11 Ų1161 Ų617%0.06733%0.334CS..  trans-72.5118.8177.7178.20000110.5R12 L13 E52 I53 D54 I64 R68R12-V56 HydrophobicContact CG-CG2 4.35Å; L13-V56 HydrophobicContact CD1-CG1 4.2Å; L13-V56 HydrophobicContact CD2-CB 4.29Å; L13-V56 HydrophobicContact CD2-CG1 4.44Å; L13-V56 HydrophobicContact CD2-CG2 3.85Å; L13-V56 HydrophobicContact CG-CB 4.49Å; L13-V56 HydrophobicContact CG-CG1 4.11Å; L13-V56 HydrophobicContact CG-CG2 4.14Å; E52-V56 WeakPolarHBondContact O-CG2 3.49Å; E52-V56 PolarHBondContact O-N 3.12Å; I53-V56 WeakPolarHBondContact O-CB 3.47Å; I53-V56 PolarHBondContact O-N 3.13Å; I53-V56 VanDerWaalsContact O-N 3.12Å; D54-V56 PolarHBondContact O-N 2.8Å; V56-I64 HydrophobicContact CG1-CG2 4.5Å; V56-R68 PolarHBondContact O-NH1 2.81Å
57D92.8Very high94.2Very high105 Ų10562 Ų6256%0.56134%0.343SS*.  trans-69.2131.8170.7-168.63.3000110.8S9 S55 E59S9-D57 WeakPolarHBondContact CB-O 3.3Å; S9-D57 PolarHBondContact OG-O 3.37Å; S55-D57 PolarHBondContact O-N 3.38Å; D57-E59 PolarHBondContact OD1-N 2.95Å
58T90.4Very high94.1Very high12 Ų1263.4 Ų63.47%0.07434%0.343CS..  trans-98.8-13-179.163.60000112.6G60 K61 I64 Q65T58-G60 PolarHBondContact O-N 2.72Å; T58-K61 WeakPolarHBondContact O-CB 3.31Å; T58-K61 PolarHBondContact O-N 3.13Å; T58-I64 HydrophobicContact CG2-CG2 4.1Å; T58-Q65 HydrophobicContact CG2-CB 4.43Å; T58-Q65 HydrophobicContact CG2-CG 3.73Å
59E89.9Confident94Very high108 Ų10863.5 Ų63.551%0.50534%0.343SS..THydrogen-bonded Turntrans51.723.8-177.8-57.6177-168.900113.5H7 D57 K61H7-E59 IonicContact CE1-OE1 3.05Å; H7-E59 PolarHBondContact CE1-OE1 3.17Å; H7-E59 VanDerWaalsContact CE1-OE1 3.28Å; H7-E59 IonicContact CE1-OE2 3.16Å; H7-E59 IonicContact NE2-OE1 2.72Å; H7-E59 PolarHBondContact NE2-OE1 3.27Å; H7-E59 IonicContact NE2-OE2 3.57Å; H7-E59 PolarHBondContact NE2-OE2 3.22Å; D57-E59 PolarHBondContact OD1-N 2.95Å; E59-K61 HydrophobicContact CB-CD 4.43Å; E59-K61 HydrophobicContact CB-CG 4.43Å; E59-K61 PolarHBondContact O-N 3.1Å; E59-K61 IonicContact OE2-NZ 3.54Å; E59-K61 PolarHBondContact OE2-NZ 2.91Å
60G88Confident94Very high58 Ų5870.2 Ų70.260%0.59837%0.369SS*.THydrogen-bonded Turntrans71.72.7-17300000115.4T58 G62T58-G60 PolarHBondContact O-N 2.72Å; G60-G62 PolarHBondContact O-N 3.34Å
61K91.5Very high93.9Very high83 Ų8368.9 Ų68.936%0.36136%0.361SS..  trans-76.3118.9-179.7-64.6173.3171.8147.40110.8H7 T58 E59 D63 I64 Q65H7-K61 PolarHBondContact CD2-NZ 2.81Å; H7-K61 VanDerWaalsContact CD2-NZ 3.25Å; H7-K61 PolarHBondContact NE2-NZ 3.16Å; T58-K61 WeakPolarHBondContact O-CB 3.31Å; T58-K61 PolarHBondContact O-N 3.13Å; E59-K61 HydrophobicContact CB-CD 4.43Å; E59-K61 HydrophobicContact CB-CG 4.43Å; E59-K61 PolarHBondContact O-N 3.1Å; E59-K61 IonicContact OE2-NZ 3.54Å; E59-K61 PolarHBondContact OE2-NZ 2.91Å; K61-D63 VanDerWaalsContact C-N 3.32Å; K61-D63 WeakPolarHBondContact CB-OD1 3.48Å; K61-D63 PolarHBondContact O-N 3.01Å; K61-I64 HydrophobicContact CB-CB 4.4Å; K61-I64 HydrophobicContact CB-CD1 3.88Å; K61-I64 HydrophobicContact CB-CG1 3.9Å; K61-I64 HydrophobicContact CD-CD1 3.61Å; K61-I64 HydrophobicContact CD-CG1 4.38Å; K61-I64 HydrophobicContact CG-CD1 4.33Å; K61-I64 PolarHBondContact O-N 3.43Å; K61-Q65 WeakPolarHBondContact O-CG 3.48Å; K61-Q65 PolarHBondContact O-N 3.49Å
62G92.1Very high93.9Very high48 Ų4862.8 Ų62.850%0.49534%0.337SS..Hα-helixtrans-63.9-31.9-172.900000114.5G60 Q66G60-G62 PolarHBondContact O-N 3.34Å; G62-Q66 VanDerWaalsContact O-CB 3.26Å; G62-Q66 WeakPolarHBondContact O-CB 3.41Å; G62-Q66 PolarHBondContact O-N 3.1Å
63D92.3Very high94Very high103 Ų10365.4 Ų65.455%0.55135%0.349SS*.Hα-helixtrans-65.3-42.7173.960.3-32.3000112.2K61 Q66 A67K61-D63 VanDerWaalsContact C-N 3.32Å; K61-D63 WeakPolarHBondContact CB-OD1 3.48Å; K61-D63 PolarHBondContact O-N 3.01Å; D63-Q66 PolarHBondContact O-N 2.92Å; D63-A67 WeakPolarHBondContact O-CB 3.3Å; D63-A67 PolarHBondContact O-N 3.28Å
64I93.5Very high94Very high0 Ų068.3 Ų68.30%036%0.363CS..Hα-helixtrans-68-43.1175.4-48.2-178.4000110.7H7 I10 L13 V56 T58 K61 Q66 A67 R68H7-I64 HydrophobicContact CB-CD1 4.3Å; H7-I64 VanDerWaalsContact ND1-CD1 3.33Å; H7-I64 WeakPolarHBondContact ND1-CD1 3.43Å; I10-I64 HydrophobicContact CD1-CB 4.2Å; I10-I64 HydrophobicContact CD1-CG1 3.89Å; I10-I64 HydrophobicContact CD1-CG2 4.29Å; I10-I64 HydrophobicContact CG1-CG1 3.99Å; L13-I64 HydrophobicContact CD1-CG2 4.22Å; V56-I64 HydrophobicContact CG1-CG2 4.5Å; T58-I64 HydrophobicContact CG2-CG2 4.1Å; K61-I64 HydrophobicContact CB-CB 4.4Å; K61-I64 HydrophobicContact CB-CD1 3.88Å; K61-I64 HydrophobicContact CB-CG1 3.9Å; K61-I64 HydrophobicContact CD-CD1 3.61Å; K61-I64 HydrophobicContact CD-CG1 4.38Å; K61-I64 HydrophobicContact CG-CD1 4.33Å; K61-I64 PolarHBondContact O-N 3.43Å; I64-Q66 VanDerWaalsContact C-N 3.31Å; I64-Q66 PolarHBondContact O-N 3.32Å; I64-A67 PolarHBondContact O-N 3.24Å; I64-R68 WeakPolarHBondContact O-CB 3.35Å; I64-R68 PolarHBondContact O-N 3.48Å
65Q94.8Very high94.1Very high88 Ų8864.1 Ų64.141%0.41134%0.34SS..Hα-helixtrans-58.2-44174.7-70.6178.9-5.800111.8T58 K61 K69T58-Q65 HydrophobicContact CG2-CB 4.43Å; T58-Q65 HydrophobicContact CG2-CG 3.73Å; K61-Q65 WeakPolarHBondContact O-CG 3.48Å; K61-Q65 PolarHBondContact O-N 3.49Å; Q65-K69 WeakPolarHBondContact O-CB 3.35Å; Q65-K69 PolarHBondContact O-N 3.19Å
66Q94.2Very high94.3Very high92 Ų9264.3 Ų64.343%0.4333%0.33SS..Hα-helixtrans-65.1-42.5177.4-173.976.348.900111.6G62 D63 I64 K69 R70G62-Q66 VanDerWaalsContact O-CB 3.26Å; G62-Q66 WeakPolarHBondContact O-CB 3.41Å; G62-Q66 PolarHBondContact O-N 3.1Å; D63-Q66 PolarHBondContact O-N 2.92Å; I64-Q66 VanDerWaalsContact C-N 3.31Å; I64-Q66 PolarHBondContact O-N 3.32Å; Q66-K69 PolarHBondContact O-N 3.05Å; Q66-R70 WeakPolarHBondContact O-CG 3.49Å; Q66-R70 PolarHBondContact O-N 2.99Å
67A94.2Very high94.4Very high22 Ų2271.6 Ų71.618%0.18236%0.356CS..Hα-helixtrans-63.4-46.5176.600000111.6I10 L13 D63 I64 K69 R70 A71I10-A67 HydrophobicContact CD1-CB 3.77Å; L13-A67 HydrophobicContact CD1-CB 3.83Å; D63-A67 WeakPolarHBondContact O-CB 3.3Å; D63-A67 PolarHBondContact O-N 3.28Å; I64-A67 PolarHBondContact O-N 3.24Å; A67-K69 PolarHBondContact O-N 2.94Å; A67-R70 PolarHBondContact O-N 2.95Å; A67-A71 PolarHBondContact O-N 3.16Å
68R96.2Very high94.7Very high78 Ų7866.9 Ų66.929%0.29433%0.331SS..Hα-helixtrans-58-48.1175.4-171.1-178.569.1-178.64.8111.2L13 I53 V56 I64 R70 A71 A72L13-R68 HydrophobicContact CD1-CB 4.07Å; L13-R68 HydrophobicContact CD2-CB 4.25Å; L13-R68 HydrophobicContact CD2-CG 4.3Å; I53-R68 HydrophobicContact CG2-CG 3.6Å; I53-R68 WeakPolarHBondContact CG2-O 3.33Å; I53-R68 VanDerWaalsContact O-CD 3.29Å; I53-R68 WeakPolarHBondContact O-CD 3.41Å; I53-R68 WeakPolarHBondContact O-CG 3.3Å; V56-R68 PolarHBondContact O-NH1 2.81Å; I64-R68 WeakPolarHBondContact O-CB 3.35Å; I64-R68 PolarHBondContact O-N 3.48Å; R68-R70 VanDerWaalsContact C-N 3.35Å; R68-R70 PolarHBondContact O-N 3.13Å; R68-A71 PolarHBondContact O-N 3.21Å; R68-A72 WeakPolarHBondContact O-CB 3.23Å; R68-A72 PolarHBondContact O-N 3.47Å
69K96Very high95Very high121 Ų12168 Ų6853%0.52634%0.336SS..Hα-helixtrans-58.6-43.7178-176176.1-178.9177.10112.2Q65 Q66 A67 Q73Q65-K69 WeakPolarHBondContact O-CB 3.35Å; Q65-K69 PolarHBondContact O-N 3.19Å; Q66-K69 PolarHBondContact O-N 3.05Å; A67-K69 PolarHBondContact O-N 2.94Å; K69-Q73 HydrophobicContact CG-CG 4.46Å; K69-Q73 WeakPolarHBondContact O-CB 3.39Å; K69-Q73 WeakPolarHBondContact O-CG 3.43Å; K69-Q73 PolarHBondContact O-N 2.91Å
70R95.3Very high95.4Very high146 Ų14669 Ų6955%0.55134%0.339SS*.Hα-helixtrans-64-45.5177.4-72.7175.3-171.6151.13.8111.8Q66 A67 R68 Q73 E74Q66-R70 WeakPolarHBondContact O-CG 3.49Å; Q66-R70 PolarHBondContact O-N 2.99Å; A67-R70 PolarHBondContact O-N 2.95Å; R68-R70 VanDerWaalsContact C-N 3.35Å; R68-R70 PolarHBondContact O-N 3.13Å; R70-Q73 PolarHBondContact O-N 2.95Å; R70-E74 WeakPolarHBondContact O-CB 3.49Å; R70-E74 PolarHBondContact O-N 3.23Å
71A96.3Very high95.9Very high0 Ų068.7 Ų68.70%032%0.322CS..Hα-helixtrans-62.9-42.5178.500000112.2L13 Q17 I53 A67 R68 E74 T75L13-A71 HydrophobicContact CD2-CB 4.31Å; Q17-A71 HydrophobicContact CG-CB 3.93Å; I53-A71 HydrophobicContact CD1-CB 3.85Å; I53-A71 HydrophobicContact CG1-CB 4.1Å; I53-A71 HydrophobicContact CG2-CB 4.17Å; A67-A71 PolarHBondContact O-N 3.16Å; R68-A71 PolarHBondContact O-N 3.21Å; A71-E74 PolarHBondContact O-N 3.22Å; A71-T75 WeakPolarHBondContact O-CB 3.38Å; A71-T75 PolarHBondContact O-N 3.09Å; A71-T75 PolarHBondContact O-OG1 3.36Å
72A97.5Very high96.2Very high10 Ų1064.8 Ų64.88%0.08331%0.305CS..Hα-helixtrans-62-50.2175.900000110.8L50 I53 R68 E74 T75 E76L50-A72 HydrophobicContact CD1-CB 4.04Å; I53-A72 HydrophobicContact CG2-CB 3.95Å; R68-A72 WeakPolarHBondContact O-CB 3.23Å; R68-A72 PolarHBondContact O-N 3.47Å; A72-E74 VanDerWaalsContact C-N 3.31Å; A72-E74 PolarHBondContact O-N 2.97Å; A72-T75 PolarHBondContact O-N 2.87Å; A72-T75 VanDerWaalsContact O-N 3.14Å; A72-E76 WeakPolarHBondContact O-CB 3.15Å; A72-E76 WeakPolarHBondContact O-CG 3.47Å; A72-E76 PolarHBondContact O-N 3.13Å
73Q97.4Very high96.4Very high99 Ų9967.6 Ų67.646%0.46331%0.305SS..Hα-helixtrans-59.5-38.9178.7-75177.6-24.300113.2K69 R70 R77K69-Q73 HydrophobicContact CG-CG 4.46Å; K69-Q73 WeakPolarHBondContact O-CB 3.39Å; K69-Q73 WeakPolarHBondContact O-CG 3.43Å; K69-Q73 PolarHBondContact O-N 2.91Å; R70-Q73 PolarHBondContact O-N 2.95Å; Q73-R77 VanDerWaalsContact O-CB 3.24Å; Q73-R77 WeakPolarHBondContact O-CB 3.24Å; Q73-R77 PolarHBondContact O-N 3Å
74E96.5Very high96.6Very high62 Ų6266.7 Ų66.729%0.2930%0.298SS..Hα-helixtrans-65.5-44.2175.5-177.8174.2-165.200111.5R70 A71 A72 R77 L78R70-E74 WeakPolarHBondContact O-CB 3.49Å; R70-E74 PolarHBondContact O-N 3.23Å; A71-E74 PolarHBondContact O-N 3.22Å; A72-E74 VanDerWaalsContact C-N 3.31Å; A72-E74 PolarHBondContact O-N 2.97Å; E74-R77 WeakPolarHBondContact O-CB 3.46Å; E74-R77 PolarHBondContact O-N 3.33Å; E74-L78 WeakPolarHBondContact O-CG 3.47Å; E74-L78 PolarHBondContact O-N 2.92Å; E74-L78 VanDerWaalsContact O-N 3.1Å
75T97.9Very high96.8Very high1 Ų166.8 Ų66.81%0.00630%0.298CS..Hα-helixtrans-67.7-44179.2-53.10000111.7V20 L46 Q49 L50 I53 A71 A72 R77 L78 L79V20-T75 HydrophobicContact CG2-CG2 4.47Å; L46-T75 HydrophobicContact CB-CG2 4.26Å; L46-T75 HydrophobicContact CD2-CG2 4.23Å; L46-T75 VanDerWaalsContact O-CG2 3.31Å; L46-T75 WeakPolarHBondContact O-CG2 3.4Å; Q49-T75 HydrophobicContact CB-CG2 4.36Å; L50-T75 HydrophobicContact CB-CG2 4.07Å; I53-T75 WeakPolarHBondContact CD1-OG1 3.33Å; A71-T75 WeakPolarHBondContact O-CB 3.38Å; A71-T75 PolarHBondContact O-N 3.09Å; A71-T75 PolarHBondContact O-OG1 3.36Å; A72-T75 PolarHBondContact O-N 2.87Å; A72-T75 VanDerWaalsContact O-N 3.14Å; T75-R77 VanDerWaalsContact C-N 3.33Å; T75-R77 PolarHBondContact O-N 2.94Å; T75-L78 PolarHBondContact O-N 3.28Å; T75-L79 PolarHBondContact O-N 3.27Å
76E98.1Very high96.9Very high103 Ų10362.6 Ų62.648%0.48128%0.279SS..Hα-helixtrans-60.7-40.9173.7-74.3174.9175.600111.8L50 A72 L78 L79 K80L50-E76 HydrophobicContact CD1-CG 4.06Å; L50-E76 HydrophobicContact CD2-CG 4.14Å; A72-E76 WeakPolarHBondContact O-CB 3.15Å; A72-E76 WeakPolarHBondContact O-CG 3.47Å; A72-E76 PolarHBondContact O-N 3.13Å; E76-L78 VanDerWaalsContact C-N 3.32Å; E76-L78 PolarHBondContact O-N 3.44Å; E76-L79 PolarHBondContact O-N 3.01Å; E76-K80 WeakPolarHBondContact O-CB 3.31Å; E76-K80 PolarHBondContact O-N 3.41Å
77R97.9Very high97Very high164 Ų16461.6 Ų61.662%0.61928%0.277SS*.Hα-helixtrans-59.3-44.3174.7178.2-172171.4-150.9-4111Q73 E74 T75 K80 E81Q73-R77 VanDerWaalsContact O-CB 3.24Å; Q73-R77 WeakPolarHBondContact O-CB 3.24Å; Q73-R77 PolarHBondContact O-N 3Å; E74-R77 WeakPolarHBondContact O-CB 3.46Å; E74-R77 PolarHBondContact O-N 3.33Å; T75-R77 VanDerWaalsContact C-N 3.33Å; T75-R77 PolarHBondContact O-N 2.94Å; R77-K80 PolarHBondContact O-N 3.05Å; R77-E81 WeakPolarHBondContact O-CB 3.44Å; R77-E81 PolarHBondContact O-N 3.5Å
78L98.1Very high97.1Very high7 Ų762.4 Ų62.44%0.03728%0.276CS..Hα-helixtrans-67.8-39.2178.4-68.4175.2000112.5V20 E24 V27 L46 E74 T75 E76 K80 E81 L82V20-L78 HydrophobicContact CG1-CD1 3.49Å; V20-L78 VanDerWaalsContact CG1-CD1 3.49Å; E24-L78 HydrophobicContact CB-CD1 4.22Å; E24-L78 HydrophobicContact CB-CD2 4.36Å; E24-L78 HydrophobicContact CG-CD2 3.96Å; V27-L78 HydrophobicContact CB-CD2 4.44Å; V27-L78 HydrophobicContact CG1-CB 4.3Å; V27-L78 HydrophobicContact CG1-CD2 4.17Å; V27-L78 VanDerWaalsContact CG1-O 3.29Å; V27-L78 WeakPolarHBondContact CG1-O 3.42Å; L46-L78 HydrophobicContact CD1-CB 4.04Å; L46-L78 HydrophobicContact CD2-CB 4.08Å; L46-L78 HydrophobicContact CD2-CD1 4.15Å; E74-L78 WeakPolarHBondContact O-CG 3.47Å; E74-L78 PolarHBondContact O-N 2.92Å; E74-L78 VanDerWaalsContact O-N 3.1Å; T75-L78 PolarHBondContact O-N 3.28Å; E76-L78 VanDerWaalsContact C-N 3.32Å; E76-L78 PolarHBondContact O-N 3.44Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.35Å; L78-E81 PolarHBondContact O-N 3.37Å; L78-L82 WeakPolarHBondContact O-CB 3.48Å; L78-L82 PolarHBondContact O-N 3.12Å
79L98.1Very high97.1Very high35 Ų3563.1 Ų63.118%0.18329%0.291CS..Hα-helixtrans-58.9-46.1172.5-80.7166.7000111.4E43 L46 L50 T75 E76 L82 E83E43-L79 HydrophobicContact CG-CD2 4.33Å; L46-L79 HydrophobicContact CB-CD1 4.28Å; L46-L79 HydrophobicContact CB-CD2 3.6Å; L46-L79 HydrophobicContact CB-CG 3.7Å; L46-L79 HydrophobicContact CD1-CD2 3.93Å; L46-L79 HydrophobicContact CD1-CG 4.02Å; L46-L79 HydrophobicContact CG-CD2 4.44Å; L50-L79 HydrophobicContact CD2-CD1 4.2Å; T75-L79 PolarHBondContact O-N 3.27Å; E76-L79 PolarHBondContact O-N 3.01Å; L79-L82 WeakPolarHBondContact O-CB 3.22Å; L79-L82 PolarHBondContact O-N 3.27Å; L79-E83 PolarHBondContact O-N 2.75Å
80K97.8Very high97.1Very high128 Ų12860 Ų6056%0.55728%0.279SS*.Hα-helixtrans-63.4-41.7176.8-174.3176-179.7177.60112.3E76 R77 L78 E83 Q84E76-K80 WeakPolarHBondContact O-CB 3.31Å; E76-K80 PolarHBondContact O-N 3.41Å; R77-K80 PolarHBondContact O-N 3.05Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.35Å; K80-E83 PolarHBondContact O-N 3.02Å; K80-Q84 HydrophobicContact CG-CG 4.48Å; K80-Q84 WeakPolarHBondContact O-CB 3.34Å; K80-Q84 WeakPolarHBondContact O-CG 3.4Å; K80-Q84 PolarHBondContact O-N 2.83Å
81E97.4Very high97.2Very high53 Ų5354 Ų5425%0.24826%0.256CS..Hα-helixtrans-62.8-43176-170.571.5-145.500111.2V27 R77 L78 Q84 N85V27-E81 HydrophobicContact CG1-CB 4.13Å; V27-E81 HydrophobicContact CG1-CG 4.31Å; R77-E81 WeakPolarHBondContact O-CB 3.44Å; R77-E81 PolarHBondContact O-N 3.5Å; L78-E81 PolarHBondContact O-N 3.37Å; E81-Q84 PolarHBondContact O-N 3.03Å; E81-N85 WeakPolarHBondContact O-CB 3.37Å; E81-N85 VanDerWaalsContact O-CG 3.31Å; E81-N85 PolarHBondContact O-N 3.24Å; E81-N85 PolarHBondContact O-ND2 2.97Å
82L98Very high97.3Very high0 Ų057.6 Ų57.60%027%0.274CS..Hα-helixtrans-60-47.6176.7-177.162.3000111.5V27 F30 Y39 L42 E43 L46 L78 L79 N85 A86V27-L82 HydrophobicContact CG1-CB 3.93Å; F30-L82 HydrophobicContact CB-CD1 3.76Å; F30-L82 HydrophobicContact CD1-CD1 3.64Å; F30-L82 HydrophobicContact CD2-CD1 4.03Å; F30-L82 HydrophobicContact CE1-CD1 4.3Å; F30-L82 HydrophobicContact CG-CD1 3.5Å; F30-L82 VanDerWaalsContact CG-CD1 3.5Å; Y39-L82 HydrophobicContact CD2-CD1 4.01Å; Y39-L82 HydrophobicContact CD2-CD2 4.19Å; Y39-L82 HydrophobicContact CD2-CG 3.8Å; Y39-L82 HydrophobicContact CE2-CD1 4.34Å; Y39-L82 HydrophobicContact CE2-CD2 4.13Å; Y39-L82 HydrophobicContact CE2-CG 3.67Å; L42-L82 HydrophobicContact CB-CD1 4.41Å; L42-L82 HydrophobicContact CB-CD2 3.7Å; L42-L82 HydrophobicContact CD1-CD1 3.94Å; E43-L82 HydrophobicContact CB-CD2 4.2Å; L46-L82 HydrophobicContact CD1-CD2 4.47Å; L78-L82 WeakPolarHBondContact O-CB 3.48Å; L78-L82 PolarHBondContact O-N 3.12Å; L79-L82 WeakPolarHBondContact O-CB 3.22Å; L79-L82 PolarHBondContact O-N 3.27Å; L82-N85 PolarHBondContact O-N 3.38Å; L82-A86 PolarHBondContact O-N 3.46Å
83E97.4Very high97.3Very high107 Ų10760.9 Ų60.950%0.529%0.288SS..Hα-helixtrans-61.8-44.3176.6-173.9-175.3-172.100111.4L79 K80 N85 A86 N87L79-E83 PolarHBondContact O-N 2.75Å; K80-E83 PolarHBondContact O-N 3.02Å; E83-N85 VanDerWaalsContact C-N 3.33Å; E83-N85 PolarHBondContact O-N 2.97Å; E83-A86 PolarHBondContact O-N 2.9Å; E83-N87 WeakPolarHBondContact CG-ND2 3.44Å; E83-N87 WeakPolarHBondContact O-CB 3.48Å; E83-N87 PolarHBondContact O-N 3.21Å; E83-N87 PolarHBondContact O-ND2 3.31Å
84Q96.8Very high97.3Very high84 Ų8456.1 Ų56.139%0.39327%0.266SS..Hα-helixtrans-64.6-36.2177.4-76.5-178.7-3.300112.8K80 E81 H88K80-Q84 HydrophobicContact CG-CG 4.48Å; K80-Q84 WeakPolarHBondContact O-CB 3.34Å; K80-Q84 WeakPolarHBondContact O-CG 3.4Å; K80-Q84 PolarHBondContact O-N 2.83Å; E81-Q84 PolarHBondContact O-N 3.03Å; Q84-H88 WeakPolarHBondContact O-CA 3.33Å; Q84-H88 WeakPolarHBondContact O-CB 3.35Å; Q84-H88 PolarHBondContact O-N 3.29Å; Q84-H88 VanDerWaalsContact O-N 3.1Å
85N96.8Very high97.3Very high2 Ų254.7 Ų54.71%0.01126%0.259CS..Hα-helixtrans-67.3-43.1175.7-79.5-26000111.5V27 F30 E81 L82 E83 S144V27-N85 PolarHBondContact O-ND2 3.46Å; F30-N85 HydrophobicContact CD1-CB 4.36Å; E81-N85 WeakPolarHBondContact O-CB 3.37Å; E81-N85 VanDerWaalsContact O-CG 3.31Å; E81-N85 PolarHBondContact O-N 3.24Å; E81-N85 PolarHBondContact O-ND2 2.97Å; L82-N85 PolarHBondContact O-N 3.38Å; E83-N85 VanDerWaalsContact C-N 3.33Å; E83-N85 PolarHBondContact O-N 2.97Å; N85-S144 WeakPolarHBondContact OD1-CB 3.33Å; N85-S144 PolarHBondContact OD1-OG 3.06Å
86A96.7Very high97.3Very high0 Ų058.4 Ų58.40%028%0.279CS..Hα-helixtrans-70-38.4-18000000113.2F30 Y39 L82 E83F30-A86 HydrophobicContact CE1-CB 3.99Å; Y39-A86 HydrophobicContact CD2-CB 3.77Å; Y39-A86 HydrophobicContact CE2-CB 3.64Å; L82-A86 PolarHBondContact O-N 3.46Å; E83-A86 PolarHBondContact O-N 2.9Å
87N96.2Very high97.4Very high72 Ų7253.9 Ų53.939%0.38526%0.258SS..THydrogen-bonded Turntrans-104.914.2-172.8-59.2-47.6000113.5E83E83-N87 WeakPolarHBondContact CG-ND2 3.44Å; E83-N87 WeakPolarHBondContact O-CB 3.48Å; E83-N87 PolarHBondContact O-N 3.21Å; E83-N87 PolarHBondContact O-ND2 3.31Å
88H96.7Very high97.3Very high38 Ų3847.1 Ų47.118%0.17623%0.233CC..  trans-61.4138.6179.6-160.8-90.4000111.3Q84 H90 R91 I92 K142 L145Q84-H88 WeakPolarHBondContact O-CA 3.33Å; Q84-H88 WeakPolarHBondContact O-CB 3.35Å; Q84-H88 PolarHBondContact O-N 3.29Å; Q84-H88 VanDerWaalsContact O-N 3.1Å; H88-H90 VanDerWaalsContact C-N 3.34Å; H88-H90 AromaticContact CE1-CD2 3.69Å; H88-H90 PolarHBondContact ND1-N 3.41Å; H88-H90 PolarHBondContact O-N 2.89Å; H88-R91 HydrophobicContact CB-CB 3.82Å; H88-R91 WeakPolarHBondContact O-CA 3.48Å; H88-R91 WeakPolarHBondContact O-CB 3.09Å; H88-R91 PolarHBondContact O-N 3.48Å; H88-I92 PolarHBondContact O-N 2.96Å; H88-K142 PolarHBondContact CD2-NZ 3.11Å; H88-K142 PolarHBondContact NE2-NZ 2.92Å; H88-K142 VanDerWaalsContact NE2-NZ 3.11Å; H88-L145 HydrophobicContact CB-CD2 4.22Å
89P96.6Very high97.3Very high94 Ų9451.1 Ų51.161%0.6125%0.251SS*.Hα-helixtrans-52.1-48.5177.5-29.235.6000113.3R91 I92 E93P89-R91 VanDerWaalsContact C-N 3.3Å; P89-R91 PolarHBondContact O-N 3.14Å; P89-I92 PolarHBondContact O-N 3.1Å; P89-E93 PolarHBondContact O-N 3.45Å
90H96.4Very high97.3Very high56 Ų5653.8 Ų53.826%0.25926%0.263SS..Hα-helixtrans-67.3-23.8175.2-62.5-43.9000114.4H88 E93 I94 V137 K138 L145H88-H90 VanDerWaalsContact C-N 3.34Å; H88-H90 AromaticContact CE1-CD2 3.69Å; H88-H90 PolarHBondContact ND1-N 3.41Å; H88-H90 PolarHBondContact O-N 2.89Å; H90-E93 IonicContact CE1-OE2 2.72Å; H90-E93 IonicContact CG-OE2 3.91Å; H90-E93 IonicContact ND1-OE2 3.8Å; H90-E93 PolarHBondContact ND1-OE2 3.21Å; H90-I94 WeakPolarHBondContact O-CD1 3.49Å; H90-I94 VanDerWaalsContact O-CG1 3.25Å; H90-I94 WeakPolarHBondContact O-CG1 3.45Å; H90-I94 PolarHBondContact O-N 2.82Å; H90-V137 HydrophobicContact CB-CG1 3.82Å; H90-K138 PolarHBondContact CD2-O 2.97Å; H90-L145 HydrophobicContact CB-CD1 4.12Å; H90-L145 HydrophobicContact CB-CD2 4.24Å
91R97Very high97.2Very high19 Ų1947.7 Ų47.77%0.07224%0.236CC..Hα-helixtrans-71.2-41.417317658.7-170.589.5-5.2110.5S31 G32 L33 H88 P89 E93 I94 Q95 L145S31-R91 PolarHBondContact O-NE 2.98Å; S31-R91 PolarHBondContact O-NH2 3.42Å; G32-R91 PolarHBondContact O-NE 3.39Å; L33-R91 HydrophobicContact CD2-CG 4.13Å; H88-R91 HydrophobicContact CB-CB 3.82Å; H88-R91 WeakPolarHBondContact O-CA 3.48Å; H88-R91 WeakPolarHBondContact O-CB 3.09Å; H88-R91 PolarHBondContact O-N 3.48Å; P89-R91 VanDerWaalsContact C-N 3.3Å; P89-R91 PolarHBondContact O-N 3.14Å; R91-E93 VanDerWaalsContact C-N 3.35Å; R91-I94 PolarHBondContact O-N 3.33Å; R91-Q95 PolarHBondContact O-N 3.37Å; R91-Q95 VanDerWaalsContact O-N 3.14Å; R91-L145 HydrophobicContact CB-CD2 3.8Å
92I97.2Very high97.2Very high76 Ų7646.4 Ų46.439%0.3923%0.231SC..Hα-helixtrans-65.6-41.2174.4-62.3176.1000109.9H88 P89 I94 Q95 N96H88-I92 PolarHBondContact O-N 2.96Å; P89-I92 PolarHBondContact O-N 3.1Å; I92-I94 PolarHBondContact O-N 2.94Å; I92-Q95 WeakPolarHBondContact O-CA 3.33Å; I92-Q95 WeakPolarHBondContact O-CB 3.5Å; I92-Q95 PolarHBondContact O-N 3.49Å; I92-Q95 VanDerWaalsContact O-N 3.08Å; I92-N96 VanDerWaalsContact O-CG 3.24Å; I92-N96 PolarHBondContact O-N 3.39Å; I92-N96 PolarHBondContact O-OD1 3.34Å
93E97.8Very high97.1Very high78 Ų7850 Ų5036%0.36426%0.255SS..Hα-helixtrans-57.4-47.7174.3-173.4-179.4-176.400112.4P89 H90 R91 Q95 N96 I97 V137P89-E93 PolarHBondContact O-N 3.45Å; H90-E93 IonicContact CE1-OE2 2.72Å; H90-E93 IonicContact CG-OE2 3.91Å; H90-E93 IonicContact ND1-OE2 3.8Å; H90-E93 PolarHBondContact ND1-OE2 3.21Å; R91-E93 VanDerWaalsContact C-N 3.35Å; E93-Q95 PolarHBondContact O-N 2.88Å; E93-N96 PolarHBondContact O-N 3Å; E93-I97 HydrophobicContact CG-CD1 4.09Å; E93-I97 VanDerWaalsContact O-CG1 3.31Å; E93-I97 WeakPolarHBondContact O-CG1 3.28Å; E93-I97 PolarHBondContact O-N 3.31Å; E93-V137 HydrophobicContact CG-CG2 4.13Å
94I97.9Very high97Very high0 Ų046.4 Ų46.40%024%0.24CC..Hα-helixtrans-57-40.4174.1-70.7161.1000111.1H90 R91 I92 F98 L134 V137 A148 R149 T152H90-I94 WeakPolarHBondContact O-CD1 3.49Å; H90-I94 VanDerWaalsContact O-CG1 3.25Å; H90-I94 WeakPolarHBondContact O-CG1 3.45Å; H90-I94 PolarHBondContact O-N 2.82Å; R91-I94 PolarHBondContact O-N 3.33Å; I92-I94 PolarHBondContact O-N 2.94Å; I94-F98 WeakPolarHBondContact O-CB 3.4Å; I94-F98 PolarHBondContact O-N 2.91Å; I94-L134 HydrophobicContact CB-CD1 4.23Å; I94-L134 HydrophobicContact CG1-CD1 3.91Å; I94-L134 HydrophobicContact CG2-CD1 3.95Å; I94-V137 HydrophobicContact CD1-CG1 4.19Å; I94-V137 HydrophobicContact CG1-CB 4.28Å; I94-V137 HydrophobicContact CG1-CG1 3.9Å; I94-V137 HydrophobicContact CG1-CG2 4.29Å; I94-A148 HydrophobicContact CD1-CB 4.02Å; I94-R149 HydrophobicContact CD1-CB 3.98Å; I94-T152 HydrophobicContact CG2-CG2 4.42Å; I94-T152 WeakPolarHBondContact CG2-OG1 3.05Å
95Q97.3Very high96.8Very high32 Ų3242.4 Ų42.415%0.1522%0.221CC..Hα-helixtrans-64.9-48.8178-174.959.228.300111.6L33 R91 I92 E93 I97 F98 E99L33-Q95 HydrophobicContact CD1-CB 4.49Å; L33-Q95 HydrophobicContact CD1-CG 3.82Å; R91-Q95 PolarHBondContact O-N 3.37Å; R91-Q95 VanDerWaalsContact O-N 3.14Å; I92-Q95 WeakPolarHBondContact O-CA 3.33Å; I92-Q95 WeakPolarHBondContact O-CB 3.5Å; I92-Q95 PolarHBondContact O-N 3.49Å; I92-Q95 VanDerWaalsContact O-N 3.08Å; E93-Q95 PolarHBondContact O-N 2.88Å; Q95-I97 VanDerWaalsContact C-N 3.32Å; Q95-I97 PolarHBondContact O-N 3.32Å; Q95-F98 CarbonylContact O-C 3.46Å; Q95-F98 WeakPolarHBondContact O-CA 3.16Å; Q95-F98 WeakPolarHBondContact O-CB 3.39Å; Q95-F98 PolarHBondContact O-N 3.45Å; Q95-E99 HydrophobicContact CG-CG 4.46Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.45Å; Q95-E99 PolarHBondContact NE2-OE1 3.09Å; Q95-E99 WeakPolarHBondContact O-CG 3.16Å; Q95-E99 PolarHBondContact O-N 3.18Å
96N98.2Very high96.6Very high78 Ų7848.1 Ų48.142%0.41724%0.242SC..Hα-helixtrans-60.8-43.5-178.3-65.6-13.4000111I92 E93 F98 E99 E100I92-N96 VanDerWaalsContact O-CG 3.24Å; I92-N96 PolarHBondContact O-N 3.39Å; I92-N96 PolarHBondContact O-OD1 3.34Å; E93-N96 PolarHBondContact O-N 3Å; N96-F98 VanDerWaalsContact C-N 3.29Å; N96-F98 PolarHBondContact O-N 3.1Å; N96-E99 PolarHBondContact O-N 3.34Å; N96-E100 WeakPolarHBondContact O-CG 3.09Å; N96-E100 PolarHBondContact O-N 3.05Å
97I98.3Very high96.3Very high8 Ų853.9 Ų53.94%0.04127%0.269CS..Hα-helixtrans-62.1-38.8175.3-64168.8000110.9E93 Q95 E100 A101 I130 R133 L134 V137E93-I97 HydrophobicContact CG-CD1 4.09Å; E93-I97 VanDerWaalsContact O-CG1 3.31Å; E93-I97 WeakPolarHBondContact O-CG1 3.28Å; E93-I97 PolarHBondContact O-N 3.31Å; Q95-I97 VanDerWaalsContact C-N 3.32Å; Q95-I97 PolarHBondContact O-N 3.32Å; I97-E100 PolarHBondContact O-N 3.04Å; I97-A101 PolarHBondContact O-N 2.93Å; I97-A101 VanDerWaalsContact O-N 3.14Å; I97-I130 HydrophobicContact CG2-CG2 3.81Å; I97-R133 HydrophobicContact CD1-CB 4.26Å; I97-L134 HydrophobicContact CG2-CB 4.06Å; I97-V137 HydrophobicContact CD1-CG2 3.73Å
98F97.4Very high95.9Very high22 Ų2252.2 Ų52.210%0.09626%0.259CS..Hα-helixtrans-66.6-39.2175.6-174.8-122.5000112.5I94 Q95 N96 A101 Q102 T152 K155 I156 M205I94-F98 WeakPolarHBondContact O-CB 3.4Å; I94-F98 PolarHBondContact O-N 2.91Å; Q95-F98 CarbonylContact O-C 3.46Å; Q95-F98 WeakPolarHBondContact O-CA 3.16Å; Q95-F98 WeakPolarHBondContact O-CB 3.39Å; Q95-F98 PolarHBondContact O-N 3.45Å; N96-F98 VanDerWaalsContact C-N 3.29Å; N96-F98 PolarHBondContact O-N 3.1Å; F98-A101 VanDerWaalsContact O-CB 3.3Å; F98-A101 WeakPolarHBondContact O-CB 3.25Å; F98-A101 PolarHBondContact O-N 3Å; F98-Q102 HydrophobicContact CD1-CG 4.43Å; F98-Q102 HydrophobicContact CE1-CG 4.17Å; F98-Q102 HydrophobicContact CZ-CG 4.24Å; F98-Q102 WeakPolarHBondContact O-CG 3.36Å; F98-Q102 PolarHBondContact O-N 3.27Å; F98-T152 HydrophobicContact CB-CG2 3.72Å; F98-T152 HydrophobicContact CD2-CG2 3.53Å; F98-T152 HydrophobicContact CE2-CG2 4.39Å; F98-T152 HydrophobicContact CG-CG2 3.83Å; F98-K155 HydrophobicContact CE2-CD 4.5Å; F98-K155 HydrophobicContact CZ-CD 4.35Å; F98-I156 HydrophobicContact CD2-CD1 4.17Å; F98-I156 HydrophobicContact CD2-CG1 4.32Å; F98-M205 HydrophobicContact CD2-CE 3.89Å; F98-M205 HydrophobicContact CE2-CE 3.42Å; F98-M205 VanDerWaalsContact CE2-CE 3.42Å; F98-M205 HydrophobicContact CE2-SD 3.93Å; F98-M205 HydrophobicContact CZ-CE 4.16Å
99E97.4Very high95.4Very high92 Ų9250.7 Ų50.743%0.4325%0.252SS..Hα-helixtrans-66.2-37.4176.8-73.9174.1-170.300112.4Q95 N96 A101 Q102 S103Q95-E99 HydrophobicContact CG-CG 4.46Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.45Å; Q95-E99 PolarHBondContact NE2-OE1 3.09Å; Q95-E99 WeakPolarHBondContact O-CG 3.16Å; Q95-E99 PolarHBondContact O-N 3.18Å; N96-E99 PolarHBondContact O-N 3.34Å; E99-A101 VanDerWaalsContact C-N 3.31Å; E99-A101 PolarHBondContact O-N 3.46Å; E99-Q102 WeakPolarHBondContact O-CB 3.42Å; E99-Q102 PolarHBondContact O-N 3.11Å; E99-S103 PolarHBondContact O-N 3.12Å
100E97.7Very high94.7Very high90 Ų9050.1 Ų50.142%0.42125%0.246SC..Hα-helixtrans-58.3-45.2169.4-71.7173-152.800111.1N96 I97 Q102 S103 L104 R133N96-E100 WeakPolarHBondContact O-CG 3.09Å; N96-E100 PolarHBondContact O-N 3.05Å; I97-E100 PolarHBondContact O-N 3.04Å; E100-Q102 VanDerWaalsContact C-N 3.35Å; E100-Q102 PolarHBondContact O-N 2.83Å; E100-S103 WeakPolarHBondContact O-CB 3.34Å; E100-S103 PolarHBondContact O-N 2.79Å; E100-L104 PolarHBondContact O-N 3.1Å; E100-R133 IonicContact OE1-NH1 2.7Å; E100-R133 IonicContact OE2-CZ 3.09Å; E100-R133 IonicContact OE2-NH1 3.34Å; E100-R133 PolarHBondContact OE2-NH1 3.49Å; E100-R133 IonicContact OE2-NH2 3.09Å; E100-R133 PolarHBondContact OE2-NH2 3.38Å
101A97.1Very high93.9Very high0 Ų049.5 Ų49.50%025%0.247CC..Hα-helixtrans-61.4-42.817600000112.3I97 F98 E99 S103 L104 V105 I130 I156 M205I97-A101 PolarHBondContact O-N 2.93Å; I97-A101 VanDerWaalsContact O-N 3.14Å; F98-A101 VanDerWaalsContact O-CB 3.3Å; F98-A101 WeakPolarHBondContact O-CB 3.25Å; F98-A101 PolarHBondContact O-N 3Å; E99-A101 VanDerWaalsContact C-N 3.31Å; E99-A101 PolarHBondContact O-N 3.46Å; A101-S103 VanDerWaalsContact C-N 3.31Å; A101-S103 PolarHBondContact O-N 2.7Å; A101-L104 PolarHBondContact O-N 2.68Å; A101-V105 WeakPolarHBondContact O-CB 3.28Å; A101-V105 VanDerWaalsContact O-CG2 3.25Å; A101-V105 WeakPolarHBondContact O-CG2 3.34Å; A101-V105 PolarHBondContact O-N 3.25Å; A101-I130 HydrophobicContact CB-CD1 3.81Å; A101-I130 HydrophobicContact CB-CG2 3.89Å; A101-I156 HydrophobicContact CB-CD1 4.06Å; A101-I156 HydrophobicContact CB-CG1 4.39Å; A101-M205 HydrophobicContact CB-CE 3.55Å
102Q96.4Very high93Very high27 Ų2748.8 Ų48.813%0.12624%0.244CC..Hα-helixtrans-61.5-40.4174.5-70.6-178.5-32.500111.9F98 E99 E100 R106 M205 V207F98-Q102 HydrophobicContact CD1-CG 4.43Å; F98-Q102 HydrophobicContact CE1-CG 4.17Å; F98-Q102 HydrophobicContact CZ-CG 4.24Å; F98-Q102 WeakPolarHBondContact O-CG 3.36Å; F98-Q102 PolarHBondContact O-N 3.27Å; E99-Q102 WeakPolarHBondContact O-CB 3.42Å; E99-Q102 PolarHBondContact O-N 3.11Å; E100-Q102 VanDerWaalsContact C-N 3.35Å; E100-Q102 PolarHBondContact O-N 2.83Å; Q102-R106 WeakPolarHBondContact O-CB 3.28Å; Q102-R106 WeakPolarHBondContact O-CG 3.47Å; Q102-R106 PolarHBondContact O-N 3.21Å; Q102-M205 HydrophobicContact CG-CB 4.46Å; Q102-M205 HydrophobicContact CG-CE 3.95Å; Q102-M205 WeakPolarHBondContact CG-O 3.47Å; Q102-M205 PolarHBondContact NE2-O 3.36Å; Q102-V207 HydrophobicContact CB-CG1 3.73Å; Q102-V207 HydrophobicContact CG-CG1 3.95Å
103S95.7Very high92.1Very high75 Ų7550 Ų5052%0.52425%0.245SC..Hα-helixtrans-64.5-47.4177.5-170.40000111.5E99 E100 A101 V105 R106 E107E99-S103 PolarHBondContact O-N 3.12Å; E100-S103 WeakPolarHBondContact O-CB 3.34Å; E100-S103 PolarHBondContact O-N 2.79Å; A101-S103 VanDerWaalsContact C-N 3.31Å; A101-S103 PolarHBondContact O-N 2.7Å; S103-V105 VanDerWaalsContact C-N 3.31Å; S103-V105 PolarHBondContact O-N 3.35Å; S103-R106 PolarHBondContact O-N 3.37Å; S103-E107 PolarHBondContact O-N 3.46Å; S103-E107 VanDerWaalsContact O-N 3.12Å
104L94.9Very high91.1Very high32 Ų3252.7 Ų52.717%0.16826%0.262CS..Hα-helixtrans-58.3-45.2177179.462.4000111.2E100 A101 E107 K108 F123 I127 I130E100-L104 PolarHBondContact O-N 3.1Å; A101-L104 PolarHBondContact O-N 2.68Å; L104-E107 PolarHBondContact O-N 3.25Å; L104-K108 HydrophobicContact CD1-CG 3.89Å; L104-K108 WeakPolarHBondContact O-CB 3.45Å; L104-K108 WeakPolarHBondContact O-CG 3.39Å; L104-K108 PolarHBondContact O-N 3.35Å; L104-F123 HydrophobicContact CD1-CD2 4.31Å; L104-F123 HydrophobicContact CD2-CD2 4.03Å; L104-F123 HydrophobicContact CD2-CE2 4.32Å; L104-F123 HydrophobicContact CG-CD2 3.85Å; L104-F123 HydrophobicContact CG-CE2 4.02Å; L104-I127 HydrophobicContact CD2-CD1 4.01Å; L104-I127 HydrophobicContact CD2-CG1 4.06Å; L104-I130 HydrophobicContact CD2-CD1 3.95Å
105V93.6Very high89.6Confident0 Ų053.4 Ų53.40%027%0.269CS..Hα-helixtrans-63.6-44.7177.6168.30000111.2A101 S103 E107 K108 I109 F123 I127 V159 I201 M205 V207A101-V105 WeakPolarHBondContact O-CB 3.28Å; A101-V105 VanDerWaalsContact O-CG2 3.25Å; A101-V105 WeakPolarHBondContact O-CG2 3.34Å; A101-V105 PolarHBondContact O-N 3.25Å; S103-V105 VanDerWaalsContact C-N 3.31Å; S103-V105 PolarHBondContact O-N 3.35Å; V105-E107 PolarHBondContact O-N 3.46Å; V105-K108 PolarHBondContact O-N 3Å; V105-I109 HydrophobicContact CG1-CD1 4.11Å; V105-I109 WeakPolarHBondContact O-CB 3.34Å; V105-I109 WeakPolarHBondContact O-CG2 3.41Å; V105-I109 PolarHBondContact O-N 3.17Å; V105-F123 HydrophobicContact CG2-CE2 3.95Å; V105-F123 HydrophobicContact CG2-CZ 3.99Å; V105-I127 HydrophobicContact CG2-CD1 4.29Å; V105-V159 HydrophobicContact CG2-CG1 4.39Å; V105-I201 HydrophobicContact CG1-CG2 3.52Å; V105-I201 HydrophobicContact CG2-CG2 4.39Å; V105-M205 HydrophobicContact CB-CG 4.39Å; V105-M205 HydrophobicContact CG1-CB 4.38Å; V105-M205 HydrophobicContact CG1-CG 4.18Å; V105-M205 HydrophobicContact CG2-CG 4.04Å; V105-V207 HydrophobicContact CG1-CG2 4.2Å
106R91.7Very high88.1Confident121 Ų12153.4 Ų53.446%0.45728%0.278SS..Hα-helixtrans-56.2-40.2177-81.2-177.2-112.3-101.13.8112.6Q102 S103 V207Q102-R106 WeakPolarHBondContact O-CB 3.28Å; Q102-R106 WeakPolarHBondContact O-CG 3.47Å; Q102-R106 PolarHBondContact O-N 3.21Å; S103-R106 PolarHBondContact O-N 3.37Å; R106-V207 HydrophobicContact CG-CB 3.72Å; R106-V207 HydrophobicContact CG-CG1 3.89Å; R106-V207 HydrophobicContact CG-CG2 4.2Å; R106-V207 VanDerWaalsContact CZ-CG1 3.49Å
107E90.1Very high86.5Confident121 Ų12153.1 Ų53.157%0.56528%0.276SS*.Hα-helixtrans-69.9-49177.8-172.4-166134.700111.6S103 L104 V105S103-E107 PolarHBondContact O-N 3.46Å; S103-E107 VanDerWaalsContact O-N 3.12Å; L104-E107 PolarHBondContact O-N 3.25Å; V105-E107 PolarHBondContact O-N 3.46Å
108K88.9Confident84.8Confident38 Ų3857 Ų5717%0.16530%0.303CS..Hα-helixtrans-88.4-7.6-167.5-58.6-61.7-168.4-171.10114.5L104 V105 P111 E122 F123L104-K108 HydrophobicContact CD1-CG 3.89Å; L104-K108 WeakPolarHBondContact O-CB 3.45Å; L104-K108 WeakPolarHBondContact O-CG 3.39Å; L104-K108 PolarHBondContact O-N 3.35Å; V105-K108 PolarHBondContact O-N 3Å; K108-P111 VanDerWaalsContact O-CD 3.23Å; K108-P111 WeakPolarHBondContact O-CD 3.39Å; K108-E122 IonicContact NZ-OE2 3.33Å; K108-E122 PolarHBondContact NZ-OE2 2.91Å; K108-E122 VanDerWaalsContact NZ-OE2 3.09Å; K108-F123 HydrophobicContact CB-CB 4.2Å; K108-F123 HydrophobicContact CB-CD1 3.84Å; K108-F123 HydrophobicContact CB-CD2 3.78Å; K108-F123 HydrophobicContact CB-CE1 4.09Å; K108-F123 HydrophobicContact CB-CE2 4.05Å; K108-F123 HydrophobicContact CB-CG 3.68Å; K108-F123 HydrophobicContact CB-CZ 4.19Å; K108-F123 HydrophobicContact CG-CB 4.05Å; K108-F123 HydrophobicContact CG-CD2 3.86Å; K108-F123 HydrophobicContact CG-CE2 4.46Å; K108-F123 HydrophobicContact CG-CG 3.93Å
109I85.8Confident83.7Confident6 Ų656.7 Ų56.73%0.03130%0.303CS..THydrogen-bonded Turntrans-82.2-17.6-177.2-154.5169.3000114.7V105 P111 F112 Y113 G198 I201 A202V105-I109 HydrophobicContact CG1-CD1 4.11Å; V105-I109 WeakPolarHBondContact O-CB 3.34Å; V105-I109 WeakPolarHBondContact O-CG2 3.41Å; V105-I109 PolarHBondContact O-N 3.17Å; I109-P111 VanDerWaalsContact C-N 3.32Å; I109-F112 HydrophobicContact CG1-CD2 4.12Å; I109-F112 WeakPolarHBondContact O-CB 3.38Å; I109-F112 PolarHBondContact O-N 2.88Å; I109-Y113 HydrophobicContact CG2-CE2 4Å; I109-G198 WeakPolarHBondContact CD1-O 3.36Å; I109-I201 HydrophobicContact CD1-CB 4Å; I109-I201 HydrophobicContact CD1-CG2 3.81Å; I109-A202 HydrophobicContact CD1-CB 3.79Å
110V82.8Confident83Confident82 Ų8255.1 Ų55.150%0.49730%0.299SS..Hα-helixtrans-50.3-42.3-177178.30000113.8F112 Y113V110-F112 PolarHBondContact O-N 2.81Å; V110-Y113 PolarHBondContact O-N 3.41Å
111P78.9Confident82.5Confident43 Ų4355.9 Ų55.928%0.27931%0.306SS..Hα-helixtrans-58.8-30.5178.4-25.236.5000114.6K108 I109 Y113 N114 G116 C118K108-P111 VanDerWaalsContact O-CD 3.23Å; K108-P111 WeakPolarHBondContact O-CD 3.39Å; I109-P111 VanDerWaalsContact C-N 3.32Å; P111-Y113 VanDerWaalsContact C-N 3.31Å; P111-Y113 PolarHBondContact O-N 3.11Å; P111-N114 PolarHBondContact O-N 2.94Å; P111-G116 PolarHBondContact O-N 3.36Å; P111-C118 HydrophobicContact CB-CB 4.48Å
112F79Confident82.2Confident3 Ų362 Ų621%0.01334%0.335CS..Hα-helixtrans-65.2-34.8179.6-74.6-91.9000112.3I109 V110 N114 G115 V119 N194 R197 I201I109-F112 HydrophobicContact CG1-CD2 4.12Å; I109-F112 WeakPolarHBondContact O-CB 3.38Å; I109-F112 PolarHBondContact O-N 2.88Å; V110-F112 PolarHBondContact O-N 2.81Å; F112-N114 PolarHBondContact O-N 3.39Å; F112-G115 PolarHBondContact O-N 2.94Å; F112-V119 HydrophobicContact CE2-CG2 4.33Å; F112-V119 HydrophobicContact CZ-CG2 3.8Å; F112-N194 WeakPolarHBondContact CD1-O 3.3Å; F112-R197 HydrophobicContact CD1-CB 4.01Å; F112-R197 HydrophobicContact CE1-CB 3.98Å; F112-I201 HydrophobicContact CE1-CD1 4.4Å; F112-I201 HydrophobicContact CE2-CD1 4.3Å; F112-I201 HydrophobicContact CZ-CD1 4.01Å
113Y77.7Confident81.9Confident101 Ų10160.8 Ų60.840%0.39633%0.329SS..Hα-helixtrans-66.9-26179.2-62.2-50.6000112.7I109 V110 P111 G115 V199I109-Y113 HydrophobicContact CG2-CE2 4Å; V110-Y113 PolarHBondContact O-N 3.41Å; P111-Y113 VanDerWaalsContact C-N 3.31Å; P111-Y113 PolarHBondContact O-N 3.11Å; Y113-G115 PolarHBondContact O-N 3.34Å; Y113-V199 HydrophobicContact CE1-CG2 4.42Å
114N76.7Confident81.7Confident136 Ų13659.5 Ų59.573%0.72732%0.315SS*.THydrogen-bonded Turntrans-82.72.1174.5-63.7-31000112.8P111 F112 G116P111-N114 PolarHBondContact O-N 2.94Å; F112-N114 PolarHBondContact O-N 3.39Å; N114-G116 PolarHBondContact O-N 3.22Å
115G65.4Low81.7Confident15 Ų1564.3 Ų64.316%0.15534%0.337CS..THydrogen-bonded Turntrans73.96.9-17500000114.3F112 Y113F112-G115 PolarHBondContact O-N 2.94Å; Y113-G115 PolarHBondContact O-N 3.34Å
116G65.9Low81.8Confident31 Ų3165.3 Ų65.332%0.3235%0.347SS..  trans-79143.817800000112.5P111 N114P111-G116 PolarHBondContact O-N 3.36Å; N114-G116 PolarHBondContact O-N 3.22Å
117N66.1Low82Confident73 Ų7359.6 Ų59.639%0.3933%0.325SS..  trans-99.255.2172.9-170.534.3000111.1C166N117-C166 PolarHBondContact ND2-O 3.42Å; N117-C166 VanDerWaalsContact OD1-CB 3.28Å; N117-C166 WeakPolarHBondContact OD1-CB 3.43Å
118C61.7Low82.2Confident88 Ų8858.9 Ų58.960%0.59532%0.322SS*.  trans-104.473175.4-78.20000109.7P111P111-C118 HydrophobicContact CB-CB 4.48Å
119V74.7Confident82.6Confident17 Ų1760.8 Ų60.810%0.10333%0.334CS..  trans-72.1124.4155.7-175.40000106.9F112 F123 I163 C166 M167F112-V119 HydrophobicContact CE2-CG2 4.33Å; F112-V119 HydrophobicContact CZ-CG2 3.8Å; V119-F123 HydrophobicContact CG1-CB 4.41Å; V119-F123 HydrophobicContact CG1-CD1 3.9Å; V119-I163 HydrophobicContact CB-CG2 4.4Å; V119-I163 HydrophobicContact CG1-CB 4.31Å; V119-I163 HydrophobicContact CG1-CG1 4.39Å; V119-I163 HydrophobicContact CG1-CG2 3.33Å; V119-I163 HydrophobicContact CG2-CG2 4.44Å; V119-C166 HydrophobicContact CG2-CB 3.76Å; V119-M167 HydrophobicContact CB-CG 4Å; V119-M167 HydrophobicContact CB-SD 4.33Å; V119-M167 HydrophobicContact CG1-CG 4.23Å; V119-M167 HydrophobicContact CG1-SD 3.93Å
120T83.2Confident83.2Confident58 Ų5860.7 Ų60.736%0.35633%0.334SS..  trans-86.1146.217554.60000110.6E122 F123 E124T120-E122 PolarHBondContact O-N 3.05Å; T120-F123 WeakPolarHBondContact O-CA 3.45Å; T120-F123 WeakPolarHBondContact O-CB 3.45Å; T120-F123 PolarHBondContact O-N 2.95Å; T120-F123 WeakPolarHBondContact OG1-CB 3.5Å; T120-F123 PolarHBondContact OG1-N 3.06Å; T120-E124 PolarHBondContact O-N 3.21Å
121D87.4Confident83.9Confident106 Ų10657 Ų5757%0.56731%0.311SS*.Hα-helixtrans-53.1-38172.3-59.7-16.3000111.5F123 E124 E125 M167D121-F123 PolarHBondContact O-N 2.79Å; D121-F123 VanDerWaalsContact O-N 3.17Å; D121-E124 PolarHBondContact O-N 3.32Å; D121-E125 WeakPolarHBondContact O-CB 3.32Å; D121-E125 WeakPolarHBondContact O-CG 3.46Å; D121-E125 PolarHBondContact O-N 3.44Å; D121-M167 VanDerWaalsContact OD1-CE 3.29Å; D121-M167 WeakPolarHBondContact OD1-CE 3.44Å
122E89.5Confident84.7Confident129 Ų12959.2 Ų59.260%0.60332%0.32SS*.Hα-helixtrans-56.2-32.7174-64.2179.8178.400113.9K108 T120 G126K108-E122 IonicContact NZ-OE2 3.33Å; K108-E122 PolarHBondContact NZ-OE2 2.91Å; K108-E122 VanDerWaalsContact NZ-OE2 3.09Å; T120-E122 PolarHBondContact O-N 3.05Å; E122-G126 PolarHBondContact O-N 2.88Å
123F91.2Very high85.6Confident2 Ų262.6 Ų62.61%0.00933%0.333CS..Hα-helixtrans-77.3-41.9-179.2-177.6-152.3000110.4L104 V105 K108 V119 T120 D121 I127 I163L104-F123 HydrophobicContact CD1-CD2 4.31Å; L104-F123 HydrophobicContact CD2-CD2 4.03Å; L104-F123 HydrophobicContact CD2-CE2 4.32Å; L104-F123 HydrophobicContact CG-CD2 3.85Å; L104-F123 HydrophobicContact CG-CE2 4.02Å; V105-F123 HydrophobicContact CG2-CE2 3.95Å; V105-F123 HydrophobicContact CG2-CZ 3.99Å; K108-F123 HydrophobicContact CB-CB 4.2Å; K108-F123 HydrophobicContact CB-CD1 3.84Å; K108-F123 HydrophobicContact CB-CD2 3.78Å; K108-F123 HydrophobicContact CB-CE1 4.09Å; K108-F123 HydrophobicContact CB-CE2 4.05Å; K108-F123 HydrophobicContact CB-CG 3.68Å; K108-F123 HydrophobicContact CB-CZ 4.19Å; K108-F123 HydrophobicContact CG-CB 4.05Å; K108-F123 HydrophobicContact CG-CD2 3.86Å; K108-F123 HydrophobicContact CG-CE2 4.46Å; K108-F123 HydrophobicContact CG-CG 3.93Å; V119-F123 HydrophobicContact CG1-CB 4.41Å; V119-F123 HydrophobicContact CG1-CD1 3.9Å; T120-F123 WeakPolarHBondContact O-CA 3.45Å; T120-F123 WeakPolarHBondContact O-CB 3.45Å; T120-F123 PolarHBondContact O-N 2.95Å; T120-F123 WeakPolarHBondContact OG1-CB 3.5Å; T120-F123 PolarHBondContact OG1-N 3.06Å; D121-F123 PolarHBondContact O-N 2.79Å; D121-F123 VanDerWaalsContact O-N 3.17Å; F123-I127 HydrophobicContact CD2-CG1 3.94Å; F123-I127 HydrophobicContact CE2-CD1 3.99Å; F123-I127 HydrophobicContact CE2-CG1 3.72Å; F123-I127 VanDerWaalsContact O-CG1 3.31Å; F123-I127 WeakPolarHBondContact O-CG1 3.48Å; F123-I127 PolarHBondContact O-N 3.44Å; F123-I163 HydrophobicContact CD1-CD1 3.76Å; F123-I163 HydrophobicContact CD1-CG1 4.16Å; F123-I163 HydrophobicContact CD2-CD1 4.34Å; F123-I163 HydrophobicContact CE1-CD1 3.33Å; F123-I163 HydrophobicContact CE1-CG1 3.75Å; F123-I163 HydrophobicContact CE2-CD1 3.97Å; F123-I163 HydrophobicContact CG-CD1 4.26Å; F123-I163 HydrophobicContact CZ-CD1 3.44Å; F123-I163 VanDerWaalsContact CZ-CD1 3.44Å; F123-I163 HydrophobicContact CZ-CG1 4.29Å
124E91.4Very high86.5Confident48 Ų4857.8 Ų57.822%0.22431%0.314CS..Hα-helixtrans-61.7-49.9173.7-174.6-178.8-16400111T120 D121 G126 I127 Q128 I163 M167T120-E124 PolarHBondContact O-N 3.21Å; D121-E124 PolarHBondContact O-N 3.32Å; E124-G126 VanDerWaalsContact C-N 3.35Å; E124-G126 PolarHBondContact O-N 2.92Å; E124-I127 PolarHBondContact O-N 2.99Å; E124-Q128 WeakPolarHBondContact O-CB 3.42Å; E124-Q128 PolarHBondContact O-N 2.94Å; E124-I163 HydrophobicContact CB-CG2 4.26Å; E124-M167 HydrophobicContact CB-SD 4.22Å; E124-M167 WeakPolarHBondContact OE2-CE 3.41Å
125E93.7Very high87.4Confident132 Ų13251.5 Ų51.562%0.61728%0.281SS*.Hα-helixtrans-60.1-43.1178.6-71.9-178.1176.100111.9D121 Q128 D129D121-E125 WeakPolarHBondContact O-CB 3.32Å; D121-E125 WeakPolarHBondContact O-CG 3.46Å; D121-E125 PolarHBondContact O-N 3.44Å; E125-Q128 PolarHBondContact O-N 3.33Å; E125-D129 PolarHBondContact O-N 3.01Å
126G95.8Very high88.8Confident21 Ų2153.7 Ų53.722%0.21629%0.286CS..Hα-helixtrans-62.6-42.8177.300000112.9E122 E124 D129 I130E122-G126 PolarHBondContact O-N 2.88Å; E124-G126 VanDerWaalsContact C-N 3.35Å; E124-G126 PolarHBondContact O-N 2.92Å; G126-D129 PolarHBondContact O-N 2.92Å; G126-I130 WeakPolarHBondContact O-CD1 3.44Å; G126-I130 VanDerWaalsContact O-CG1 3.28Å; G126-I130 WeakPolarHBondContact O-CG1 3.31Å; G126-I130 PolarHBondContact O-N 3.42Å; G126-I130 VanDerWaalsContact O-N 3.13Å
127I96.1Very high90.2Very high1 Ų152.2 Ų52.21%0.00527%0.272CS..Hα-helixtrans-66.4-39.6175.1-68.6-66.8000111L104 V105 F123 E124 I130 I131 I156 V159 Q160 I163L104-I127 HydrophobicContact CD2-CD1 4.01Å; L104-I127 HydrophobicContact CD2-CG1 4.06Å; V105-I127 HydrophobicContact CG2-CD1 4.29Å; F123-I127 HydrophobicContact CD2-CG1 3.94Å; F123-I127 HydrophobicContact CE2-CD1 3.99Å; F123-I127 HydrophobicContact CE2-CG1 3.72Å; F123-I127 VanDerWaalsContact O-CG1 3.31Å; F123-I127 WeakPolarHBondContact O-CG1 3.48Å; F123-I127 PolarHBondContact O-N 3.44Å; E124-I127 PolarHBondContact O-N 2.99Å; I127-I130 PolarHBondContact O-N 3.33Å; I127-I131 HydrophobicContact CG2-CD1 3.92Å; I127-I131 HydrophobicContact CG2-CG1 4.48Å; I127-I131 WeakPolarHBondContact O-CG1 2.88Å; I127-I131 PolarHBondContact O-N 3.29Å; I127-I156 HydrophobicContact CG2-CG2 3.95Å; I127-V159 HydrophobicContact CD1-CG1 4.41Å; I127-Q160 HydrophobicContact CG2-CB 3.83Å; I127-Q160 HydrophobicContact CG2-CG 4.32Å; I127-I163 HydrophobicContact CG1-CD1 4.08Å
128Q95.2Very high91.5Very high107 Ų10751.2 Ų51.250%0.526%0.264SS..Hα-helixtrans-63.7-41.4177.9-174.8174-4.800112.3E124 E125 I131 L132E124-Q128 WeakPolarHBondContact O-CB 3.42Å; E124-Q128 PolarHBondContact O-N 2.94Å; E125-Q128 PolarHBondContact O-N 3.33Å; Q128-I131 PolarHBondContact O-N 3.49Å; Q128-L132 PolarHBondContact O-N 3.45Å
129D97Very high92.9Very high77 Ų7747.1 Ų47.141%0.41224%0.236SC..Hα-helixtrans-61.3-46.4174172.672000112E125 G126 I131 L132 R133E125-D129 PolarHBondContact O-N 3.01Å; G126-D129 PolarHBondContact O-N 2.92Å; D129-I131 VanDerWaalsContact C-N 3.33Å; D129-I131 PolarHBondContact O-N 2.99Å; D129-L132 WeakPolarHBondContact O-CB 3.43Å; D129-L132 PolarHBondContact O-N 3.36Å; D129-L132 VanDerWaalsContact O-N 3.15Å; D129-R133 PolarHBondContact O-N 3.23Å; D129-R133 IonicContact OD1-NE 3.09Å; D129-R133 IonicContact OD2-CZ 3.6Å; D129-R133 VanDerWaalsContact OD2-CZ 3.28Å; D129-R133 IonicContact OD2-NE 3.68Å; D129-R133 PolarHBondContact OD2-NE 3.1Å; D129-R133 IonicContact OD2-NH2 3.55Å; D129-R133 PolarHBondContact OD2-NH2 3.3Å
130I97.9Very high93.5Very high4 Ų449.2 Ų49.22%0.02126%0.261CS..Hα-helixtrans-58.1-46.4176.8-73.2162.7000110.9I97 A101 L104 G126 I127 L132 R133 L134 I156I97-I130 HydrophobicContact CG2-CG2 3.81Å; A101-I130 HydrophobicContact CB-CD1 3.81Å; A101-I130 HydrophobicContact CB-CG2 3.89Å; L104-I130 HydrophobicContact CD2-CD1 3.95Å; G126-I130 WeakPolarHBondContact O-CD1 3.44Å; G126-I130 VanDerWaalsContact O-CG1 3.28Å; G126-I130 WeakPolarHBondContact O-CG1 3.31Å; G126-I130 PolarHBondContact O-N 3.42Å; G126-I130 VanDerWaalsContact O-N 3.13Å; I127-I130 PolarHBondContact O-N 3.33Å; I130-L132 VanDerWaalsContact C-N 3.29Å; I130-L132 PolarHBondContact O-N 3.18Å; I130-R133 VanDerWaalsContact CG1-NH2 3.33Å; I130-R133 PolarHBondContact O-N 3.3Å; I130-L134 VanDerWaalsContact O-CB 3.26Å; I130-L134 WeakPolarHBondContact O-CB 3.4Å; I130-L134 PolarHBondContact O-N 3.49Å; I130-I156 HydrophobicContact CG2-CD1 3.72Å; I130-I156 HydrophobicContact CG2-CG2 4.29Å
131I96.8Very high93.7Very high6 Ų648.1 Ų48.13%0.03126%0.261CS..Hα-helixtrans-60.1-42.7177.9-71.5169.9000110.6I127 Q128 D129 T135 L153 I156 Q160 P326I127-I131 HydrophobicContact CG2-CD1 3.92Å; I127-I131 HydrophobicContact CG2-CG1 4.48Å; I127-I131 WeakPolarHBondContact O-CG1 2.88Å; I127-I131 PolarHBondContact O-N 3.29Å; Q128-I131 PolarHBondContact O-N 3.49Å; D129-I131 VanDerWaalsContact C-N 3.33Å; D129-I131 PolarHBondContact O-N 2.99Å; I131-T135 WeakPolarHBondContact O-CB 3.37Å; I131-T135 PolarHBondContact O-N 3.44Å; I131-T135 PolarHBondContact O-OG1 3.25Å; I131-L153 HydrophobicContact CG2-CD2 4.18Å; I131-I156 HydrophobicContact CD1-CG2 3.98Å; I131-I156 HydrophobicContact CG1-CB 4.36Å; I131-I156 HydrophobicContact CG1-CG2 3.53Å; I131-Q160 HydrophobicContact CD1-CB 3.96Å; I131-Q160 HydrophobicContact CD1-CG 4.29Å; I131-P326 HydrophobicContact CG2-CB 3.85Å; I131-P326 HydrophobicContact CG2-CG 3.55Å
132L95.8Very high93.9Very high89 Ų8946.1 Ų46.147%0.46625%0.247SC..Hα-helixtrans-60.6-53178.5-176.665.8000110.9Q128 D129 I130 L134 T135 H136Q128-L132 PolarHBondContact O-N 3.45Å; D129-L132 WeakPolarHBondContact O-CB 3.43Å; D129-L132 PolarHBondContact O-N 3.36Å; D129-L132 VanDerWaalsContact O-N 3.15Å; I130-L132 VanDerWaalsContact C-N 3.29Å; I130-L132 PolarHBondContact O-N 3.18Å; L132-L134 VanDerWaalsContact C-N 3.35Å; L132-L134 PolarHBondContact O-N 3.2Å; L132-T135 WeakPolarHBondContact O-CB 3.45Å; L132-T135 PolarHBondContact O-N 3.42Å; L132-H136 WeakPolarHBondContact CD1-CE1 3.23Å; L132-H136 PolarHBondContact O-N 2.96Å; L132-H136 VanDerWaalsContact O-N 3.15Å; L132-H136 PolarHBondContact O-ND1 3.39Å
133R97.5Very high93.9Very high74 Ų7443.2 Ų43.228%0.27924%0.235SC..Hα-helixtrans-59.6-45178.9-72.1-174.3-71.8122.1-9.6111.9I97 E100 D129 I130 T135 H136 V137I97-R133 HydrophobicContact CD1-CB 4.26Å; E100-R133 IonicContact OE1-NH1 2.7Å; E100-R133 IonicContact OE2-CZ 3.09Å; E100-R133 IonicContact OE2-NH1 3.34Å; E100-R133 PolarHBondContact OE2-NH1 3.49Å; E100-R133 IonicContact OE2-NH2 3.09Å; E100-R133 PolarHBondContact OE2-NH2 3.38Å; D129-R133 PolarHBondContact O-N 3.23Å; D129-R133 IonicContact OD1-NE 3.09Å; D129-R133 IonicContact OD2-CZ 3.6Å; D129-R133 VanDerWaalsContact OD2-CZ 3.28Å; D129-R133 IonicContact OD2-NE 3.68Å; D129-R133 PolarHBondContact OD2-NE 3.1Å; D129-R133 IonicContact OD2-NH2 3.55Å; D129-R133 PolarHBondContact OD2-NH2 3.3Å; I130-R133 VanDerWaalsContact CG1-NH2 3.33Å; I130-R133 PolarHBondContact O-N 3.3Å; R133-T135 VanDerWaalsContact C-N 3.32Å; R133-T135 PolarHBondContact O-N 2.94Å; R133-H136 PolarHBondContact O-N 3.27Å; R133-H136 VanDerWaalsContact O-N 3.14Å; R133-V137 PolarHBondContact O-N 3.3Å
134L97Very high94Very high0 Ų043.2 Ų43.20%024%0.236CC..Hα-helixtrans-63.2-38.5178.5-176.258.6000112.3I94 I97 I130 L132 H136 V137 R149 T152 L153 I156I94-L134 HydrophobicContact CB-CD1 4.23Å; I94-L134 HydrophobicContact CG1-CD1 3.91Å; I94-L134 HydrophobicContact CG2-CD1 3.95Å; I97-L134 HydrophobicContact CG2-CB 4.06Å; I130-L134 VanDerWaalsContact O-CB 3.26Å; I130-L134 WeakPolarHBondContact O-CB 3.4Å; I130-L134 PolarHBondContact O-N 3.49Å; L132-L134 VanDerWaalsContact C-N 3.35Å; L132-L134 PolarHBondContact O-N 3.2Å; L134-H136 VanDerWaalsContact C-N 3.26Å; L134-H136 PolarHBondContact O-N 2.9Å; L134-V137 HydrophobicContact CD1-CG2 4.45Å; L134-V137 PolarHBondContact O-N 2.98Å; L134-R149 HydrophobicContact CD1-CG 4.26Å; L134-R149 HydrophobicContact CG-CG 4.31Å; L134-R149 WeakPolarHBondContact O-CD 3.38Å; L134-R149 WeakPolarHBondContact O-CG 3.47Å; L134-T152 HydrophobicContact CD1-CG2 4.33Å; L134-T152 HydrophobicContact CD2-CG2 3.39Å; L134-L153 HydrophobicContact CB-CD2 4.03Å; L134-L153 HydrophobicContact CD2-CB 4.38Å; L134-L153 HydrophobicContact CD2-CD2 3.63Å; L134-L153 HydrophobicContact CD2-CG 3.64Å; L134-L153 HydrophobicContact CG-CD2 3.82Å; L134-L153 HydrophobicContact CG-CG 3.84Å; L134-I156 HydrophobicContact CD2-CD1 3.85Å
135T95.5Very high94.1Very high4 Ų441.1 Ų41.13%0.02523%0.226CC..Hα-helixtrans-62.6-34.7176-58.60000111.5I131 L132 R133 R149 P326 E330 W445I131-T135 WeakPolarHBondContact O-CB 3.37Å; I131-T135 PolarHBondContact O-N 3.44Å; I131-T135 PolarHBondContact O-OG1 3.25Å; L132-T135 WeakPolarHBondContact O-CB 3.45Å; L132-T135 PolarHBondContact O-N 3.42Å; R133-T135 VanDerWaalsContact C-N 3.32Å; R133-T135 PolarHBondContact O-N 2.94Å; T135-R149 PolarHBondContact O-NH1 3.43Å; T135-P326 HydrophobicContact CG2-CB 4.22Å; T135-P326 WeakPolarHBondContact OG1-CB 3.47Å; T135-E330 HydrophobicContact CG2-CB 3.85Å; T135-E330 HydrophobicContact CG2-CG 4.38Å; T135-W445 HydrophobicContact CG2-CZ2 4.41Å; T135-W445 PolarHBondContact O-NE1 3.09Å
136H94.8Very high94Very high60 Ų6035.3 Ų35.328%0.27820%0.198SC..Hα-helixtrans-83.5-6.8-178.7-65.6154.2000114.7L132 R133 L134 K138 E330L132-H136 WeakPolarHBondContact CD1-CE1 3.23Å; L132-H136 PolarHBondContact O-N 2.96Å; L132-H136 VanDerWaalsContact O-N 3.15Å; L132-H136 PolarHBondContact O-ND1 3.39Å; R133-H136 PolarHBondContact O-N 3.27Å; R133-H136 VanDerWaalsContact O-N 3.14Å; L134-H136 VanDerWaalsContact C-N 3.26Å; L134-H136 PolarHBondContact O-N 2.9Å; H136-K138 PolarHBondContact O-N 3.41Å; H136-E330 VanDerWaalsContact NE2-CD 3.26Å; H136-E330 IonicContact NE2-OE1 3.94Å; H136-E330 IonicContact NE2-OE2 2.76Å; H136-E330 PolarHBondContact NE2-OE2 2.91Å; H136-E330 VanDerWaalsContact NE2-OE2 3.16Å
137V95.9Very high93.8Very high1 Ų136.1 Ų36.11%0.00620%0.196CC..  trans-60.9127.2173.5-178.70000110.1H90 E93 I94 I97 R133 L134 R149H90-V137 HydrophobicContact CB-CG1 3.82Å; E93-V137 HydrophobicContact CG-CG2 4.13Å; I94-V137 HydrophobicContact CD1-CG1 4.19Å; I94-V137 HydrophobicContact CG1-CB 4.28Å; I94-V137 HydrophobicContact CG1-CG1 3.9Å; I94-V137 HydrophobicContact CG1-CG2 4.29Å; I97-V137 HydrophobicContact CD1-CG2 3.73Å; R133-V137 PolarHBondContact O-N 3.3Å; L134-V137 HydrophobicContact CD1-CG2 4.45Å; L134-V137 PolarHBondContact O-N 2.98Å; V137-R149 PolarHBondContact O-NH1 3.45Å
138K93.1Very high93.7Very high52 Ų5236.2 Ų36.223%0.22620%0.197CC..  trans-77.4139.2-177-56.1-175.3-172.3-160.10111.3H90 H136 D443H90-K138 PolarHBondContact CD2-O 2.97Å; H136-K138 PolarHBondContact O-N 3.41Å; K138-D443 WeakPolarHBondContact CD-O 3.47Å; K138-D443 WeakPolarHBondContact CE-O 3.31Å; K138-D443 WeakPolarHBondContact CE-OD1 3.36Å; K138-D443 PolarHBondContact NZ-O 3.38Å; K138-D443 IonicContact NZ-OD1 3.77Å; K138-D443 PolarHBondContact NZ-OD1 3.34Å
139T92Very high93.7Very high1 Ų131.2 Ų31.21%0.00617%0.174CC..  trans-109.2-17.6-177.458.70000113.1G141 K142 L145 R146T139-G141 VanDerWaalsContact C-N 3.26Å; T139-G141 PolarHBondContact O-N 2.98Å; T139-K142 WeakPolarHBondContact O-CB 3.43Å; T139-K142 PolarHBondContact O-N 3.25Å; T139-L145 HydrophobicContact CG2-CB 4.01Å; T139-L145 WeakPolarHBondContact O-CD1 3.46Å; T139-R146 HydrophobicContact CG2-CB 4.48Å; T139-R146 HydrophobicContact CG2-CG 3.72Å
140G87.1Confident93.4Very high62 Ų6229.9 Ų29.964%0.63916%0.163SC*.THydrogen-bonded Turntrans52.639.7173.800000113.7K142G140-K142 PolarHBondContact O-N 3.2Å; G140-K142 VanDerWaalsContact O-N 3.12Å
141G86.2Confident93Very high34 Ų3432.5 Ų32.535%0.35118%0.175SC..THydrogen-bonded Turntrans73.5-6.2-17700000115.6T139 I143 E446T139-G141 VanDerWaalsContact C-N 3.26Å; T139-G141 PolarHBondContact O-N 2.98Å; G141-I143 PolarHBondContact O-N 3.24Å; G141-E446 WeakPolarHBondContact CA-OE2 3.19Å; G141-E446 PolarHBondContact N-OE2 3.09Å
142K91.2Very high92.9Very high64 Ų6432.7 Ų32.728%0.27818%0.177SC..  trans-75.6126.5-176.3-64.6-172.9174.8-179.70111.5H88 T139 G140 L145 R146H88-K142 PolarHBondContact CD2-NZ 3.11Å; H88-K142 PolarHBondContact NE2-NZ 2.92Å; H88-K142 VanDerWaalsContact NE2-NZ 3.11Å; T139-K142 WeakPolarHBondContact O-CB 3.43Å; T139-K142 PolarHBondContact O-N 3.25Å; G140-K142 PolarHBondContact O-N 3.2Å; G140-K142 VanDerWaalsContact O-N 3.12Å; K142-L145 HydrophobicContact CB-CB 4.28Å; K142-L145 HydrophobicContact CB-CD1 4.12Å; K142-L145 HydrophobicContact CB-CG 4.12Å; K142-L145 HydrophobicContact CD-CD1 4.04Å; K142-L145 HydrophobicContact CD-CG 4.49Å; K142-L145 PolarHBondContact O-N 2.94Å; K142-R146 PolarHBondContact O-N 3.29Å; K142-R146 VanDerWaalsContact O-N 3.14Å
143I90.3Very high92.7Very high68 Ų6828.7 Ų28.735%0.34916%0.155SC..Hα-helixtrans-64.6-41.8178-64.4172.8000110.8G141 L145 R146 K147 F268G141-I143 PolarHBondContact O-N 3.24Å; I143-L145 VanDerWaalsContact C-N 3.32Å; I143-L145 PolarHBondContact O-N 3.27Å; I143-R146 PolarHBondContact O-N 2.96Å; I143-K147 WeakPolarHBondContact O-CB 3.29Å; I143-K147 PolarHBondContact O-N 3.19Å; I143-F268 HydrophobicContact CG2-CE2 3.81Å; I143-F268 HydrophobicContact CG2-CZ 4.23Å
144S92.9Very high92.4Very high3 Ų326.5 Ų26.52%0.02115%0.15CC..Hα-helixtrans-53.3-46.4176.549.50000112.7F30 S31 N85 A148F30-S144 WeakPolarHBondContact O-CB 3.29Å; S31-S144 WeakPolarHBondContact CB-O 3.39Å; N85-S144 WeakPolarHBondContact OD1-CB 3.33Å; N85-S144 PolarHBondContact OD1-OG 3.06Å; S144-A148 WeakPolarHBondContact O-CB 3.46Å; S144-A148 PolarHBondContact O-N 3.38Å
145L94.4Very high92.1Very high3 Ų328.5 Ų28.52%0.01616%0.159CC..Hα-helixtrans-72.3-42179.7-65178.6000112.7H88 H90 R91 T139 K142 I143 K147 A148 R149H88-L145 HydrophobicContact CB-CD2 4.22Å; H90-L145 HydrophobicContact CB-CD1 4.12Å; H90-L145 HydrophobicContact CB-CD2 4.24Å; R91-L145 HydrophobicContact CB-CD2 3.8Å; T139-L145 HydrophobicContact CG2-CB 4.01Å; T139-L145 WeakPolarHBondContact O-CD1 3.46Å; K142-L145 HydrophobicContact CB-CB 4.28Å; K142-L145 HydrophobicContact CB-CD1 4.12Å; K142-L145 HydrophobicContact CB-CG 4.12Å; K142-L145 HydrophobicContact CD-CD1 4.04Å; K142-L145 HydrophobicContact CD-CG 4.49Å; K142-L145 PolarHBondContact O-N 2.94Å; I143-L145 VanDerWaalsContact C-N 3.32Å; I143-L145 PolarHBondContact O-N 3.27Å; L145-K147 VanDerWaalsContact C-N 3.33Å; L145-K147 PolarHBondContact O-N 2.96Å; L145-A148 PolarHBondContact O-N 3.49Å; L145-R149 WeakPolarHBondContact O-CB 3.38Å; L145-R149 PolarHBondContact O-N 2.88Å
146R92.4Very high92.1Very high11 Ų1128.3 Ų28.34%0.04216%0.158CC..Hα-helixtrans-59.9-45.2174.1-74.6-167.3-68.3155.75111.2T139 K142 I143 R149 Y150 D269 Y447T139-R146 HydrophobicContact CG2-CB 4.48Å; T139-R146 HydrophobicContact CG2-CG 3.72Å; K142-R146 PolarHBondContact O-N 3.29Å; K142-R146 VanDerWaalsContact O-N 3.14Å; I143-R146 PolarHBondContact O-N 2.96Å; R146-R149 PolarHBondContact O-N 3.27Å; R146-Y150 VanDerWaalsContact O-CB 3.27Å; R146-Y150 WeakPolarHBondContact O-CB 3.37Å; R146-Y150 PolarHBondContact O-N 3.44Å; R146-D269 IonicContact CZ-OD1 2.81Å; R146-D269 IonicContact NH1-OD1 2.62Å; R146-D269 PolarHBondContact NH1-OD1 2.89Å; R146-D269 IonicContact NH2-OD1 3.73Å; R146-Y447 VanDerWaalsContact CD-O 3.28Å; R146-Y447 WeakPolarHBondContact CD-O 3.35Å
147K91.4Very high92Very high37 Ų3726 Ų2616%0.16115%0.148CC..Hα-helixtrans-62.1-45.5176.1-175176.7179.8178.20111.7I143 L145 Y150 H151 D263 F268I143-K147 WeakPolarHBondContact O-CB 3.29Å; I143-K147 PolarHBondContact O-N 3.19Å; L145-K147 VanDerWaalsContact C-N 3.33Å; L145-K147 PolarHBondContact O-N 2.96Å; K147-Y150 PolarHBondContact O-N 3.49Å; K147-H151 WeakPolarHBondContact O-CB 3.38Å; K147-H151 PolarHBondContact O-N 3.36Å; K147-D263 WeakPolarHBondContact CE-OD1 3.47Å; K147-D263 IonicContact NZ-OD1 3.95Å; K147-D263 PolarHBondContact NZ-OD1 2.99Å; K147-F268 HydrophobicContact CB-CD1 4.16Å; K147-F268 HydrophobicContact CB-CD2 4.26Å; K147-F268 HydrophobicContact CB-CE1 4.25Å; K147-F268 HydrophobicContact CB-CE2 4.41Å; K147-F268 HydrophobicContact CB-CG 4.14Å; K147-F268 HydrophobicContact CB-CZ 4.38Å; K147-F268 HydrophobicContact CD-CD1 4.36Å; K147-F268 HydrophobicContact CD-CE1 3.9Å; K147-F268 HydrophobicContact CD-CZ 4.35Å; K147-F268 HydrophobicContact CG-CD1 3.91Å; K147-F268 HydrophobicContact CG-CE1 3.94Å; K147-F268 HydrophobicContact CG-CG 4.37Å; K147-F268 HydrophobicContact CG-CZ 4.48Å
148A93.5Very high91.8Very high4 Ų426.1 Ų26.13%0.03315%0.15CC..Hα-helixtrans-60.1-50.8177.500000111.7I94 S144 L145 Y150 H151 T152I94-A148 HydrophobicContact CD1-CB 4.02Å; S144-A148 WeakPolarHBondContact O-CB 3.46Å; S144-A148 PolarHBondContact O-N 3.38Å; L145-A148 PolarHBondContact O-N 3.49Å; A148-Y150 PolarHBondContact O-N 3.46Å; A148-H151 PolarHBondContact O-N 3.49Å; A148-T152 PolarHBondContact O-N 3.32Å; A148-T152 VanDerWaalsContact O-N 3.12Å; A148-T152 PolarHBondContact O-OG1 3.15Å; A148-T152 VanDerWaalsContact O-OG1 3.09Å
149R94.3Very high91.7Very high2 Ų223.7 Ų23.71%0.00814%0.139CC..Hα-helixtrans-59.4-46.2178.8-175177.966-176.12.8111.2I94 L134 T135 V137 L145 R146 T152 L153 E446 Y447I94-R149 HydrophobicContact CD1-CB 3.98Å; L134-R149 HydrophobicContact CD1-CG 4.26Å; L134-R149 HydrophobicContact CG-CG 4.31Å; L134-R149 WeakPolarHBondContact O-CD 3.38Å; L134-R149 WeakPolarHBondContact O-CG 3.47Å; T135-R149 PolarHBondContact O-NH1 3.43Å; V137-R149 PolarHBondContact O-NH1 3.45Å; L145-R149 WeakPolarHBondContact O-CB 3.38Å; L145-R149 PolarHBondContact O-N 2.88Å; R146-R149 PolarHBondContact O-N 3.27Å; R149-T152 PolarHBondContact O-N 3.24Å; R149-L153 HydrophobicContact CG-CD1 3.9Å; R149-L153 HydrophobicContact CG-CG 4.42Å; R149-L153 WeakPolarHBondContact O-CB 3.41Å; R149-L153 WeakPolarHBondContact O-CG 3.16Å; R149-L153 PolarHBondContact O-N 2.94Å; R149-E446 PolarHBondContact NH1-O 3.46Å; R149-E446 PolarHBondContact NH2-O 2.78Å; R149-Y447 PolarHBondContact NH2-OXT 3.04Å
150Y91.4Very high91.8Very high49 Ų4924.4 Ų24.419%0.19214%0.142CC..Hα-helixtrans-60.3-49.9178.5178-100.5000112.1R146 K147 A148 T152 L153 T154 A267 F268R146-Y150 VanDerWaalsContact O-CB 3.27Å; R146-Y150 WeakPolarHBondContact O-CB 3.37Å; R146-Y150 PolarHBondContact O-N 3.44Å; K147-Y150 PolarHBondContact O-N 3.49Å; A148-Y150 PolarHBondContact O-N 3.46Å; Y150-T152 VanDerWaalsContact C-N 3.3Å; Y150-T152 PolarHBondContact O-N 3.37Å; Y150-L153 PolarHBondContact O-N 3.32Å; Y150-T154 PolarHBondContact O-N 3.05Å; Y150-T154 PolarHBondContact O-OG1 3.02Å; Y150-T154 VanDerWaalsContact O-OG1 3.05Å; Y150-A267 HydrophobicContact CD1-CB 4.4Å; Y150-A267 HydrophobicContact CE1-CB 3.49Å; Y150-A267 VanDerWaalsContact CE1-CB 3.49Å; Y150-A267 WeakPolarHBondContact CE2-O 3.33Å; Y150-A267 WeakPolarHBondContact OH-CB 3.38Å; Y150-F268 HydrophobicContact CD1-CB 3.73Å; Y150-F268 HydrophobicContact CD2-CB 4.32Å; Y150-F268 HydrophobicContact CG-CB 3.59Å
151H90Very high92Very high59 Ų5922.9 Ų22.927%0.27312%0.118SC..Hα-helixtrans-58.6-44-179.2-176.375.9000112K147 A148 K155K147-H151 WeakPolarHBondContact O-CB 3.38Å; K147-H151 PolarHBondContact O-N 3.36Å; A148-H151 PolarHBondContact O-N 3.49Å; H151-K155 VanDerWaalsContact NE2-CE 3.29Å; H151-K155 WeakPolarHBondContact NE2-CE 3.36Å; H151-K155 PolarHBondContact NE2-NZ 3.42Å; H151-K155 PolarHBondContact O-N 3.15Å
152T93.1Very high92.2Very high10 Ų1021.4 Ų21.46%0.06110%0.102CC..Hα-helixtrans-66.2-44.3177.1-550000111.5I94 F98 L134 A148 R149 Y150 T154 K155 I156I94-T152 HydrophobicContact CG2-CG2 4.42Å; I94-T152 WeakPolarHBondContact CG2-OG1 3.05Å; F98-T152 HydrophobicContact CB-CG2 3.72Å; F98-T152 HydrophobicContact CD2-CG2 3.53Å; F98-T152 HydrophobicContact CE2-CG2 4.39Å; F98-T152 HydrophobicContact CG-CG2 3.83Å; L134-T152 HydrophobicContact CD1-CG2 4.33Å; L134-T152 HydrophobicContact CD2-CG2 3.39Å; A148-T152 PolarHBondContact O-N 3.32Å; A148-T152 VanDerWaalsContact O-N 3.12Å; A148-T152 PolarHBondContact O-OG1 3.15Å; A148-T152 VanDerWaalsContact O-OG1 3.09Å; R149-T152 PolarHBondContact O-N 3.24Å; Y150-T152 VanDerWaalsContact C-N 3.3Å; Y150-T152 PolarHBondContact O-N 3.37Å; T152-T154 PolarHBondContact O-N 2.73Å; T152-K155 PolarHBondContact O-N 2.83Å; T152-I156 HydrophobicContact CG2-CD1 3.82Å; T152-I156 WeakPolarHBondContact O-CG1 3.12Å; T152-I156 PolarHBondContact O-N 3.33Å; T152-I156 VanDerWaalsContact O-N 3.14Å
153L93.4Very high92.1Very high4 Ų418.4 Ų18.42%0.0219%0.089CC..Hα-helixtrans-60.2-44.2176.7-79.3170.8000111.9I131 L134 R149 Y150 K155 I156 C157 P326I131-L153 HydrophobicContact CG2-CD2 4.18Å; L134-L153 HydrophobicContact CB-CD2 4.03Å; L134-L153 HydrophobicContact CD2-CB 4.38Å; L134-L153 HydrophobicContact CD2-CD2 3.63Å; L134-L153 HydrophobicContact CD2-CG 3.64Å; L134-L153 HydrophobicContact CG-CD2 3.82Å; L134-L153 HydrophobicContact CG-CG 3.84Å; R149-L153 HydrophobicContact CG-CD1 3.9Å; R149-L153 HydrophobicContact CG-CG 4.42Å; R149-L153 WeakPolarHBondContact O-CB 3.41Å; R149-L153 WeakPolarHBondContact O-CG 3.16Å; R149-L153 PolarHBondContact O-N 2.94Å; Y150-L153 PolarHBondContact O-N 3.32Å; L153-K155 VanDerWaalsContact C-N 3.29Å; L153-K155 PolarHBondContact O-N 2.85Å; L153-I156 PolarHBondContact O-N 3Å; L153-C157 VanDerWaalsContact O-CB 3.27Å; L153-C157 WeakPolarHBondContact O-CB 3.35Å; L153-C157 PolarHBondContact O-N 2.97Å; L153-C157 PolarHBondContact O-SG 3.28Å; L153-C157 VanDerWaalsContact O-SG 3.35Å; L153-P326 HydrophobicContact CD2-CB 4.46Å; L153-P326 HydrophobicContact CD2-CG 4.23Å
154T90Very high92Very high28 Ų2817.2 Ų17.217%0.1728%0.082CC..Hα-helixtrans-56-44.3179.5-63.10000111.7Y150 T152 A158 L258Y150-T154 PolarHBondContact O-N 3.05Å; Y150-T154 PolarHBondContact O-OG1 3.02Å; Y150-T154 VanDerWaalsContact O-OG1 3.05Å; T152-T154 PolarHBondContact O-N 2.73Å; T154-A158 WeakPolarHBondContact O-CB 3.5Å; T154-A158 PolarHBondContact O-N 3.23Å; T154-A158 VanDerWaalsContact O-N 3.07Å; T154-L258 HydrophobicContact CG2-CD2 4.15Å
155K91.4Very high91.6Very high43 Ų4318.6 Ų18.619%0.1879%0.09CC..Hα-helixtrans-64.4-48.9177.4-73.4174.2165.7174.60112.1F98 H151 T152 L153 A158 V159 L204F98-K155 HydrophobicContact CE2-CD 4.5Å; F98-K155 HydrophobicContact CZ-CD 4.35Å; H151-K155 VanDerWaalsContact NE2-CE 3.29Å; H151-K155 WeakPolarHBondContact NE2-CE 3.36Å; H151-K155 PolarHBondContact NE2-NZ 3.42Å; H151-K155 PolarHBondContact O-N 3.15Å; T152-K155 PolarHBondContact O-N 2.83Å; L153-K155 VanDerWaalsContact C-N 3.29Å; L153-K155 PolarHBondContact O-N 2.85Å; K155-A158 PolarHBondContact O-N 3.13Å; K155-V159 PolarHBondContact O-N 2.9Å; K155-V159 VanDerWaalsContact O-N 3.14Å; K155-L204 WeakPolarHBondContact CD-O 3.02Å
156I94.2Very high91Very high0 Ų018.6 Ų18.60%09%0.09CC..Hα-helixtrans-70.3-38.3-176.1-59.4171.7000111.1F98 A101 I127 I130 I131 L134 T152 L153 A158 V159 Q160 M205F98-I156 HydrophobicContact CD2-CD1 4.17Å; F98-I156 HydrophobicContact CD2-CG1 4.32Å; A101-I156 HydrophobicContact CB-CD1 4.06Å; A101-I156 HydrophobicContact CB-CG1 4.39Å; I127-I156 HydrophobicContact CG2-CG2 3.95Å; I130-I156 HydrophobicContact CG2-CD1 3.72Å; I130-I156 HydrophobicContact CG2-CG2 4.29Å; I131-I156 HydrophobicContact CD1-CG2 3.98Å; I131-I156 HydrophobicContact CG1-CB 4.36Å; I131-I156 HydrophobicContact CG1-CG2 3.53Å; L134-I156 HydrophobicContact CD2-CD1 3.85Å; T152-I156 HydrophobicContact CG2-CD1 3.82Å; T152-I156 WeakPolarHBondContact O-CG1 3.12Å; T152-I156 PolarHBondContact O-N 3.33Å; T152-I156 VanDerWaalsContact O-N 3.14Å; L153-I156 PolarHBondContact O-N 3Å; I156-A158 VanDerWaalsContact C-N 3.35Å; I156-V159 WeakPolarHBondContact O-CB 3.39Å; I156-V159 PolarHBondContact O-N 3.24Å; I156-Q160 PolarHBondContact O-N 3.36Å; I156-M205 HydrophobicContact CG1-CE 4.32Å; I156-M205 HydrophobicContact CG1-SD 4.36Å
157C93.1Very high90.2Very high10 Ų1021.1 Ų21.17%0.06810%0.103CC..Hα-helixtrans-64.8-37.9174.4-72.50000111.9L153 V159 Q160 E161 P326L153-C157 VanDerWaalsContact O-CB 3.27Å; L153-C157 WeakPolarHBondContact O-CB 3.35Å; L153-C157 PolarHBondContact O-N 2.97Å; L153-C157 PolarHBondContact O-SG 3.28Å; L153-C157 VanDerWaalsContact O-SG 3.35Å; C157-V159 VanDerWaalsContact C-N 3.3Å; C157-V159 PolarHBondContact O-N 3.44Å; C157-Q160 WeakPolarHBondContact O-CB 3.36Å; C157-Q160 PolarHBondContact O-N 2.87Å; C157-E161 VanDerWaalsContact O-CG 3.3Å; C157-E161 WeakPolarHBondContact O-CG 3.28Å; C157-E161 PolarHBondContact O-N 3.32Å; C157-P326 WeakPolarHBondContact SG-CG 3.3Å
158A91.1Very high89.3Confident5 Ų526.3 Ų26.34%0.04113%0.126CC..Hα-helixtrans-60.8-41.4172.400000111.5T154 K155 I156 E161 I162 L204 Y255 L258T154-A158 WeakPolarHBondContact O-CB 3.5Å; T154-A158 PolarHBondContact O-N 3.23Å; T154-A158 VanDerWaalsContact O-N 3.07Å; K155-A158 PolarHBondContact O-N 3.13Å; I156-A158 VanDerWaalsContact C-N 3.35Å; A158-E161 PolarHBondContact O-N 2.62Å; A158-I162 WeakPolarHBondContact O-CD1 3.45Å; A158-I162 VanDerWaalsContact O-CG1 3.22Å; A158-I162 WeakPolarHBondContact O-CG1 3.33Å; A158-I162 PolarHBondContact O-N 3.07Å; A158-L204 HydrophobicContact CB-CD1 3.92Å; A158-Y255 HydrophobicContact CB-CD1 3.87Å; A158-Y255 HydrophobicContact CB-CE1 4.18Å; A158-L258 HydrophobicContact CB-CD1 3.54Å
159V92.9Very high87.8Confident0 Ų028.4 Ų28.40%013%0.134CC..Hα-helixtrans-62.5-46.8173.6172.60000111.6V105 I127 K155 I156 C157 E161 I162 I163 I201 L204 M205V105-V159 HydrophobicContact CG2-CG1 4.39Å; I127-V159 HydrophobicContact CD1-CG1 4.41Å; K155-V159 PolarHBondContact O-N 2.9Å; K155-V159 VanDerWaalsContact O-N 3.14Å; I156-V159 WeakPolarHBondContact O-CB 3.39Å; I156-V159 PolarHBondContact O-N 3.24Å; C157-V159 VanDerWaalsContact C-N 3.3Å; C157-V159 PolarHBondContact O-N 3.44Å; V159-E161 VanDerWaalsContact C-N 3.28Å; V159-E161 PolarHBondContact O-N 3.25Å; V159-I162 PolarHBondContact O-N 3.42Å; V159-I163 HydrophobicContact CG1-CD1 3.71Å; V159-I163 HydrophobicContact CG1-CG1 4.47Å; V159-I163 WeakPolarHBondContact O-CG1 3.29Å; V159-I163 PolarHBondContact O-N 2.92Å; V159-I201 HydrophobicContact CG1-CG1 4.49Å; V159-I201 HydrophobicContact CG1-CG2 4.03Å; V159-I201 HydrophobicContact CG2-CG2 4.2Å; V159-L204 HydrophobicContact CG2-CB 4.19Å; V159-L204 HydrophobicContact CG2-CD1 4.14Å; V159-M205 HydrophobicContact CG2-CG 3.86Å; V159-M205 HydrophobicContact CG2-SD 3.9Å
160Q93.3Very high85.8Confident17 Ų1736.7 Ų36.78%0.07917%0.173CC..Hα-helixtrans-54.6-45.5175.1-175.9-17621.900111.2I127 I131 I156 C157 I162 I163 E164I127-Q160 HydrophobicContact CG2-CB 3.83Å; I127-Q160 HydrophobicContact CG2-CG 4.32Å; I131-Q160 HydrophobicContact CD1-CB 3.96Å; I131-Q160 HydrophobicContact CD1-CG 4.29Å; I156-Q160 PolarHBondContact O-N 3.36Å; C157-Q160 WeakPolarHBondContact O-CB 3.36Å; C157-Q160 PolarHBondContact O-N 2.87Å; Q160-I162 PolarHBondContact O-N 2.98Å; Q160-I163 WeakPolarHBondContact O-CB 3.36Å; Q160-I163 PolarHBondContact O-N 2.74Å; Q160-E164 HydrophobicContact CG-CG 4.34Å; Q160-E164 WeakPolarHBondContact CG-OE1 3.41Å; Q160-E164 PolarHBondContact NE2-OE1 3.07Å; Q160-E164 VanDerWaalsContact NE2-OE1 3.12Å; Q160-E164 WeakPolarHBondContact O-CG 3.42Å; Q160-E164 PolarHBondContact O-N 3.41Å
161E90.6Very high84Confident29 Ų2935.5 Ų35.514%0.13617%0.171CC..Hα-helixtrans-67.2-38.2-178.7-72.2176.1178.900113C157 A158 V159 I163 E164 D165 Y255 K324C157-E161 VanDerWaalsContact O-CG 3.3Å; C157-E161 WeakPolarHBondContact O-CG 3.28Å; C157-E161 PolarHBondContact O-N 3.32Å; A158-E161 PolarHBondContact O-N 2.62Å; V159-E161 VanDerWaalsContact C-N 3.28Å; V159-E161 PolarHBondContact O-N 3.25Å; E161-I163 VanDerWaalsContact C-N 3.29Å; E161-E164 PolarHBondContact O-N 2.98Å; E161-D165 VanDerWaalsContact O-CB 3.32Å; E161-D165 WeakPolarHBondContact O-CB 3.25Å; E161-D165 PolarHBondContact O-N 3.46Å; E161-Y255 WeakPolarHBondContact CB-OH 3.4Å; E161-Y255 WeakPolarHBondContact OE2-CE1 3.49Å; E161-Y255 PolarHBondContact OE2-OH 2.87Å; E161-K324 VanDerWaalsContact CD-CE 3.46Å; E161-K324 WeakPolarHBondContact OE1-CB 3.19Å; E161-K324 WeakPolarHBondContact OE1-CD 3.49Å; E161-K324 WeakPolarHBondContact OE1-CE 3.31Å; E161-K324 WeakPolarHBondContact OE1-CG 3.33Å; E161-K324 IonicContact OE1-NZ 2.63Å; E161-K324 PolarHBondContact OE1-NZ 3.25Å; E161-K324 VanDerWaalsContact OE1-NZ 3.09Å; E161-K324 WeakPolarHBondContact OE2-CE 3.33Å; E161-K324 IonicContact OE2-NZ 3.95Å; E161-K324 PolarHBondContact OE2-NZ 3.2Å
162I90.4Very high82.4Confident3 Ų337 Ų372%0.01519%0.188CC..Hα-helixtrans-63-41.7174.5-64.5160.5000109.9A158 V159 Q160 C166 R197 L200 I201 L204 Y255A158-I162 WeakPolarHBondContact O-CD1 3.45Å; A158-I162 VanDerWaalsContact O-CG1 3.22Å; A158-I162 WeakPolarHBondContact O-CG1 3.33Å; A158-I162 PolarHBondContact O-N 3.07Å; V159-I162 PolarHBondContact O-N 3.42Å; Q160-I162 PolarHBondContact O-N 2.98Å; I162-C166 PolarHBondContact O-N 3.45Å; I162-C166 VanDerWaalsContact O-N 3.14Å; I162-R197 HydrophobicContact CG2-CB 4.23Å; I162-R197 HydrophobicContact CG2-CG 4.22Å; I162-L200 HydrophobicContact CD1-CD2 3.58Å; I162-L200 HydrophobicContact CD1-CG 3.93Å; I162-L200 HydrophobicContact CG1-CD2 4.43Å; I162-I201 HydrophobicContact CB-CD1 4.44Å; I162-I201 HydrophobicContact CB-CG1 4.36Å; I162-I201 HydrophobicContact CD1-CG1 4.11Å; I162-I201 HydrophobicContact CG2-CD1 3.81Å; I162-I201 HydrophobicContact CG2-CG1 4Å; I162-L204 HydrophobicContact CD1-CD1 3.8Å; I162-Y255 HydrophobicContact CD1-CD2 3.91Å; I162-Y255 HydrophobicContact CD1-CE2 4.22Å; I162-Y255 HydrophobicContact CD1-CG 4.4Å; I162-Y255 HydrophobicContact CG1-CD2 3.76Å; I162-Y255 HydrophobicContact CG1-CE2 3.57Å
163I89.3Confident80.6Confident1 Ų142.5 Ų42.51%0.00522%0.216CC..Hα-helixtrans-63.1-50.7176.4-73.9165000111.4V119 F123 E124 I127 V159 Q160 E161 D165 C166 M167V119-I163 HydrophobicContact CB-CG2 4.4Å; V119-I163 HydrophobicContact CG1-CB 4.31Å; V119-I163 HydrophobicContact CG1-CG1 4.39Å; V119-I163 HydrophobicContact CG1-CG2 3.33Å; V119-I163 HydrophobicContact CG2-CG2 4.44Å; F123-I163 HydrophobicContact CD1-CD1 3.76Å; F123-I163 HydrophobicContact CD1-CG1 4.16Å; F123-I163 HydrophobicContact CD2-CD1 4.34Å; F123-I163 HydrophobicContact CE1-CD1 3.33Å; F123-I163 HydrophobicContact CE1-CG1 3.75Å; F123-I163 HydrophobicContact CE2-CD1 3.97Å; F123-I163 HydrophobicContact CG-CD1 4.26Å; F123-I163 HydrophobicContact CZ-CD1 3.44Å; F123-I163 VanDerWaalsContact CZ-CD1 3.44Å; F123-I163 HydrophobicContact CZ-CG1 4.29Å; E124-I163 HydrophobicContact CB-CG2 4.26Å; I127-I163 HydrophobicContact CG1-CD1 4.08Å; V159-I163 HydrophobicContact CG1-CD1 3.71Å; V159-I163 HydrophobicContact CG1-CG1 4.47Å; V159-I163 WeakPolarHBondContact O-CG1 3.29Å; V159-I163 PolarHBondContact O-N 2.92Å; Q160-I163 WeakPolarHBondContact O-CB 3.36Å; Q160-I163 PolarHBondContact O-N 2.74Å; E161-I163 VanDerWaalsContact C-N 3.29Å; I163-D165 VanDerWaalsContact C-N 3.32Å; I163-D165 PolarHBondContact O-N 3.06Å; I163-C166 VanDerWaalsContact O-CB 3.25Å; I163-C166 WeakPolarHBondContact O-CB 3.44Å; I163-C166 PolarHBondContact O-N 2.89Å; I163-C166 VanDerWaalsContact O-N 3.09Å; I163-M167 HydrophobicContact CG2-SD 4.24Å; I163-M167 PolarHBondContact O-N 2.85Å; I163-M167 VanDerWaalsContact O-N 3.13Å
164E88.5Confident79.4Confident43 Ų4346.3 Ų46.320%0.20124%0.241CC..Hα-helixtrans-63-39.1179.9-75.2-176.9-15500111.9Q160 E161 C166 M167 K168Q160-E164 HydrophobicContact CG-CG 4.34Å; Q160-E164 WeakPolarHBondContact CG-OE1 3.41Å; Q160-E164 PolarHBondContact NE2-OE1 3.07Å; Q160-E164 VanDerWaalsContact NE2-OE1 3.12Å; Q160-E164 WeakPolarHBondContact O-CG 3.42Å; Q160-E164 PolarHBondContact O-N 3.41Å; E161-E164 PolarHBondContact O-N 2.98Å; E164-C166 VanDerWaalsContact C-N 3.26Å; E164-C166 PolarHBondContact O-N 3.33Å; E164-M167 PolarHBondContact O-N 2.94Å; E164-K168 WeakPolarHBondContact O-CB 3.41Å; E164-K168 WeakPolarHBondContact O-CG 3.32Å; E164-K168 PolarHBondContact O-N 3.44Å; E164-K168 IonicContact OE2-NZ 3.94Å; E164-K168 PolarHBondContact OE2-NZ 3.43Å
165D85.2Confident78.7Confident32 Ų3246.5 Ų46.517%0.17124%0.241CC..Hα-helixtrans-63.5-33.6175.4-93.34.7000111.2E161 I163 K169 K251E161-D165 VanDerWaalsContact O-CB 3.32Å; E161-D165 WeakPolarHBondContact O-CB 3.25Å; E161-D165 PolarHBondContact O-N 3.46Å; I163-D165 VanDerWaalsContact C-N 3.32Å; I163-D165 PolarHBondContact O-N 3.06Å; D165-K169 VanDerWaalsContact O-CB 3.24Å; D165-K169 WeakPolarHBondContact O-CB 3.49Å; D165-K169 VanDerWaalsContact O-CG 3.26Å; D165-K169 WeakPolarHBondContact O-CG 3.41Å; D165-K169 PolarHBondContact O-N 3.46Å; D165-K169 IonicContact OD2-NZ 3.89Å; D165-K251 IonicContact OD1-NZ 2.7Å; D165-K251 WeakPolarHBondContact OD2-CD 3.37Å; D165-K251 IonicContact OD2-NZ 3.82Å; D165-K251 PolarHBondContact OD2-NZ 3.4Å
166C81.2Confident78.3Confident3 Ų347.9 Ų47.92%0.0226%0.256CS..Hα-helixtrans-67-35.6173-84.80000113.2N117 V119 I162 I163 E164 R197N117-C166 PolarHBondContact ND2-O 3.42Å; N117-C166 VanDerWaalsContact OD1-CB 3.28Å; N117-C166 WeakPolarHBondContact OD1-CB 3.43Å; V119-C166 HydrophobicContact CG2-CB 3.76Å; I162-C166 PolarHBondContact O-N 3.45Å; I162-C166 VanDerWaalsContact O-N 3.14Å; I163-C166 VanDerWaalsContact O-CB 3.25Å; I163-C166 WeakPolarHBondContact O-CB 3.44Å; I163-C166 PolarHBondContact O-N 2.89Å; I163-C166 VanDerWaalsContact O-N 3.09Å; E164-C166 VanDerWaalsContact C-N 3.26Å; E164-C166 PolarHBondContact O-N 3.33Å; C166-R197 WeakPolarHBondContact SG-CD 3.47Å; C166-R197 PolarHBondContact SG-NE 2.85Å; C166-R197 VanDerWaalsContact SG-NE 3.44Å
167M76.5Confident77.5Confident64 Ų6453.8 Ų53.832%0.31528%0.284SS..Hα-helixtrans-81.9-41-178.9-66.4177.271.900112.8V119 D121 E124 I163 E164V119-M167 HydrophobicContact CB-CG 4Å; V119-M167 HydrophobicContact CB-SD 4.33Å; V119-M167 HydrophobicContact CG1-CG 4.23Å; V119-M167 HydrophobicContact CG1-SD 3.93Å; D121-M167 VanDerWaalsContact OD1-CE 3.29Å; D121-M167 WeakPolarHBondContact OD1-CE 3.44Å; E124-M167 HydrophobicContact CB-SD 4.22Å; E124-M167 WeakPolarHBondContact OE2-CE 3.41Å; I163-M167 HydrophobicContact CG2-SD 4.24Å; I163-M167 PolarHBondContact O-N 2.85Å; I163-M167 VanDerWaalsContact O-N 3.13Å; E164-M167 PolarHBondContact O-N 2.94Å
168K72.5Confident76.9Confident147 Ų14760.8 Ų60.864%0.63932%0.32SS*.Hα-helixtrans-73.9-34.4-178.7-68.8171.1-169.3160.90112.3E164 Q170E164-K168 WeakPolarHBondContact O-CB 3.41Å; E164-K168 WeakPolarHBondContact O-CG 3.32Å; E164-K168 PolarHBondContact O-N 3.44Å; E164-K168 IonicContact OE2-NZ 3.94Å; E164-K168 PolarHBondContact OE2-NZ 3.43Å; K168-Q170 PolarHBondContact O-N 3.42Å
169K61.3Low76.4Confident47 Ų4762.2 Ų62.220%0.20433%0.332CS..  trans-88.682.5176.9-58.7-179.3-168.4-178.70109.7D165 P171 D248D165-K169 VanDerWaalsContact O-CB 3.24Å; D165-K169 WeakPolarHBondContact O-CB 3.49Å; D165-K169 VanDerWaalsContact O-CG 3.26Å; D165-K169 WeakPolarHBondContact O-CG 3.41Å; D165-K169 PolarHBondContact O-N 3.46Å; D165-K169 IonicContact OD2-NZ 3.89Å; K169-P171 VanDerWaalsContact O-CD 3.23Å; K169-P171 WeakPolarHBondContact O-CD 3.39Å; K169-D248 IonicContact NZ-OD1 3.27Å; K169-D248 PolarHBondContact NZ-OD1 3.47Å
170Q53.4Low76Confident177 Ų17764 Ų6483%0.82734%0.34SS*.  trans-65.3112.4133.2-71-164.2-17.300104.3K168 S172K168-Q170 PolarHBondContact O-N 3.42Å; Q170-S172 PolarHBondContact O-N 3Å
171P53.1Low75.7Confident23 Ų2368.3 Ų68.315%0.14937%0.37CS..  trans-49.2148.4168.725.8-37000107.2K169 L173 M190K169-P171 VanDerWaalsContact O-CD 3.23Å; K169-P171 WeakPolarHBondContact O-CD 3.39Å; P171-L173 PolarHBondContact O-N 3.04Å; P171-M190 HydrophobicContact CB-CE 3.91Å; P171-M190 HydrophobicContact CG-CE 3.49Å; P171-M190 VanDerWaalsContact CG-CE 3.49Å; P171-M190 HydrophobicContact CG-SD 4.33Å
172S55.9Low75.6Confident90 Ų9067.5 Ų67.563%0.62937%0.367SS*.SBendtrans-64.678.3172.352.80000108.8Q170Q170-S172 PolarHBondContact O-N 3Å
173L54.7Low75.6Confident127 Ų12767.3 Ų67.367%0.66537%0.367SS*.  trans58.4130.7-169.5-57.1130.7000114.3P171 L175P171-L173 PolarHBondContact O-N 3.04Å; L173-L175 PolarHBondContact O-N 3.34Å; L173-L175 VanDerWaalsContact O-N 3.12Å
174P69.4Low75.6Confident83 Ų8369.3 Ų69.354%0.53938%0.383SS..PPolyproline II helixtrans-58.4117.9142.326.3-27.9000106.7
175L75.5Confident75.8Confident33 Ų3370.5 Ų70.517%0.17339%0.388CS..PPolyproline II helixtrans-61.7146.6176-67.3175.7000109.3L173 E177 V183 N187 I238 Y241L173-L175 PolarHBondContact O-N 3.34Å; L173-L175 VanDerWaalsContact O-N 3.12Å; L175-E177 PolarHBondContact O-N 2.86Å; L175-V183 HydrophobicContact CB-CG1 3.71Å; L175-V183 HydrophobicContact CB-CG2 4.06Å; L175-V183 HydrophobicContact CD1-CG2 4.07Å; L175-V183 VanDerWaalsContact O-CG1 3.25Å; L175-V183 WeakPolarHBondContact O-CG1 3.47Å; L175-N187 PolarHBondContact O-ND2 3.01Å; L175-I238 HydrophobicContact CD1-CG1 4.06Å; L175-Y241 HydrophobicContact CB-CD1 4.47Å; L175-Y241 HydrophobicContact CD1-CD1 3.92Å; L175-Y241 HydrophobicContact CD1-CG 4.39Å; L175-Y241 HydrophobicContact CG-CD1 4.12Å
176S81.4Confident76.1Confident71 Ų7169 Ų6950%0.49738%0.379SS..PPolyproline II helixtrans-57.2136.1171.6-179.50000109.7D178 A179S176-D178 PolarHBondContact O-N 2.92Å; S176-D178 VanDerWaalsContact O-N 3.12Å; S176-D178 PolarHBondContact OG-N 3.47Å; S176-D178 PolarHBondContact OG-OD2 3.32Å; S176-A179 VanDerWaalsContact O-CB 3.22Å; S176-A179 WeakPolarHBondContact O-CB 3.37Å; S176-A179 PolarHBondContact O-N 2.77Å
177E79.2Confident76.5Confident125 Ų12570.3 Ų70.358%0.58439%0.386SS*.G310 helixtrans-58.3-25.7177.2-63.7-173.4170.700112.1L175 A179L175-E177 PolarHBondContact O-N 2.86Å; E177-A179 PolarHBondContact O-N 3.12Å
178D80.5Confident77.2Confident156 Ų15672.2 Ų72.283%0.83439%0.393SS*.G310 helixtrans-67.9-16.3176.8-58.2-42.2000113.4S176S176-D178 PolarHBondContact O-N 2.92Å; S176-D178 VanDerWaalsContact O-N 3.12Å; S176-D178 PolarHBondContact OG-N 3.47Å; S176-D178 PolarHBondContact OG-OD2 3.32Å
179A79.8Confident78.2Confident35 Ų3565.2 Ų65.229%0.28936%0.363SS..G310 helixtrans-69.2-38.2-175.700000112.2S176 E177 V183 R235S176-A179 VanDerWaalsContact O-CB 3.22Å; S176-A179 WeakPolarHBondContact O-CB 3.37Å; S176-A179 PolarHBondContact O-N 2.77Å; E177-A179 PolarHBondContact O-N 3.12Å; A179-V183 HydrophobicContact CB-CG2 4.39Å; A179-R235 VanDerWaalsContact O-CZ 3.31Å; A179-R235 PolarHBondContact O-NH1 3.2Å; A179-R235 PolarHBondContact O-NH2 2.85Å
180H84.3Confident79.5Confident38 Ų3864.8 Ų64.818%0.17636%0.362CS..  trans-172.1146.4-177.3-167.4-93.2000111.9S182 V183 D231 I238H180-S182 VanDerWaalsContact C-N 3.25Å; H180-S182 PolarHBondContact CE1-OG 3.48Å; H180-S182 VanDerWaalsContact ND1-CB 3.27Å; H180-S182 WeakPolarHBondContact ND1-CB 3.3Å; H180-S182 PolarHBondContact ND1-N 2.89Å; H180-S182 PolarHBondContact ND1-OG 3.01Å; H180-S182 PolarHBondContact O-N 3.47Å; H180-S182 VanDerWaalsContact O-N 3.16Å; H180-V183 HydrophobicContact CB-CG2 4.06Å; H180-V183 VanDerWaalsContact O-CB 3.31Å; H180-V183 WeakPolarHBondContact O-CB 3.44Å; H180-V183 PolarHBondContact O-N 2.93Å; H180-D231 PolarHBondContact CE1-O 3.42Å; H180-I238 HydrophobicContact CB-CD1 3.18Å; H180-I238 HydrophobicContact CB-CG1 4.5Å; H180-I238 VanDerWaalsContact CG-CD1 3.41Å
181P86.4Confident81.2Confident107 Ų10758.5 Ų58.570%0.69534%0.337SS*.Hα-helixtrans-56-35.9178.320.9-34.1000114V183 A184P181-V183 PolarHBondContact O-N 3.46Å; P181-A184 PolarHBondContact O-N 3.11Å
182S90Very high83Confident12 Ų1260 Ų608%0.08434%0.342CS..Hα-helixtrans-63.6-24.1176-46.60000113.6H180 K185 I186 D231H180-S182 VanDerWaalsContact C-N 3.25Å; H180-S182 PolarHBondContact CE1-OG 3.48Å; H180-S182 VanDerWaalsContact ND1-CB 3.27Å; H180-S182 WeakPolarHBondContact ND1-CB 3.3Å; H180-S182 PolarHBondContact ND1-N 2.89Å; H180-S182 PolarHBondContact ND1-OG 3.01Å; H180-S182 PolarHBondContact O-N 3.47Å; H180-S182 VanDerWaalsContact O-N 3.16Å; S182-K185 PolarHBondContact O-N 3.38Å; S182-I186 VanDerWaalsContact O-CG1 3.27Å; S182-I186 WeakPolarHBondContact O-CG1 3.38Å; S182-I186 PolarHBondContact O-N 2.85Å; S182-D231 PolarHBondContact OG-O 3.35Å
183V89.9Confident84.7Confident0 Ų055.7 Ų55.70%031%0.312CS..Hα-helixtrans-65.1-42.2-179.7170.70000111L175 A179 H180 P181 K185 I186 N187 I238L175-V183 HydrophobicContact CB-CG1 3.71Å; L175-V183 HydrophobicContact CB-CG2 4.06Å; L175-V183 HydrophobicContact CD1-CG2 4.07Å; L175-V183 VanDerWaalsContact O-CG1 3.25Å; L175-V183 WeakPolarHBondContact O-CG1 3.47Å; A179-V183 HydrophobicContact CB-CG2 4.39Å; H180-V183 HydrophobicContact CB-CG2 4.06Å; H180-V183 VanDerWaalsContact O-CB 3.31Å; H180-V183 WeakPolarHBondContact O-CB 3.44Å; H180-V183 PolarHBondContact O-N 2.93Å; P181-V183 PolarHBondContact O-N 3.46Å; V183-K185 VanDerWaalsContact C-N 3.28Å; V183-K185 PolarHBondContact O-N 3.43Å; V183-I186 PolarHBondContact O-N 2.94Å; V183-N187 WeakPolarHBondContact O-CB 3.22Å; V183-N187 VanDerWaalsContact O-CG 3.26Å; V183-N187 PolarHBondContact O-N 3.23Å; V183-I238 HydrophobicContact CG2-CD1 4.19Å; V183-I238 HydrophobicContact CG2-CG1 4.19Å; V183-I238 HydrophobicContact CG2-CG2 4.46Å
184A90.1Very high86.3Confident42 Ų4250.5 Ų50.535%0.34729%0.285SS..Hα-helixtrans-59-40.5176.100000111.8P181 F188P181-A184 PolarHBondContact O-N 3.11Å; A184-F188 WeakPolarHBondContact O-CB 3.41Å; A184-F188 PolarHBondContact O-N 3.14Å
185K91.5Very high87.3Confident69 Ų6950 Ų5030%0.327%0.274SS..Hα-helixtrans-70.9-37.7176.5-174.961.1177.9-178.10112.4S182 V183 F188 V189 D226 L230S182-K185 PolarHBondContact O-N 3.38Å; V183-K185 VanDerWaalsContact C-N 3.28Å; V183-K185 PolarHBondContact O-N 3.43Å; K185-F188 HydrophobicContact CD-CD1 4.32Å; K185-F188 PolarHBondContact O-N 3.35Å; K185-V189 WeakPolarHBondContact O-CG2 3.29Å; K185-V189 PolarHBondContact O-N 3.46Å; K185-D226 WeakPolarHBondContact CE-OD2 3.45Å; K185-D226 IonicContact NZ-OD2 2.76Å; K185-D226 PolarHBondContact NZ-OD2 3.48Å; K185-L230 HydrophobicContact CB-CD2 4.05Å; K185-L230 HydrophobicContact CG-CD2 3.88Å
186I91.9Very high88Confident0 Ų048.7 Ų48.70%027%0.268CS..Hα-helixtrans-63.6-45173.9-64163.7000110.3S182 V183 F188 V189 M190 L227 L230 I238 Y241 R242 V245S182-I186 VanDerWaalsContact O-CG1 3.27Å; S182-I186 WeakPolarHBondContact O-CG1 3.38Å; S182-I186 PolarHBondContact O-N 2.85Å; V183-I186 PolarHBondContact O-N 2.94Å; I186-F188 VanDerWaalsContact C-N 3.33Å; I186-F188 PolarHBondContact O-N 2.76Å; I186-V189 PolarHBondContact O-N 2.87Å; I186-M190 WeakPolarHBondContact O-CB 3.34Å; I186-M190 PolarHBondContact O-N 3.04Å; I186-L227 HydrophobicContact CG1-CD2 4.02Å; I186-L230 HydrophobicContact CD1-CD1 4.19Å; I186-L230 HydrophobicContact CG1-CD1 3.57Å; I186-I238 HydrophobicContact CD1-CG2 3.74Å; I186-Y241 HydrophobicContact CB-CD1 4.2Å; I186-Y241 HydrophobicContact CB-CE1 3.98Å; I186-Y241 HydrophobicContact CD1-CD1 4.16Å; I186-Y241 HydrophobicContact CG2-CD1 3.57Å; I186-Y241 HydrophobicContact CG2-CD2 4.36Å; I186-Y241 HydrophobicContact CG2-CE1 3.38Å; I186-Y241 HydrophobicContact CG2-CE2 4.18Å; I186-Y241 HydrophobicContact CG2-CG 4.07Å; I186-R242 HydrophobicContact CD1-CB 3.98Å; I186-V245 HydrophobicContact CG2-CG2 3.85Å
187N89.5Confident88.5Confident31 Ų3145.7 Ų45.717%0.16625%0.246CC..Hα-helixtrans-60.6-41.6176.1-70.2-12.6000111.6L175 V183 M190 C191 Y241L175-N187 PolarHBondContact O-ND2 3.01Å; V183-N187 WeakPolarHBondContact O-CB 3.22Å; V183-N187 VanDerWaalsContact O-CG 3.26Å; V183-N187 PolarHBondContact O-N 3.23Å; N187-M190 WeakPolarHBondContact O-CB 3.17Å; N187-M190 PolarHBondContact O-N 3.27Å; N187-C191 PolarHBondContact O-N 3.37Å; N187-C191 VanDerWaalsContact O-N 3.08Å; N187-Y241 WeakPolarHBondContact OD1-CE1 3.42Å; N187-Y241 PolarHBondContact OD1-OH 3.08Å
188F91.1Very high89.1Confident104 Ų10439.7 Ų39.746%0.45622%0.218SC..Hα-helixtrans-59.6-50.3173.4173.2-92.9000111.8A184 K185 I186 M190 C191 E192A184-F188 WeakPolarHBondContact O-CB 3.41Å; A184-F188 PolarHBondContact O-N 3.14Å; K185-F188 HydrophobicContact CD-CD1 4.32Å; K185-F188 PolarHBondContact O-N 3.35Å; I186-F188 VanDerWaalsContact C-N 3.33Å; I186-F188 PolarHBondContact O-N 2.76Å; F188-M190 VanDerWaalsContact C-N 3.27Å; F188-M190 PolarHBondContact O-N 3.28Å; F188-C191 WeakPolarHBondContact O-CB 3.29Å; F188-C191 PolarHBondContact O-N 3.11Å; F188-C191 VanDerWaalsContact O-N 3.12Å; F188-E192 HydrophobicContact CD1-CG 4.36Å; F188-E192 HydrophobicContact CE1-CG 3.79Å; F188-E192 HydrophobicContact CE2-CG 4.39Å; F188-E192 HydrophobicContact CZ-CG 3.81Å; F188-E192 PolarHBondContact O-N 3.41Å; F188-E192 VanDerWaalsContact O-N 3.1Å
189V93Very high89.6Confident0 Ų033.4 Ų33.40%019%0.185CC..Hα-helixtrans-60.2-40.7178.1172.50000110.5K185 I186 C191 E192 V193 L223 L227 V245 I249K185-V189 WeakPolarHBondContact O-CG2 3.29Å; K185-V189 PolarHBondContact O-N 3.46Å; I186-V189 PolarHBondContact O-N 2.87Å; V189-C191 VanDerWaalsContact C-N 3.29Å; V189-C191 PolarHBondContact O-N 3.36Å; V189-E192 CarbonylContact O-C 3.58Å; V189-E192 PolarHBondContact O-N 3.04Å; V189-E192 VanDerWaalsContact O-N 3.09Å; V189-V193 HydrophobicContact CG1-CG2 4.11Å; V189-V193 VanDerWaalsContact O-CG2 3.28Å; V189-V193 WeakPolarHBondContact O-CG2 3.43Å; V189-V193 PolarHBondContact O-N 3.4Å; V189-L223 HydrophobicContact CG1-CB 3.97Å; V189-L223 HydrophobicContact CG1-CD1 4.42Å; V189-L223 HydrophobicContact CG1-CD2 4.17Å; V189-L223 HydrophobicContact CG1-CG 4.41Å; V189-L223 HydrophobicContact CG2-CD2 4.26Å; V189-L227 HydrophobicContact CB-CD2 4.04Å; V189-L227 HydrophobicContact CB-CG 4.37Å; V189-L227 HydrophobicContact CG1-CD1 3.79Å; V189-L227 HydrophobicContact CG1-CD2 4.09Å; V189-L227 HydrophobicContact CG1-CG 3.95Å; V189-L227 HydrophobicContact CG2-CD2 4.04Å; V189-L227 HydrophobicContact CG2-CG 4.25Å; V189-V245 HydrophobicContact CG1-CG1 4.02Å; V189-I249 HydrophobicContact CG1-CD1 4.17Å
190M88.9Confident90.2Very high37 Ų3731.8 Ų31.818%0.18217%0.171CC..Hα-helixtrans-58.4-40.1176.3-169.1178.4-169.300112.6P171 I186 N187 F188 V193 N194 Y241P171-M190 HydrophobicContact CB-CE 3.91Å; P171-M190 HydrophobicContact CG-CE 3.49Å; P171-M190 VanDerWaalsContact CG-CE 3.49Å; P171-M190 HydrophobicContact CG-SD 4.33Å; I186-M190 WeakPolarHBondContact O-CB 3.34Å; I186-M190 PolarHBondContact O-N 3.04Å; N187-M190 WeakPolarHBondContact O-CB 3.17Å; N187-M190 PolarHBondContact O-N 3.27Å; F188-M190 VanDerWaalsContact C-N 3.27Å; F188-M190 PolarHBondContact O-N 3.28Å; M190-V193 PolarHBondContact O-N 3.46Å; M190-N194 PolarHBondContact O-N 3.24Å; M190-Y241 HydrophobicContact SD-CE2 4.44Å
191C88.2Confident90.6Very high46 Ų4630 Ų3031%0.31116%0.163SC..Hα-helixtrans-63.3-42.7173.8-173.70000112N187 F188 V189 V193 N194 K195N187-C191 PolarHBondContact O-N 3.37Å; N187-C191 VanDerWaalsContact O-N 3.08Å; F188-C191 WeakPolarHBondContact O-CB 3.29Å; F188-C191 PolarHBondContact O-N 3.11Å; F188-C191 VanDerWaalsContact O-N 3.12Å; V189-C191 VanDerWaalsContact C-N 3.29Å; V189-C191 PolarHBondContact O-N 3.36Å; C191-V193 VanDerWaalsContact C-N 3.35Å; C191-V193 PolarHBondContact O-N 3Å; C191-N194 WeakPolarHBondContact O-CB 3.39Å; C191-N194 PolarHBondContact O-N 3.31Å; C191-K195 PolarHBondContact O-N 2.89Å; C191-K195 VanDerWaalsContact O-N 3.11Å
192E91.6Very high90.9Very high54 Ų5424.9 Ų24.925%0.25213%0.13SC..Hα-helixtrans-66-36.3175.6-64.5-57.6107.700112.2F188 V189 N194 K195 A196 L223F188-E192 HydrophobicContact CD1-CG 4.36Å; F188-E192 HydrophobicContact CE1-CG 3.79Å; F188-E192 HydrophobicContact CE2-CG 4.39Å; F188-E192 HydrophobicContact CZ-CG 3.81Å; F188-E192 PolarHBondContact O-N 3.41Å; F188-E192 VanDerWaalsContact O-N 3.1Å; V189-E192 CarbonylContact O-C 3.58Å; V189-E192 PolarHBondContact O-N 3.04Å; V189-E192 VanDerWaalsContact O-N 3.09Å; E192-N194 VanDerWaalsContact C-N 3.34Å; E192-N194 PolarHBondContact O-N 2.88Å; E192-K195 PolarHBondContact O-N 3.08Å; E192-K195 IonicContact OE1-NZ 3.74Å; E192-K195 PolarHBondContact OE1-NZ 3.24Å; E192-A196 WeakPolarHBondContact O-CB 3.08Å; E192-A196 PolarHBondContact O-N 3.06Å; E192-L223 HydrophobicContact CB-CD1 3.95Å; E192-L223 HydrophobicContact CB-CD2 4.11Å
193V91.3Very high90.9Very high0 Ų025.6 Ų25.60%013%0.133CC..Hα-helixtrans-62.8-40.3172.8175.10000110.9V189 M190 C191 K195 A196 R197 L223 V245 I249 L252V189-V193 HydrophobicContact CG1-CG2 4.11Å; V189-V193 VanDerWaalsContact O-CG2 3.28Å; V189-V193 WeakPolarHBondContact O-CG2 3.43Å; V189-V193 PolarHBondContact O-N 3.4Å; M190-V193 PolarHBondContact O-N 3.46Å; C191-V193 VanDerWaalsContact C-N 3.35Å; C191-V193 PolarHBondContact O-N 3Å; V193-K195 PolarHBondContact O-N 2.7Å; V193-A196 WeakPolarHBondContact O-CB 3.38Å; V193-A196 PolarHBondContact O-N 3.42Å; V193-R197 WeakPolarHBondContact O-CG 3.4Å; V193-R197 PolarHBondContact O-N 3.25Å; V193-L223 HydrophobicContact CG2-CD1 4.05Å; V193-V245 HydrophobicContact CG2-CG1 4.39Å; V193-I249 HydrophobicContact CG1-CG1 4.42Å; V193-I249 HydrophobicContact CG2-CD1 3.81Å; V193-I249 HydrophobicContact CG2-CG1 3.45Å; V193-I249 VanDerWaalsContact CG2-CG1 3.45Å; V193-L252 HydrophobicContact CG1-CD1 3.76Å
194N88.7Confident91Very high18 Ų1826.6 Ų26.610%0.09614%0.138CC..Hα-helixtrans-61.5-42.5173.8-74.7-20.7000112.5F112 M190 C191 E192 R197 G198F112-N194 WeakPolarHBondContact CD1-O 3.3Å; M190-N194 PolarHBondContact O-N 3.24Å; C191-N194 WeakPolarHBondContact O-CB 3.39Å; C191-N194 PolarHBondContact O-N 3.31Å; E192-N194 VanDerWaalsContact C-N 3.34Å; E192-N194 PolarHBondContact O-N 2.88Å; N194-R197 WeakPolarHBondContact O-CB 3.28Å; N194-R197 PolarHBondContact O-N 2.7Å; N194-R197 PolarHBondContact OD1-NH1 2.99Å; N194-G198 PolarHBondContact O-N 3.27Å
195K89.8Confident91.1Very high72 Ų7224.6 Ų24.631%0.31312%0.121SC..Hα-helixtrans-63.6-43.8173.9-65.6173.1-172.61660111.2C191 E192 V193 R197 G198 V199C191-K195 PolarHBondContact O-N 2.89Å; C191-K195 VanDerWaalsContact O-N 3.11Å; E192-K195 PolarHBondContact O-N 3.08Å; E192-K195 IonicContact OE1-NZ 3.74Å; E192-K195 PolarHBondContact OE1-NZ 3.24Å; V193-K195 PolarHBondContact O-N 2.7Å; K195-R197 VanDerWaalsContact C-N 3.26Å; K195-R197 PolarHBondContact O-N 3.04Å; K195-G198 PolarHBondContact O-N 2.93Å; K195-G198 VanDerWaalsContact O-N 3.12Å; K195-V199 WeakPolarHBondContact O-CG2 3.42Å; K195-V199 PolarHBondContact O-N 3.12Å
196A91.7Very high91Very high5 Ų523.4 Ų23.44%0.04113%0.128CC..Hα-helixtrans-60.4-33.7177.600000112.6E192 V193 V199 L200 L216 L220E192-A196 WeakPolarHBondContact O-CB 3.08Å; E192-A196 PolarHBondContact O-N 3.06Å; V193-A196 WeakPolarHBondContact O-CB 3.38Å; V193-A196 PolarHBondContact O-N 3.42Å; A196-V199 PolarHBondContact O-N 3.17Å; A196-L200 WeakPolarHBondContact O-CB 3.5Å; A196-L200 PolarHBondContact O-N 3.39Å; A196-L216 HydrophobicContact CB-CD1 3.88Å; A196-L220 HydrophobicContact CB-CD2 3.66Å
197R91.5Very high90.8Very high8 Ų824.6 Ų24.63%0.0314%0.136CC..Hα-helixtrans-60.5-49.1170.9-72.4174.2166.1105.7-0.4112.3F112 I162 C166 V193 N194 K195 V199 L200 I201 D248 L252F112-R197 HydrophobicContact CD1-CB 4.01Å; F112-R197 HydrophobicContact CE1-CB 3.98Å; I162-R197 HydrophobicContact CG2-CB 4.23Å; I162-R197 HydrophobicContact CG2-CG 4.22Å; C166-R197 WeakPolarHBondContact SG-CD 3.47Å; C166-R197 PolarHBondContact SG-NE 2.85Å; C166-R197 VanDerWaalsContact SG-NE 3.44Å; V193-R197 WeakPolarHBondContact O-CG 3.4Å; V193-R197 PolarHBondContact O-N 3.25Å; N194-R197 WeakPolarHBondContact O-CB 3.28Å; N194-R197 PolarHBondContact O-N 2.7Å; N194-R197 PolarHBondContact OD1-NH1 2.99Å; K195-R197 VanDerWaalsContact C-N 3.26Å; K195-R197 PolarHBondContact O-N 3.04Å; R197-V199 VanDerWaalsContact C-N 3.27Å; R197-V199 PolarHBondContact O-N 3.5Å; R197-L200 WeakPolarHBondContact O-CB 3.18Å; R197-L200 PolarHBondContact O-N 2.99Å; R197-L200 VanDerWaalsContact O-N 3.17Å; R197-I201 WeakPolarHBondContact O-CG1 3.42Å; R197-I201 PolarHBondContact O-N 3.31Å; R197-D248 IonicContact CZ-OD1 2.8Å; R197-D248 IonicContact CZ-OD2 2.58Å; R197-D248 VanDerWaalsContact CZ-OD2 3.27Å; R197-D248 IonicContact NH1-OD2 2.7Å; R197-D248 PolarHBondContact NH1-OD2 3.04Å; R197-D248 IonicContact NH2-OD1 3.94Å; R197-D248 PolarHBondContact NH2-OD1 3.41Å; R197-D248 IonicContact NH2-OD2 3.34Å; R197-D248 PolarHBondContact NH2-OD2 2.92Å; R197-L252 HydrophobicContact CG-CD1 3.78Å; R197-L252 HydrophobicContact CG-CD2 3.87Å; R197-L252 HydrophobicContact CG-CG 4.49Å
198G90.6Very high90.4Very high0 Ų024.7 Ų24.70%014%0.136CC..Hα-helixtrans-58.8-42.7176.300000111.2I109 N194 K195 L200 A202I109-G198 WeakPolarHBondContact CD1-O 3.36Å; N194-G198 PolarHBondContact O-N 3.27Å; K195-G198 PolarHBondContact O-N 2.93Å; K195-G198 VanDerWaalsContact O-N 3.12Å; G198-L200 PolarHBondContact O-N 3.3Å; G198-A202 WeakPolarHBondContact O-CB 3.35Å; G198-A202 PolarHBondContact O-N 2.88Å
199V91.8Very high89.5Confident24 Ų2426.8 Ų26.815%0.14515%0.152CC..Hα-helixtrans-61.3-46.2174.3174.90000112Y113 K195 A196 R197 A202 L203 E211 L216Y113-V199 HydrophobicContact CE1-CG2 4.42Å; K195-V199 WeakPolarHBondContact O-CG2 3.42Å; K195-V199 PolarHBondContact O-N 3.12Å; A196-V199 PolarHBondContact O-N 3.17Å; R197-V199 VanDerWaalsContact C-N 3.27Å; R197-V199 PolarHBondContact O-N 3.5Å; V199-A202 WeakPolarHBondContact O-CB 3.45Å; V199-A202 PolarHBondContact O-N 3.14Å; V199-A202 VanDerWaalsContact O-N 3.16Å; V199-L203 HydrophobicContact CG1-CD1 4.17Å; V199-L203 HydrophobicContact CG1-CG 4.43Å; V199-L203 WeakPolarHBondContact O-CG 3.29Å; V199-L203 PolarHBondContact O-N 3.32Å; V199-E211 HydrophobicContact CG1-CB 4.04Å; V199-E211 HydrophobicContact CG1-CG 3.25Å; V199-L216 HydrophobicContact CB-CD1 4.29Å; V199-L216 HydrophobicContact CB-CD2 4.36Å; V199-L216 HydrophobicContact CG1-CD1 4.01Å; V199-L216 HydrophobicContact CG1-CD2 3.94Å; V199-L216 HydrophobicContact CG1-CG 4.45Å
200L92.2Very high89Confident1 Ų133.9 Ų33.91%0.00519%0.19CC..Hα-helixtrans-60.3-48.4179.2176.161.3000112I162 A196 R197 G198 A202 L203 L204 L216 L252 Y255 L256I162-L200 HydrophobicContact CD1-CD2 3.58Å; I162-L200 HydrophobicContact CD1-CG 3.93Å; I162-L200 HydrophobicContact CG1-CD2 4.43Å; A196-L200 WeakPolarHBondContact O-CB 3.5Å; A196-L200 PolarHBondContact O-N 3.39Å; R197-L200 WeakPolarHBondContact O-CB 3.18Å; R197-L200 PolarHBondContact O-N 2.99Å; R197-L200 VanDerWaalsContact O-N 3.17Å; G198-L200 PolarHBondContact O-N 3.3Å; L200-A202 PolarHBondContact O-N 2.89Å; L200-L203 PolarHBondContact O-N 3.13Å; L200-L203 VanDerWaalsContact O-N 3.15Å; L200-L204 HydrophobicContact CD1-CD1 4.24Å; L200-L204 HydrophobicContact CD1-CG 4.19Å; L200-L204 HydrophobicContact CG-CD1 4.09Å; L200-L204 HydrophobicContact CG-CG 4.47Å; L200-L204 WeakPolarHBondContact O-CG 3.32Å; L200-L204 PolarHBondContact O-N 2.98Å; L200-L216 HydrophobicContact CB-CD2 3.77Å; L200-L216 HydrophobicContact CD1-CD2 4.3Å; L200-L252 HydrophobicContact CD2-CB 4.06Å; L200-L252 HydrophobicContact CD2-CD2 3.78Å; L200-L252 HydrophobicContact CD2-CG 4.45Å; L200-Y255 HydrophobicContact CD2-CD2 4.04Å; L200-Y255 HydrophobicContact CD2-CG 4.46Å; L200-L256 HydrophobicContact CD1-CD2 3.4Å; L200-L256 HydrophobicContact CD1-CG 3.78Å
201I92.6Very high88.9Confident0 Ų034.3 Ų34.30%019%0.192CC..Hα-helixtrans-56.7-43.1175.3-70.2168.7000109.7V105 I109 F112 V159 I162 R197 L203 L204 M205V105-I201 HydrophobicContact CG1-CG2 3.52Å; V105-I201 HydrophobicContact CG2-CG2 4.39Å; I109-I201 HydrophobicContact CD1-CB 4Å; I109-I201 HydrophobicContact CD1-CG2 3.81Å; F112-I201 HydrophobicContact CE1-CD1 4.4Å; F112-I201 HydrophobicContact CE2-CD1 4.3Å; F112-I201 HydrophobicContact CZ-CD1 4.01Å; V159-I201 HydrophobicContact CG1-CG1 4.49Å; V159-I201 HydrophobicContact CG1-CG2 4.03Å; V159-I201 HydrophobicContact CG2-CG2 4.2Å; I162-I201 HydrophobicContact CB-CD1 4.44Å; I162-I201 HydrophobicContact CB-CG1 4.36Å; I162-I201 HydrophobicContact CD1-CG1 4.11Å; I162-I201 HydrophobicContact CG2-CD1 3.81Å; I162-I201 HydrophobicContact CG2-CG1 4Å; R197-I201 WeakPolarHBondContact O-CG1 3.42Å; R197-I201 PolarHBondContact O-N 3.31Å; I201-L203 VanDerWaalsContact C-N 3.34Å; I201-L203 PolarHBondContact O-N 2.99Å; I201-L204 PolarHBondContact O-N 3.09Å; I201-M205 WeakPolarHBondContact O-CB 3.27Å; I201-M205 WeakPolarHBondContact O-CG 3.02Å; I201-M205 PolarHBondContact O-N 3.12Å; I201-M205 VanDerWaalsContact O-N 3.15Å
202A92.1Very high88.9Confident0 Ų035.9 Ų35.90%020%0.2CC..Hα-helixtrans-64.7-37.317900000113.3I109 G198 V199 L200 G206 V207 N208I109-A202 HydrophobicContact CD1-CB 3.79Å; G198-A202 WeakPolarHBondContact O-CB 3.35Å; G198-A202 PolarHBondContact O-N 2.88Å; V199-A202 WeakPolarHBondContact O-CB 3.45Å; V199-A202 PolarHBondContact O-N 3.14Å; V199-A202 VanDerWaalsContact O-N 3.16Å; L200-A202 PolarHBondContact O-N 2.89Å; A202-G206 PolarHBondContact O-N 3.05Å; A202-V207 HydrophobicContact CB-CG2 3.83Å; A202-V207 PolarHBondContact O-N 3.09Å; A202-N208 HydrophobicContact CB-CB 3.51Å
203L91.5Very high88.7Confident27 Ų2735.4 Ų35.414%0.14120%0.202CC..Hα-helixtrans-68.5-48.5176.4-73.1174.5000111.7V199 L200 I201 M205 G206 E211 L216 L256V199-L203 HydrophobicContact CG1-CD1 4.17Å; V199-L203 HydrophobicContact CG1-CG 4.43Å; V199-L203 WeakPolarHBondContact O-CG 3.29Å; V199-L203 PolarHBondContact O-N 3.32Å; L200-L203 PolarHBondContact O-N 3.13Å; L200-L203 VanDerWaalsContact O-N 3.15Å; I201-L203 VanDerWaalsContact C-N 3.34Å; I201-L203 PolarHBondContact O-N 2.99Å; L203-M205 PolarHBondContact O-N 3.5Å; L203-G206 PolarHBondContact O-N 3.37Å; L203-E211 HydrophobicContact CD1-CG 4.44Å; L203-E211 HydrophobicContact CD2-CB 4.22Å; L203-E211 VanDerWaalsContact CD2-O 3.29Å; L203-E211 WeakPolarHBondContact CD2-O 3.34Å; L203-L216 HydrophobicContact CD1-CB 4.26Å; L203-L216 HydrophobicContact CD1-CD2 3.98Å; L203-L256 HydrophobicContact CD1-CD2 4.36Å
204L90.8Very high88.7Confident20 Ų2046.1 Ų46.111%0.10524%0.243CC..Hα-helixtrans-56-37.3178.2-73.1170.9000111.8K155 A158 V159 I162 L200 I201 L258K155-L204 WeakPolarHBondContact CD-O 3.02Å; A158-L204 HydrophobicContact CB-CD1 3.92Å; V159-L204 HydrophobicContact CG2-CB 4.19Å; V159-L204 HydrophobicContact CG2-CD1 4.14Å; I162-L204 HydrophobicContact CD1-CD1 3.8Å; L200-L204 HydrophobicContact CD1-CD1 4.24Å; L200-L204 HydrophobicContact CD1-CG 4.19Å; L200-L204 HydrophobicContact CG-CD1 4.09Å; L200-L204 HydrophobicContact CG-CG 4.47Å; L200-L204 WeakPolarHBondContact O-CG 3.32Å; L200-L204 PolarHBondContact O-N 2.98Å; I201-L204 PolarHBondContact O-N 3.09Å; L204-L258 HydrophobicContact CD2-CD1 4.03Å
205M92.3Very high88.9Confident1 Ų150 Ų501%0.00526%0.26CS..THydrogen-bonded Turntrans-90.4-4.2179.7-60.8-56.7-61.900113.6F98 A101 Q102 V105 I156 V159 I201 L203 V207F98-M205 HydrophobicContact CD2-CE 3.89Å; F98-M205 HydrophobicContact CE2-CE 3.42Å; F98-M205 VanDerWaalsContact CE2-CE 3.42Å; F98-M205 HydrophobicContact CE2-SD 3.93Å; F98-M205 HydrophobicContact CZ-CE 4.16Å; A101-M205 HydrophobicContact CB-CE 3.55Å; Q102-M205 HydrophobicContact CG-CB 4.46Å; Q102-M205 HydrophobicContact CG-CE 3.95Å; Q102-M205 WeakPolarHBondContact CG-O 3.47Å; Q102-M205 PolarHBondContact NE2-O 3.36Å; V105-M205 HydrophobicContact CB-CG 4.39Å; V105-M205 HydrophobicContact CG1-CB 4.38Å; V105-M205 HydrophobicContact CG1-CG 4.18Å; V105-M205 HydrophobicContact CG2-CG 4.04Å; I156-M205 HydrophobicContact CG1-CE 4.32Å; I156-M205 HydrophobicContact CG1-SD 4.36Å; V159-M205 HydrophobicContact CG2-CG 3.86Å; V159-M205 HydrophobicContact CG2-SD 3.9Å; I201-M205 WeakPolarHBondContact O-CB 3.27Å; I201-M205 WeakPolarHBondContact O-CG 3.02Å; I201-M205 PolarHBondContact O-N 3.12Å; I201-M205 VanDerWaalsContact O-N 3.15Å; L203-M205 PolarHBondContact O-N 3.5Å; M205-V207 HydrophobicContact CB-CG1 3.94Å; M205-V207 HydrophobicContact CB-CG2 4.41Å; M205-V207 PolarHBondContact O-N 2.69Å
206G89.5Confident89Confident43 Ų4346.9 Ų46.944%0.44325%0.246SC..THydrogen-bonded Turntrans60.630.5-178.500000113.8A202 L203A202-G206 PolarHBondContact O-N 3.05Å; L203-G206 PolarHBondContact O-N 3.37Å
207V88.9Confident89.2Confident26 Ų2648.5 Ų48.516%0.15826%0.257CS..  trans-97.4-13.7-178.7-56.10000113.3Q102 V105 R106 A202 M205Q102-V207 HydrophobicContact CB-CG1 3.73Å; Q102-V207 HydrophobicContact CG-CG1 3.95Å; V105-V207 HydrophobicContact CG1-CG2 4.2Å; R106-V207 HydrophobicContact CG-CB 3.72Å; R106-V207 HydrophobicContact CG-CG1 3.89Å; R106-V207 HydrophobicContact CG-CG2 4.2Å; R106-V207 VanDerWaalsContact CZ-CG1 3.49Å; A202-V207 HydrophobicContact CB-CG2 3.83Å; A202-V207 PolarHBondContact O-N 3.09Å; M205-V207 HydrophobicContact CB-CG1 3.94Å; M205-V207 HydrophobicContact CB-CG2 4.41Å; M205-V207 PolarHBondContact O-N 2.69Å
208N80Confident89.4Confident32 Ų3252.3 Ų52.317%0.17128%0.284CS..  trans-115.9127.9174.6-178.817.1000110.5A202 N210A202-N208 HydrophobicContact CB-CB 3.51Å; N208-N210 WeakPolarHBondContact OD1-CB 3.35Å; N208-N210 PolarHBondContact OD1-N 3.06Å
209N72.9Confident89.6Confident149 Ų14954.8 Ų54.880%0.79730%0.3SS*.SBendtrans-102.7-6.2-179.6-65.3-27.6000113.3E211N209-E211 VanDerWaalsContact C-N 3.33Å
210N82.6Confident89.8Confident149 Ų14953.7 Ų53.780%0.79729%0.293SS*.SBendtrans-87.5-6.1-173.1-64.7-14.9000113.2N208N208-N210 WeakPolarHBondContact OD1-CB 3.35Å; N208-N210 PolarHBondContact OD1-N 3.06Å
211E85.4Confident90Very high45 Ų4556.3 Ų56.321%0.2131%0.311CS..  trans-133.2159-168.1-160.737.8-98.500110.7V199 L203 N209 H215V199-E211 HydrophobicContact CG1-CB 4.04Å; V199-E211 HydrophobicContact CG1-CG 3.25Å; L203-E211 HydrophobicContact CD1-CG 4.44Å; L203-E211 HydrophobicContact CD2-CB 4.22Å; L203-E211 VanDerWaalsContact CD2-O 3.29Å; L203-E211 WeakPolarHBondContact CD2-O 3.34Å; N209-E211 VanDerWaalsContact C-N 3.33Å; E211-H215 WeakPolarHBondContact OE1-CB 3.37Å; E211-H215 IonicContact OE1-CD2 3.6Å; E211-H215 PolarHBondContact OE1-CD2 3.5Å; E211-H215 IonicContact OE1-CG 3.27Å; E211-H215 IonicContact OE2-CD2 2.94Å; E211-H215 PolarHBondContact OE2-CD2 3.2Å; E211-H215 VanDerWaalsContact OE2-CD2 3.27Å; E211-H215 IonicContact OE2-NE2 2.85Å
212T88.3Confident90.3Very high80 Ų8058 Ų5849%0.49133%0.329SS..  trans-134.8151.1-179.863.50000111.2R214 H215 L216T212-R214 PolarHBondContact O-N 3.15Å; T212-R214 VanDerWaalsContact O-N 3.14Å; T212-H215 PolarHBondContact O-N 2.91Å; T212-H215 VanDerWaalsContact O-N 3.12Å; T212-H215 WeakPolarHBondContact OG1-CB 3.33Å; T212-H215 PolarHBondContact OG1-N 3.11Å; T212-L216 PolarHBondContact O-N 3.28Å
213C88.3Confident90.5Very high44 Ų4458.8 Ų58.830%0.29733%0.333SS..Hα-helixtrans-54.7-35.6175.5-60.40000112.2S217 L256C213-S217 WeakPolarHBondContact O-CB 3.18Å; C213-S217 PolarHBondContact O-N 3.44Å; C213-L256 HydrophobicContact CB-CD2 3.86Å
214R90.6Very high90.8Very high225 Ų22558.7 Ų58.785%0.84933%0.332SS*.Hα-helixtrans-64.3-47.7177-114.8-176.5-171.9137.75113T212 C218T212-R214 PolarHBondContact O-N 3.15Å; T212-R214 VanDerWaalsContact O-N 3.14Å; R214-C218 PolarHBondContact O-N 3.41Å; R214-C218 VanDerWaalsContact O-N 3.07Å
215H92.6Very high91.1Very high99 Ų9960.5 Ų60.546%0.45835%0.35SS..Hα-helixtrans-70.4-42.5-179.7176.483.9000110.8E211 T212 S217 C218 V219E211-H215 WeakPolarHBondContact OE1-CB 3.37Å; E211-H215 IonicContact OE1-CD2 3.6Å; E211-H215 PolarHBondContact OE1-CD2 3.5Å; E211-H215 IonicContact OE1-CG 3.27Å; E211-H215 IonicContact OE2-CD2 2.94Å; E211-H215 PolarHBondContact OE2-CD2 3.2Å; E211-H215 VanDerWaalsContact OE2-CD2 3.27Å; E211-H215 IonicContact OE2-NE2 2.85Å; T212-H215 PolarHBondContact O-N 2.91Å; T212-H215 VanDerWaalsContact O-N 3.12Å; T212-H215 WeakPolarHBondContact OG1-CB 3.33Å; T212-H215 PolarHBondContact OG1-N 3.11Å; H215-S217 VanDerWaalsContact C-N 3.32Å; H215-S217 PolarHBondContact O-N 3.14Å; H215-C218 WeakPolarHBondContact O-CA 3.28Å; H215-C218 WeakPolarHBondContact O-CB 3.47Å; H215-C218 PolarHBondContact O-N 2.62Å; H215-C218 VanDerWaalsContact O-N 3.08Å; H215-V219 WeakPolarHBondContact NE2-CG2 3.43Å; H215-V219 WeakPolarHBondContact O-CG2 3.44Å; H215-V219 PolarHBondContact O-N 3.24Å
216L93.6Very high91.2Very high6 Ų663.8 Ų63.83%0.03137%0.367CS..Hα-helixtrans-60-41.8174.5-170.160.7000112.4A196 V199 L200 L203 T212 C218 V219 L220 L256A196-L216 HydrophobicContact CB-CD1 3.88Å; V199-L216 HydrophobicContact CB-CD1 4.29Å; V199-L216 HydrophobicContact CB-CD2 4.36Å; V199-L216 HydrophobicContact CG1-CD1 4.01Å; V199-L216 HydrophobicContact CG1-CD2 3.94Å; V199-L216 HydrophobicContact CG1-CG 4.45Å; L200-L216 HydrophobicContact CB-CD2 3.77Å; L200-L216 HydrophobicContact CD1-CD2 4.3Å; L203-L216 HydrophobicContact CD1-CB 4.26Å; L203-L216 HydrophobicContact CD1-CD2 3.98Å; T212-L216 PolarHBondContact O-N 3.28Å; L216-C218 VanDerWaalsContact C-N 3.3Å; L216-C218 PolarHBondContact O-N 3.16Å; L216-V219 PolarHBondContact O-N 3.04Å; L216-L220 HydrophobicContact CD1-CG 4.44Å; L216-L220 HydrophobicContact CG-CD1 4.21Å; L216-L220 HydrophobicContact CG-CG 4.38Å; L216-L220 WeakPolarHBondContact O-CB 3.07Å; L216-L220 WeakPolarHBondContact O-CG 3.5Å; L216-L220 PolarHBondContact O-N 2.97Å; L216-L256 HydrophobicContact CB-CD1 4.12Å; L216-L256 HydrophobicContact CD2-CD1 4.21Å; L216-L256 HydrophobicContact CD2-CD2 4.1Å; L216-L256 HydrophobicContact CG-CD1 4.1Å
217S94.3Very high91.5Very high39 Ų3961.7 Ų61.727%0.27335%0.346SS..Hα-helixtrans-59.8-40.5174.41800000112C213 H215 S221C213-S217 WeakPolarHBondContact O-CB 3.18Å; C213-S217 PolarHBondContact O-N 3.44Å; H215-S217 VanDerWaalsContact C-N 3.32Å; H215-S217 PolarHBondContact O-N 3.14Å; S217-S221 VanDerWaalsContact O-CB 3.28Å; S217-S221 WeakPolarHBondContact O-CB 3.48Å; S217-S221 PolarHBondContact O-N 2.98Å; S217-S221 PolarHBondContact O-OG 2.95Å
218C95.8Very high91.8Very high88 Ų8865 Ų6560%0.59536%0.363SS*.Hα-helixtrans-64.8-43.1174.7-171.20000112.3R214 H215 L216 S221 G222R214-C218 PolarHBondContact O-N 3.41Å; R214-C218 VanDerWaalsContact O-N 3.07Å; H215-C218 WeakPolarHBondContact O-CA 3.28Å; H215-C218 WeakPolarHBondContact O-CB 3.47Å; H215-C218 PolarHBondContact O-N 2.62Å; H215-C218 VanDerWaalsContact O-N 3.08Å; L216-C218 VanDerWaalsContact C-N 3.3Å; L216-C218 PolarHBondContact O-N 3.16Å; C218-S221 PolarHBondContact O-N 3.01Å; C218-G222 PolarHBondContact O-N 3.31Å
219V95.3Very high92.4Very high53 Ų5367.6 Ų67.632%0.32139%0.389SS..Hα-helixtrans-61.7-51.8177.4170.80000110.5H215 L216 S221 G222 L223H215-V219 WeakPolarHBondContact NE2-CG2 3.43Å; H215-V219 WeakPolarHBondContact O-CG2 3.44Å; H215-V219 PolarHBondContact O-N 3.24Å; L216-V219 PolarHBondContact O-N 3.04Å; V219-S221 VanDerWaalsContact C-N 3.34Å; V219-S221 PolarHBondContact O-N 3.07Å; V219-G222 WeakPolarHBondContact O-CA 3.4Å; V219-G222 PolarHBondContact O-N 3.13Å; V219-G222 VanDerWaalsContact O-N 3.13Å; V219-L223 HydrophobicContact CG1-CD1 4.48Å; V219-L223 WeakPolarHBondContact O-CG 3.16Å; V219-L223 PolarHBondContact O-N 3.07Å
220L96.5Very high93.3Very high0 Ų061.8 Ų61.80%036%0.357CS..Hα-helixtrans-60.1-42.8178.8-71.2178.7000112A196 L216 G222 L223 I224 I249 L252 L253 L256A196-L220 HydrophobicContact CB-CD2 3.66Å; L216-L220 HydrophobicContact CD1-CG 4.44Å; L216-L220 HydrophobicContact CG-CD1 4.21Å; L216-L220 HydrophobicContact CG-CG 4.38Å; L216-L220 WeakPolarHBondContact O-CB 3.07Å; L216-L220 WeakPolarHBondContact O-CG 3.5Å; L216-L220 PolarHBondContact O-N 2.97Å; L220-G222 VanDerWaalsContact C-N 3.31Å; L220-G222 PolarHBondContact O-N 3.22Å; L220-L223 HydrophobicContact CD2-CD1 4.43Å; L220-L223 PolarHBondContact O-N 3.09Å; L220-I224 PolarHBondContact O-N 3.36Å; L220-I249 HydrophobicContact CB-CG2 3.76Å; L220-I249 HydrophobicContact CD2-CG2 4.03Å; L220-I249 HydrophobicContact CG-CG2 4.36Å; L220-L252 HydrophobicContact CD1-CB 3.82Å; L220-L252 HydrophobicContact CD2-CD1 4.24Å; L220-L253 HydrophobicContact CB-CD2 3.78Å; L220-L253 HydrophobicContact CB-CG 4.1Å; L220-L253 HydrophobicContact CD1-CD2 3.94Å; L220-L253 HydrophobicContact CD1-CG 4.11Å; L220-L256 HydrophobicContact CD1-CD1 4.12Å
221S96.6Very high93.6Very high57 Ų5759.8 Ų59.840%0.39935%0.347SS..Hα-helixtrans-63.3-37.6175.5-58.50000112.2S217 C218 V219 I224 A225S217-S221 VanDerWaalsContact O-CB 3.28Å; S217-S221 WeakPolarHBondContact O-CB 3.48Å; S217-S221 PolarHBondContact O-N 2.98Å; S217-S221 PolarHBondContact O-OG 2.95Å; C218-S221 PolarHBondContact O-N 3.01Å; V219-S221 VanDerWaalsContact C-N 3.34Å; V219-S221 PolarHBondContact O-N 3.07Å; S221-I224 PolarHBondContact O-N 2.98Å; S221-A225 PolarHBondContact O-N 3.18Å; S221-A225 VanDerWaalsContact O-N 3.12Å
222G97.4Very high93.5Very high35 Ų3558.1 Ų58.136%0.36134%0.34SS..Hα-helixtrans-63-41.5172.900000112.7C218 V219 L220 I224 A225 D226C218-G222 PolarHBondContact O-N 3.31Å; V219-G222 WeakPolarHBondContact O-CA 3.4Å; V219-G222 PolarHBondContact O-N 3.13Å; V219-G222 VanDerWaalsContact O-N 3.13Å; L220-G222 VanDerWaalsContact C-N 3.31Å; L220-G222 PolarHBondContact O-N 3.22Å; G222-I224 VanDerWaalsContact C-N 3.34Å; G222-I224 PolarHBondContact O-N 3.12Å; G222-A225 PolarHBondContact O-N 3.2Å; G222-D226 PolarHBondContact O-N 2.83Å
223L97.3Very high93.2Very high16 Ų1659.4 Ų59.48%0.08435%0.351CS..Hα-helixtrans-63.5-36.9175.5-66176.7000112.4V189 E192 V193 V219 L220 D226 L227 I249V189-L223 HydrophobicContact CG1-CB 3.97Å; V189-L223 HydrophobicContact CG1-CD1 4.42Å; V189-L223 HydrophobicContact CG1-CD2 4.17Å; V189-L223 HydrophobicContact CG1-CG 4.41Å; V189-L223 HydrophobicContact CG2-CD2 4.26Å; E192-L223 HydrophobicContact CB-CD1 3.95Å; E192-L223 HydrophobicContact CB-CD2 4.11Å; V193-L223 HydrophobicContact CG2-CD1 4.05Å; V219-L223 HydrophobicContact CG1-CD1 4.48Å; V219-L223 WeakPolarHBondContact O-CG 3.16Å; V219-L223 PolarHBondContact O-N 3.07Å; L220-L223 HydrophobicContact CD2-CD1 4.43Å; L220-L223 PolarHBondContact O-N 3.09Å; L223-D226 PolarHBondContact O-N 3.15Å; L223-L227 WeakPolarHBondContact O-CG 3.39Å; L223-L227 PolarHBondContact O-N 2.94Å; L223-I249 HydrophobicContact CB-CD1 3.94Å
224I97.2Very high92.8Very high26 Ų2661.1 Ų61.113%0.13338%0.375CS..Hα-helixtrans-61.5-48.1172.4-68.9172.2000110.4L220 S221 G222 D226 L227 D228 I249 L253L220-I224 PolarHBondContact O-N 3.36Å; S221-I224 PolarHBondContact O-N 2.98Å; G222-I224 VanDerWaalsContact C-N 3.34Å; G222-I224 PolarHBondContact O-N 3.12Å; I224-D226 VanDerWaalsContact C-N 3.3Å; I224-D226 PolarHBondContact O-N 3.21Å; I224-L227 WeakPolarHBondContact O-CB 3.14Å; I224-L227 PolarHBondContact O-N 2.81Å; I224-L227 VanDerWaalsContact O-N 3.1Å; I224-D228 PolarHBondContact O-N 3.38Å; I224-I249 HydrophobicContact CD1-CB 4.24Å; I224-I249 HydrophobicContact CD1-CG2 3.63Å; I224-I249 HydrophobicContact CG1-CB 4.02Å; I224-I249 HydrophobicContact CG1-CD1 4.03Å; I224-I249 HydrophobicContact CG1-CG2 3.62Å; I224-L253 HydrophobicContact CD1-CD1 3.85Å
225A97Very high92.5Very high58 Ų5856.4 Ų56.448%0.47936%0.358SS..Hα-helixtrans-60.6-40.3179.400000112.2S221 G222 L227 D228 A229S221-A225 PolarHBondContact O-N 3.18Å; S221-A225 VanDerWaalsContact O-N 3.12Å; G222-A225 PolarHBondContact O-N 3.2Å; A225-L227 VanDerWaalsContact C-N 3.33Å; A225-L227 PolarHBondContact O-N 3.26Å; A225-D228 PolarHBondContact O-N 3.26Å; A225-A229 WeakPolarHBondContact O-CB 3.47Å; A225-A229 PolarHBondContact O-N 2.8Å
226D96.2Very high92.4Very high69 Ų6955.4 Ų55.437%0.36936%0.359SS..Hα-helixtrans-59.9-40.9173.5-91.815.1000112.3K185 G222 L223 I224K185-D226 WeakPolarHBondContact CE-OD2 3.45Å; K185-D226 IonicContact NZ-OD2 2.76Å; K185-D226 PolarHBondContact NZ-OD2 3.48Å; G222-D226 PolarHBondContact O-N 2.83Å; L223-D226 PolarHBondContact O-N 3.15Å; I224-D226 VanDerWaalsContact C-N 3.3Å; I224-D226 PolarHBondContact O-N 3.21Å
227L95.3Very high92.1Very high0 Ų062 Ų620%039%0.389CS..Hα-helixtrans-69.6-43.4176.7-71170.4000111.4I186 V189 L223 I224 A225 A229 L230 R242 V245 V246 I249I186-L227 HydrophobicContact CG1-CD2 4.02Å; V189-L227 HydrophobicContact CB-CD2 4.04Å; V189-L227 HydrophobicContact CB-CG 4.37Å; V189-L227 HydrophobicContact CG1-CD1 3.79Å; V189-L227 HydrophobicContact CG1-CD2 4.09Å; V189-L227 HydrophobicContact CG1-CG 3.95Å; V189-L227 HydrophobicContact CG2-CD2 4.04Å; V189-L227 HydrophobicContact CG2-CG 4.25Å; L223-L227 WeakPolarHBondContact O-CG 3.39Å; L223-L227 PolarHBondContact O-N 2.94Å; I224-L227 WeakPolarHBondContact O-CB 3.14Å; I224-L227 PolarHBondContact O-N 2.81Å; I224-L227 VanDerWaalsContact O-N 3.1Å; A225-L227 VanDerWaalsContact C-N 3.33Å; A225-L227 PolarHBondContact O-N 3.26Å; L227-A229 VanDerWaalsContact C-N 3.26Å; L227-A229 PolarHBondContact O-N 3.39Å; L227-L230 HydrophobicContact CD2-CD1 3.99Å; L227-L230 VanDerWaalsContact O-CB 3.24Å; L227-L230 WeakPolarHBondContact O-CB 3.39Å; L227-L230 WeakPolarHBondContact O-CG 3.14Å; L227-L230 PolarHBondContact O-N 3.36Å; L227-L230 VanDerWaalsContact O-N 3.07Å; L227-R242 HydrophobicContact CB-CG 4.08Å; L227-R242 HydrophobicContact CD2-CG 4.26Å; L227-R242 WeakPolarHBondContact O-CD 3.35Å; L227-V245 HydrophobicContact CD1-CB 4.14Å; L227-V245 HydrophobicContact CD1-CG1 3.72Å; L227-V246 HydrophobicContact CB-CG2 4.01Å; L227-V246 HydrophobicContact CD1-CG2 3.63Å; L227-V246 HydrophobicContact CG-CG2 4.47Å; L227-I249 HydrophobicContact CD1-CD1 3.73Å
228D94Very high91.9Very high96 Ų9660.2 Ų60.251%0.51338%0.377SS..Hα-helixtrans-65.3-30-179.2-76.7-24000112.6I224 A225 L230I224-D228 PolarHBondContact O-N 3.38Å; A225-D228 PolarHBondContact O-N 3.26Å; D228-L230 PolarHBondContact O-N 3.46Å
229A93.7Very high91.6Very high85 Ų8561 Ų6170%0.70237%0.367SS*.THydrogen-bonded Turntrans-70.3-11.3174.100000114A225 L227 D231A225-A229 WeakPolarHBondContact O-CB 3.47Å; A225-A229 PolarHBondContact O-N 2.8Å; L227-A229 VanDerWaalsContact C-N 3.26Å; L227-A229 PolarHBondContact O-N 3.39Å; A229-D231 PolarHBondContact O-N 3.37Å
230L91.6Very high91.3Very high27 Ų2762 Ų6214%0.14137%0.371CS..  trans-71.5123.6179.2-62.8173.2000111.5K185 I186 L227 D228 V232 R242K185-L230 HydrophobicContact CB-CD2 4.05Å; K185-L230 HydrophobicContact CG-CD2 3.88Å; I186-L230 HydrophobicContact CD1-CD1 4.19Å; I186-L230 HydrophobicContact CG1-CD1 3.57Å; L227-L230 HydrophobicContact CD2-CD1 3.99Å; L227-L230 VanDerWaalsContact O-CB 3.24Å; L227-L230 WeakPolarHBondContact O-CB 3.39Å; L227-L230 WeakPolarHBondContact O-CG 3.14Å; L227-L230 PolarHBondContact O-N 3.36Å; L227-L230 VanDerWaalsContact O-N 3.07Å; D228-L230 PolarHBondContact O-N 3.46Å; L230-V232 HydrophobicContact CB-CG1 4.11Å; L230-V232 PolarHBondContact O-N 2.83Å; L230-R242 PolarHBondContact O-NH1 3Å
231D88.3Confident91Very high108 Ų10862.3 Ų62.358%0.57837%0.372SS*.  trans-71.9117.1163.5-171.14.8000109.5H180 S182 A229 C233H180-D231 PolarHBondContact CE1-O 3.42Å; S182-D231 PolarHBondContact OG-O 3.35Å; A229-D231 PolarHBondContact O-N 3.37Å; D231-C233 WeakPolarHBondContact OD1-CB 3.46Å; D231-C233 PolarHBondContact OD1-N 2.92Å; D231-C233 PolarHBondContact OD1-SG 3.14Å
232V84.4Confident90.8Very high10 Ų1062 Ų626%0.06136%0.362CS..  trans-129.623.8178.9-62.30000110.8L230 G234 R235 I238 R239L230-V232 HydrophobicContact CB-CG1 4.11Å; L230-V232 PolarHBondContact O-N 2.83Å; V232-G234 PolarHBondContact O-N 3.32Å; V232-R235 PolarHBondContact O-N 3.48Å; V232-I238 HydrophobicContact CB-CG2 4.16Å; V232-I238 HydrophobicContact CG1-CG2 3.59Å; V232-R239 HydrophobicContact CG2-CB 4.14Å
233C81Confident90.5Very high107 Ų10766.4 Ų66.472%0.72337%0.368SS*.THydrogen-bonded Turntrans-57.2134.9-177-70.70000111.9D231 R235D231-C233 WeakPolarHBondContact OD1-CB 3.46Å; D231-C233 PolarHBondContact OD1-N 2.92Å; D231-C233 PolarHBondContact OD1-SG 3.14Å; C233-R235 VanDerWaalsContact C-N 3.3Å; C233-R235 PolarHBondContact O-N 3.32Å
234G80.7Confident90.2Very high79 Ų7968 Ų6881%0.81438%0.375SS*.THydrogen-bonded Turntrans80-9.5174.800000116.7V232V232-G234 PolarHBondContact O-N 3.32Å
235R84.7Confident89.9Confident127 Ų12767 Ų6748%0.47937%0.37SS..  trans-113.898.6178.8-61.3-145-172.7-170.211.9112.5A179 V232 C233 E237 I238 R239A179-R235 VanDerWaalsContact O-CZ 3.31Å; A179-R235 PolarHBondContact O-NH1 3.2Å; A179-R235 PolarHBondContact O-NH2 2.85Å; V232-R235 PolarHBondContact O-N 3.48Å; C233-R235 VanDerWaalsContact C-N 3.3Å; C233-R235 PolarHBondContact O-N 3.32Å; R235-E237 VanDerWaalsContact C-N 3.33Å; R235-E237 PolarHBondContact O-N 2.87Å; R235-I238 HydrophobicContact CB-CB 4.26Å; R235-I238 HydrophobicContact CB-CD1 3.8Å; R235-I238 HydrophobicContact CB-CG1 4.03Å; R235-I238 HydrophobicContact CG-CD1 4.21Å; R235-I238 PolarHBondContact O-N 2.87Å; R235-R239 PolarHBondContact O-N 3.41Å; R235-R239 VanDerWaalsContact O-N 3.15Å
236T88.6Confident89.7Confident77 Ų7765.4 Ų65.447%0.47235%0.354SS..Hα-helixtrans-60.7-39.8-177.8-610000113I238 R239 N240T236-I238 PolarHBondContact O-N 3.37Å; T236-R239 PolarHBondContact O-N 2.96Å; T236-R239 PolarHBondContact OG1-NH2 3.44Å; T236-N240 WeakPolarHBondContact O-CB 3.44Å; T236-N240 VanDerWaalsContact O-CG 3.22Å; T236-N240 PolarHBondContact O-N 3.41Å; T236-N240 PolarHBondContact O-OD1 2.88Å
237E88.7Confident89.6Confident145 Ų14567.4 Ų67.468%0.67836%0.361SS*.Hα-helixtrans-59.4-47.3179.5-66.5167.6-17300111.8R235 N240 Y241R235-E237 VanDerWaalsContact C-N 3.33Å; R235-E237 PolarHBondContact O-N 2.87Å; E237-N240 PolarHBondContact O-N 3.19Å; E237-Y241 WeakPolarHBondContact O-CB 3.26Å; E237-Y241 PolarHBondContact O-N 3.28Å
238I88.8Confident89.4Confident2 Ų267.9 Ų67.91%0.0136%0.364CS..Hα-helixtrans-68.9-38.9-179.3-55.4177.2000111.1L175 H180 V183 I186 V232 R235 T236 N240 Y241 R242L175-I238 HydrophobicContact CD1-CG1 4.06Å; H180-I238 HydrophobicContact CB-CD1 3.18Å; H180-I238 HydrophobicContact CB-CG1 4.5Å; H180-I238 VanDerWaalsContact CG-CD1 3.41Å; V183-I238 HydrophobicContact CG2-CD1 4.19Å; V183-I238 HydrophobicContact CG2-CG1 4.19Å; V183-I238 HydrophobicContact CG2-CG2 4.46Å; I186-I238 HydrophobicContact CD1-CG2 3.74Å; V232-I238 HydrophobicContact CB-CG2 4.16Å; V232-I238 HydrophobicContact CG1-CG2 3.59Å; R235-I238 HydrophobicContact CB-CB 4.26Å; R235-I238 HydrophobicContact CB-CD1 3.8Å; R235-I238 HydrophobicContact CB-CG1 4.03Å; R235-I238 HydrophobicContact CG-CD1 4.21Å; R235-I238 PolarHBondContact O-N 2.87Å; T236-I238 PolarHBondContact O-N 3.37Å; I238-N240 VanDerWaalsContact C-N 3.3Å; I238-N240 PolarHBondContact O-N 3.42Å; I238-Y241 PolarHBondContact O-N 2.87Å; I238-R242 WeakPolarHBondContact O-CB 3.38Å; I238-R242 PolarHBondContact O-N 3.16Å
239R90.1Very high89.4Confident103 Ų10363.3 Ų63.339%0.38934%0.339SS..Hα-helixtrans-63.3-37.8174.7175.4174.951.2-164.1-9.5111.9V232 R235 T236 R243V232-R239 HydrophobicContact CG2-CB 4.14Å; R235-R239 PolarHBondContact O-N 3.41Å; R235-R239 VanDerWaalsContact O-N 3.15Å; T236-R239 PolarHBondContact O-N 2.96Å; T236-R239 PolarHBondContact OG1-NH2 3.44Å; R239-R243 VanDerWaalsContact O-CB 3.31Å; R239-R243 WeakPolarHBondContact O-CB 3.35Å; R239-R243 PolarHBondContact O-N 2.82Å
240N90.2Very high89.4Confident74 Ų7462.6 Ų62.640%0.39632%0.324SS..Hα-helixtrans-69.4-43.7175-70.3-9.2000110.7T236 E237 I238 R242 R243 E244T236-N240 WeakPolarHBondContact O-CB 3.44Å; T236-N240 VanDerWaalsContact O-CG 3.22Å; T236-N240 PolarHBondContact O-N 3.41Å; T236-N240 PolarHBondContact O-OD1 2.88Å; E237-N240 PolarHBondContact O-N 3.19Å; I238-N240 VanDerWaalsContact C-N 3.3Å; I238-N240 PolarHBondContact O-N 3.42Å; N240-R242 PolarHBondContact O-N 3.08Å; N240-R243 WeakPolarHBondContact O-CB 3.48Å; N240-R243 PolarHBondContact O-N 3.39Å; N240-R243 VanDerWaalsContact O-N 3.15Å; N240-E244 PolarHBondContact O-N 3.48Å
241Y89.5Confident89.4Confident7 Ų764.9 Ų64.93%0.02733%0.333CS..Hα-helixtrans-60.9-47177-176-146.7000112L175 I186 N187 M190 E237 I238 R243 E244 V245L175-Y241 HydrophobicContact CB-CD1 4.47Å; L175-Y241 HydrophobicContact CD1-CD1 3.92Å; L175-Y241 HydrophobicContact CD1-CG 4.39Å; L175-Y241 HydrophobicContact CG-CD1 4.12Å; I186-Y241 HydrophobicContact CB-CD1 4.2Å; I186-Y241 HydrophobicContact CB-CE1 3.98Å; I186-Y241 HydrophobicContact CD1-CD1 4.16Å; I186-Y241 HydrophobicContact CG2-CD1 3.57Å; I186-Y241 HydrophobicContact CG2-CD2 4.36Å; I186-Y241 HydrophobicContact CG2-CE1 3.38Å; I186-Y241 HydrophobicContact CG2-CE2 4.18Å; I186-Y241 HydrophobicContact CG2-CG 4.07Å; N187-Y241 WeakPolarHBondContact OD1-CE1 3.42Å; N187-Y241 PolarHBondContact OD1-OH 3.08Å; M190-Y241 HydrophobicContact SD-CE2 4.44Å; E237-Y241 WeakPolarHBondContact O-CB 3.26Å; E237-Y241 PolarHBondContact O-N 3.28Å; I238-Y241 PolarHBondContact O-N 2.87Å; Y241-R243 VanDerWaalsContact C-N 3.32Å; Y241-R243 PolarHBondContact O-N 3.02Å; Y241-E244 PolarHBondContact O-N 3.26Å; Y241-V245 HydrophobicContact CD2-CG2 4.46Å; Y241-V245 HydrophobicContact CE2-CG2 4.22Å; Y241-V245 WeakPolarHBondContact O-CG2 3.21Å; Y241-V245 PolarHBondContact O-N 3.49Å
242R92Very high89.6Confident51 Ų5160 Ų6019%0.19231%0.306CS..Hα-helixtrans-56-47172.1-176.1-170.567.6177.69.8111.5I186 L227 L230 I238 N240 E244 V245 V246I186-R242 HydrophobicContact CD1-CB 3.98Å; L227-R242 HydrophobicContact CB-CG 4.08Å; L227-R242 HydrophobicContact CD2-CG 4.26Å; L227-R242 WeakPolarHBondContact O-CD 3.35Å; L230-R242 PolarHBondContact O-NH1 3Å; I238-R242 WeakPolarHBondContact O-CB 3.38Å; I238-R242 PolarHBondContact O-N 3.16Å; N240-R242 PolarHBondContact O-N 3.08Å; R242-E244 VanDerWaalsContact C-N 3.33Å; R242-E244 PolarHBondContact O-N 2.79Å; R242-V245 PolarHBondContact O-N 2.74Å; R242-V246 WeakPolarHBondContact O-CG2 3.34Å; R242-V246 PolarHBondContact O-N 3.03Å
243R91.7Very high90Very high127 Ų12760.7 Ų60.748%0.47931%0.31SS..Hα-helixtrans-60.1-43.6-179.5-174.4-167.4-51.7-171.74.2111.4R239 N240 Y241 V245 V246 E247R239-R243 VanDerWaalsContact O-CB 3.31Å; R239-R243 WeakPolarHBondContact O-CB 3.35Å; R239-R243 PolarHBondContact O-N 2.82Å; N240-R243 WeakPolarHBondContact O-CB 3.48Å; N240-R243 PolarHBondContact O-N 3.39Å; N240-R243 VanDerWaalsContact O-N 3.15Å; Y241-R243 VanDerWaalsContact C-N 3.32Å; Y241-R243 PolarHBondContact O-N 3.02Å; R243-V245 VanDerWaalsContact C-N 3.33Å; R243-V245 PolarHBondContact O-N 3.23Å; R243-V246 PolarHBondContact O-N 2.85Å; R243-E247 WeakPolarHBondContact CD-OE1 3.39Å; R243-E247 HydrophobicContact CG-CG 4.37Å; R243-E247 WeakPolarHBondContact CG-OE1 3.14Å; R243-E247 WeakPolarHBondContact O-CG 3.49Å; R243-E247 PolarHBondContact O-N 3.32Å
244E90.4Very high90.4Very high49 Ų4962.8 Ų62.823%0.22931%0.307CS..Hα-helixtrans-58.7-44.8177.9-173-178.3169.700111.4N240 Y241 R242 E247 D248N240-E244 PolarHBondContact O-N 3.48Å; Y241-E244 PolarHBondContact O-N 3.26Å; R242-E244 VanDerWaalsContact C-N 3.33Å; R242-E244 PolarHBondContact O-N 2.79Å; E244-E247 PolarHBondContact O-N 3.45Å; E244-D248 VanDerWaalsContact O-CB 3.31Å; E244-D248 WeakPolarHBondContact O-CB 3.46Å; E244-D248 PolarHBondContact O-N 2.88Å
245V91.1Very high90.8Very high5 Ų560.3 Ų60.33%0.0327%0.273CS..Hα-helixtrans-65.7-39.1176.2-177.20000111.6I186 V189 V193 L227 Y241 R242 R243 D248 I249I186-V245 HydrophobicContact CG2-CG2 3.85Å; V189-V245 HydrophobicContact CG1-CG1 4.02Å; V193-V245 HydrophobicContact CG2-CG1 4.39Å; L227-V245 HydrophobicContact CD1-CB 4.14Å; L227-V245 HydrophobicContact CD1-CG1 3.72Å; Y241-V245 HydrophobicContact CD2-CG2 4.46Å; Y241-V245 HydrophobicContact CE2-CG2 4.22Å; Y241-V245 WeakPolarHBondContact O-CG2 3.21Å; Y241-V245 PolarHBondContact O-N 3.49Å; R242-V245 PolarHBondContact O-N 2.74Å; R243-V245 VanDerWaalsContact C-N 3.33Å; R243-V245 PolarHBondContact O-N 3.23Å; V245-D248 WeakPolarHBondContact O-CB 3.45Å; V245-D248 PolarHBondContact O-N 2.74Å; V245-I249 HydrophobicContact CG1-CD1 4.23Å; V245-I249 WeakPolarHBondContact O-CG1 3.39Å; V245-I249 PolarHBondContact O-N 2.86Å
246V93.8Very high90.9Very high25 Ų2555 Ų5515%0.15225%0.254CS..Hα-helixtrans-64.8-42.7174.8171.60000111.7L227 R242 R243 D248 I249 N250L227-V246 HydrophobicContact CB-CG2 4.01Å; L227-V246 HydrophobicContact CD1-CG2 3.63Å; L227-V246 HydrophobicContact CG-CG2 4.47Å; R242-V246 WeakPolarHBondContact O-CG2 3.34Å; R242-V246 PolarHBondContact O-N 3.03Å; R243-V246 PolarHBondContact O-N 2.85Å; V246-D248 VanDerWaalsContact C-N 3.26Å; V246-D248 PolarHBondContact O-N 2.87Å; V246-I249 PolarHBondContact O-N 3.06Å; V246-N250 WeakPolarHBondContact CG1-ND2 3.4Å; V246-N250 WeakPolarHBondContact O-CB 3.33Å; V246-N250 PolarHBondContact O-N 3.4Å; V246-N250 PolarHBondContact O-ND2 3.29Å
247E92.5Very high90.5Very high111 Ų11156.1 Ų56.152%0.51926%0.257SS..Hα-helixtrans-61.4-38.7175.7-75.1173.6-170.400111.2R243 E244 N250 K251R243-E247 WeakPolarHBondContact CD-OE1 3.39Å; R243-E247 HydrophobicContact CG-CG 4.37Å; R243-E247 WeakPolarHBondContact CG-OE1 3.14Å; R243-E247 WeakPolarHBondContact O-CG 3.49Å; R243-E247 PolarHBondContact O-N 3.32Å; E244-E247 PolarHBondContact O-N 3.45Å; E247-N250 PolarHBondContact O-N 3.06Å; E247-K251 WeakPolarHBondContact O-CG 3.31Å; E247-K251 PolarHBondContact O-N 3.41Å
248D91Very high89.8Confident10 Ų1050.7 Ų50.75%0.05323%0.233CC..Hα-helixtrans-65.5-44.9176.6-163.646000112.5K169 R197 E244 V245 V246 N250 K251 L252K169-D248 IonicContact NZ-OD1 3.27Å; K169-D248 PolarHBondContact NZ-OD1 3.47Å; R197-D248 IonicContact CZ-OD1 2.8Å; R197-D248 IonicContact CZ-OD2 2.58Å; R197-D248 VanDerWaalsContact CZ-OD2 3.27Å; R197-D248 IonicContact NH1-OD2 2.7Å; R197-D248 PolarHBondContact NH1-OD2 3.04Å; R197-D248 IonicContact NH2-OD1 3.94Å; R197-D248 PolarHBondContact NH2-OD1 3.41Å; R197-D248 IonicContact NH2-OD2 3.34Å; R197-D248 PolarHBondContact NH2-OD2 2.92Å; E244-D248 VanDerWaalsContact O-CB 3.31Å; E244-D248 WeakPolarHBondContact O-CB 3.46Å; E244-D248 PolarHBondContact O-N 2.88Å; V245-D248 WeakPolarHBondContact O-CB 3.45Å; V245-D248 PolarHBondContact O-N 2.74Å; V246-D248 VanDerWaalsContact C-N 3.26Å; V246-D248 PolarHBondContact O-N 2.87Å; D248-N250 VanDerWaalsContact C-N 3.35Å; D248-N250 PolarHBondContact O-N 3.33Å; D248-K251 WeakPolarHBondContact O-CB 3.45Å; D248-K251 PolarHBondContact O-N 2.93Å; D248-L252 PolarHBondContact O-N 3.14Å
249I94.1Very high88.6Confident0 Ų056.6 Ų56.60%026%0.26CS..Hα-helixtrans-61.2-44.4173.5-64.9163.6000111.1V189 V193 L220 L223 I224 L227 V245 V246 K251 L252 L253V189-I249 HydrophobicContact CG1-CD1 4.17Å; V193-I249 HydrophobicContact CG1-CG1 4.42Å; V193-I249 HydrophobicContact CG2-CD1 3.81Å; V193-I249 HydrophobicContact CG2-CG1 3.45Å; V193-I249 VanDerWaalsContact CG2-CG1 3.45Å; L220-I249 HydrophobicContact CB-CG2 3.76Å; L220-I249 HydrophobicContact CD2-CG2 4.03Å; L220-I249 HydrophobicContact CG-CG2 4.36Å; L223-I249 HydrophobicContact CB-CD1 3.94Å; I224-I249 HydrophobicContact CD1-CB 4.24Å; I224-I249 HydrophobicContact CD1-CG2 3.63Å; I224-I249 HydrophobicContact CG1-CB 4.02Å; I224-I249 HydrophobicContact CG1-CD1 4.03Å; I224-I249 HydrophobicContact CG1-CG2 3.62Å; L227-I249 HydrophobicContact CD1-CD1 3.73Å; V245-I249 HydrophobicContact CG1-CD1 4.23Å; V245-I249 WeakPolarHBondContact O-CG1 3.39Å; V245-I249 PolarHBondContact O-N 2.86Å; V246-I249 PolarHBondContact O-N 3.06Å; I249-K251 PolarHBondContact O-N 3.21Å; I249-L252 PolarHBondContact O-N 3.15Å; I249-L253 HydrophobicContact CG2-CD1 4.26Å; I249-L253 HydrophobicContact CG2-CG 4.47Å; I249-L253 PolarHBondContact O-N 3.05Å
250N94.4Very high87.1Confident70 Ų7059.7 Ų59.737%0.37428%0.279SS..Hα-helixtrans-61.8-31.2177.8-79.6-58000112.6V246 E247 D248 K254V246-N250 WeakPolarHBondContact CG1-ND2 3.4Å; V246-N250 WeakPolarHBondContact O-CB 3.33Å; V246-N250 PolarHBondContact O-N 3.4Å; V246-N250 PolarHBondContact O-ND2 3.29Å; E247-N250 PolarHBondContact O-N 3.06Å; D248-N250 VanDerWaalsContact C-N 3.35Å; D248-N250 PolarHBondContact O-N 3.33Å; N250-K254 WeakPolarHBondContact O-CG 3.43Å; N250-K254 PolarHBondContact O-N 2.99Å
251K91.4Very high85.5Confident76 Ų7662.2 Ų62.233%0.3329%0.288SS..Hα-helixtrans-65.5-44.7171-72.5179.4174.3-162.30111.6D165 E247 D248 I249 L253 K254 Y255D165-K251 IonicContact OD1-NZ 2.7Å; D165-K251 WeakPolarHBondContact OD2-CD 3.37Å; D165-K251 IonicContact OD2-NZ 3.82Å; D165-K251 PolarHBondContact OD2-NZ 3.4Å; E247-K251 WeakPolarHBondContact O-CG 3.31Å; E247-K251 PolarHBondContact O-N 3.41Å; D248-K251 WeakPolarHBondContact O-CB 3.45Å; D248-K251 PolarHBondContact O-N 2.93Å; I249-K251 PolarHBondContact O-N 3.21Å; K251-L253 VanDerWaalsContact C-N 3.33Å; K251-L253 PolarHBondContact O-N 3.44Å; K251-K254 WeakPolarHBondContact O-CB 3.46Å; K251-K254 PolarHBondContact O-N 3.46Å; K251-Y255 WeakPolarHBondContact O-CD2 3.27Å
252L92.3Very high84Confident5 Ų562.1 Ų62.13%0.02629%0.289CS..Hα-helixtrans-62.9-39.8178.5-59.8-177.3000112.3V193 R197 L200 L220 D248 I249 K254 Y255V193-L252 HydrophobicContact CG1-CD1 3.76Å; R197-L252 HydrophobicContact CG-CD1 3.78Å; R197-L252 HydrophobicContact CG-CD2 3.87Å; R197-L252 HydrophobicContact CG-CG 4.49Å; L200-L252 HydrophobicContact CD2-CB 4.06Å; L200-L252 HydrophobicContact CD2-CD2 3.78Å; L200-L252 HydrophobicContact CD2-CG 4.45Å; L220-L252 HydrophobicContact CD1-CB 3.82Å; L220-L252 HydrophobicContact CD2-CD1 4.24Å; D248-L252 PolarHBondContact O-N 3.14Å; I249-L252 PolarHBondContact O-N 3.15Å; L252-K254 VanDerWaalsContact C-N 3.32Å; L252-K254 PolarHBondContact O-N 2.86Å; L252-Y255 PolarHBondContact O-N 3.16Å
253L92.5Very high82.5Confident25 Ų2564.7 Ų64.713%0.13131%0.306CS..Hα-helixtrans-58.6-41.6175.4-75.3171.1000112.1L220 I224 I249 K251 Y255 L256L220-L253 HydrophobicContact CB-CD2 3.78Å; L220-L253 HydrophobicContact CB-CG 4.1Å; L220-L253 HydrophobicContact CD1-CD2 3.94Å; L220-L253 HydrophobicContact CD1-CG 4.11Å; I224-L253 HydrophobicContact CD1-CD1 3.85Å; I249-L253 HydrophobicContact CG2-CD1 4.26Å; I249-L253 HydrophobicContact CG2-CG 4.47Å; I249-L253 PolarHBondContact O-N 3.05Å; K251-L253 VanDerWaalsContact C-N 3.33Å; K251-L253 PolarHBondContact O-N 3.44Å; L253-Y255 PolarHBondContact O-N 2.88Å; L253-L256 HydrophobicContact CD2-CD1 4.4Å; L253-L256 WeakPolarHBondContact O-CB 3.46Å; L253-L256 PolarHBondContact O-N 3.3Å
254K89.7Confident81.2Confident151 Ų15162.2 Ų62.266%0.65731%0.305SS*.Hα-helixtrans-59.4-34.2177.5-70.8173.4-178.7-178.20113.3N250 K251 L252 L256 D257N250-K254 WeakPolarHBondContact O-CG 3.43Å; N250-K254 PolarHBondContact O-N 2.99Å; K251-K254 WeakPolarHBondContact O-CB 3.46Å; K251-K254 PolarHBondContact O-N 3.46Å; L252-K254 VanDerWaalsContact C-N 3.32Å; L252-K254 PolarHBondContact O-N 2.86Å; K254-L256 VanDerWaalsContact C-N 3.28Å; K254-L256 PolarHBondContact O-N 2.93Å; K254-D257 PolarHBondContact O-N 3.39Å
255Y89.1Confident79.7Confident26 Ų2664.4 Ų64.410%0.10232%0.322CS..Hα-helixtrans-72.1-23.4178.4-64.5-54.9000113A158 E161 I162 L200 K251 L252 L253 D257 L258A158-Y255 HydrophobicContact CB-CD1 3.87Å; A158-Y255 HydrophobicContact CB-CE1 4.18Å; E161-Y255 WeakPolarHBondContact CB-OH 3.4Å; E161-Y255 WeakPolarHBondContact OE2-CE1 3.49Å; E161-Y255 PolarHBondContact OE2-OH 2.87Å; I162-Y255 HydrophobicContact CD1-CD2 3.91Å; I162-Y255 HydrophobicContact CD1-CE2 4.22Å; I162-Y255 HydrophobicContact CD1-CG 4.4Å; I162-Y255 HydrophobicContact CG1-CD2 3.76Å; I162-Y255 HydrophobicContact CG1-CE2 3.57Å; L200-Y255 HydrophobicContact CD2-CD2 4.04Å; L200-Y255 HydrophobicContact CD2-CG 4.46Å; K251-Y255 WeakPolarHBondContact O-CD2 3.27Å; L252-Y255 PolarHBondContact O-N 3.16Å; L253-Y255 PolarHBondContact O-N 2.88Å; Y255-D257 PolarHBondContact O-N 3.48Å; Y255-L258 HydrophobicContact CD1-CD1 3.99Å; Y255-L258 WeakPolarHBondContact O-CB 3.25Å; Y255-L258 WeakPolarHBondContact O-CD1 3.49Å; Y255-L258 WeakPolarHBondContact O-CG 3.43Å; Y255-L258 PolarHBondContact O-N 2.85Å
256L86.6Confident78.5Confident16 Ų1673.4 Ų73.48%0.08436%0.361CS..Hα-helixtrans-71.2-20.9176-72173.8000112.9L200 L203 C213 L216 L220 L253 K254L200-L256 HydrophobicContact CD1-CD2 3.4Å; L200-L256 HydrophobicContact CD1-CG 3.78Å; L203-L256 HydrophobicContact CD1-CD2 4.36Å; C213-L256 HydrophobicContact CB-CD2 3.86Å; L216-L256 HydrophobicContact CB-CD1 4.12Å; L216-L256 HydrophobicContact CD2-CD1 4.21Å; L216-L256 HydrophobicContact CD2-CD2 4.1Å; L216-L256 HydrophobicContact CG-CD1 4.1Å; L220-L256 HydrophobicContact CD1-CD1 4.12Å; L253-L256 HydrophobicContact CD2-CD1 4.4Å; L253-L256 WeakPolarHBondContact O-CB 3.46Å; L253-L256 PolarHBondContact O-N 3.3Å; K254-L256 VanDerWaalsContact C-N 3.28Å; K254-L256 PolarHBondContact O-N 2.93Å
257D80.5Confident77.3Confident100 Ų10073 Ų7354%0.53536%0.361SS..THydrogen-bonded Turntrans-89.8-0.5179.8-60.6-33.7000113.1K254 Y255 E259 E260K254-D257 PolarHBondContact O-N 3.39Å; Y255-D257 PolarHBondContact O-N 3.48Å; D257-E259 VanDerWaalsContact C-N 3.25Å; D257-E259 PolarHBondContact O-N 3.2Å; D257-E259 VanDerWaalsContact O-N 3.17Å; D257-E260 PolarHBondContact O-N 3.37Å
258L73.8Confident76.6Confident32 Ų3268.3 Ų68.317%0.16834%0.339CS..Hα-helixtrans-60.7-27.6-174.9-75.9174.6000114.6T154 A158 L204 Y255 E260 E261 A262T154-L258 HydrophobicContact CG2-CD2 4.15Å; A158-L258 HydrophobicContact CB-CD1 3.54Å; L204-L258 HydrophobicContact CD2-CD1 4.03Å; Y255-L258 HydrophobicContact CD1-CD1 3.99Å; Y255-L258 WeakPolarHBondContact O-CB 3.25Å; Y255-L258 WeakPolarHBondContact O-CD1 3.49Å; Y255-L258 WeakPolarHBondContact O-CG 3.43Å; Y255-L258 PolarHBondContact O-N 2.85Å; L258-E260 VanDerWaalsContact C-N 3.29Å; L258-E260 PolarHBondContact O-N 3.45Å; L258-E261 PolarHBondContact O-N 3.41Å; L258-A262 PolarHBondContact O-N 3.41Å
259E63.6Low76.1Confident126 Ų12670 Ų7059%0.58935%0.347SS*.Hα-helixtrans-64.9-32.8-177.4-70.6-166.8160.200112.4D257D257-E259 VanDerWaalsContact C-N 3.25Å; D257-E259 PolarHBondContact O-N 3.2Å; D257-E259 VanDerWaalsContact O-N 3.17Å
260E58.9Low75.7Confident168 Ų16870.2 Ų70.279%0.78535%0.349SS*.Hα-helixtrans-74.5-30.4-178.9-64.9-168.8173.400112.5D257 L258D257-E260 PolarHBondContact O-N 3.37Å; L258-E260 VanDerWaalsContact C-N 3.29Å; L258-E260 PolarHBondContact O-N 3.45Å
261E56.1Low75.2Confident127 Ų12772.8 Ų72.859%0.59335%0.353SS*.Hα-helixtrans-79-33.5-177.6-64.6-170.9164.300113L258 D263 T264L258-E261 PolarHBondContact O-N 3.41Å; E261-D263 PolarHBondContact O-N 3.2Å; E261-T264 PolarHBondContact O-N 3.05Å; E261-T264 PolarHBondContact O-OG1 2.93Å
262A58.6Low74.9Confident4 Ų476.4 Ų76.43%0.03337%0.371CS..THydrogen-bonded Turntrans-66.7-20.3-171.100000114.4L258L258-A262 PolarHBondContact O-N 3.41Å
263D61Low74.9Confident106 Ų10677.6 Ų77.657%0.56738%0.378SS*.THydrogen-bonded Turntrans-83.9-10.1179.5-95.7-31.4000113.9K147 E261K147-D263 WeakPolarHBondContact CE-OD1 3.47Å; K147-D263 IonicContact NZ-OD1 3.95Å; K147-D263 PolarHBondContact NZ-OD1 2.99Å; E261-D263 PolarHBondContact O-N 3.2Å
264T63.6Low74.9Confident74 Ų7482.4 Ų82.445%0.45440%0.399SS..SBendtrans-74.3132.3-179.267.10000111.6E261 K266 A267E261-T264 PolarHBondContact O-N 3.05Å; E261-T264 PolarHBondContact O-OG1 2.93Å; T264-K266 PolarHBondContact O-N 2.98Å; T264-K266 VanDerWaalsContact O-N 3.13Å; T264-A267 VanDerWaalsContact O-CB 3.29Å; T264-A267 WeakPolarHBondContact O-CB 3.46Å; T264-A267 PolarHBondContact O-N 3.49Å; T264-A267 WeakPolarHBondContact OG1-CB 3.33Å
265T60.2Low75.1Confident95 Ų9575.3 Ų75.358%0.58337%0.369SS*.Hα-helixtrans-57.3-31.7-179.4-48.40000113.4A267 F268 D269T265-A267 PolarHBondContact O-N 3.27Å; T265-F268 VanDerWaalsContact CA-CE1 3.48Å; T265-F268 HydrophobicContact CG2-CE2 4.15Å; T265-F268 HydrophobicContact CG2-CZ 3.82Å; T265-D269 WeakPolarHBondContact O-CB 3.34Å; T265-D269 PolarHBondContact O-N 2.88Å; T265-D269 VanDerWaalsContact O-N 3.09Å
266K65.1Low75.4Confident194 Ų19474.1 Ų74.184%0.84336%0.364SS*.Hα-helixtrans-67.5-22.4179.1-63.3-176.6-179.1178.60113.1T264T264-K266 PolarHBondContact O-N 2.98Å; T264-K266 VanDerWaalsContact O-N 3.13Å
267A69Low75.8Confident18 Ų1877.2 Ų77.215%0.14938%0.38CS..Hα-helixtrans-76.3-41.6-175.600000111.7Y150 T264 T265Y150-A267 HydrophobicContact CD1-CB 4.4Å; Y150-A267 HydrophobicContact CE1-CB 3.49Å; Y150-A267 VanDerWaalsContact CE1-CB 3.49Å; Y150-A267 WeakPolarHBondContact CE2-O 3.33Å; Y150-A267 WeakPolarHBondContact OH-CB 3.38Å; T264-A267 VanDerWaalsContact O-CB 3.29Å; T264-A267 WeakPolarHBondContact O-CB 3.46Å; T264-A267 PolarHBondContact O-N 3.49Å; T264-A267 WeakPolarHBondContact OG1-CB 3.33Å; T265-A267 PolarHBondContact O-N 3.27Å
268F76.7Confident76.6Confident12 Ų1276.4 Ų76.45%0.05337%0.372CS..Hα-helixtrans-97.6-19.5-179.664.5-101.9000114.5I143 K147 Y150 T265 L270I143-F268 HydrophobicContact CG2-CE2 3.81Å; I143-F268 HydrophobicContact CG2-CZ 4.23Å; K147-F268 HydrophobicContact CB-CD1 4.16Å; K147-F268 HydrophobicContact CB-CD2 4.26Å; K147-F268 HydrophobicContact CB-CE1 4.25Å; K147-F268 HydrophobicContact CB-CE2 4.41Å; K147-F268 HydrophobicContact CB-CG 4.14Å; K147-F268 HydrophobicContact CB-CZ 4.38Å; K147-F268 HydrophobicContact CD-CD1 4.36Å; K147-F268 HydrophobicContact CD-CE1 3.9Å; K147-F268 HydrophobicContact CD-CZ 4.35Å; K147-F268 HydrophobicContact CG-CD1 3.91Å; K147-F268 HydrophobicContact CG-CE1 3.94Å; K147-F268 HydrophobicContact CG-CG 4.37Å; K147-F268 HydrophobicContact CG-CZ 4.48Å; Y150-F268 HydrophobicContact CD1-CB 3.73Å; Y150-F268 HydrophobicContact CD2-CB 4.32Å; Y150-F268 HydrophobicContact CG-CB 3.59Å; T265-F268 VanDerWaalsContact CA-CE1 3.48Å; T265-F268 HydrophobicContact CG2-CE2 4.15Å; T265-F268 HydrophobicContact CG2-CZ 3.82Å; F268-L270 PolarHBondContact O-N 3.48Å
269D81.6Confident77.7Confident44 Ų4475 Ų7524%0.23537%0.365CS..  trans-90.592.8175.5-167.919.5000111.5R146 T265 R271R146-D269 IonicContact CZ-OD1 2.81Å; R146-D269 IonicContact NH1-OD1 2.62Å; R146-D269 PolarHBondContact NH1-OD1 2.89Å; R146-D269 IonicContact NH2-OD1 3.73Å; T265-D269 WeakPolarHBondContact O-CB 3.34Å; T265-D269 PolarHBondContact O-N 2.88Å; T265-D269 VanDerWaalsContact O-N 3.09Å; D269-R271 PolarHBondContact O-N 3.2Å; D269-R271 WeakPolarHBondContact OD1-CD 3.43Å; D269-R271 VanDerWaalsContact OD1-CG 3.31Å; D269-R271 WeakPolarHBondContact OD1-CG 3.47Å; D269-R271 IonicContact OD1-NE 2.83Å
270L85.5Confident79.3Confident6 Ų672.3 Ų72.33%0.03135%0.352CS..G310 helixtrans-77.91-176-54.9174.5000114.1F268 Q272 N273 I276 C327 I328 Y447F268-L270 PolarHBondContact O-N 3.48Å; L270-Q272 PolarHBondContact O-N 3.4Å; L270-Q272 VanDerWaalsContact O-N 3.14Å; L270-N273 HydrophobicContact CB-CB 4.25Å; L270-N273 HydrophobicContact CD2-CB 4.33Å; L270-N273 VanDerWaalsContact O-CB 3.25Å; L270-N273 WeakPolarHBondContact O-CB 3.49Å; L270-N273 PolarHBondContact O-N 3.14Å; L270-I276 HydrophobicContact CB-CG1 3.89Å; L270-I276 WeakPolarHBondContact O-CB 3.45Å; L270-I276 WeakPolarHBondContact O-CG1 3.33Å; L270-C327 HydrophobicContact CD1-CB 3.8Å; L270-I328 HydrophobicContact CD1-CG1 4.34Å; L270-Y447 HydrophobicContact CB-CD2 3.76Å; L270-Y447 HydrophobicContact CB-CE2 4.3Å
271R83.7Confident81.1Confident123 Ų12371.3 Ų71.346%0.46435%0.345SS..G310 helixtrans-58.3-29-179.8-71.8177.2-178.2-1781.4114.1D269 Y447D269-R271 PolarHBondContact O-N 3.2Å; D269-R271 WeakPolarHBondContact OD1-CD 3.43Å; D269-R271 VanDerWaalsContact OD1-CG 3.31Å; D269-R271 WeakPolarHBondContact OD1-CG 3.47Å; D269-R271 IonicContact OD1-NE 2.83Å; R271-Y447 HydrophobicContact CG-CE2 4.03Å
272Q85.5Confident83.1Confident153 Ų15365.4 Ų65.472%0.71532%0.318SS*.G310 helixtrans-102.92.6177.9-61-59.9-41.300112.6L270 H274L270-Q272 PolarHBondContact O-N 3.4Å; L270-Q272 VanDerWaalsContact O-N 3.14Å; Q272-H274 PolarHBondContact O-N 2.72Å
273N90.7Very high84.9Confident30 Ų3065.9 Ų65.916%0.1632%0.32CS..  trans-67.5133.1177.6179-75.2000109.6L270 S275 I276 L277 E323L270-N273 HydrophobicContact CB-CB 4.25Å; L270-N273 HydrophobicContact CD2-CB 4.33Å; L270-N273 VanDerWaalsContact O-CB 3.25Å; L270-N273 WeakPolarHBondContact O-CB 3.49Å; L270-N273 PolarHBondContact O-N 3.14Å; N273-S275 VanDerWaalsContact C-N 3.29Å; N273-S275 PolarHBondContact O-N 2.89Å; N273-S275 WeakPolarHBondContact OD1-CA 3.4Å; N273-S275 VanDerWaalsContact OD1-CB 3.25Å; N273-S275 WeakPolarHBondContact OD1-CB 3.41Å; N273-S275 PolarHBondContact OD1-N 3.15Å; N273-I276 HydrophobicContact CB-CB 4.29Å; N273-I276 HydrophobicContact CB-CG1 4.1Å; N273-I276 PolarHBondContact O-N 3.43Å; N273-I276 VanDerWaalsContact O-N 3.17Å; N273-I276 PolarHBondContact OD1-N 3.46Å; N273-L277 WeakPolarHBondContact O-CG 3.43Å; N273-L277 PolarHBondContact O-N 2.95Å; N273-E323 PolarHBondContact ND2-OE1 3.39Å; N273-E323 PolarHBondContact ND2-OE2 3.41Å; N273-E323 VanDerWaalsContact ND2-OE2 3.14Å
274H93Very high86.7Confident125 Ų12566.8 Ų66.858%0.57932%0.319SS*.Hα-helixtrans-60.1-37.9-175.5-175.459.7000113Q272 L277 K278Q272-H274 PolarHBondContact O-N 2.72Å; H274-L277 PolarHBondContact O-N 2.83Å; H274-K278 VanDerWaalsContact NE2-CE 3.28Å; H274-K278 WeakPolarHBondContact NE2-CE 3.44Å; H274-K278 WeakPolarHBondContact O-CG 3.37Å; H274-K278 PolarHBondContact O-N 2.76Å
275S94.7Very high88.3Confident3 Ų366.7 Ų66.72%0.02131%0.31CS..Hα-helixtrans-67.2-41.5177.2-67.60000111.8N273 K278 I279 S321N273-S275 VanDerWaalsContact C-N 3.29Å; N273-S275 PolarHBondContact O-N 2.89Å; N273-S275 WeakPolarHBondContact OD1-CA 3.4Å; N273-S275 VanDerWaalsContact OD1-CB 3.25Å; N273-S275 WeakPolarHBondContact OD1-CB 3.41Å; N273-S275 PolarHBondContact OD1-N 3.15Å; S275-K278 PolarHBondContact O-N 2.76Å; S275-I279 VanDerWaalsContact O-CG1 3.31Å; S275-I279 WeakPolarHBondContact O-CG1 3.19Å; S275-I279 PolarHBondContact O-N 3.09Å; S275-S321 VanDerWaalsContact CB-O 3.3Å; S275-S321 WeakPolarHBondContact CB-O 3.37Å; S275-S321 PolarHBondContact OG-O 3.13Å
276I94.5Very high90.1Very high1 Ų162.2 Ų62.21%0.00528%0.282CS..Hα-helixtrans-63.1-45.2173.6-64.4-55.5000111L270 N273 K278 I279 E280 I328 A331 Y447L270-I276 HydrophobicContact CB-CG1 3.89Å; L270-I276 WeakPolarHBondContact O-CB 3.45Å; L270-I276 WeakPolarHBondContact O-CG1 3.33Å; N273-I276 HydrophobicContact CB-CB 4.29Å; N273-I276 HydrophobicContact CB-CG1 4.1Å; N273-I276 PolarHBondContact O-N 3.43Å; N273-I276 VanDerWaalsContact O-N 3.17Å; N273-I276 PolarHBondContact OD1-N 3.46Å; I276-K278 VanDerWaalsContact C-N 3.28Å; I276-K278 PolarHBondContact O-N 2.65Å; I276-I279 HydrophobicContact CD1-CD1 4.27Å; I276-I279 WeakPolarHBondContact O-CB 3.41Å; I276-I279 PolarHBondContact O-N 3.27Å; I276-I279 VanDerWaalsContact O-N 3.09Å; I276-E280 HydrophobicContact CG2-CG 4.29Å; I276-E280 WeakPolarHBondContact O-CG 3.47Å; I276-E280 PolarHBondContact O-N 3.23Å; I276-I328 HydrophobicContact CD1-CG1 4.13Å; I276-I328 HydrophobicContact CG1-CG1 4.41Å; I276-A331 HydrophobicContact CD1-CB 3.86Å; I276-Y447 HydrophobicContact CD1-CD1 4.18Å; I276-Y447 HydrophobicContact CD1-CG 4.2Å; I276-Y447 HydrophobicContact CG2-CD1 4.31Å; I276-Y447 HydrophobicContact CG2-CE1 3.71Å; I276-Y447 HydrophobicContact CG2-CE2 3.91Å; I276-Y447 VanDerWaalsContact CG2-CZ 3.47Å
277L95.4Very high91.6Very high81 Ų8157.6 Ų57.642%0.42426%0.26SS..Hα-helixtrans-60-37.5177.6-68.7174.8000112.6N273 H274 K281N273-L277 WeakPolarHBondContact O-CG 3.43Å; N273-L277 PolarHBondContact O-N 2.95Å; H274-L277 PolarHBondContact O-N 2.83Å; L277-K281 WeakPolarHBondContact O-CB 3.38Å; L277-K281 PolarHBondContact O-N 2.95Å
278K96.7Very high93Very high83 Ų8360.1 Ų60.136%0.36127%0.268SS..Hα-helixtrans-63.8-46.4172.4-76.1-178.5177.2-1740111.9H274 S275 I276 E280 K281 V282 V320H274-K278 VanDerWaalsContact NE2-CE 3.28Å; H274-K278 WeakPolarHBondContact NE2-CE 3.44Å; H274-K278 WeakPolarHBondContact O-CG 3.37Å; H274-K278 PolarHBondContact O-N 2.76Å; S275-K278 PolarHBondContact O-N 2.76Å; I276-K278 VanDerWaalsContact C-N 3.28Å; I276-K278 PolarHBondContact O-N 2.65Å; K278-E280 VanDerWaalsContact C-N 3.35Å; K278-E280 PolarHBondContact O-N 2.96Å; K278-K281 WeakPolarHBondContact O-CB 3.31Å; K278-K281 PolarHBondContact O-N 3.45Å; K278-V282 PolarHBondContact O-N 2.92Å; K278-V320 HydrophobicContact CB-CG2 4.26Å
279I97.3Very high93.9Very high3 Ų359.6 Ų59.62%0.01527%0.266CS..Hα-helixtrans-59.1-47.3177.6-68.3162.4000110.3S275 I276 K281 V282 L283 L317 V320 I328 A331 R332 A335S275-I279 VanDerWaalsContact O-CG1 3.31Å; S275-I279 WeakPolarHBondContact O-CG1 3.19Å; S275-I279 PolarHBondContact O-N 3.09Å; I276-I279 HydrophobicContact CD1-CD1 4.27Å; I276-I279 WeakPolarHBondContact O-CB 3.41Å; I276-I279 PolarHBondContact O-N 3.27Å; I276-I279 VanDerWaalsContact O-N 3.09Å; I279-K281 VanDerWaalsContact C-N 3.3Å; I279-K281 PolarHBondContact O-N 3.37Å; I279-V282 WeakPolarHBondContact O-CB 3.38Å; I279-V282 PolarHBondContact O-N 3.49Å; I279-V282 VanDerWaalsContact O-N 3.12Å; I279-L283 HydrophobicContact CG2-CD1 4.07Å; I279-L283 HydrophobicContact CG2-CG 4.38Å; I279-L283 WeakPolarHBondContact O-CG 3.3Å; I279-L283 PolarHBondContact O-N 2.72Å; I279-L317 HydrophobicContact CG1-CD2 4.1Å; I279-L317 HydrophobicContact CG2-CD2 4.48Å; I279-V320 HydrophobicContact CD1-CG1 4.08Å; I279-V320 HydrophobicContact CG1-CG1 4.16Å; I279-V320 HydrophobicContact CG1-CG2 4.11Å; I279-I328 HydrophobicContact CD1-CG2 4.48Å; I279-A331 HydrophobicContact CD1-CB 4.01Å; I279-R332 HydrophobicContact CD1-CB 4.06Å; I279-A335 HydrophobicContact CG2-CB 3.69Å
280E96.7Very high94.5Very high68 Ų6858.7 Ų58.732%0.31826%0.26SS..Hα-helixtrans-62.2-36.7178.8-71.3-61.6164.300112.8I276 K278 L283 K284I276-E280 HydrophobicContact CG2-CG 4.29Å; I276-E280 WeakPolarHBondContact O-CG 3.47Å; I276-E280 PolarHBondContact O-N 3.23Å; K278-E280 VanDerWaalsContact C-N 3.35Å; K278-E280 PolarHBondContact O-N 2.96Å; E280-L283 PolarHBondContact O-N 2.87Å; E280-K284 WeakPolarHBondContact O-CB 3.32Å; E280-K284 PolarHBondContact O-N 3.31Å
281K97.6Very high95Very high147 Ų14762.1 Ų62.164%0.63928%0.278SS*.Hα-helixtrans-63.2-43.6173.8-175-176.2176.9-172.40111.5L277 K278 I279 K284 R285L277-K281 WeakPolarHBondContact O-CB 3.38Å; L277-K281 PolarHBondContact O-N 2.95Å; K278-K281 WeakPolarHBondContact O-CB 3.31Å; K278-K281 PolarHBondContact O-N 3.45Å; I279-K281 VanDerWaalsContact C-N 3.3Å; I279-K281 PolarHBondContact O-N 3.37Å; K281-K284 PolarHBondContact O-N 3.45Å; K281-R285 PolarHBondContact O-N 3.26Å; K281-R285 VanDerWaalsContact O-N 3.08Å
282V98.2Very high95.5Very high4 Ų460.7 Ų60.72%0.02428%0.277CS..Hα-helixtrans-62.6-48.3175.9169.50000110.7K278 I279 K284 R285 M286 L313 Q316 L317 V339K278-V282 PolarHBondContact O-N 2.92Å; I279-V282 WeakPolarHBondContact O-CB 3.38Å; I279-V282 PolarHBondContact O-N 3.49Å; I279-V282 VanDerWaalsContact O-N 3.12Å; V282-K284 VanDerWaalsContact C-N 3.29Å; V282-K284 PolarHBondContact O-N 2.9Å; V282-R285 PolarHBondContact O-N 2.88Å; V282-R285 VanDerWaalsContact O-N 3.16Å; V282-M286 WeakPolarHBondContact O-CB 3.37Å; V282-M286 PolarHBondContact O-N 3.09Å; V282-L313 HydrophobicContact CG1-CB 3.87Å; V282-L313 HydrophobicContact CG1-CD1 4.3Å; V282-L313 HydrophobicContact CG1-CD2 4.21Å; V282-L313 HydrophobicContact CG1-CG 4.35Å; V282-L313 HydrophobicContact CG2-CD2 4.48Å; V282-Q316 HydrophobicContact CG2-CB 4.01Å; V282-L317 HydrophobicContact CB-CD2 4.08Å; V282-L317 HydrophobicContact CB-CG 4.37Å; V282-L317 HydrophobicContact CG1-CD1 3.9Å; V282-L317 HydrophobicContact CG1-CD2 4.01Å; V282-L317 HydrophobicContact CG1-CG 3.85Å; V282-L317 HydrophobicContact CG2-CD2 4.21Å; V282-L317 HydrophobicContact CG2-CG 4.34Å; V282-V339 HydrophobicContact CG1-CG2 4.33Å
283L97.2Very high95.8Very high14 Ų1453.8 Ų53.87%0.07325%0.245CC..Hα-helixtrans-60.3-39.4178-72.9177.1000112.1I279 E280 M286 R287 A335 E338I279-L283 HydrophobicContact CG2-CD1 4.07Å; I279-L283 HydrophobicContact CG2-CG 4.38Å; I279-L283 WeakPolarHBondContact O-CG 3.3Å; I279-L283 PolarHBondContact O-N 2.72Å; E280-L283 PolarHBondContact O-N 2.87Å; L283-M286 PolarHBondContact O-N 3.49Å; L283-R287 WeakPolarHBondContact O-CG 3.25Å; L283-R287 PolarHBondContact O-N 3.09Å; L283-A335 HydrophobicContact CD1-CB 4.35Å; L283-A335 HydrophobicContact CD2-CB 3.81Å; L283-A335 HydrophobicContact CG-CB 4.05Å; L283-E338 HydrophobicContact CD2-CB 4.26Å; L283-E338 HydrophobicContact CD2-CG 4.42Å
284K97.9Very high95.8Very high125 Ų12555.1 Ų55.154%0.54325%0.252SS..Hα-helixtrans-59.4-50173.9-176.6-176.5174.3-175.30111.2E280 K281 V282 M286 R287 E288E280-K284 WeakPolarHBondContact O-CB 3.32Å; E280-K284 PolarHBondContact O-N 3.31Å; K281-K284 PolarHBondContact O-N 3.45Å; V282-K284 VanDerWaalsContact C-N 3.29Å; V282-K284 PolarHBondContact O-N 2.9Å; K284-M286 VanDerWaalsContact C-N 3.34Å; K284-M286 PolarHBondContact O-N 3.12Å; K284-R287 WeakPolarHBondContact O-CB 3.45Å; K284-R287 PolarHBondContact O-N 3.06Å; K284-E288 WeakPolarHBondContact CE-OE1 3.36Å; K284-E288 PolarHBondContact O-N 3.36Å; K284-E288 VanDerWaalsContact O-N 3.15Å
285R98.1Very high95.6Very high72 Ų7256.7 Ų56.727%0.27226%0.259SS..Hα-helixtrans-64.9-39.7-179.8-175.356.3-176.3144.914.4112K281 V282 R287 E288 I289 E292 E309 L313K281-R285 PolarHBondContact O-N 3.26Å; K281-R285 VanDerWaalsContact O-N 3.08Å; V282-R285 PolarHBondContact O-N 2.88Å; V282-R285 VanDerWaalsContact O-N 3.16Å; R285-R287 VanDerWaalsContact C-N 3.31Å; R285-R287 PolarHBondContact O-N 3.34Å; R285-E288 WeakPolarHBondContact CD-OE2 3.28Å; R285-E288 IonicContact CZ-OE2 2.76Å; R285-E288 IonicContact NE-OE2 3.83Å; R285-E288 IonicContact NH1-OE2 2.95Å; R285-E288 PolarHBondContact NH1-OE2 2.94Å; R285-E288 WeakPolarHBondContact O-CB 3.42Å; R285-E288 PolarHBondContact O-N 3.45Å; R285-I289 HydrophobicContact CG-CD1 4.32Å; R285-I289 WeakPolarHBondContact O-CG1 3.35Å; R285-I289 PolarHBondContact O-N 2.67Å; R285-I289 VanDerWaalsContact O-N 3.08Å; R285-E292 IonicContact NH1-OE1 3.76Å; R285-E309 IonicContact CZ-OE1 3.69Å; R285-E309 IonicContact CZ-OE2 3.74Å; R285-E309 IonicContact NE-OE1 2.97Å; R285-E309 PolarHBondContact NE-OE1 3.35Å; R285-E309 VanDerWaalsContact NH2-CD 3.32Å; R285-E309 IonicContact NH2-OE1 2.68Å; R285-E309 PolarHBondContact NH2-OE1 3.04Å; R285-E309 IonicContact NH2-OE2 2.83Å; R285-E309 PolarHBondContact NH2-OE2 2.98Å; R285-L313 HydrophobicContact CB-CD1 4.31Å; R285-L313 HydrophobicContact CB-CD2 4.31Å; R285-L313 HydrophobicContact CG-CD1 4.25Å; R285-L313 HydrophobicContact CG-CD2 4.22Å
286M97.5Very high95.2Very high1 Ų158 Ų581%0.00527%0.27CS..Hα-helixtrans-58.5-43.5173.8177.9-79.8-136.900111.7V282 L283 K284 E288 I289 K290 L310 L313 E338 V339 L342V282-M286 WeakPolarHBondContact O-CB 3.37Å; V282-M286 PolarHBondContact O-N 3.09Å; L283-M286 PolarHBondContact O-N 3.49Å; K284-M286 VanDerWaalsContact C-N 3.34Å; K284-M286 PolarHBondContact O-N 3.12Å; M286-E288 VanDerWaalsContact C-N 3.3Å; M286-E288 PolarHBondContact O-N 2.9Å; M286-I289 PolarHBondContact O-N 3.12Å; M286-K290 WeakPolarHBondContact O-CB 3.29Å; M286-K290 PolarHBondContact O-N 3.38Å; M286-K290 HydrophobicContact SD-CB 4.44Å; M286-L310 HydrophobicContact CG-CD2 4.06Å; M286-L313 HydrophobicContact CB-CD1 4Å; M286-E338 HydrophobicContact CE-CB 3.53Å; M286-E338 WeakPolarHBondContact CE-O 3.49Å; M286-V339 HydrophobicContact CB-CG2 4.23Å; M286-V339 HydrophobicContact CG-CG2 4Å; M286-L342 HydrophobicContact CG-CD2 4.13Å; M286-L342 HydrophobicContact SD-CD2 4.21Å
287R96.9Very high94.5Very high96 Ų9667.8 Ų67.836%0.36232%0.316SS..Hα-helixtrans-61.8-37.5176.9-75.1-176.5-68.7-100.34.6112.4L283 K284 R285 K290 N291L283-R287 WeakPolarHBondContact O-CG 3.25Å; L283-R287 PolarHBondContact O-N 3.09Å; K284-R287 WeakPolarHBondContact O-CB 3.45Å; K284-R287 PolarHBondContact O-N 3.06Å; R285-R287 VanDerWaalsContact C-N 3.31Å; R285-R287 PolarHBondContact O-N 3.34Å; R287-K290 PolarHBondContact O-N 3.45Å; R287-N291 WeakPolarHBondContact O-CB 3.11Å; R287-N291 PolarHBondContact O-N 3.37Å; R287-N291 PolarHBondContact O-ND2 3.49Å; R287-N291 PolarHBondContact O-OD1 3.44Å
288E96.9Very high94Very high71 Ų7167.6 Ų67.633%0.33232%0.316SS..Hα-helixtrans-61.5-51.9174-66.7165.9-172.500110.8K284 R285 M286 K290 N291 E292K284-E288 WeakPolarHBondContact CE-OE1 3.36Å; K284-E288 PolarHBondContact O-N 3.36Å; K284-E288 VanDerWaalsContact O-N 3.15Å; R285-E288 WeakPolarHBondContact CD-OE2 3.28Å; R285-E288 IonicContact CZ-OE2 2.76Å; R285-E288 IonicContact NE-OE2 3.83Å; R285-E288 IonicContact NH1-OE2 2.95Å; R285-E288 PolarHBondContact NH1-OE2 2.94Å; R285-E288 WeakPolarHBondContact O-CB 3.42Å; R285-E288 PolarHBondContact O-N 3.45Å; M286-E288 VanDerWaalsContact C-N 3.3Å; M286-E288 PolarHBondContact O-N 2.9Å; E288-K290 VanDerWaalsContact C-N 3.31Å; E288-K290 PolarHBondContact O-N 2.88Å; E288-N291 PolarHBondContact O-N 3.13Å; E288-N291 VanDerWaalsContact O-N 3.11Å; E288-E292 WeakPolarHBondContact O-CG 3.25Å; E288-E292 PolarHBondContact O-N 3.24Å
289I96.1Very high93.2Very high1 Ų165.4 Ų65.41%0.00531%0.309CS..Hα-helixtrans-58-43.9177.1-62.7166.1000111R285 M286 N291 E292 L293 E309 L310 L313 L342R285-I289 HydrophobicContact CG-CD1 4.32Å; R285-I289 WeakPolarHBondContact O-CG1 3.35Å; R285-I289 PolarHBondContact O-N 2.67Å; R285-I289 VanDerWaalsContact O-N 3.08Å; M286-I289 PolarHBondContact O-N 3.12Å; I289-N291 VanDerWaalsContact C-N 3.33Å; I289-N291 PolarHBondContact O-N 3.43Å; I289-E292 PolarHBondContact O-N 2.99Å; I289-L293 HydrophobicContact CG2-CD1 3.9Å; I289-L293 HydrophobicContact CG2-CG 4.42Å; I289-L293 WeakPolarHBondContact O-CB 3.49Å; I289-L293 WeakPolarHBondContact O-CG 3.37Å; I289-L293 PolarHBondContact O-N 3.21Å; I289-E309 HydrophobicContact CD1-CB 4.15Å; I289-E309 HydrophobicContact CD1-CG 3.7Å; I289-L310 HydrophobicContact CD1-CD2 4.03Å; I289-L310 HydrophobicContact CD1-CG 4.3Å; I289-L310 HydrophobicContact CG2-CD1 4.32Å; I289-L310 HydrophobicContact CG2-CD2 4.34Å; I289-L310 HydrophobicContact CG2-CG 4.29Å; I289-L313 HydrophobicContact CD1-CD1 4.04Å; I289-L342 HydrophobicContact CG2-CD2 4.37Å
290K95.3Very high92.6Very high26 Ų2667.8 Ų67.811%0.11333%0.327CS..Hα-helixtrans-57.2-47.2176.6-173.1-173.570.9170.90111.3M286 R287 E288 L293 L294 L342 L384M286-K290 WeakPolarHBondContact O-CB 3.29Å; M286-K290 PolarHBondContact O-N 3.38Å; M286-K290 HydrophobicContact SD-CB 4.44Å; R287-K290 PolarHBondContact O-N 3.45Å; E288-K290 VanDerWaalsContact C-N 3.31Å; E288-K290 PolarHBondContact O-N 2.88Å; K290-L293 PolarHBondContact O-N 2.91Å; K290-L294 HydrophobicContact CG-CD1 3.99Å; K290-L294 WeakPolarHBondContact O-CB 3.46Å; K290-L294 VanDerWaalsContact O-CG 3.3Å; K290-L294 WeakPolarHBondContact O-CG 3.39Å; K290-L294 PolarHBondContact O-N 3.17Å; K290-L342 HydrophobicContact CB-CD1 4.45Å; K290-L342 HydrophobicContact CB-CD2 3.86Å; K290-L342 HydrophobicContact CG-CD1 4.2Å; K290-L342 HydrophobicContact CG-CD2 4.42Å; K290-L384 HydrophobicContact CD-CB 4.28Å; K290-L384 HydrophobicContact CD-CD2 4.43Å; K290-L384 PolarHBondContact NZ-O 3.5Å
291N94.7Very high92.2Very high77 Ų7771.7 Ų71.741%0.41235%0.345SS..Hα-helixtrans-67.3-41.5-178.7-68.6-15.8000111.4R287 E288 I289 L293 L294 Q295R287-N291 WeakPolarHBondContact O-CB 3.11Å; R287-N291 PolarHBondContact O-N 3.37Å; R287-N291 PolarHBondContact O-ND2 3.49Å; R287-N291 PolarHBondContact O-OD1 3.44Å; E288-N291 PolarHBondContact O-N 3.13Å; E288-N291 VanDerWaalsContact O-N 3.11Å; I289-N291 VanDerWaalsContact C-N 3.33Å; I289-N291 PolarHBondContact O-N 3.43Å; N291-L293 VanDerWaalsContact C-N 3.33Å; N291-L293 PolarHBondContact O-N 3.41Å; N291-L294 PolarHBondContact O-N 3.36Å; N291-Q295 WeakPolarHBondContact O-CB 3.31Å; N291-Q295 WeakPolarHBondContact O-CG 3.3Å; N291-Q295 PolarHBondContact O-N 3.04Å
292E94Very high91.8Very high94 Ų9467.5 Ų67.544%0.43933%0.329SS..Hα-helixtrans-57.6-45.9173.9-71169.9-160.500111.1R285 E288 I289 A296R285-E292 IonicContact NH1-OE1 3.76Å; E288-E292 WeakPolarHBondContact O-CG 3.25Å; E288-E292 PolarHBondContact O-N 3.24Å; I289-E292 PolarHBondContact O-N 2.99Å; E292-A296 VanDerWaalsContact O-CB 3.29Å; E292-A296 WeakPolarHBondContact O-CB 3.48Å; E292-A296 PolarHBondContact O-N 3.42Å
293L93.1Very high91.6Very high7 Ų767.9 Ų67.94%0.03733%0.33CS..Hα-helixtrans-65.7-40.9178.5-75.4168.5000113.7I289 K290 N291 L302 Y303 L342 I346I289-L293 HydrophobicContact CG2-CD1 3.9Å; I289-L293 HydrophobicContact CG2-CG 4.42Å; I289-L293 WeakPolarHBondContact O-CB 3.49Å; I289-L293 WeakPolarHBondContact O-CG 3.37Å; I289-L293 PolarHBondContact O-N 3.21Å; K290-L293 PolarHBondContact O-N 2.91Å; N291-L293 VanDerWaalsContact C-N 3.33Å; N291-L293 PolarHBondContact O-N 3.41Å; L293-L302 HydrophobicContact CD2-CB 3.91Å; L293-Y303 HydrophobicContact CD2-CD1 4.07Å; L293-Y303 HydrophobicContact CD2-CE1 4.37Å; L293-L342 HydrophobicContact CD1-CD1 4.13Å; L293-L342 HydrophobicContact CD1-CD2 4.49Å; L293-L342 HydrophobicContact CD1-CG 4.41Å; L293-I346 HydrophobicContact CD1-CD1 3.66Å; L293-I346 HydrophobicContact CD1-CG1 3.96Å
294L89.3Confident91.4Very high59 Ų5973.3 Ų73.331%0.30936%0.358SS..Hα-helixtrans-76.7-24.3-177.6-68.3177.1000113K290 N291 Y345 S385K290-L294 HydrophobicContact CG-CD1 3.99Å; K290-L294 WeakPolarHBondContact O-CB 3.46Å; K290-L294 VanDerWaalsContact O-CG 3.3Å; K290-L294 WeakPolarHBondContact O-CG 3.39Å; K290-L294 PolarHBondContact O-N 3.17Å; N291-L294 PolarHBondContact O-N 3.36Å; L294-Y345 HydrophobicContact CD2-CE1 4.19Å; L294-S385 WeakPolarHBondContact CD1-OG 3.42Å
295Q89.7Confident91.2Very high158 Ų15870.5 Ų70.574%0.73836%0.355SS*.Hα-helixtrans-100-9.6-179.2-64.1178.81.100113.7N291N291-Q295 WeakPolarHBondContact O-CB 3.31Å; N291-Q295 WeakPolarHBondContact O-CG 3.3Å; N291-Q295 PolarHBondContact O-N 3.04Å
296A86.7Confident91.1Very high30 Ų3067.3 Ų67.325%0.24834%0.343CS..  trans-64137.1-179.500000112.5E292 P299 L302E292-A296 VanDerWaalsContact O-CB 3.29Å; E292-A296 WeakPolarHBondContact O-CB 3.48Å; E292-A296 PolarHBondContact O-N 3.42Å; A296-P299 HydrophobicContact CB-CB 4.26Å; A296-L302 HydrophobicContact CB-CD1 3.72Å
297Q80.1Confident91Very high206 Ų20669.6 Ų69.696%0.96335%0.353SS*.SBendtrans-71.3-35.5173.8-65.217813.600112
298N83.4Confident91Very high78 Ų7869 Ų6942%0.41736%0.36SS..SBendtrans-123.978.4172.2-166.310000110.5S300 E301N298-S300 PolarHBondContact O-N 3.43Å; N298-S300 VanDerWaalsContact O-N 3.11Å; N298-E301 PolarHBondContact ND2-OE1 3.29Å; N298-E301 PolarHBondContact O-N 2.95Å
299P81Confident91.1Very high36 Ų3668.9 Ų68.923%0.23436%0.36CS..G310 helixtrans-62-22.6-175.625.7-34.4000112.8A296 E301 L302 Y303A296-P299 HydrophobicContact CB-CB 4.26Å; P299-E301 VanDerWaalsContact C-N 3.28Å; P299-E301 PolarHBondContact O-N 3.48Å; P299-L302 PolarHBondContact O-N 2.88Å; P299-Y303 HydrophobicContact CB-CE1 3.85Å; P299-Y303 WeakPolarHBondContact O-CD1 3.42Å; P299-Y303 VanDerWaalsContact O-CE1 3.28Å; P299-Y303 WeakPolarHBondContact O-CE1 3.29Å; P299-Y303 PolarHBondContact O-N 3.05Å
300S84.2Confident91.2Very high54 Ų5468.8 Ų68.838%0.37836%0.359SS..G310 helixtrans-61.9-29.6-178.6-57.80000114.7N298 L302 Y303N298-S300 PolarHBondContact O-N 3.43Å; N298-S300 VanDerWaalsContact O-N 3.11Å; S300-L302 VanDerWaalsContact C-N 3.28Å; S300-Y303 VanDerWaalsContact CA-CE2 3.47Å
301E88.2Confident91.3Very high150 Ų15072.5 Ų72.570%0.70138%0.377SS*.G310 helixtrans-73-24176.4-70.7173.4-161.800112.4N298 P299N298-E301 PolarHBondContact ND2-OE1 3.29Å; N298-E301 PolarHBondContact O-N 2.95Å; P299-E301 VanDerWaalsContact C-N 3.28Å; P299-E301 PolarHBondContact O-N 3.48Å
302L90.3Very high91.5Very high58 Ų5870.7 Ų70.730%0.30438%0.376SS..THydrogen-bonded Turntrans-92.1-13.5-176.4-60.5-179.7000113.4L293 A296 P299 S300 L304 S305 S306L293-L302 HydrophobicContact CD2-CB 3.91Å; A296-L302 HydrophobicContact CB-CD1 3.72Å; P299-L302 PolarHBondContact O-N 2.88Å; S300-L302 VanDerWaalsContact C-N 3.28Å; L302-L304 PolarHBondContact O-N 2.76Å; L302-S305 PolarHBondContact O-N 3.07Å; L302-S305 PolarHBondContact O-OG 3.14Å; L302-S305 VanDerWaalsContact O-OG 3.04Å; L302-S306 WeakPolarHBondContact O-CB 3.3Å; L302-S306 PolarHBondContact O-N 2.92Å; L302-S306 PolarHBondContact O-OG 3.17Å
303Y92.5Very high91.7Very high13 Ų1366.5 Ų66.55%0.05136%0.357CS..Hα-helixtrans-58.8-48.3-173.2-67.5-23.8000113L293 P299 S300 K307 I346 K349 E350L293-Y303 HydrophobicContact CD2-CD1 4.07Å; L293-Y303 HydrophobicContact CD2-CE1 4.37Å; P299-Y303 HydrophobicContact CB-CE1 3.85Å; P299-Y303 WeakPolarHBondContact O-CD1 3.42Å; P299-Y303 VanDerWaalsContact O-CE1 3.28Å; P299-Y303 WeakPolarHBondContact O-CE1 3.29Å; P299-Y303 PolarHBondContact O-N 3.05Å; S300-Y303 VanDerWaalsContact CA-CE2 3.47Å; Y303-K307 WeakPolarHBondContact O-CB 3.44Å; Y303-K307 PolarHBondContact O-N 2.9Å; Y303-I346 HydrophobicContact CD1-CG1 4.44Å; Y303-I346 HydrophobicContact CD1-CG2 3.8Å; Y303-I346 HydrophobicContact CG-CG2 3.79Å; Y303-K349 HydrophobicContact CE1-CB 4.26Å; Y303-K349 HydrophobicContact CE2-CB 4Å; Y303-K349 WeakPolarHBondContact OH-CB 3.3Å; Y303-E350 WeakPolarHBondContact CB-OE1 3.41Å; Y303-E350 HydrophobicContact CD2-CG 3.48Å; Y303-E350 VanDerWaalsContact CD2-CG 3.48Å; Y303-E350 HydrophobicContact CE2-CG 4.23Å; Y303-E350 HydrophobicContact CG-CG 4.06Å
304L93.5Very high91.9Very high127 Ų12767.5 Ų67.567%0.66536%0.362SS*.Hα-helixtrans-65.3-46.1-177.6-178.962.1000112.3L302 T308L302-L304 PolarHBondContact O-N 2.76Å; L304-T308 WeakPolarHBondContact O-CB 3.42Å; L304-T308 PolarHBondContact O-N 3.34Å; L304-T308 VanDerWaalsContact O-N 3.07Å; L304-T308 PolarHBondContact O-OG1 3.46Å
305S94.6Very high92.3Very high66 Ų6666.1 Ų66.146%0.46236%0.362SS..Hα-helixtrans-66.6-47.1179.353.40000111.3L302 K307 T308 E309L302-S305 PolarHBondContact O-N 3.07Å; L302-S305 PolarHBondContact O-OG 3.14Å; L302-S305 VanDerWaalsContact O-OG 3.04Å; S305-K307 PolarHBondContact O-N 2.92Å; S305-T308 PolarHBondContact O-N 2.68Å; S305-E309 PolarHBondContact O-N 3.46Å
306S95.5Very high92.7Very high5 Ų562.9 Ų62.94%0.03535%0.347CS..Hα-helixtrans-61.8-43.6178.6-57.50000111.5L302 E309 L310L302-S306 WeakPolarHBondContact O-CB 3.3Å; L302-S306 PolarHBondContact O-N 2.92Å; L302-S306 PolarHBondContact O-OG 3.17Å; S306-E309 PolarHBondContact O-N 2.96Å; S306-L310 WeakPolarHBondContact O-CB 3.26Å; S306-L310 WeakPolarHBondContact O-CD1 3.45Å; S306-L310 WeakPolarHBondContact O-CG 3.48Å; S306-L310 PolarHBondContact O-N 3.27Å
307K96Very high93.3Very high50 Ų5061.4 Ų61.422%0.21734%0.335CS..Hα-helixtrans-63-43.8177.6-178.2174.8179.2174.40111.9Y303 S305 E309 L310 Q311 I343 D347Y303-K307 WeakPolarHBondContact O-CB 3.44Å; Y303-K307 PolarHBondContact O-N 2.9Å; S305-K307 PolarHBondContact O-N 2.92Å; K307-E309 VanDerWaalsContact C-N 3.31Å; K307-E309 PolarHBondContact O-N 3.17Å; K307-L310 PolarHBondContact O-N 3.42Å; K307-Q311 VanDerWaalsContact O-CG 3.31Å; K307-Q311 WeakPolarHBondContact O-CG 3.42Å; K307-Q311 PolarHBondContact O-N 3.23Å; K307-I343 HydrophobicContact CG-CG2 4.4Å; K307-D347 WeakPolarHBondContact CE-OD1 3.4Å; K307-D347 IonicContact NZ-OD1 2.98Å; K307-D347 PolarHBondContact NZ-OD1 3.47Å; K307-D347 IonicContact NZ-OD2 2.67Å
308T97.2Very high94.1Very high82 Ų8256.6 Ų56.650%0.50332%0.316SS..Hα-helixtrans-61.5-43.2177-55.90000110.6L304 S305 Q311 G312L304-T308 WeakPolarHBondContact O-CB 3.42Å; L304-T308 PolarHBondContact O-N 3.34Å; L304-T308 VanDerWaalsContact O-N 3.07Å; L304-T308 PolarHBondContact O-OG1 3.46Å; S305-T308 PolarHBondContact O-N 2.68Å; T308-Q311 PolarHBondContact O-N 2.75Å; T308-G312 PolarHBondContact O-N 2.88Å
309E97.9Very high94.6Very high69 Ų6960.1 Ų60.132%0.32233%0.33SS..Hα-helixtrans-65.6-44.3177.2-170.6172.3-179.200112.1R285 I289 S305 S306 K307 Q311 G312 L313R285-E309 IonicContact CZ-OE1 3.69Å; R285-E309 IonicContact CZ-OE2 3.74Å; R285-E309 IonicContact NE-OE1 2.97Å; R285-E309 PolarHBondContact NE-OE1 3.35Å; R285-E309 VanDerWaalsContact NH2-CD 3.32Å; R285-E309 IonicContact NH2-OE1 2.68Å; R285-E309 PolarHBondContact NH2-OE1 3.04Å; R285-E309 IonicContact NH2-OE2 2.83Å; R285-E309 PolarHBondContact NH2-OE2 2.98Å; I289-E309 HydrophobicContact CD1-CB 4.15Å; I289-E309 HydrophobicContact CD1-CG 3.7Å; S305-E309 PolarHBondContact O-N 3.46Å; S306-E309 PolarHBondContact O-N 2.96Å; K307-E309 VanDerWaalsContact C-N 3.31Å; K307-E309 PolarHBondContact O-N 3.17Å; E309-Q311 VanDerWaalsContact C-N 3.32Å; E309-Q311 PolarHBondContact O-N 2.98Å; E309-G312 CarbonylContact O-C 3.59Å; E309-G312 WeakPolarHBondContact O-CA 3.46Å; E309-G312 PolarHBondContact O-N 3.42Å; E309-L313 PolarHBondContact O-N 3.42Å
310L98.1Very high95.3Very high0 Ų058.7 Ų58.70%032%0.32CS..Hα-helixtrans-62.3-37.8176.7-69.2165.2000112.1M286 I289 S306 K307 G312 L313 I314 V339 L342 I343 I346M286-L310 HydrophobicContact CG-CD2 4.06Å; I289-L310 HydrophobicContact CD1-CD2 4.03Å; I289-L310 HydrophobicContact CD1-CG 4.3Å; I289-L310 HydrophobicContact CG2-CD1 4.32Å; I289-L310 HydrophobicContact CG2-CD2 4.34Å; I289-L310 HydrophobicContact CG2-CG 4.29Å; S306-L310 WeakPolarHBondContact O-CB 3.26Å; S306-L310 WeakPolarHBondContact O-CD1 3.45Å; S306-L310 WeakPolarHBondContact O-CG 3.48Å; S306-L310 PolarHBondContact O-N 3.27Å; K307-L310 PolarHBondContact O-N 3.42Å; L310-G312 VanDerWaalsContact C-N 3.32Å; L310-L313 HydrophobicContact CD2-CD1 4.22Å; L310-L313 WeakPolarHBondContact O-CB 3.49Å; L310-L313 PolarHBondContact O-N 2.92Å; L310-L313 VanDerWaalsContact O-N 3.17Å; L310-I314 PolarHBondContact O-N 3.46Å; L310-V339 HydrophobicContact CB-CG1 4.01Å; L310-V339 HydrophobicContact CD2-CG1 3.96Å; L310-V339 WeakPolarHBondContact O-CG1 3.46Å; L310-L342 HydrophobicContact CD1-CB 4.25Å; L310-L342 HydrophobicContact CD1-CD2 3.83Å; L310-L342 HydrophobicContact CD1-CG 3.74Å; L310-L342 HydrophobicContact CD2-CD2 3.76Å; L310-L342 HydrophobicContact CD2-CG 4.42Å; L310-L342 HydrophobicContact CG-CD2 4.44Å; L310-I343 HydrophobicContact CB-CD1 3.87Å; L310-I343 HydrophobicContact CB-CG1 3.62Å; L310-I343 HydrophobicContact CD1-CG1 3.93Å; L310-I343 HydrophobicContact CG-CG1 4.39Å; L310-I346 HydrophobicContact CD1-CD1 3.6Å
311Q98.1Very high95.7Very high103 Ų10359.5 Ų59.548%0.48133%0.326SS..Hα-helixtrans-63-39.4171.4-74175-16.200111.6K307 T308 E309 L313 I314 G315 I343K307-Q311 VanDerWaalsContact O-CG 3.31Å; K307-Q311 WeakPolarHBondContact O-CG 3.42Å; K307-Q311 PolarHBondContact O-N 3.23Å; T308-Q311 PolarHBondContact O-N 2.75Å; E309-Q311 VanDerWaalsContact C-N 3.32Å; E309-Q311 PolarHBondContact O-N 2.98Å; Q311-L313 VanDerWaalsContact C-N 3.31Å; Q311-L313 PolarHBondContact O-N 3.12Å; Q311-I314 PolarHBondContact O-N 3.17Å; Q311-G315 PolarHBondContact O-N 2.94Å; Q311-I343 HydrophobicContact CG-CD1 4.2Å
312G98.2Very high95.6Very high39 Ų3954.2 Ų54.240%0.40230%0.302SS..Hα-helixtrans-62.6-35.2171.200000113.3T308 E309 L310 G315 Q316T308-G312 PolarHBondContact O-N 2.88Å; E309-G312 CarbonylContact O-C 3.59Å; E309-G312 WeakPolarHBondContact O-CA 3.46Å; E309-G312 PolarHBondContact O-N 3.42Å; L310-G312 VanDerWaalsContact C-N 3.32Å; G312-G315 PolarHBondContact O-N 3.41Å; G312-Q316 PolarHBondContact O-N 3.49Å
313L98.4Very high95.2Very high6 Ų655.6 Ų55.63%0.03131%0.308CS..Hα-helixtrans-67.2-37173.2-67.1-174.2000112.3V282 R285 M286 I289 E309 L310 Q311 Q316 L317 V339V282-L313 HydrophobicContact CG1-CB 3.87Å; V282-L313 HydrophobicContact CG1-CD1 4.3Å; V282-L313 HydrophobicContact CG1-CD2 4.21Å; V282-L313 HydrophobicContact CG1-CG 4.35Å; V282-L313 HydrophobicContact CG2-CD2 4.48Å; R285-L313 HydrophobicContact CB-CD1 4.31Å; R285-L313 HydrophobicContact CB-CD2 4.31Å; R285-L313 HydrophobicContact CG-CD1 4.25Å; R285-L313 HydrophobicContact CG-CD2 4.22Å; M286-L313 HydrophobicContact CB-CD1 4Å; I289-L313 HydrophobicContact CD1-CD1 4.04Å; E309-L313 PolarHBondContact O-N 3.42Å; L310-L313 HydrophobicContact CD2-CD1 4.22Å; L310-L313 WeakPolarHBondContact O-CB 3.49Å; L310-L313 PolarHBondContact O-N 2.92Å; L310-L313 VanDerWaalsContact O-N 3.17Å; Q311-L313 VanDerWaalsContact C-N 3.31Å; Q311-L313 PolarHBondContact O-N 3.12Å; L313-Q316 PolarHBondContact O-N 2.93Å; L313-L317 WeakPolarHBondContact O-CG 3.48Å; L313-L317 PolarHBondContact O-N 2.89Å; L313-V339 HydrophobicContact CB-CG1 4.41Å
314I98.1Very high94.6Very high29 Ų2961.6 Ų61.615%0.14933%0.334CS..Hα-helixtrans-61.2-45.9171.4-67176.5000110.1L310 Q311 Q316 L317 D318 V339 I343L310-I314 PolarHBondContact O-N 3.46Å; Q311-I314 PolarHBondContact O-N 3.17Å; I314-Q316 VanDerWaalsContact C-N 3.29Å; I314-Q316 PolarHBondContact O-N 3.26Å; I314-L317 WeakPolarHBondContact O-CA 3.17Å; I314-L317 WeakPolarHBondContact O-CB 3.34Å; I314-L317 PolarHBondContact O-N 3.27Å; I314-D318 PolarHBondContact O-N 3.09Å; I314-V339 HydrophobicContact CD1-CG1 4.11Å; I314-V339 HydrophobicContact CG1-CB 4.25Å; I314-V339 HydrophobicContact CG1-CG1 3.64Å; I314-I343 HydrophobicContact CD1-CD1 3.59Å
315G97.8Very high94.3Very high30 Ų3056.3 Ų56.331%0.30931%0.306SS..Hα-helixtrans-57.1-40.5175.200000113.1Q311 G312 L317 D318 E319Q311-G315 PolarHBondContact O-N 2.94Å; G312-G315 PolarHBondContact O-N 3.41Å; G315-L317 VanDerWaalsContact C-N 3.33Å; G315-L317 PolarHBondContact O-N 3.06Å; G315-D318 PolarHBondContact O-N 2.97Å; G315-E319 WeakPolarHBondContact O-CG 3.27Å; G315-E319 PolarHBondContact O-N 3.13Å
316Q97.9Very high94.2Very high89 Ų8953.5 Ų53.542%0.41629%0.287SS..Hα-helixtrans-64.3-35.8173.8-73.2176.557.500113V282 G312 L313 I314V282-Q316 HydrophobicContact CG2-CB 4.01Å; G312-Q316 PolarHBondContact O-N 3.49Å; L313-Q316 PolarHBondContact O-N 2.93Å; I314-Q316 VanDerWaalsContact C-N 3.29Å; I314-Q316 PolarHBondContact O-N 3.26Å
317L97.8Very high94.1Very high0 Ų053.5 Ų53.50%029%0.286CS..Hα-helixtrans-69.2-38.1175.3-70.4169.3000111.5I279 V282 L313 I314 G315 E319 V320 R332 A335 V336 V339I279-L317 HydrophobicContact CG1-CD2 4.1Å; I279-L317 HydrophobicContact CG2-CD2 4.48Å; V282-L317 HydrophobicContact CB-CD2 4.08Å; V282-L317 HydrophobicContact CB-CG 4.37Å; V282-L317 HydrophobicContact CG1-CD1 3.9Å; V282-L317 HydrophobicContact CG1-CD2 4.01Å; V282-L317 HydrophobicContact CG1-CG 3.85Å; V282-L317 HydrophobicContact CG2-CD2 4.21Å; V282-L317 HydrophobicContact CG2-CG 4.34Å; L313-L317 WeakPolarHBondContact O-CG 3.48Å; L313-L317 PolarHBondContact O-N 2.89Å; I314-L317 WeakPolarHBondContact O-CA 3.17Å; I314-L317 WeakPolarHBondContact O-CB 3.34Å; I314-L317 PolarHBondContact O-N 3.27Å; G315-L317 VanDerWaalsContact C-N 3.33Å; G315-L317 PolarHBondContact O-N 3.06Å; L317-E319 PolarHBondContact O-N 3.05Å; L317-V320 VanDerWaalsContact O-CB 3.26Å; L317-V320 WeakPolarHBondContact O-CB 3.44Å; L317-V320 WeakPolarHBondContact O-CG2 3.42Å; L317-V320 PolarHBondContact O-N 3.19Å; L317-R332 HydrophobicContact CB-CG 4.34Å; L317-R332 WeakPolarHBondContact O-CD 3.41Å; L317-A335 HydrophobicContact CD1-CB 3.98Å; L317-A335 HydrophobicContact CD2-CB 3.88Å; L317-V336 HydrophobicContact CB-CG2 3.92Å; L317-V336 HydrophobicContact CD1-CB 4.46Å; L317-V336 HydrophobicContact CD1-CG2 3.74Å; L317-V336 HydrophobicContact CG-CG2 4.43Å; L317-V339 HydrophobicContact CD1-CG2 4.19Å
318D96.7Very high93.9Very high105 Ų10551.1 Ų51.156%0.56128%0.276SS*.Hα-helixtrans-62.6-31.5177-69.8-26.6000112.1I314 G315 V320I314-D318 PolarHBondContact O-N 3.09Å; G315-D318 PolarHBondContact O-N 2.97Å; D318-V320 VanDerWaalsContact C-N 3.28Å; D318-V320 PolarHBondContact O-N 3.33Å
319E95.9Very high93.8Very high152 Ų15251.9 Ų51.971%0.7127%0.27SS*.THydrogen-bonded Turntrans-78.2-4.4174.4-67.8176.9-171.400114.4G315 L317 S321G315-E319 WeakPolarHBondContact O-CG 3.27Å; G315-E319 PolarHBondContact O-N 3.13Å; L317-E319 PolarHBondContact O-N 3.05Å; E319-S321 PolarHBondContact O-N 3Å
320V95.2Very high93.7Very high5 Ų549.1 Ų49.13%0.0326%0.257CS..SBendtrans-69.3121177.41760000109.5K278 I279 L317 D318 L322 I328K278-V320 HydrophobicContact CB-CG2 4.26Å; I279-V320 HydrophobicContact CD1-CG1 4.08Å; I279-V320 HydrophobicContact CG1-CG1 4.16Å; I279-V320 HydrophobicContact CG1-CG2 4.11Å; L317-V320 VanDerWaalsContact O-CB 3.26Å; L317-V320 WeakPolarHBondContact O-CB 3.44Å; L317-V320 WeakPolarHBondContact O-CG2 3.42Å; L317-V320 PolarHBondContact O-N 3.19Å; D318-V320 VanDerWaalsContact C-N 3.28Å; D318-V320 PolarHBondContact O-N 3.33Å; V320-L322 PolarHBondContact O-N 2.96Å; V320-L322 VanDerWaalsContact O-N 3.08Å; V320-I328 HydrophobicContact CG1-CG2 4.47Å
321S92.3Very high93.5Very high71 Ų7149.5 Ų49.550%0.49726%0.26SS..  trans-62.2112.7170.9179.50000109.1S275 E319 E323S275-S321 VanDerWaalsContact CB-O 3.3Å; S275-S321 WeakPolarHBondContact CB-O 3.37Å; S275-S321 PolarHBondContact OG-O 3.13Å; E319-S321 PolarHBondContact O-N 3Å; S321-E323 PolarHBondContact O-N 3.14Å; S321-E323 PolarHBondContact OG-N 3.05Å
322L86Confident93.4Very high39 Ų3947.6 Ų47.620%0.20425%0.248CC..  trans-66.1-19.5175.9-65.6-176.2000113V320 N325 R329 R332V320-L322 PolarHBondContact O-N 2.96Å; V320-L322 VanDerWaalsContact O-N 3.08Å; L322-N325 PolarHBondContact O-N 3.47Å; L322-R329 HydrophobicContact CD1-CB 4.45Å; L322-R329 HydrophobicContact CD1-CG 4.1Å; L322-R329 HydrophobicContact CD2-CB 4.11Å; L322-R329 HydrophobicContact CD2-CG 4.35Å; L322-R332 HydrophobicContact CD2-CB 4.22Å
323E81Confident93.3Very high88 Ų8851.8 Ų51.841%0.41125%0.252SS..THydrogen-bonded Turntrans51.8-163.7-164.7-55.2172.3-171.700109.7N273 S321 N325 I328N273-E323 PolarHBondContact ND2-OE1 3.39Å; N273-E323 PolarHBondContact ND2-OE2 3.41Å; N273-E323 VanDerWaalsContact ND2-OE2 3.14Å; S321-E323 PolarHBondContact O-N 3.14Å; S321-E323 PolarHBondContact OG-N 3.05Å; E323-N325 HydrophobicContact CB-CB 4.45Å; E323-N325 PolarHBondContact O-N 3.19Å; E323-I328 HydrophobicContact CB-CD1 4.26Å; E323-I328 HydrophobicContact CG-CD1 4.15Å; E323-I328 VanDerWaalsContact OE2-CD1 3.3Å; E323-I328 WeakPolarHBondContact OE2-CD1 3.41Å
324K79.7Confident93.2Very high139 Ų13952.7 Ų52.760%0.60426%0.255SS*.THydrogen-bonded Turntrans-92.132.1170-69.2164150.8-153.50110.7E161E161-K324 VanDerWaalsContact CD-CE 3.46Å; E161-K324 WeakPolarHBondContact OE1-CB 3.19Å; E161-K324 WeakPolarHBondContact OE1-CD 3.49Å; E161-K324 WeakPolarHBondContact OE1-CE 3.31Å; E161-K324 WeakPolarHBondContact OE1-CG 3.33Å; E161-K324 IonicContact OE1-NZ 2.63Å; E161-K324 PolarHBondContact OE1-NZ 3.25Å; E161-K324 VanDerWaalsContact OE1-NZ 3.09Å; E161-K324 WeakPolarHBondContact OE2-CE 3.33Å; E161-K324 IonicContact OE2-NZ 3.95Å; E161-K324 PolarHBondContact OE2-NZ 3.2Å
325N87.9Confident93.2Very high15 Ų1551.3 Ų51.38%0.0825%0.248CC..  trans-114.6108.3-172.9-168.5-34000111.2L322 E323 C327 I328 R329L322-N325 PolarHBondContact O-N 3.47Å; E323-N325 HydrophobicContact CB-CB 4.45Å; E323-N325 PolarHBondContact O-N 3.19Å; N325-C327 PolarHBondContact O-N 2.89Å; N325-C327 WeakPolarHBondContact OD1-CB 3.33Å; N325-C327 PolarHBondContact OD1-N 3.14Å; N325-I328 HydrophobicContact CB-CB 4.37Å; N325-I328 HydrophobicContact CB-CD1 3.84Å; N325-I328 HydrophobicContact CB-CG1 3.93Å; N325-I328 PolarHBondContact O-N 3.17Å; N325-I328 VanDerWaalsContact O-N 3.13Å; N325-R329 PolarHBondContact O-N 3.34Å
326P92.3Very high93.2Very high8 Ų851.8 Ų51.85%0.05225%0.245CC..Hα-helixtrans-57-30.8178.1-29.138.1000114.6I131 T135 L153 C157 I328 R329 E330I131-P326 HydrophobicContact CG2-CB 3.85Å; I131-P326 HydrophobicContact CG2-CG 3.55Å; T135-P326 HydrophobicContact CG2-CB 4.22Å; T135-P326 WeakPolarHBondContact OG1-CB 3.47Å; L153-P326 HydrophobicContact CD2-CB 4.46Å; L153-P326 HydrophobicContact CD2-CG 4.23Å; C157-P326 WeakPolarHBondContact SG-CG 3.3Å; P326-I328 PolarHBondContact O-N 3.31Å; P326-R329 WeakPolarHBondContact O-CB 3.16Å; P326-R329 PolarHBondContact O-N 2.87Å; P326-E330 PolarHBondContact O-N 3.02Å
327C92.8Very high93.1Very high4 Ų449.7 Ų49.73%0.02724%0.236CC..Hα-helixtrans-68.3-35.8178.7-62.60000111.6L270 N325 E330 A331L270-C327 HydrophobicContact CD1-CB 3.8Å; N325-C327 PolarHBondContact O-N 2.89Å; N325-C327 WeakPolarHBondContact OD1-CB 3.33Å; N325-C327 PolarHBondContact OD1-N 3.14Å; C327-E330 PolarHBondContact O-N 2.93Å; C327-A331 WeakPolarHBondContact O-CB 3.42Å; C327-A331 PolarHBondContact O-N 3.39Å
328I93.4Very high93Very high0 Ų051.5 Ų51.50%024%0.244CC..Hα-helixtrans-68-39.6174.6-59.4178.9000110.1L270 I276 I279 V320 E323 N325 P326 A331 R332L270-I328 HydrophobicContact CD1-CG1 4.34Å; I276-I328 HydrophobicContact CD1-CG1 4.13Å; I276-I328 HydrophobicContact CG1-CG1 4.41Å; I279-I328 HydrophobicContact CD1-CG2 4.48Å; V320-I328 HydrophobicContact CG1-CG2 4.47Å; E323-I328 HydrophobicContact CB-CD1 4.26Å; E323-I328 HydrophobicContact CG-CD1 4.15Å; E323-I328 VanDerWaalsContact OE2-CD1 3.3Å; E323-I328 WeakPolarHBondContact OE2-CD1 3.41Å; N325-I328 HydrophobicContact CB-CB 4.37Å; N325-I328 HydrophobicContact CB-CD1 3.84Å; N325-I328 HydrophobicContact CB-CG1 3.93Å; N325-I328 PolarHBondContact O-N 3.17Å; N325-I328 VanDerWaalsContact O-N 3.13Å; P326-I328 PolarHBondContact O-N 3.31Å; I328-A331 PolarHBondContact O-N 3.05Å; I328-R332 WeakPolarHBondContact O-CB 3.31Å; I328-R332 PolarHBondContact O-N 3.03Å
329R94.3Very high93.1Very high99 Ų9946.5 Ų46.537%0.37422%0.218SC..Hα-helixtrans-59.9-46174.3-173.2-172.1-57.3157.61.5111.9L322 N325 P326 R332 R333L322-R329 HydrophobicContact CD1-CB 4.45Å; L322-R329 HydrophobicContact CD1-CG 4.1Å; L322-R329 HydrophobicContact CD2-CB 4.11Å; L322-R329 HydrophobicContact CD2-CG 4.35Å; N325-R329 PolarHBondContact O-N 3.34Å; P326-R329 WeakPolarHBondContact O-CB 3.16Å; P326-R329 PolarHBondContact O-N 2.87Å; R329-R332 PolarHBondContact O-N 3.19Å; R329-R333 WeakPolarHBondContact O-CB 3.47Å; R329-R333 PolarHBondContact O-N 3.35Å
330E95Very high93.2Very high10 Ų1043.2 Ų43.25%0.04720%0.202CC..Hα-helixtrans-66.6-43.1177-177.357.4-15500111.6T135 H136 P326 C327 R332 R333 R334 W445T135-E330 HydrophobicContact CG2-CB 3.85Å; T135-E330 HydrophobicContact CG2-CG 4.38Å; H136-E330 VanDerWaalsContact NE2-CD 3.26Å; H136-E330 IonicContact NE2-OE1 3.94Å; H136-E330 IonicContact NE2-OE2 2.76Å; H136-E330 PolarHBondContact NE2-OE2 2.91Å; H136-E330 VanDerWaalsContact NE2-OE2 3.16Å; P326-E330 PolarHBondContact O-N 3.02Å; C327-E330 PolarHBondContact O-N 2.93Å; E330-R332 VanDerWaalsContact C-N 3.35Å; E330-R332 PolarHBondContact O-N 3.5Å; E330-R333 WeakPolarHBondContact O-CB 3.46Å; E330-R333 PolarHBondContact O-N 3.46Å; E330-R333 VanDerWaalsContact O-N 3.17Å; E330-R333 IonicContact OE1-NH1 2.88Å; E330-R333 PolarHBondContact OE1-NH1 3.43Å; E330-R333 IonicContact OE2-NH1 3.2Å; E330-R334 HydrophobicContact CG-CG 4.48Å; E330-R334 WeakPolarHBondContact O-CG 3.32Å; E330-R334 PolarHBondContact O-N 3.04Å; E330-R334 WeakPolarHBondContact OE1-CG 3.36Å; E330-R334 IonicContact OE1-CZ 3.6Å; E330-R334 IonicContact OE1-NE 3.84Å; E330-R334 PolarHBondContact OE1-NE 3.3Å; E330-R334 IonicContact OE1-NH2 3.89Å; E330-W445 HydrophobicContact CB-CH2 3.94Å; E330-W445 HydrophobicContact CB-CZ2 3.82Å; E330-W445 HydrophobicContact CG-CD2 4.44Å; E330-W445 HydrophobicContact CG-CH2 3.84Å; E330-W445 HydrophobicContact CG-CZ2 3.61Å; E330-W445 HydrophobicContact CG-CZ3 4.36Å
331A95.3Very high93.3Very high8 Ų843.6 Ų43.67%0.06621%0.205CC..Hα-helixtrans-58.5-45.2175.700000111.9I276 I279 C327 I328 R334 A335 W445I276-A331 HydrophobicContact CD1-CB 3.86Å; I279-A331 HydrophobicContact CD1-CB 4.01Å; C327-A331 WeakPolarHBondContact O-CB 3.42Å; C327-A331 PolarHBondContact O-N 3.39Å; I328-A331 PolarHBondContact O-N 3.05Å; A331-R334 PolarHBondContact O-N 2.87Å; A331-A335 WeakPolarHBondContact O-CB 3.35Å; A331-A335 PolarHBondContact O-N 3.47Å; A331-W445 HydrophobicContact CB-CH2 4.14Å; A331-W445 HydrophobicContact CB-CZ3 4.26Å
332R96.6Very high93.5Very high64 Ų6440.3 Ų40.324%0.24218%0.181CC..Hα-helixtrans-61.5-46.8174.5-172.9-167.968177.25.9111.1I279 L317 L322 I328 R329 E330 R334 A335 V336I279-R332 HydrophobicContact CD1-CB 4.06Å; L317-R332 HydrophobicContact CB-CG 4.34Å; L317-R332 WeakPolarHBondContact O-CD 3.41Å; L322-R332 HydrophobicContact CD2-CB 4.22Å; I328-R332 WeakPolarHBondContact O-CB 3.31Å; I328-R332 PolarHBondContact O-N 3.03Å; R329-R332 PolarHBondContact O-N 3.19Å; E330-R332 VanDerWaalsContact C-N 3.35Å; E330-R332 PolarHBondContact O-N 3.5Å; R332-R334 PolarHBondContact O-N 3.31Å; R332-A335 PolarHBondContact O-N 3.35Å; R332-V336 HydrophobicContact CG-CG2 4.47Å; R332-V336 WeakPolarHBondContact O-CG2 3.49Å; R332-V336 PolarHBondContact O-N 2.99Å
333R95.7Very high94Very high127 Ų12738.7 Ų38.748%0.47917%0.173SC..Hα-helixtrans-56.8-48.3178.7175.9-175.2168.5-94.3-4.9111.1R329 E330 A335 V336 I337R329-R333 WeakPolarHBondContact O-CB 3.47Å; R329-R333 PolarHBondContact O-N 3.35Å; E330-R333 WeakPolarHBondContact O-CB 3.46Å; E330-R333 PolarHBondContact O-N 3.46Å; E330-R333 VanDerWaalsContact O-N 3.17Å; E330-R333 IonicContact OE1-NH1 2.88Å; E330-R333 PolarHBondContact OE1-NH1 3.43Å; E330-R333 IonicContact OE2-NH1 3.2Å; R333-A335 VanDerWaalsContact C-N 3.35Å; R333-A335 PolarHBondContact O-N 2.98Å; R333-V336 PolarHBondContact O-N 3.03Å; R333-I337 HydrophobicContact CG-CD1 4.04Å; R333-I337 WeakPolarHBondContact O-CG1 3.28Å; R333-I337 PolarHBondContact O-N 3.29Å
334R95.9Very high94.8Very high24 Ų2436.3 Ų36.39%0.09116%0.164CC..Hα-helixtrans-60-44.8177.6-69.2-177178-119.91.7111.3E330 A331 R332 V336 I337 E338 L440 D443E330-R334 HydrophobicContact CG-CG 4.48Å; E330-R334 WeakPolarHBondContact O-CG 3.32Å; E330-R334 PolarHBondContact O-N 3.04Å; E330-R334 WeakPolarHBondContact OE1-CG 3.36Å; E330-R334 IonicContact OE1-CZ 3.6Å; E330-R334 IonicContact OE1-NE 3.84Å; E330-R334 PolarHBondContact OE1-NE 3.3Å; E330-R334 IonicContact OE1-NH2 3.89Å; A331-R334 PolarHBondContact O-N 2.87Å; R332-R334 PolarHBondContact O-N 3.31Å; R334-V336 PolarHBondContact O-N 3.23Å; R334-I337 WeakPolarHBondContact O-CB 3.4Å; R334-I337 PolarHBondContact O-N 3.07Å; R334-E338 WeakPolarHBondContact O-CG 3.39Å; R334-E338 PolarHBondContact O-N 3.42Å; R334-L440 HydrophobicContact CG-CD1 4.09Å; R334-L440 HydrophobicContact CG-CG 4.5Å; R334-D443 IonicContact CZ-OD2 3.27Å; R334-D443 IonicContact NH1-OD2 2.83Å; R334-D443 PolarHBondContact NH1-OD2 3.28Å; R334-D443 IonicContact NH2-OD2 3.19Å; R334-D443 PolarHBondContact NH2-OD2 3.42Å
335A97Very high95.6Very high1 Ų130.7 Ų30.71%0.00814%0.14CC..Hα-helixtrans-62.5-41.1176.800000113.4I279 L283 L317 A331 R332 R333 I337 E338 V339I279-A335 HydrophobicContact CG2-CB 3.69Å; L283-A335 HydrophobicContact CD1-CB 4.35Å; L283-A335 HydrophobicContact CD2-CB 3.81Å; L283-A335 HydrophobicContact CG-CB 4.05Å; L317-A335 HydrophobicContact CD1-CB 3.98Å; L317-A335 HydrophobicContact CD2-CB 3.88Å; A331-A335 WeakPolarHBondContact O-CB 3.35Å; A331-A335 PolarHBondContact O-N 3.47Å; R332-A335 PolarHBondContact O-N 3.35Å; R333-A335 VanDerWaalsContact C-N 3.35Å; R333-A335 PolarHBondContact O-N 2.98Å; A335-I337 VanDerWaalsContact C-N 3.33Å; A335-I337 PolarHBondContact O-N 3.05Å; A335-E338 PolarHBondContact O-N 3.22Å; A335-V339 WeakPolarHBondContact O-CG2 3.48Å; A335-V339 PolarHBondContact O-N 3.14Å
336V97.9Very high96Very high39 Ų3930 Ų3024%0.23614%0.136CC..Hα-helixtrans-61.2-44.3174.4170.80000110.5L317 R332 R333 R334 E338 V339 Q340L317-V336 HydrophobicContact CB-CG2 3.92Å; L317-V336 HydrophobicContact CD1-CB 4.46Å; L317-V336 HydrophobicContact CD1-CG2 3.74Å; L317-V336 HydrophobicContact CG-CG2 4.43Å; R332-V336 HydrophobicContact CG-CG2 4.47Å; R332-V336 WeakPolarHBondContact O-CG2 3.49Å; R332-V336 PolarHBondContact O-N 2.99Å; R333-V336 PolarHBondContact O-N 3.03Å; R334-V336 PolarHBondContact O-N 3.23Å; V336-E338 VanDerWaalsContact C-N 3.33Å; V336-E338 PolarHBondContact O-N 2.91Å; V336-V339 PolarHBondContact O-N 3.34Å; V336-Q340 WeakPolarHBondContact O-CB 3.29Å; V336-Q340 PolarHBondContact O-N 3.31Å
337I96.6Very high96.1Very high45 Ų4532.3 Ų32.323%0.23115%0.148CC..Hα-helixtrans-59.9-45.1176.3-68.5166.6000110.4R333 R334 A335 V339 Q340 T341 Y437 L440R333-I337 HydrophobicContact CG-CD1 4.04Å; R333-I337 WeakPolarHBondContact O-CG1 3.28Å; R333-I337 PolarHBondContact O-N 3.29Å; R334-I337 WeakPolarHBondContact O-CB 3.4Å; R334-I337 PolarHBondContact O-N 3.07Å; A335-I337 VanDerWaalsContact C-N 3.33Å; A335-I337 PolarHBondContact O-N 3.05Å; I337-V339 PolarHBondContact O-N 3.35Å; I337-Q340 PolarHBondContact O-N 2.79Å; I337-T341 WeakPolarHBondContact O-CB 3.44Å; I337-T341 PolarHBondContact O-N 3.28Å; I337-T341 PolarHBondContact O-OG1 2.95Å; I337-Y437 HydrophobicContact CG2-CD2 3.86Å; I337-Y437 HydrophobicContact CG2-CE2 4.44Å; I337-L440 HydrophobicContact CD1-CD1 3.78Å; I337-L440 HydrophobicContact CG2-CD1 4.25Å
338E96.3Very high96.3Very high39 Ų3932.8 Ų32.818%0.18215%0.15CC..Hα-helixtrans-59.4-48.3178.3-68.9-166.7-14000112.3L283 M286 R334 A335 V336 T341 L342 Y437L283-E338 HydrophobicContact CD2-CB 4.26Å; L283-E338 HydrophobicContact CD2-CG 4.42Å; M286-E338 HydrophobicContact CE-CB 3.53Å; M286-E338 WeakPolarHBondContact CE-O 3.49Å; R334-E338 WeakPolarHBondContact O-CG 3.39Å; R334-E338 PolarHBondContact O-N 3.42Å; A335-E338 PolarHBondContact O-N 3.22Å; V336-E338 VanDerWaalsContact C-N 3.33Å; V336-E338 PolarHBondContact O-N 2.91Å; E338-T341 PolarHBondContact O-N 3.29Å; E338-L342 PolarHBondContact O-N 3.26Å; E338-Y437 HydrophobicContact CB-CE2 4.23Å; E338-Y437 HydrophobicContact CG-CE2 3.84Å
339V98Very high96.3Very high0 Ų034.9 Ų34.90%016%0.159CC..Hα-helixtrans-64.1-45.1178.6177.60000111V282 M286 L310 L313 I314 L317 A335 V336 I337 T341 L342 I343V282-V339 HydrophobicContact CG1-CG2 4.33Å; M286-V339 HydrophobicContact CB-CG2 4.23Å; M286-V339 HydrophobicContact CG-CG2 4Å; L310-V339 HydrophobicContact CB-CG1 4.01Å; L310-V339 HydrophobicContact CD2-CG1 3.96Å; L310-V339 WeakPolarHBondContact O-CG1 3.46Å; L313-V339 HydrophobicContact CB-CG1 4.41Å; I314-V339 HydrophobicContact CD1-CG1 4.11Å; I314-V339 HydrophobicContact CG1-CB 4.25Å; I314-V339 HydrophobicContact CG1-CG1 3.64Å; L317-V339 HydrophobicContact CD1-CG2 4.19Å; A335-V339 WeakPolarHBondContact O-CG2 3.48Å; A335-V339 PolarHBondContact O-N 3.14Å; V336-V339 PolarHBondContact O-N 3.34Å; I337-V339 PolarHBondContact O-N 3.35Å; V339-T341 VanDerWaalsContact C-N 3.31Å; V339-T341 PolarHBondContact O-N 2.93Å; V339-L342 PolarHBondContact O-N 3.28Å; V339-L342 VanDerWaalsContact O-N 3.17Å; V339-I343 HydrophobicContact CG1-CD1 4.32Å; V339-I343 PolarHBondContact O-N 3.33Å
340Q97.5Very high96.3Very high82 Ų8232.2 Ų32.238%0.38315%0.151SC..Hα-helixtrans-63.1-38.9179.7-173.260.754.700111.4V336 I337 L342 I343 T344V336-Q340 WeakPolarHBondContact O-CB 3.29Å; V336-Q340 PolarHBondContact O-N 3.31Å; I337-Q340 PolarHBondContact O-N 2.79Å; Q340-L342 VanDerWaalsContact C-N 3.31Å; Q340-L342 PolarHBondContact O-N 3.42Å; Q340-I343 WeakPolarHBondContact O-CB 2.94Å; Q340-I343 PolarHBondContact O-N 3.06Å; Q340-T344 WeakPolarHBondContact O-CG2 2.89Å; Q340-T344 PolarHBondContact O-N 3.32Å
341T96.9Very high96.2Very high14 Ų1433.3 Ų33.39%0.08616%0.162CC..Hα-helixtrans-60.5-42175.5-62.10000111.1I337 E338 V339 I343 T344 Y345 Q380 L384 Y437I337-T341 WeakPolarHBondContact O-CB 3.44Å; I337-T341 PolarHBondContact O-N 3.28Å; I337-T341 PolarHBondContact O-OG1 2.95Å; E338-T341 PolarHBondContact O-N 3.29Å; V339-T341 VanDerWaalsContact C-N 3.31Å; V339-T341 PolarHBondContact O-N 2.93Å; T341-I343 PolarHBondContact O-N 3.15Å; T341-T344 WeakPolarHBondContact CA-OG1 3.15Å; T341-T344 PolarHBondContact O-N 3.19Å; T341-T344 PolarHBondContact O-OG1 2.86Å; T341-Y345 PolarHBondContact O-N 3.12Å; T341-Q380 PolarHBondContact O-NE2 3.26Å; T341-L384 HydrophobicContact CG2-CD2 4.12Å; T341-Y437 HydrophobicContact CG2-CD1 3.57Å; T341-Y437 HydrophobicContact CG2-CD2 4.33Å; T341-Y437 HydrophobicContact CG2-CE1 3.79Å; T341-Y437 HydrophobicContact CG2-CG 3.85Å; T341-Y437 WeakPolarHBondContact OG1-CD2 3.2Å
342L97Very high96.1Very high1 Ų134.1 Ų34.11%0.00517%0.165CC..Hα-helixtrans-65.2-38.9176-174.457.4000112.3M286 I289 K290 L293 L310 E338 V339 Q340 Y345 I346 L384M286-L342 HydrophobicContact CG-CD2 4.13Å; M286-L342 HydrophobicContact SD-CD2 4.21Å; I289-L342 HydrophobicContact CG2-CD2 4.37Å; K290-L342 HydrophobicContact CB-CD1 4.45Å; K290-L342 HydrophobicContact CB-CD2 3.86Å; K290-L342 HydrophobicContact CG-CD1 4.2Å; K290-L342 HydrophobicContact CG-CD2 4.42Å; L293-L342 HydrophobicContact CD1-CD1 4.13Å; L293-L342 HydrophobicContact CD1-CD2 4.49Å; L293-L342 HydrophobicContact CD1-CG 4.41Å; L310-L342 HydrophobicContact CD1-CB 4.25Å; L310-L342 HydrophobicContact CD1-CD2 3.83Å; L310-L342 HydrophobicContact CD1-CG 3.74Å; L310-L342 HydrophobicContact CD2-CD2 3.76Å; L310-L342 HydrophobicContact CD2-CG 4.42Å; L310-L342 HydrophobicContact CG-CD2 4.44Å; E338-L342 PolarHBondContact O-N 3.26Å; V339-L342 PolarHBondContact O-N 3.28Å; V339-L342 VanDerWaalsContact O-N 3.17Å; Q340-L342 VanDerWaalsContact C-N 3.31Å; Q340-L342 PolarHBondContact O-N 3.42Å; L342-Y345 HydrophobicContact CD1-CD1 4.2Å; L342-Y345 WeakPolarHBondContact O-CB 3.39Å; L342-Y345 PolarHBondContact O-N 3.34Å; L342-I346 WeakPolarHBondContact O-CG1 3.49Å; L342-I346 PolarHBondContact O-N 3.18Å; L342-I346 VanDerWaalsContact O-N 3.12Å; L342-L384 HydrophobicContact CD1-CD1 3.99Å; L342-L384 HydrophobicContact CD1-CD2 4.4Å
343I97.6Very high95.8Very high6 Ų634.3 Ų34.33%0.03117%0.169CC..Hα-helixtrans-60.1-47172.6-66.1172.2000110.7K307 L310 Q311 I314 V339 Q340 T341 Y345 I346 D347K307-I343 HydrophobicContact CG-CG2 4.4Å; L310-I343 HydrophobicContact CB-CD1 3.87Å; L310-I343 HydrophobicContact CB-CG1 3.62Å; L310-I343 HydrophobicContact CD1-CG1 3.93Å; L310-I343 HydrophobicContact CG-CG1 4.39Å; Q311-I343 HydrophobicContact CG-CD1 4.2Å; I314-I343 HydrophobicContact CD1-CD1 3.59Å; V339-I343 HydrophobicContact CG1-CD1 4.32Å; V339-I343 PolarHBondContact O-N 3.33Å; Q340-I343 WeakPolarHBondContact O-CB 2.94Å; Q340-I343 PolarHBondContact O-N 3.06Å; T341-I343 PolarHBondContact O-N 3.15Å; I343-Y345 PolarHBondContact O-N 3.17Å; I343-I346 WeakPolarHBondContact O-CB 3.37Å; I343-I346 PolarHBondContact O-N 2.93Å; I343-I346 VanDerWaalsContact O-N 3.14Å; I343-D347 PolarHBondContact O-N 2.98Å
344T96.4Very high95.5Very high37 Ų3733.9 Ų33.923%0.22717%0.17CC..Hα-helixtrans-62.9-33179.662.30000112.6Q340 T341 D347 L348 Q380Q340-T344 WeakPolarHBondContact O-CG2 2.89Å; Q340-T344 PolarHBondContact O-N 3.32Å; T341-T344 WeakPolarHBondContact CA-OG1 3.15Å; T341-T344 PolarHBondContact O-N 3.19Å; T341-T344 PolarHBondContact O-OG1 2.86Å; T344-D347 PolarHBondContact O-N 2.88Å; T344-L348 WeakPolarHBondContact O-CB 3.22Å; T344-L348 PolarHBondContact O-N 3.18Å; T344-Q380 PolarHBondContact OG1-NE2 2.91Å
345Y96.7Very high95.1Very high22 Ų2235.4 Ų35.49%0.08618%0.176CC..Hα-helixtrans-64.5-44.9173.9172.1-105.3000111.7L294 T341 L342 I343 L348 K349 S377 Q380 L384L294-Y345 HydrophobicContact CD2-CE1 4.19Å; T341-Y345 PolarHBondContact O-N 3.12Å; L342-Y345 HydrophobicContact CD1-CD1 4.2Å; L342-Y345 WeakPolarHBondContact O-CB 3.39Å; L342-Y345 PolarHBondContact O-N 3.34Å; I343-Y345 PolarHBondContact O-N 3.17Å; Y345-L348 PolarHBondContact O-N 2.85Å; Y345-K349 HydrophobicContact CE1-CG 4.28Å; Y345-K349 HydrophobicContact CE2-CD 4.5Å; Y345-K349 HydrophobicContact CE2-CG 4.19Å; Y345-K349 VanDerWaalsContact CZ-CE 3.43Å; Y345-K349 WeakPolarHBondContact O-CG 2.96Å; Y345-K349 PolarHBondContact O-N 3.37Å; Y345-K349 WeakPolarHBondContact OH-CE 3.4Å; Y345-S377 WeakPolarHBondContact CE2-O 3.4Å; Y345-Q380 HydrophobicContact CD2-CB 4.13Å; Y345-Q380 HydrophobicContact CD2-CG 3.93Å; Y345-Q380 HydrophobicContact CG-CG 4.49Å; Y345-L384 HydrophobicContact CD1-CD1 3.81Å; Y345-L384 HydrophobicContact CD2-CD1 3.95Å; Y345-L384 HydrophobicContact CE1-CD1 4.37Å; Y345-L384 HydrophobicContact CE2-CD1 4.49Å; Y345-L384 HydrophobicContact CG-CD1 3.56Å
346I96Very high94.6Very high0 Ų042.1 Ų42.10%021%0.205CC..Hα-helixtrans-61.1-48.3175.5-65.1166.8000110.4L293 Y303 L310 L342 I343 L348 K349 E350L293-I346 HydrophobicContact CD1-CD1 3.66Å; L293-I346 HydrophobicContact CD1-CG1 3.96Å; Y303-I346 HydrophobicContact CD1-CG1 4.44Å; Y303-I346 HydrophobicContact CD1-CG2 3.8Å; Y303-I346 HydrophobicContact CG-CG2 3.79Å; L310-I346 HydrophobicContact CD1-CD1 3.6Å; L342-I346 WeakPolarHBondContact O-CG1 3.49Å; L342-I346 PolarHBondContact O-N 3.18Å; L342-I346 VanDerWaalsContact O-N 3.12Å; I343-I346 WeakPolarHBondContact O-CB 3.37Å; I343-I346 PolarHBondContact O-N 2.93Å; I343-I346 VanDerWaalsContact O-N 3.14Å; I346-L348 VanDerWaalsContact C-N 3.28Å; I346-L348 PolarHBondContact O-N 3.32Å; I346-K349 PolarHBondContact O-N 3.39Å; I346-K349 VanDerWaalsContact O-N 3.13Å; I346-E350 PolarHBondContact O-N 3.39Å
347D96Very high94Very high57 Ų5746.7 Ų46.731%0.30523%0.227SC..Hα-helixtrans-58.6-40.8179.4-74.3-25.1000112.1K307 I343 T344 A351K307-D347 WeakPolarHBondContact CE-OD1 3.4Å; K307-D347 IonicContact NZ-OD1 2.98Å; K307-D347 PolarHBondContact NZ-OD1 3.47Å; K307-D347 IonicContact NZ-OD2 2.67Å; I343-D347 PolarHBondContact O-N 2.98Å; T344-D347 PolarHBondContact O-N 2.88Å; D347-A351 WeakPolarHBondContact O-CB 3.33Å; D347-A351 PolarHBondContact O-N 3.4Å
348L95.5Very high93.1Very high13 Ų1352.2 Ų52.27%0.06825%0.25CC..Hα-helixtrans-65.5-44.5176.1179.761.9000111.7T344 Y345 I346 A351 L352 L373 S377 L430T344-L348 WeakPolarHBondContact O-CB 3.22Å; T344-L348 PolarHBondContact O-N 3.18Å; Y345-L348 PolarHBondContact O-N 2.85Å; I346-L348 VanDerWaalsContact C-N 3.28Å; I346-L348 PolarHBondContact O-N 3.32Å; L348-A351 PolarHBondContact O-N 3.24Å; L348-L352 HydrophobicContact CD1-CD1 4.34Å; L348-L352 HydrophobicContact CD1-CG 4.43Å; L348-L352 HydrophobicContact CG-CD1 4.2Å; L348-L352 VanDerWaalsContact O-CG 3.28Å; L348-L352 WeakPolarHBondContact O-CG 3.23Å; L348-L352 PolarHBondContact O-N 3.08Å; L348-L373 HydrophobicContact CD1-CB 4.13Å; L348-L373 HydrophobicContact CD1-CD2 4.06Å; L348-S377 VanDerWaalsContact CD2-CA 3.49Å; L348-L430 HydrophobicContact CD1-CD2 3.95Å; L348-L430 HydrophobicContact CD2-CD2 3.79Å; L348-L430 HydrophobicContact CG-CD2 4.41Å
349K94.4Very high91.7Very high45 Ų4554.2 Ų54.220%0.19627%0.273CS..Hα-helixtrans-61.2-45.7176.1-74.1-67.9-172.2-158.50111.6Y303 Y345 I346 A351 L352 E353 S377Y303-K349 HydrophobicContact CE1-CB 4.26Å; Y303-K349 HydrophobicContact CE2-CB 4Å; Y303-K349 WeakPolarHBondContact OH-CB 3.3Å; Y345-K349 HydrophobicContact CE1-CG 4.28Å; Y345-K349 HydrophobicContact CE2-CD 4.5Å; Y345-K349 HydrophobicContact CE2-CG 4.19Å; Y345-K349 VanDerWaalsContact CZ-CE 3.43Å; Y345-K349 WeakPolarHBondContact O-CG 2.96Å; Y345-K349 PolarHBondContact O-N 3.37Å; Y345-K349 WeakPolarHBondContact OH-CE 3.4Å; I346-K349 PolarHBondContact O-N 3.39Å; I346-K349 VanDerWaalsContact O-N 3.13Å; K349-A351 VanDerWaalsContact C-N 3.34Å; K349-A351 PolarHBondContact O-N 2.64Å; K349-L352 PolarHBondContact O-N 3.44Å; K349-E353 PolarHBondContact O-N 2.91Å; K349-S377 VanDerWaalsContact CD-OG 3.25Å; K349-S377 WeakPolarHBondContact CD-OG 3.28Å; K349-S377 WeakPolarHBondContact CE-OG 3.25Å; K349-S377 PolarHBondContact NZ-OG 3.26Å
350E93.7Very high90.1Very high42 Ų4259.2 Ų59.220%0.19631%0.307CS..Hα-helixtrans-59.4-43.8175.5-77.2-168.6178.100112.5Y303 I346 L352 E353 K354Y303-E350 WeakPolarHBondContact CB-OE1 3.41Å; Y303-E350 HydrophobicContact CD2-CG 3.48Å; Y303-E350 VanDerWaalsContact CD2-CG 3.48Å; Y303-E350 HydrophobicContact CE2-CG 4.23Å; Y303-E350 HydrophobicContact CG-CG 4.06Å; I346-E350 PolarHBondContact O-N 3.39Å; E350-L352 VanDerWaalsContact C-N 3.33Å; E350-L352 PolarHBondContact O-N 3.03Å; E350-E353 PolarHBondContact O-N 3.09Å; E350-K354 WeakPolarHBondContact O-CB 3.38Å; E350-K354 VanDerWaalsContact O-CG 3.3Å; E350-K354 WeakPolarHBondContact O-CG 3.22Å; E350-K354 PolarHBondContact O-N 2.92Å; E350-K354 IonicContact OE2-NZ 3.04Å; E350-K354 PolarHBondContact OE2-NZ 3.45Å
351A92.8Very high88.9Confident34 Ų3465.3 Ų65.328%0.28134%0.335SS..Hα-helixtrans-62.9-41178.900000111.6D347 L348 K349 R355 W370D347-A351 WeakPolarHBondContact O-CB 3.33Å; D347-A351 PolarHBondContact O-N 3.4Å; L348-A351 PolarHBondContact O-N 3.24Å; K349-A351 VanDerWaalsContact C-N 3.34Å; K349-A351 PolarHBondContact O-N 2.64Å; A351-R355 WeakPolarHBondContact O-CB 3.5Å; A351-R355 PolarHBondContact O-N 3.15Å; A351-W370 HydrophobicContact CB-CH2 4.39Å; A351-W370 HydrophobicContact CB-CZ3 4.36Å
352L92.9Very high87.8Confident24 Ų2467.7 Ų67.713%0.12635%0.345CS..Hα-helixtrans-66.5-39176.7-70170.9000112.3L348 K349 E350 R355 K356 W370 L373L348-L352 HydrophobicContact CD1-CD1 4.34Å; L348-L352 HydrophobicContact CD1-CG 4.43Å; L348-L352 HydrophobicContact CG-CD1 4.2Å; L348-L352 VanDerWaalsContact O-CG 3.28Å; L348-L352 WeakPolarHBondContact O-CG 3.23Å; L348-L352 PolarHBondContact O-N 3.08Å; K349-L352 PolarHBondContact O-N 3.44Å; E350-L352 VanDerWaalsContact C-N 3.33Å; E350-L352 PolarHBondContact O-N 3.03Å; L352-R355 WeakPolarHBondContact O-CB 3.42Å; L352-R355 PolarHBondContact O-N 3.2Å; L352-K356 WeakPolarHBondContact O-CG 3.34Å; L352-K356 PolarHBondContact O-N 3.48Å; L352-W370 HydrophobicContact CD2-CE3 3.97Å; L352-W370 HydrophobicContact CD2-CZ3 4.19Å; L352-L373 HydrophobicContact CD2-CB 4.36Å
353E90.5Very high87.1Confident69 Ų6970.8 Ų70.832%0.32236%0.36SS..Hα-helixtrans-68.1-44.5175.3-71.9-54.4137.900112.1K349 E350 R355 K356 L357K349-E353 PolarHBondContact O-N 2.91Å; E350-E353 PolarHBondContact O-N 3.09Å; E353-R355 PolarHBondContact O-N 3Å; E353-K356 WeakPolarHBondContact O-CB 3.16Å; E353-K356 PolarHBondContact O-N 3.34Å; E353-K356 VanDerWaalsContact O-N 3.1Å; E353-K356 IonicContact OE1-NZ 3.11Å; E353-K356 PolarHBondContact OE1-NZ 2.88Å; E353-K356 IonicContact OE2-NZ 3.75Å; E353-L357 PolarHBondContact O-N 3.24Å
354K89.8Confident86.6Confident117 Ų11775.1 Ų75.151%0.50939%0.388SS..Hα-helixtrans-57.6-39.8173.9-73.3167.7-174.8159.40111.2E350 K356 L357 F358E350-K354 WeakPolarHBondContact O-CB 3.38Å; E350-K354 VanDerWaalsContact O-CG 3.3Å; E350-K354 WeakPolarHBondContact O-CG 3.22Å; E350-K354 PolarHBondContact O-N 2.92Å; E350-K354 IonicContact OE2-NZ 3.04Å; E350-K354 PolarHBondContact OE2-NZ 3.45Å; K354-K356 PolarHBondContact O-N 3.01Å; K354-L357 PolarHBondContact O-N 2.99Å; K354-F358 WeakPolarHBondContact O-CD2 3.29Å; K354-F358 PolarHBondContact O-N 3.44Å
355R87.8Confident86.1Confident56 Ų5674 Ų7421%0.21138%0.382CS..Hα-helixtrans-60.5-44.4175.4-172.8-164.9-176-151.73.4112.3A351 L352 E353 L357 F358 A359 E362 W370A351-R355 WeakPolarHBondContact O-CB 3.5Å; A351-R355 PolarHBondContact O-N 3.15Å; L352-R355 WeakPolarHBondContact O-CB 3.42Å; L352-R355 PolarHBondContact O-N 3.2Å; E353-R355 PolarHBondContact O-N 3Å; R355-L357 PolarHBondContact O-N 3.35Å; R355-F358 CarbonylContact O-C 3.52Å; R355-F358 PolarHBondContact O-N 3.05Å; R355-A359 PolarHBondContact O-N 3.35Å; R355-E362 IonicContact CZ-OE2 3.22Å; R355-E362 IonicContact NE-OE1 3.45Å; R355-E362 IonicContact NE-OE2 3.28Å; R355-E362 IonicContact NH2-OE2 2.69Å; R355-E362 PolarHBondContact NH2-OE2 3.16Å; R355-W370 HydrophobicContact CB-CH2 4.43Å; R355-W370 HydrophobicContact CB-CZ3 4.47Å; R355-W370 VanDerWaalsContact CD-CD2 3.47Å; R355-W370 HydrophobicContact CG-CD2 4.37Å
356K86.6Confident85.8Confident142 Ų14274.9 Ų74.962%0.61739%0.387SS*.Hα-helixtrans-59.8-34.8178.7-70172.6-173.6169.80112.1L352 E353 K354L352-K356 WeakPolarHBondContact O-CG 3.34Å; L352-K356 PolarHBondContact O-N 3.48Å; E353-K356 WeakPolarHBondContact O-CB 3.16Å; E353-K356 PolarHBondContact O-N 3.34Å; E353-K356 VanDerWaalsContact O-N 3.1Å; E353-K356 IonicContact OE1-NZ 3.11Å; E353-K356 PolarHBondContact OE1-NZ 2.88Å; E353-K356 IonicContact OE2-NZ 3.75Å; K354-K356 PolarHBondContact O-N 3.01Å
357L84.7Confident85.4Confident135 Ų13580.6 Ų80.671%0.70741%0.412SS*.Hα-helixtrans-74.7-31.4179.6-65172.2000113.5E353 K354 R355E353-L357 PolarHBondContact O-N 3.24Å; K354-L357 PolarHBondContact O-N 2.99Å; R355-L357 PolarHBondContact O-N 3.35Å
358F78.1Confident85.2Confident161 Ų16179.6 Ų79.671%0.70641%0.411SS*.THydrogen-bonded Turntrans-115.533-173.9-65.8-74.3000113.6K354 R355 C360K354-F358 WeakPolarHBondContact O-CD2 3.29Å; K354-F358 PolarHBondContact O-N 3.44Å; R355-F358 CarbonylContact O-C 3.52Å; R355-F358 PolarHBondContact O-N 3.05Å; F358-C360 PolarHBondContact O-N 2.91Å
359A67.1Low85.1Confident81 Ų8179 Ų7967%0.66941%0.408SS*.  trans-61.4101.7-178.600000111.8R355R355-A359 PolarHBondContact O-N 3.35Å
360C64Low85.1Confident105 Ų10579.1 Ų79.171%0.70941%0.407SS*.  trans-99169.5171.2-84.30000111F358 E362F358-C360 PolarHBondContact O-N 2.91Å; C360-E362 PolarHBondContact O-N 3.27Å
361E71.8Confident85.1Confident210 Ų21081 Ų8198%0.98142%0.419SS*.  trans-62.8102.3168.7-69.4-171.1162.100110
362E75.4Confident85.2Confident64 Ų6479.8 Ų79.830%0.29941%0.408SS..  trans-99.4149.3179.2-70174.4177.500111.1R355 C360 H366R355-E362 IonicContact CZ-OE2 3.22Å; R355-E362 IonicContact NE-OE1 3.45Å; R355-E362 IonicContact NE-OE2 3.28Å; R355-E362 IonicContact NH2-OE2 2.69Å; R355-E362 PolarHBondContact NH2-OE2 3.16Å; C360-E362 PolarHBondContact O-N 3.27Å; E362-H366 HydrophobicContact CB-CB 4.49Å; E362-H366 IonicContact OE1-CD2 3.72Å; E362-H366 IonicContact OE2-CD2 3.76Å
363H82.4Confident85.4Confident67 Ų6779.8 Ų79.831%0.3141%0.408SS..  trans-57141.5170.4-168.7-98000110.9S365 H366 K367 Q415H363-S365 PolarHBondContact CE1-OG 3.23Å; H363-S365 WeakPolarHBondContact ND1-CB 3.32Å; H363-S365 PolarHBondContact ND1-N 2.68Å; H363-S365 PolarHBondContact ND1-OG 3.21Å; H363-S365 VanDerWaalsContact ND1-OG 3.09Å; H363-S365 PolarHBondContact O-N 3.23Å; H363-S365 VanDerWaalsContact O-N 3.11Å; H363-H366 WeakPolarHBondContact O-CB 3.49Å; H363-H366 PolarHBondContact O-N 3.17Å; H363-K367 PolarHBondContact O-N 3.14Å; H363-K367 VanDerWaalsContact O-N 3.09Å; H363-Q415 PolarHBondContact CE1-OE1 3.22Å; H363-Q415 PolarHBondContact NE2-OE1 2.76Å
364P86.2Confident85.7Confident96 Ų9677.4 Ų77.462%0.62340%0.402SS*.Hα-helixtrans-51.1-38.4179.6-29.835.8000114H366 K367 A368P364-H366 PolarHBondContact O-N 2.83Å; P364-K367 PolarHBondContact O-N 3.44Å; P364-A368 PolarHBondContact O-N 3.45Å
365S86.8Confident86Confident14 Ų1475.1 Ų75.110%0.09840%0.395CS..Hα-helixtrans-64.6-37.6177.1-46.20000112.7H363 A368 V369 D413 C420H363-S365 PolarHBondContact CE1-OG 3.23Å; H363-S365 WeakPolarHBondContact ND1-CB 3.32Å; H363-S365 PolarHBondContact ND1-N 2.68Å; H363-S365 PolarHBondContact ND1-OG 3.21Å; H363-S365 VanDerWaalsContact ND1-OG 3.09Å; H363-S365 PolarHBondContact O-N 3.23Å; H363-S365 VanDerWaalsContact O-N 3.11Å; S365-A368 PolarHBondContact O-N 3.47Å; S365-V369 WeakPolarHBondContact O-CG2 3.35Å; S365-V369 PolarHBondContact O-N 2.92Å; S365-D413 VanDerWaalsContact CB-O 3.3Å; S365-D413 WeakPolarHBondContact CB-O 3.46Å; S365-D413 PolarHBondContact OG-O 3.01Å; S365-C420 WeakPolarHBondContact CB-SG 3.31Å
366H88.7Confident86.5Confident41 Ų4172.5 Ų72.519%0.1939%0.385CS..Hα-helixtrans-70-41.9177-163.163.9000111.1E362 H363 P364 A368 V369 W370E362-H366 HydrophobicContact CB-CB 4.49Å; E362-H366 IonicContact OE1-CD2 3.72Å; E362-H366 IonicContact OE2-CD2 3.76Å; H363-H366 WeakPolarHBondContact O-CB 3.49Å; H363-H366 PolarHBondContact O-N 3.17Å; P364-H366 PolarHBondContact O-N 2.83Å; H366-A368 VanDerWaalsContact C-N 3.27Å; H366-A368 PolarHBondContact O-N 3.22Å; H366-V369 PolarHBondContact O-N 2.98Å; H366-W370 AromaticContact CD2-CD1 3.55Å; H366-W370 AromaticContact CD2-NE1 3.29Å; H366-W370 PolarHBondContact CD2-NE1 3.41Å; H366-W370 VanDerWaalsContact CD2-NE1 3.29Å; H366-W370 AromaticContact CE1-NE1 3.58Å; H366-W370 AromaticContact NE2-CD1 3.62Å; H366-W370 AromaticContact NE2-CE2 3.91Å; H366-W370 AromaticContact NE2-NE1 2.88Å; H366-W370 PolarHBondContact NE2-NE1 3.19Å; H366-W370 VanDerWaalsContact O-CD1 3.24Å; H366-W370 PolarHBondContact O-N 3.12Å; H366-W370 VanDerWaalsContact O-N 3.13Å
367K89.3Confident87Confident120 Ų12065.7 Ų65.752%0.52236%0.356SS..Hα-helixtrans-58.5-39.6174.1-174.7175.8-178.4176.30112H363 P364 W370 N371H363-K367 PolarHBondContact O-N 3.14Å; H363-K367 VanDerWaalsContact O-N 3.09Å; P364-K367 PolarHBondContact O-N 3.44Å; K367-W370 PolarHBondContact O-N 3.37Å; K367-N371 VanDerWaalsContact O-CG 3.23Å; K367-N371 PolarHBondContact O-N 2.9Å; K367-N371 PolarHBondContact O-OD1 2.82Å
368A91.9Very high87.5Confident35 Ų3565.3 Ų65.329%0.28935%0.351SS..Hα-helixtrans-62.7-46.1176.600000112.6P364 S365 H366 W370 N371 V372 V412P364-A368 PolarHBondContact O-N 3.45Å; S365-A368 PolarHBondContact O-N 3.47Å; H366-A368 VanDerWaalsContact C-N 3.27Å; H366-A368 PolarHBondContact O-N 3.22Å; A368-W370 VanDerWaalsContact C-N 3.3Å; A368-W370 PolarHBondContact O-N 2.97Å; A368-N371 WeakPolarHBondContact O-CB 3.32Å; A368-N371 PolarHBondContact O-N 2.63Å; A368-V372 PolarHBondContact O-N 3.49Å; A368-V372 VanDerWaalsContact O-N 3.16Å; A368-V412 HydrophobicContact CB-CG2 3.95Å
369V93.3Very high88.4Confident1 Ų158 Ų581%0.00632%0.319CS..Hα-helixtrans-58.1-44.6176.6173.80000110.9S365 H366 N371 V372 L373 L409 V412 A423 R424 A427S365-V369 WeakPolarHBondContact O-CG2 3.35Å; S365-V369 PolarHBondContact O-N 2.92Å; H366-V369 PolarHBondContact O-N 2.98Å; V369-N371 PolarHBondContact O-N 3.17Å; V369-V372 WeakPolarHBondContact O-CB 3.47Å; V369-V372 PolarHBondContact O-N 3.4Å; V369-L373 HydrophobicContact CG1-CD1 4.26Å; V369-L373 WeakPolarHBondContact O-CG 3.48Å; V369-L373 PolarHBondContact O-N 3.49Å; V369-L409 HydrophobicContact CG1-CD2 4.46Å; V369-L409 HydrophobicContact CG2-CD2 4.48Å; V369-V412 HydrophobicContact CG2-CG1 4.15Å; V369-V412 HydrophobicContact CG2-CG2 4.47Å; V369-A423 HydrophobicContact CG1-CB 4.16Å; V369-R424 HydrophobicContact CG2-CB 4.17Å; V369-A427 HydrophobicContact CG1-CB 4.05Å
370W93.1Very high89.8Confident47 Ų4754.3 Ų54.318%0.17829%0.288CS..Hα-helixtrans-67.9-32.8178.8-77.2116.5000114.5A351 L352 R355 H366 K367 A368 V372 L373 G374A351-W370 HydrophobicContact CB-CH2 4.39Å; A351-W370 HydrophobicContact CB-CZ3 4.36Å; L352-W370 HydrophobicContact CD2-CE3 3.97Å; L352-W370 HydrophobicContact CD2-CZ3 4.19Å; R355-W370 HydrophobicContact CB-CH2 4.43Å; R355-W370 HydrophobicContact CB-CZ3 4.47Å; R355-W370 VanDerWaalsContact CD-CD2 3.47Å; R355-W370 HydrophobicContact CG-CD2 4.37Å; H366-W370 AromaticContact CD2-CD1 3.55Å; H366-W370 AromaticContact CD2-NE1 3.29Å; H366-W370 PolarHBondContact CD2-NE1 3.41Å; H366-W370 VanDerWaalsContact CD2-NE1 3.29Å; H366-W370 AromaticContact CE1-NE1 3.58Å; H366-W370 AromaticContact NE2-CD1 3.62Å; H366-W370 AromaticContact NE2-CE2 3.91Å; H366-W370 AromaticContact NE2-NE1 2.88Å; H366-W370 PolarHBondContact NE2-NE1 3.19Å; H366-W370 VanDerWaalsContact O-CD1 3.24Å; H366-W370 PolarHBondContact O-N 3.12Å; H366-W370 VanDerWaalsContact O-N 3.13Å; K367-W370 PolarHBondContact O-N 3.37Å; A368-W370 VanDerWaalsContact C-N 3.3Å; A368-W370 PolarHBondContact O-N 2.97Å; W370-V372 VanDerWaalsContact C-N 3.26Å; W370-V372 PolarHBondContact O-N 3.36Å; W370-L373 HydrophobicContact CD2-CD1 4.12Å; W370-L373 HydrophobicContact CE3-CB 4.28Å; W370-L373 HydrophobicContact CE3-CD1 3.56Å; W370-L373 HydrophobicContact CZ3-CD1 3.9Å; W370-L373 PolarHBondContact O-N 2.94Å; W370-G374 PolarHBondContact O-N 3.49Å
371N93.6Very high91.3Very high83 Ų8349.8 Ų49.844%0.44426%0.259SS..Hα-helixtrans-61.6-41.1173-68.8-14.6000110.4K367 A368 V369 G374 N375K367-N371 VanDerWaalsContact O-CG 3.23Å; K367-N371 PolarHBondContact O-N 2.9Å; K367-N371 PolarHBondContact O-OD1 2.82Å; A368-N371 WeakPolarHBondContact O-CB 3.32Å; A368-N371 PolarHBondContact O-N 2.63Å; V369-N371 PolarHBondContact O-N 3.17Å; N371-G374 PolarHBondContact O-N 3Å; N371-N375 PolarHBondContact O-N 3.33Å; N371-N375 VanDerWaalsContact O-N 3.1Å
372V96.2Very high92.4Very high8 Ų843.3 Ų43.35%0.04823%0.229CC..Hα-helixtrans-63.8-43.3173.4177.80000111.3A368 V369 W370 G374 N375 L376 Q405 A408 L409A368-V372 PolarHBondContact O-N 3.49Å; A368-V372 VanDerWaalsContact O-N 3.16Å; V369-V372 WeakPolarHBondContact O-CB 3.47Å; V369-V372 PolarHBondContact O-N 3.4Å; W370-V372 VanDerWaalsContact C-N 3.26Å; W370-V372 PolarHBondContact O-N 3.36Å; V372-G374 VanDerWaalsContact C-N 3.25Å; V372-G374 PolarHBondContact O-N 3.12Å; V372-N375 PolarHBondContact O-N 3.35Å; V372-N375 VanDerWaalsContact O-N 3.16Å; V372-L376 HydrophobicContact CG1-CD1 3.94Å; V372-L376 HydrophobicContact CG1-CG 4.05Å; V372-L376 WeakPolarHBondContact O-CB 3.49Å; V372-L376 WeakPolarHBondContact O-CG 3.44Å; V372-L376 PolarHBondContact O-N 2.89Å; V372-Q405 HydrophobicContact CG1-CB 3.83Å; V372-Q405 HydrophobicContact CG1-CG 4.26Å; V372-A408 HydrophobicContact CG2-CB 3.95Å; V372-L409 HydrophobicContact CB-CD2 4.03Å; V372-L409 HydrophobicContact CB-CG 4.25Å; V372-L409 HydrophobicContact CG1-CD1 3.9Å; V372-L409 HydrophobicContact CG1-CD2 4.01Å; V372-L409 HydrophobicContact CG1-CG 3.78Å; V372-L409 HydrophobicContact CG2-CD2 4.17Å; V372-L409 HydrophobicContact CG2-CG 4.25Å
373L96.5Very high93.4Very high23 Ų2340.3 Ų40.312%0.1222%0.215CC..Hα-helixtrans-59.2-36.4175.5-71173.1000112.5L348 L352 V369 W370 L376 S377 A427 L430L348-L373 HydrophobicContact CD1-CB 4.13Å; L348-L373 HydrophobicContact CD1-CD2 4.06Å; L352-L373 HydrophobicContact CD2-CB 4.36Å; V369-L373 HydrophobicContact CG1-CD1 4.26Å; V369-L373 WeakPolarHBondContact O-CG 3.48Å; V369-L373 PolarHBondContact O-N 3.49Å; W370-L373 HydrophobicContact CD2-CD1 4.12Å; W370-L373 HydrophobicContact CE3-CB 4.28Å; W370-L373 HydrophobicContact CE3-CD1 3.56Å; W370-L373 HydrophobicContact CZ3-CD1 3.9Å; W370-L373 PolarHBondContact O-N 2.94Å; L373-L376 HydrophobicContact CD2-CD1 4.4Å; L373-L376 PolarHBondContact O-N 3.44Å; L373-S377 PolarHBondContact O-N 3.42Å; L373-A427 HydrophobicContact CD2-CB 3.79Å; L373-A427 HydrophobicContact CG-CB 4.24Å; L373-L430 HydrophobicContact CD2-CD2 3.75Å
374G95.7Very high94Very high20 Ų2037.1 Ų37.121%0.20620%0.2CC..Hα-helixtrans-59.8-52.2171.700000112.1W370 N371 V372 L376 S377 E378W370-G374 PolarHBondContact O-N 3.49Å; N371-G374 PolarHBondContact O-N 3Å; V372-G374 VanDerWaalsContact C-N 3.25Å; V372-G374 PolarHBondContact O-N 3.12Å; G374-L376 VanDerWaalsContact C-N 3.35Å; G374-L376 PolarHBondContact O-N 3.14Å; G374-S377 VanDerWaalsContact O-CB 3.32Å; G374-S377 WeakPolarHBondContact O-CB 3.4Å; G374-S377 PolarHBondContact O-N 3.09Å; G374-S377 VanDerWaalsContact O-N 3.13Å; G374-E378 PolarHBondContact O-N 2.89Å
375N97.4Very high94.4Very high69 Ų6935.9 Ų35.937%0.36919%0.194SC..Hα-helixtrans-60.6-42.8176.9-61.8-20000112N371 V372 S377 E378 I379 Q405N371-N375 PolarHBondContact O-N 3.33Å; N371-N375 VanDerWaalsContact O-N 3.1Å; V372-N375 PolarHBondContact O-N 3.35Å; V372-N375 VanDerWaalsContact O-N 3.16Å; N375-S377 PolarHBondContact O-N 3.41Å; N375-E378 PolarHBondContact O-N 3.13Å; N375-I379 VanDerWaalsContact O-CG1 3.27Å; N375-I379 WeakPolarHBondContact O-CG1 3.37Å; N375-I379 PolarHBondContact O-N 3.24Å; N375-Q405 HydrophobicContact CB-CG 4.35Å; N375-Q405 PolarHBondContact ND2-OE1 3.33Å
376L98Very high94.7Very high0 Ų036 Ų360%019%0.193CC..Hα-helixtrans-61-34.5177-73.1175.1000111.7V372 L373 G374 Q380 L402 Q405 L430 A431 I434V372-L376 HydrophobicContact CG1-CD1 3.94Å; V372-L376 HydrophobicContact CG1-CG 4.05Å; V372-L376 WeakPolarHBondContact O-CB 3.49Å; V372-L376 WeakPolarHBondContact O-CG 3.44Å; V372-L376 PolarHBondContact O-N 2.89Å; L373-L376 HydrophobicContact CD2-CD1 4.4Å; L373-L376 PolarHBondContact O-N 3.44Å; G374-L376 VanDerWaalsContact C-N 3.35Å; G374-L376 PolarHBondContact O-N 3.14Å; L376-Q380 WeakPolarHBondContact O-CB 3.43Å; L376-Q380 PolarHBondContact O-N 3.42Å; L376-L402 HydrophobicContact CD2-CD2 3.9Å; L376-Q405 HydrophobicContact CD2-CB 3.84Å; L376-Q405 HydrophobicContact CD2-CG 3.81Å; L376-Q405 HydrophobicContact CG-CB 4.34Å; L376-Q405 HydrophobicContact CG-CG 4.23Å; L376-L430 HydrophobicContact CB-CD2 4.49Å; L376-L430 HydrophobicContact CD1-CD2 4.15Å; L376-L430 HydrophobicContact CD1-CG 4.41Å; L376-A431 HydrophobicContact CD1-CB 4.03Å; L376-A431 HydrophobicContact CD2-CB 3.78Å; L376-I434 HydrophobicContact CB-CD1 4.21Å; L376-I434 HydrophobicContact CD2-CD1 4.18Å
377S96.1Very high94.8Very high0 Ų042 Ų420%023%0.226CC..Hα-helixtrans-65.6-39.2175.6-172.80000112.6Y345 L348 K349 L373 G374 N375 G381Y345-S377 WeakPolarHBondContact CE2-O 3.4Å; L348-S377 VanDerWaalsContact CD2-CA 3.49Å; K349-S377 VanDerWaalsContact CD-OG 3.25Å; K349-S377 WeakPolarHBondContact CD-OG 3.28Å; K349-S377 WeakPolarHBondContact CE-OG 3.25Å; K349-S377 PolarHBondContact NZ-OG 3.26Å; L373-S377 PolarHBondContact O-N 3.42Å; G374-S377 VanDerWaalsContact O-CB 3.32Å; G374-S377 WeakPolarHBondContact O-CB 3.4Å; G374-S377 PolarHBondContact O-N 3.09Å; G374-S377 VanDerWaalsContact O-N 3.13Å; N375-S377 PolarHBondContact O-N 3.41Å; S377-G381 PolarHBondContact O-N 3.2Å
378E95.9Very high94.8Very high127 Ų12737.3 Ų37.359%0.59321%0.212SC*.Hα-helixtrans-67.6-49.2175-65.1175.917600110.7G374 N375 Q380 G381 E382G374-E378 PolarHBondContact O-N 2.89Å; N375-E378 PolarHBondContact O-N 3.13Å; E378-Q380 VanDerWaalsContact C-N 3.33Å; E378-Q380 PolarHBondContact O-N 3Å; E378-G381 PolarHBondContact O-N 3.31Å; E378-G381 VanDerWaalsContact O-N 3.1Å; E378-E382 PolarHBondContact O-N 3.37Å; E378-E382 VanDerWaalsContact O-N 3.13Å
379I97.1Very high94.8Very high8 Ų837.8 Ų37.84%0.04121%0.209CC..Hα-helixtrans-59.6-43.6178.3-62.9162000110.9N375 G381 E382 V383 L398 L401 L402 Q405N375-I379 VanDerWaalsContact O-CG1 3.27Å; N375-I379 WeakPolarHBondContact O-CG1 3.37Å; N375-I379 PolarHBondContact O-N 3.24Å; I379-G381 VanDerWaalsContact C-N 3.28Å; I379-G381 PolarHBondContact O-N 3.43Å; I379-E382 WeakPolarHBondContact O-CB 3.2Å; I379-E382 PolarHBondContact O-N 3.07Å; I379-E382 VanDerWaalsContact O-N 3.12Å; I379-V383 HydrophobicContact CG2-CG2 4.19Å; I379-V383 WeakPolarHBondContact O-CG2 3.43Å; I379-V383 PolarHBondContact O-N 3.08Å; I379-L398 HydrophobicContact CG2-CD2 4.24Å; I379-L401 HydrophobicContact CD1-CB 3.91Å; I379-L401 HydrophobicContact CG1-CB 4.22Å; I379-L402 HydrophobicContact CB-CD2 4.48Å; I379-L402 HydrophobicContact CG2-CD1 4.41Å; I379-L402 HydrophobicContact CG2-CD2 3.63Å; I379-L402 HydrophobicContact CG2-CG 3.79Å; I379-Q405 HydrophobicContact CD1-CG 3.68Å
380Q96.9Very high94.5Very high2 Ų243.4 Ų43.41%0.00923%0.23CC..Hα-helixtrans-61.9-36.6177.9-172.6171.717.800112T341 T344 Y345 L376 E378 V383 L384 I434T341-Q380 PolarHBondContact O-NE2 3.26Å; T344-Q380 PolarHBondContact OG1-NE2 2.91Å; Y345-Q380 HydrophobicContact CD2-CB 4.13Å; Y345-Q380 HydrophobicContact CD2-CG 3.93Å; Y345-Q380 HydrophobicContact CG-CG 4.49Å; L376-Q380 WeakPolarHBondContact O-CB 3.43Å; L376-Q380 PolarHBondContact O-N 3.42Å; E378-Q380 VanDerWaalsContact C-N 3.33Å; E378-Q380 PolarHBondContact O-N 3Å; Q380-V383 PolarHBondContact O-N 3.38Å; Q380-L384 HydrophobicContact CG-CD1 4.43Å; Q380-L384 WeakPolarHBondContact O-CB 3.49Å; Q380-L384 VanDerWaalsContact O-CG 3.28Å; Q380-L384 WeakPolarHBondContact O-CG 3.34Å; Q380-L384 PolarHBondContact O-N 2.91Å; Q380-I434 HydrophobicContact CB-CD1 3.88Å; Q380-I434 HydrophobicContact CB-CG1 4.17Å; Q380-I434 HydrophobicContact CB-CG2 4.46Å; Q380-I434 HydrophobicContact CG-CD1 4.24Å; Q380-I434 HydrophobicContact CG-CG1 4.05Å
381G94.7Very high94.3Very high11 Ų1146.6 Ų46.611%0.11326%0.256CS..Hα-helixtrans-62.2-41.217300000112.7S377 E378 I379 S385S377-G381 PolarHBondContact O-N 3.2Å; E378-G381 PolarHBondContact O-N 3.31Å; E378-G381 VanDerWaalsContact O-N 3.1Å; I379-G381 VanDerWaalsContact C-N 3.28Å; I379-G381 PolarHBondContact O-N 3.43Å; G381-S385 PolarHBondContact O-N 3.22Å; G381-S385 PolarHBondContact O-OG 3.26Å; G381-S385 VanDerWaalsContact O-OG 3.09Å
382E95.5Very high94.2Very high74 Ų7445.4 Ų45.435%0.34625%0.249SC..Hα-helixtrans-65.7-44.6173.6-64-170-134.300111.7E378 I379 L384 S385 F386 R397 L398E378-E382 PolarHBondContact O-N 3.37Å; E378-E382 VanDerWaalsContact O-N 3.13Å; I379-E382 WeakPolarHBondContact O-CB 3.2Å; I379-E382 PolarHBondContact O-N 3.07Å; I379-E382 VanDerWaalsContact O-N 3.12Å; E382-L384 PolarHBondContact O-N 3.05Å; E382-S385 CarbonylContact O-C 3.58Å; E382-S385 WeakPolarHBondContact O-CA 3.4Å; E382-S385 PolarHBondContact O-N 3.25Å; E382-F386 PolarHBondContact O-N 3.27Å; E382-R397 IonicContact OE1-NH2 3.09Å; E382-R397 PolarHBondContact OE1-NH2 3.2Å; E382-R397 VanDerWaalsContact OE1-NH2 3.11Å; E382-R397 IonicContact OE2-CZ 3.32Å; E382-R397 IonicContact OE2-NH1 2.68Å; E382-R397 PolarHBondContact OE2-NH1 2.7Å; E382-R397 IonicContact OE2-NH2 2.86Å; E382-R397 PolarHBondContact OE2-NH2 2.89Å; E382-R397 VanDerWaalsContact OE2-NH2 3.09Å; E382-L398 HydrophobicContact CB-CD2 3.67Å
383V96.5Very high94.2Very high0 Ų053.7 Ų53.70%029%0.285CS..Hα-helixtrans-62.7-39.1177.6173.80000111.9I379 Q380 S385 F386 L398 I434 Y437 L438 K441I379-V383 HydrophobicContact CG2-CG2 4.19Å; I379-V383 WeakPolarHBondContact O-CG2 3.43Å; I379-V383 PolarHBondContact O-N 3.08Å; Q380-V383 PolarHBondContact O-N 3.38Å; V383-S385 PolarHBondContact O-N 3.41Å; V383-F386 WeakPolarHBondContact O-CB 3.49Å; V383-F386 PolarHBondContact O-N 3.33Å; V383-F386 VanDerWaalsContact O-N 3.17Å; V383-L398 HydrophobicContact CG2-CB 4.47Å; V383-L398 HydrophobicContact CG2-CD1 4.09Å; V383-L398 HydrophobicContact CG2-CD2 4.25Å; V383-I434 HydrophobicContact CB-CG2 4.28Å; V383-I434 HydrophobicContact CG1-CG2 4.36Å; V383-I434 HydrophobicContact CG2-CG2 3.9Å; V383-Y437 HydrophobicContact CG1-CD1 3.68Å; V383-Y437 HydrophobicContact CG1-CE1 4.2Å; V383-L438 HydrophobicContact CG1-CB 3.95Å; V383-L438 HydrophobicContact CG1-CD1 4.21Å; V383-L438 HydrophobicContact CG2-CB 4.5Å; V383-L438 HydrophobicContact CG2-CD1 4.39Å; V383-K441 PolarHBondContact O-NZ 3.39Å
384L95.4Very high94.1Very high0 Ų057.5 Ų57.50%031%0.305CS..Hα-helixtrans-60.3-30.5174.3-80.2170.3000112.4K290 T341 L342 Y345 Q380 E382 Y437 K441K290-L384 HydrophobicContact CD-CB 4.28Å; K290-L384 HydrophobicContact CD-CD2 4.43Å; K290-L384 PolarHBondContact NZ-O 3.5Å; T341-L384 HydrophobicContact CG2-CD2 4.12Å; L342-L384 HydrophobicContact CD1-CD1 3.99Å; L342-L384 HydrophobicContact CD1-CD2 4.4Å; Y345-L384 HydrophobicContact CD1-CD1 3.81Å; Y345-L384 HydrophobicContact CD2-CD1 3.95Å; Y345-L384 HydrophobicContact CE1-CD1 4.37Å; Y345-L384 HydrophobicContact CE2-CD1 4.49Å; Y345-L384 HydrophobicContact CG-CD1 3.56Å; Q380-L384 HydrophobicContact CG-CD1 4.43Å; Q380-L384 WeakPolarHBondContact O-CB 3.49Å; Q380-L384 VanDerWaalsContact O-CG 3.28Å; Q380-L384 WeakPolarHBondContact O-CG 3.34Å; Q380-L384 PolarHBondContact O-N 2.91Å; E382-L384 PolarHBondContact O-N 3.05Å; L384-Y437 HydrophobicContact CD2-CE1 4.11Å; L384-K441 PolarHBondContact O-NZ 2.96Å
385S93.2Very high94.1Very high71 Ų7157.1 Ų57.150%0.49730%0.297SS..Hα-helixtrans-92.9-9.9179.2-53.10000113.7L294 G381 E382 V383 D387L294-S385 WeakPolarHBondContact CD1-OG 3.42Å; G381-S385 PolarHBondContact O-N 3.22Å; G381-S385 PolarHBondContact O-OG 3.26Å; G381-S385 VanDerWaalsContact O-OG 3.09Å; E382-S385 CarbonylContact O-C 3.58Å; E382-S385 WeakPolarHBondContact O-CA 3.4Å; E382-S385 PolarHBondContact O-N 3.25Å; V383-S385 PolarHBondContact O-N 3.41Å; S385-D387 PolarHBondContact O-N 3.47Å
386F94.1Very high94.1Very high16 Ų1657.1 Ų57.17%0.0730%0.297CS..  trans-65.4129.4179.6177.1-100.7000111.4E382 V383 G388 N394 Y395 L398 L438 K441E382-F386 PolarHBondContact O-N 3.27Å; V383-F386 WeakPolarHBondContact O-CB 3.49Å; V383-F386 PolarHBondContact O-N 3.33Å; V383-F386 VanDerWaalsContact O-N 3.17Å; F386-G388 WeakPolarHBondContact CE1-O 3.34Å; F386-N394 HydrophobicContact CD2-CB 4.39Å; F386-N394 HydrophobicContact CE2-CB 4.2Å; F386-Y395 HydrophobicContact CE1-CD2 4.28Å; F386-Y395 HydrophobicContact CZ-CD2 4.13Å; F386-Y395 HydrophobicContact CZ-CG 4.43Å; F386-L398 HydrophobicContact CB-CD1 4.23Å; F386-L398 HydrophobicContact CD2-CD1 4.04Å; F386-L398 HydrophobicContact CG-CD1 4.3Å; F386-L438 HydrophobicContact CB-CD1 4.43Å; F386-L438 HydrophobicContact CD1-CD1 3.61Å; F386-L438 HydrophobicContact CE1-CD1 3.94Å; F386-L438 HydrophobicContact CG-CD1 3.93Å; F386-K441 HydrophobicContact CD1-CB 4.4Å; F386-K441 WeakPolarHBondContact O-CE 3.47Å; F386-K441 PolarHBondContact O-NZ 3.34Å
387D90Very high94Very high166 Ų16662.2 Ų62.289%0.88832%0.316SS*.  trans-138.992175.7-171.731.1000107.3S385S385-D387 PolarHBondContact O-N 3.47Å
388G90.6Very high94.1Very high22 Ų2262.4 Ų62.423%0.22732%0.317CS..  trans-175.6179.8-16900000112.3F386 D392F386-G388 WeakPolarHBondContact CE1-O 3.34Å; G388-D392 WeakPolarHBondContact CA-OD2 3.36Å
389N90.3Very high94.1Very high45 Ų4559.8 Ų59.824%0.24131%0.305CS..  trans-113177.2-179.867.148.5000111.8T391 D392 Y395 E444N389-T391 PolarHBondContact O-N 3.19Å; N389-T391 WeakPolarHBondContact OD1-CA 3.43Å; N389-T391 WeakPolarHBondContact OD1-CB 3.41Å; N389-T391 PolarHBondContact OD1-N 3.3Å; N389-T391 PolarHBondContact OD1-OG1 3.19Å; N389-D392 PolarHBondContact N-OD2 2.8Å; N389-D392 WeakPolarHBondContact O-CB 3.48Å; N389-D392 PolarHBondContact O-N 3.04Å; N389-D392 VanDerWaalsContact O-N 3.14Å; N389-D392 PolarHBondContact OD1-N 2.85Å; N389-Y395 WeakPolarHBondContact O-CB 3.24Å; N389-E444 WeakPolarHBondContact CB-OE1 3.22Å
390R88.2Confident94.1Very high119 Ų11965.4 Ų65.445%0.44933%0.331SS..THydrogen-bonded Turntrans-66.9-15.6-176.7-62.9-170.5177.8179.8-1.3114.7Y395 D439 S442R390-Y395 HydrophobicContact CB-CD1 4.38Å; R390-Y395 HydrophobicContact CB-CE1 4.23Å; R390-Y395 HydrophobicContact CG-CD2 4.49Å; R390-Y395 HydrophobicContact CG-CE1 4.26Å; R390-Y395 HydrophobicContact CG-CE2 3.98Å; R390-D439 PolarHBondContact NH2-O 3.05Å; R390-S442 VanDerWaalsContact CG-OG 3.3Å; R390-S442 WeakPolarHBondContact CG-OG 3.45Å; R390-S442 PolarHBondContact NE-OG 2.97Å
391T88.6Confident94.2Very high115 Ų11567.6 Ų67.671%0.70634%0.342SS*.THydrogen-bonded Turntrans-87.7-9.9177.570.60000112.7N389N389-T391 PolarHBondContact O-N 3.19Å; N389-T391 WeakPolarHBondContact OD1-CA 3.43Å; N389-T391 WeakPolarHBondContact OD1-CB 3.41Å; N389-T391 PolarHBondContact OD1-N 3.3Å; N389-T391 PolarHBondContact OD1-OG1 3.19Å
392D92.5Very high94.3Very high57 Ų5767.1 Ų67.131%0.30534%0.337SS..SBendtrans-71.3137.3-179.7-69.7-34.1000111.9G388 N389 N394 Y395 I396G388-D392 WeakPolarHBondContact CA-OD2 3.36Å; N389-D392 PolarHBondContact N-OD2 2.8Å; N389-D392 WeakPolarHBondContact O-CB 3.48Å; N389-D392 PolarHBondContact O-N 3.04Å; N389-D392 VanDerWaalsContact O-N 3.14Å; N389-D392 PolarHBondContact OD1-N 2.85Å; D392-N394 PolarHBondContact O-N 3.24Å; D392-N394 VanDerWaalsContact O-N 3.11Å; D392-Y395 WeakPolarHBondContact O-CB 3.47Å; D392-Y395 PolarHBondContact O-N 3.49Å; D392-I396 PolarHBondContact O-N 2.7Å
393K95.1Very high94.4Very high183 Ų18366.5 Ų66.580%0.79634%0.339SS*.Hα-helixtrans-56.5-32.3176.8-63.6-176179.9-179.90112.8R397K393-R397 WeakPolarHBondContact O-CB 3.39Å; K393-R397 PolarHBondContact O-N 2.86Å
394N94.7Very high94.4Very high102 Ų10273.2 Ų73.255%0.54537%0.368SS..Hα-helixtrans-69.6-37.1178.5-72.7-20.7000112.1F386 D392 L398F386-N394 HydrophobicContact CD2-CB 4.39Å; F386-N394 HydrophobicContact CE2-CB 4.2Å; D392-N394 PolarHBondContact O-N 3.24Å; D392-N394 VanDerWaalsContact O-N 3.11Å; N394-L398 VanDerWaalsContact O-CG 3.26Å; N394-L398 WeakPolarHBondContact O-CG 3.26Å; N394-L398 PolarHBondContact O-N 3.26Å
395Y96.1Very high94.5Very high12 Ų1273.8 Ų73.85%0.04737%0.37CS..Hα-helixtrans-60.4-52.9174174.2-86.8000110.1F386 N389 R390 D392 R397 L398 E399 L438 D439 S442F386-Y395 HydrophobicContact CE1-CD2 4.28Å; F386-Y395 HydrophobicContact CZ-CD2 4.13Å; F386-Y395 HydrophobicContact CZ-CG 4.43Å; N389-Y395 WeakPolarHBondContact O-CB 3.24Å; R390-Y395 HydrophobicContact CB-CD1 4.38Å; R390-Y395 HydrophobicContact CB-CE1 4.23Å; R390-Y395 HydrophobicContact CG-CD2 4.49Å; R390-Y395 HydrophobicContact CG-CE1 4.26Å; R390-Y395 HydrophobicContact CG-CE2 3.98Å; D392-Y395 WeakPolarHBondContact O-CB 3.47Å; D392-Y395 PolarHBondContact O-N 3.49Å; Y395-R397 VanDerWaalsContact C-N 3.31Å; Y395-R397 PolarHBondContact O-N 3.49Å; Y395-L398 PolarHBondContact O-N 3.11Å; Y395-E399 WeakPolarHBondContact CE1-OE2 3.44Å; Y395-E399 PolarHBondContact O-N 2.99Å; Y395-L438 HydrophobicContact CD2-CD1 3.91Å; Y395-L438 HydrophobicContact CD2-CD2 4.15Å; Y395-L438 HydrophobicContact CD2-CG 3.78Å; Y395-L438 HydrophobicContact CE2-CD1 4.33Å; Y395-L438 HydrophobicContact CE2-CD2 4.17Å; Y395-L438 HydrophobicContact CE2-CG 3.73Å; Y395-D439 PolarHBondContact OH-OD1 3.23Å; Y395-S442 VanDerWaalsContact CE2-OG 3.31Å; Y395-S442 WeakPolarHBondContact CE2-OG 3.23Å
396I96Very high94.7Very high70 Ų7072 Ų7236%0.35936%0.355SS..Hα-helixtrans-57.6-45.2-179.1-59.9170.5000110.4D392 L398 E399 E400D392-I396 PolarHBondContact O-N 2.7Å; I396-L398 PolarHBondContact O-N 3.35Å; I396-E399 PolarHBondContact O-N 2.82Å; I396-E400 HydrophobicContact CG2-CG 4.47Å; I396-E400 WeakPolarHBondContact O-CB 3.28Å; I396-E400 VanDerWaalsContact O-CG 3.31Å; I396-E400 WeakPolarHBondContact O-CG 3.41Å; I396-E400 PolarHBondContact O-N 3.5Å
397R97.5Very high94.8Very high106 Ų10676.5 Ų76.540%0.438%0.379SS..Hα-helixtrans-58.2-47.1175.3174.3-179.3161.4-102.2-9.9112.1E382 K393 Y395 E400 L401E382-R397 IonicContact OE1-NH2 3.09Å; E382-R397 PolarHBondContact OE1-NH2 3.2Å; E382-R397 VanDerWaalsContact OE1-NH2 3.11Å; E382-R397 IonicContact OE2-CZ 3.32Å; E382-R397 IonicContact OE2-NH1 2.68Å; E382-R397 PolarHBondContact OE2-NH1 2.7Å; E382-R397 IonicContact OE2-NH2 2.86Å; E382-R397 PolarHBondContact OE2-NH2 2.89Å; E382-R397 VanDerWaalsContact OE2-NH2 3.09Å; K393-R397 WeakPolarHBondContact O-CB 3.39Å; K393-R397 PolarHBondContact O-N 2.86Å; Y395-R397 VanDerWaalsContact C-N 3.31Å; Y395-R397 PolarHBondContact O-N 3.49Å; R397-E400 PolarHBondContact O-N 2.58Å; R397-L401 HydrophobicContact CG-CD1 4.12Å; R397-L401 HydrophobicContact CG-CG 4.49Å; R397-L401 VanDerWaalsContact O-CG 3.27Å; R397-L401 WeakPolarHBondContact O-CG 3.48Å; R397-L401 PolarHBondContact O-N 3.34Å
398L97.6Very high95.1Very high4 Ų470.5 Ų70.52%0.02135%0.353CS..Hα-helixtrans-65.8-41.4-178.6-71.3169.5000111.4I379 E382 V383 F386 N394 Y395 I396 L401 L402 L438I379-L398 HydrophobicContact CG2-CD2 4.24Å; E382-L398 HydrophobicContact CB-CD2 3.67Å; V383-L398 HydrophobicContact CG2-CB 4.47Å; V383-L398 HydrophobicContact CG2-CD1 4.09Å; V383-L398 HydrophobicContact CG2-CD2 4.25Å; F386-L398 HydrophobicContact CB-CD1 4.23Å; F386-L398 HydrophobicContact CD2-CD1 4.04Å; F386-L398 HydrophobicContact CG-CD1 4.3Å; N394-L398 VanDerWaalsContact O-CG 3.26Å; N394-L398 WeakPolarHBondContact O-CG 3.26Å; N394-L398 PolarHBondContact O-N 3.26Å; Y395-L398 PolarHBondContact O-N 3.11Å; I396-L398 PolarHBondContact O-N 3.35Å; L398-L401 PolarHBondContact O-N 3.44Å; L398-L402 VanDerWaalsContact O-CG 3.31Å; L398-L402 WeakPolarHBondContact O-CG 3.45Å; L398-L402 PolarHBondContact O-N 3.42Å; L398-L438 HydrophobicContact CB-CD2 3.71Å; L398-L438 HydrophobicContact CD1-CD1 4.16Å
399E96.6Very high95.3Very high72 Ų7269.5 Ų69.534%0.33634%0.342SS..Hα-helixtrans-60.1-45.4174.1-179.7177.1-15000112Y395 I396 L401 L402 T403 L435Y395-E399 WeakPolarHBondContact CE1-OE2 3.44Å; Y395-E399 PolarHBondContact O-N 2.99Å; I396-E399 PolarHBondContact O-N 2.82Å; E399-L401 PolarHBondContact O-N 2.73Å; E399-L402 PolarHBondContact O-N 3.07Å; E399-T403 WeakPolarHBondContact O-CB 3.33Å; E399-T403 PolarHBondContact O-N 2.7Å; E399-T403 PolarHBondContact O-OG1 3.24Å; E399-L435 HydrophobicContact CB-CD1 4.48Å; E399-L435 HydrophobicContact CG-CD1 4.11Å
400E97.1Very high95.5Very high127 Ų12772.6 Ų72.659%0.59336%0.359SS*.Hα-helixtrans-61.6-43.1175-75.5176.4-178.600112I396 R397 L402 T403 K404I396-E400 HydrophobicContact CG2-CG 4.47Å; I396-E400 WeakPolarHBondContact O-CB 3.28Å; I396-E400 VanDerWaalsContact O-CG 3.31Å; I396-E400 WeakPolarHBondContact O-CG 3.41Å; I396-E400 PolarHBondContact O-N 3.5Å; R397-E400 PolarHBondContact O-N 2.58Å; E400-L402 PolarHBondContact O-N 3.21Å; E400-T403 PolarHBondContact O-N 2.95Å; E400-K404 WeakPolarHBondContact O-CB 3.4Å; E400-K404 PolarHBondContact O-N 3.13Å
401L97.7Very high95.7Very high48 Ų4870.9 Ų70.925%0.25137%0.37SS..Hα-helixtrans-63-41177.7-73.7173.9000112.1I379 R397 L398 E399 K404 Q405I379-L401 HydrophobicContact CD1-CB 3.91Å; I379-L401 HydrophobicContact CG1-CB 4.22Å; R397-L401 HydrophobicContact CG-CD1 4.12Å; R397-L401 HydrophobicContact CG-CG 4.49Å; R397-L401 VanDerWaalsContact O-CG 3.27Å; R397-L401 WeakPolarHBondContact O-CG 3.48Å; R397-L401 PolarHBondContact O-N 3.34Å; L398-L401 PolarHBondContact O-N 3.44Å; E399-L401 PolarHBondContact O-N 2.73Å; L401-K404 PolarHBondContact O-N 3.49Å; L401-Q405 WeakPolarHBondContact O-CG 3.31Å; L401-Q405 PolarHBondContact O-N 2.94Å; L401-Q405 VanDerWaalsContact O-N 3.12Å; L401-Q405 PolarHBondContact O-NE2 2.95Å
402L97.7Very high95.7Very high0 Ų066 Ų660%034%0.34CS..Hα-helixtrans-67-45.9176.2-72.3167000111.5L376 I379 L398 E399 E400 K404 Q405 L406 I434 L435 L438L376-L402 HydrophobicContact CD2-CD2 3.9Å; I379-L402 HydrophobicContact CB-CD2 4.48Å; I379-L402 HydrophobicContact CG2-CD1 4.41Å; I379-L402 HydrophobicContact CG2-CD2 3.63Å; I379-L402 HydrophobicContact CG2-CG 3.79Å; L398-L402 VanDerWaalsContact O-CG 3.31Å; L398-L402 WeakPolarHBondContact O-CG 3.45Å; L398-L402 PolarHBondContact O-N 3.42Å; E399-L402 PolarHBondContact O-N 3.07Å; E400-L402 PolarHBondContact O-N 3.21Å; L402-K404 VanDerWaalsContact C-N 3.26Å; L402-K404 PolarHBondContact O-N 2.96Å; L402-Q405 WeakPolarHBondContact O-CB 3.37Å; L402-Q405 PolarHBondContact O-N 2.95Å; L402-L406 PolarHBondContact O-N 2.87Å; L402-I434 HydrophobicContact CD1-CG2 3.98Å; L402-I434 HydrophobicContact CD2-CB 4.02Å; L402-I434 HydrophobicContact CD2-CG2 3.7Å; L402-I434 HydrophobicContact CG-CG2 4.47Å; L402-L435 HydrophobicContact CD1-CB 4.04Å; L402-L435 HydrophobicContact CD1-CD1 3.96Å; L402-L438 HydrophobicContact CD1-CD2 4.27Å
403T96.7Very high95.5Very high62 Ų6267.9 Ų67.938%0.3835%0.35SS..Hα-helixtrans-58.5-41.1175.6-60.70000111E399 E400 Q405 L406 L407E399-T403 WeakPolarHBondContact O-CB 3.33Å; E399-T403 PolarHBondContact O-N 2.7Å; E399-T403 PolarHBondContact O-OG1 3.24Å; E400-T403 PolarHBondContact O-N 2.95Å; T403-Q405 VanDerWaalsContact C-N 3.33Å; T403-Q405 PolarHBondContact O-N 2.97Å; T403-L406 WeakPolarHBondContact O-CB 3.28Å; T403-L406 PolarHBondContact O-N 3.46Å; T403-L407 HydrophobicContact CG2-CD1 4.49Å; T403-L407 WeakPolarHBondContact O-CG 3.37Å; T403-L407 PolarHBondContact O-N 3.42Å
404K97.6Very high94.8Very high140 Ų14059.8 Ų59.861%0.60932%0.316SS*.Hα-helixtrans-62.1-37.5174.3-173.5177.4-179.8179.10112.7E400 L401 L402 A408E400-K404 WeakPolarHBondContact O-CB 3.4Å; E400-K404 PolarHBondContact O-N 3.13Å; L401-K404 PolarHBondContact O-N 3.49Å; L402-K404 VanDerWaalsContact C-N 3.26Å; L402-K404 PolarHBondContact O-N 2.96Å; K404-A408 WeakPolarHBondContact O-CB 3.47Å; K404-A408 PolarHBondContact O-N 3.37Å
405Q97.3Very high94.1Very high13 Ų1361.3 Ų61.36%0.06132%0.32CS..Hα-helixtrans-68-37.6174.9-63.7-32-68.800112.2V372 N375 L376 I379 L401 L402 T403 A408 L409V372-Q405 HydrophobicContact CG1-CB 3.83Å; V372-Q405 HydrophobicContact CG1-CG 4.26Å; N375-Q405 HydrophobicContact CB-CG 4.35Å; N375-Q405 PolarHBondContact ND2-OE1 3.33Å; L376-Q405 HydrophobicContact CD2-CB 3.84Å; L376-Q405 HydrophobicContact CD2-CG 3.81Å; L376-Q405 HydrophobicContact CG-CB 4.34Å; L376-Q405 HydrophobicContact CG-CG 4.23Å; I379-Q405 HydrophobicContact CD1-CG 3.68Å; L401-Q405 WeakPolarHBondContact O-CG 3.31Å; L401-Q405 PolarHBondContact O-N 2.94Å; L401-Q405 VanDerWaalsContact O-N 3.12Å; L401-Q405 PolarHBondContact O-NE2 2.95Å; L402-Q405 WeakPolarHBondContact O-CB 3.37Å; L402-Q405 PolarHBondContact O-N 2.95Å; T403-Q405 VanDerWaalsContact C-N 3.33Å; T403-Q405 PolarHBondContact O-N 2.97Å; Q405-A408 PolarHBondContact O-N 3.42Å; Q405-L409 WeakPolarHBondContact O-CG 3.5Å; Q405-L409 PolarHBondContact O-N 3.32Å
406L97.1Very high93.2Very high33 Ų3363.4 Ų63.417%0.17335%0.345CS..Hα-helixtrans-61.4-47.7174.5-72168.9000111.3L402 T403 A408 L409 D410 V428 A431 Q432L402-L406 PolarHBondContact O-N 2.87Å; T403-L406 WeakPolarHBondContact O-CB 3.28Å; T403-L406 PolarHBondContact O-N 3.46Å; L406-A408 VanDerWaalsContact C-N 3.3Å; L406-A408 PolarHBondContact O-N 3.35Å; L406-L409 WeakPolarHBondContact O-CB 3.37Å; L406-L409 PolarHBondContact O-N 3.09Å; L406-L409 VanDerWaalsContact O-N 3.11Å; L406-D410 PolarHBondContact O-N 2.86Å; L406-V428 HydrophobicContact CD2-CG1 4.11Å; L406-A431 HydrophobicContact CD2-CB 3.66Å; L406-A431 HydrophobicContact CG-CB 4.07Å; L406-Q432 HydrophobicContact CD2-CG 4.32Å
407L96.6Very high92.6Very high111 Ų11163.7 Ų63.758%0.58135%0.345SS*.Hα-helixtrans-61.1-38.5175.6-66.9173.4000112.5T403 L409 D410 A411T403-L407 HydrophobicContact CG2-CD1 4.49Å; T403-L407 WeakPolarHBondContact O-CG 3.37Å; T403-L407 PolarHBondContact O-N 3.42Å; L407-L409 VanDerWaalsContact C-N 3.32Å; L407-L409 PolarHBondContact O-N 3.1Å; L407-D410 PolarHBondContact O-N 3.36Å; L407-A411 PolarHBondContact O-N 2.83Å; L407-A411 VanDerWaalsContact O-N 3.11Å
408A95.8Very high92Very high40 Ų4064.7 Ų64.733%0.33135%0.354SS..Hα-helixtrans-63.9-37.2175.500000112.1V372 K404 Q405 L406 V412V372-A408 HydrophobicContact CG2-CB 3.95Å; K404-A408 WeakPolarHBondContact O-CB 3.47Å; K404-A408 PolarHBondContact O-N 3.37Å; Q405-A408 PolarHBondContact O-N 3.42Å; L406-A408 VanDerWaalsContact C-N 3.3Å; L406-A408 PolarHBondContact O-N 3.35Å; A408-V412 WeakPolarHBondContact O-CG2 3.39Å
409L94.8Very high91.5Very high0 Ų072.2 Ų72.20%039%0.387CS..Hα-helixtrans-68.6-39.9174.7-72.5165000112.1V369 V372 Q405 L406 L407 A411 V412 R424 A427 V428V369-L409 HydrophobicContact CG1-CD2 4.46Å; V369-L409 HydrophobicContact CG2-CD2 4.48Å; V372-L409 HydrophobicContact CB-CD2 4.03Å; V372-L409 HydrophobicContact CB-CG 4.25Å; V372-L409 HydrophobicContact CG1-CD1 3.9Å; V372-L409 HydrophobicContact CG1-CD2 4.01Å; V372-L409 HydrophobicContact CG1-CG 3.78Å; V372-L409 HydrophobicContact CG2-CD2 4.17Å; V372-L409 HydrophobicContact CG2-CG 4.25Å; Q405-L409 WeakPolarHBondContact O-CG 3.5Å; Q405-L409 PolarHBondContact O-N 3.32Å; L406-L409 WeakPolarHBondContact O-CB 3.37Å; L406-L409 PolarHBondContact O-N 3.09Å; L406-L409 VanDerWaalsContact O-N 3.11Å; L407-L409 VanDerWaalsContact C-N 3.32Å; L407-L409 PolarHBondContact O-N 3.1Å; L409-A411 VanDerWaalsContact C-N 3.26Å; L409-A411 PolarHBondContact O-N 3.34Å; L409-V412 WeakPolarHBondContact O-CB 3.48Å; L409-V412 PolarHBondContact O-N 3.12Å; L409-V412 VanDerWaalsContact O-N 3.1Å; L409-R424 HydrophobicContact CB-CG 4.44Å; L409-R424 HydrophobicContact CD2-CG 4.36Å; L409-R424 VanDerWaalsContact O-CD 3.3Å; L409-R424 WeakPolarHBondContact O-CD 3.32Å; L409-A427 HydrophobicContact CD1-CB 3.81Å; L409-A427 HydrophobicContact CD2-CB 3.65Å; L409-A427 HydrophobicContact CG-CB 4.41Å; L409-V428 HydrophobicContact CB-CG2 3.97Å; L409-V428 HydrophobicContact CD1-CG2 3.82Å; L409-V428 HydrophobicContact CG-CG2 4.45Å
410D93.3Very high91Very high110 Ų11068.8 Ų68.859%0.58837%0.371SS*.Hα-helixtrans-63.8-33.1177.3-72-24.7000112.3L406 L407 V412L406-D410 PolarHBondContact O-N 2.86Å; L407-D410 PolarHBondContact O-N 3.36Å; D410-V412 PolarHBondContact O-N 3.34Å
411A92.8Very high90.6Very high84 Ų8466.5 Ų66.569%0.69436%0.359SS*.THydrogen-bonded Turntrans-72.8-9.7175.200000114.2L407 L409 D413L407-A411 PolarHBondContact O-N 2.83Å; L407-A411 VanDerWaalsContact O-N 3.11Å; L409-A411 VanDerWaalsContact C-N 3.26Å; L409-A411 PolarHBondContact O-N 3.34Å; A411-D413 PolarHBondContact O-N 3.08Å
412V90.1Very high90.3Very high11 Ų1166.8 Ų66.87%0.06737%0.368CS..  trans-77.1110.3176.5-178.40000109.9A368 V369 A408 L409 D410 P414 R424A368-V412 HydrophobicContact CB-CG2 3.95Å; V369-V412 HydrophobicContact CG2-CG1 4.15Å; V369-V412 HydrophobicContact CG2-CG2 4.47Å; A408-V412 WeakPolarHBondContact O-CG2 3.39Å; L409-V412 WeakPolarHBondContact O-CB 3.48Å; L409-V412 PolarHBondContact O-N 3.12Å; L409-V412 VanDerWaalsContact O-N 3.1Å; D410-V412 PolarHBondContact O-N 3.34Å; V412-P414 VanDerWaalsContact O-CD 3.31Å; V412-P414 WeakPolarHBondContact O-CD 3.4Å; V412-R424 PolarHBondContact O-NH1 3.15Å
413D87.2Confident90Very high98 Ų9867.8 Ų67.852%0.52438%0.376SS..  trans-78.4115168.2-1798.4000110.5S365 A411 Q415S365-D413 VanDerWaalsContact CB-O 3.3Å; S365-D413 WeakPolarHBondContact CB-O 3.46Å; S365-D413 PolarHBondContact OG-O 3.01Å; A411-D413 PolarHBondContact O-N 3.08Å; D413-Q415 PolarHBondContact O-N 2.6Å; D413-Q415 PolarHBondContact OD1-N 3.46Å
414P80Confident89.8Confident13 Ų1368.3 Ų68.38%0.08437%0.371CS..  trans-75.2-6.4178.531.1-34.9000113.9V412 G416 E417 C420 K421V412-P414 VanDerWaalsContact O-CD 3.31Å; V412-P414 WeakPolarHBondContact O-CD 3.4Å; P414-G416 PolarHBondContact O-N 3.36Å; P414-E417 WeakPolarHBondContact O-CB 3.42Å; P414-E417 PolarHBondContact O-N 3.12Å; P414-C420 HydrophobicContact CB-CB 4.19Å; P414-K421 HydrophobicContact CB-CG 3.55Å; P414-K421 HydrophobicContact CG-CD 4.47Å; P414-K421 HydrophobicContact CG-CG 3.68Å
415Q81Confident89.6Confident134 Ų13467.6 Ų67.663%0.62637%0.368SS*.THydrogen-bonded Turntrans48.629.5-179.3-62.4-172.6-7.600114.4H363 D413H363-Q415 PolarHBondContact CE1-OE1 3.22Å; H363-Q415 PolarHBondContact NE2-OE1 2.76Å; D413-Q415 PolarHBondContact O-N 2.6Å; D413-Q415 PolarHBondContact OD1-N 3.46Å
416G76.4Confident89.5Confident55 Ų5573.6 Ų73.657%0.56740%0.396SS*.THydrogen-bonded Turntrans85.6-5.5-178.500000116P414 E418P414-G416 PolarHBondContact O-N 3.36Å; G416-E418 PolarHBondContact O-N 2.96Å
417E83Confident89.4Confident76 Ų7672 Ų7236%0.35539%0.388SS..  trans-72.3113.6178.9-168.5-175178.200111.5P414 K419 C420 K421P414-E417 WeakPolarHBondContact O-CB 3.42Å; P414-E417 PolarHBondContact O-N 3.12Å; E417-K419 VanDerWaalsContact C-N 3.29Å; E417-K419 HydrophobicContact CG-CB 4.3Å; E417-K419 PolarHBondContact O-N 3.38Å; E417-C420 HydrophobicContact CB-CB 4.03Å; E417-C420 HydrophobicContact CG-CB 4.36Å; E417-C420 PolarHBondContact O-N 3.45Å; E417-C420 VanDerWaalsContact O-N 3.15Å; E417-K421 PolarHBondContact O-N 3.1Å
418E85.6Confident89.4Confident128 Ų12868.1 Ų68.160%0.59837%0.369SS*.Hα-helixtrans-63.8-34.7-176.1-164.855.7-144.300112.7G416 C420 K421 A422G416-E418 PolarHBondContact O-N 2.96Å; E418-C420 PolarHBondContact O-N 3.46Å; E418-K421 PolarHBondContact O-N 3.05Å; E418-K421 IonicContact OE2-NZ 3.28Å; E418-A422 WeakPolarHBondContact O-CB 3.41Å; E418-A422 PolarHBondContact O-N 3.48Å
419K86.3Confident89.5Confident162 Ų16272.7 Ų72.770%0.70438%0.378SS*.Hα-helixtrans-62.4-43175-67-178.5179.2177.50111.7E417 A422 A423E417-K419 VanDerWaalsContact C-N 3.29Å; E417-K419 HydrophobicContact CG-CB 4.3Å; E417-K419 PolarHBondContact O-N 3.38Å; K419-A422 PolarHBondContact O-N 2.87Å; K419-A423 WeakPolarHBondContact O-CB 3.36Å; K419-A423 PolarHBondContact O-N 3.18Å
420C87.1Confident89.6Confident0 Ų073.8 Ų73.80%038%0.383CS..Hα-helixtrans-65.5-42.6177-173.10000111.1S365 P414 E417 E418 A422 A423 R424S365-C420 WeakPolarHBondContact CB-SG 3.31Å; P414-C420 HydrophobicContact CB-CB 4.19Å; E417-C420 HydrophobicContact CB-CB 4.03Å; E417-C420 HydrophobicContact CG-CB 4.36Å; E417-C420 PolarHBondContact O-N 3.45Å; E417-C420 VanDerWaalsContact O-N 3.15Å; E418-C420 PolarHBondContact O-N 3.46Å; C420-A422 PolarHBondContact O-N 2.98Å; C420-A423 PolarHBondContact O-N 3.29Å; C420-R424 WeakPolarHBondContact O-CB 3.47Å; C420-R424 PolarHBondContact O-N 3.28Å
421K89.7Confident89.8Confident78 Ų7868.6 Ų68.634%0.33936%0.355SS..Hα-helixtrans-58.4-46.4174.6-69.6178.7-172.9166.70112.4P414 E417 E418 R424 K425P414-K421 HydrophobicContact CB-CG 3.55Å; P414-K421 HydrophobicContact CG-CD 4.47Å; P414-K421 HydrophobicContact CG-CG 3.68Å; E417-K421 PolarHBondContact O-N 3.1Å; E418-K421 PolarHBondContact O-N 3.05Å; E418-K421 IonicContact OE2-NZ 3.28Å; K421-R424 PolarHBondContact O-N 2.9Å; K421-K425 WeakPolarHBondContact O-CB 3.5Å; K421-K425 PolarHBondContact O-N 3.23Å
422A90.4Very high90Very high55 Ų5569.2 Ų69.246%0.45534%0.344SS..Hα-helixtrans-63.1-46.1178.700000111.7E418 K419 C420 R424 K425 Q426E418-A422 WeakPolarHBondContact O-CB 3.41Å; E418-A422 PolarHBondContact O-N 3.48Å; K419-A422 PolarHBondContact O-N 2.87Å; C420-A422 PolarHBondContact O-N 2.98Å; A422-R424 PolarHBondContact O-N 3.44Å; A422-K425 PolarHBondContact O-N 2.95Å; A422-Q426 PolarHBondContact O-N 3.44Å
423A90.8Very high90.3Very high20 Ų2073.4 Ų73.417%0.16537%0.366CS..Hα-helixtrans-61-44.3176.800000111.9V369 K419 C420 K425 Q426 A427V369-A423 HydrophobicContact CG1-CB 4.16Å; K419-A423 WeakPolarHBondContact O-CB 3.36Å; K419-A423 PolarHBondContact O-N 3.18Å; C420-A423 PolarHBondContact O-N 3.29Å; A423-K425 PolarHBondContact O-N 3.46Å; A423-Q426 PolarHBondContact O-N 3.38Å; A423-A427 PolarHBondContact O-N 2.84Å
424R93.5Very high90.8Very high73 Ų7368.8 Ų68.828%0.27534%0.341SS..Hα-helixtrans-59.2-47.3174.9-174-177.170.916710.1111.3V369 L409 V412 C420 K421 A422 Q426 A427 V428V369-R424 HydrophobicContact CG2-CB 4.17Å; L409-R424 HydrophobicContact CB-CG 4.44Å; L409-R424 HydrophobicContact CD2-CG 4.36Å; L409-R424 VanDerWaalsContact O-CD 3.3Å; L409-R424 WeakPolarHBondContact O-CD 3.32Å; V412-R424 PolarHBondContact O-NH1 3.15Å; C420-R424 WeakPolarHBondContact O-CB 3.47Å; C420-R424 PolarHBondContact O-N 3.28Å; K421-R424 PolarHBondContact O-N 2.9Å; A422-R424 PolarHBondContact O-N 3.44Å; R424-Q426 VanDerWaalsContact C-N 3.29Å; R424-Q426 PolarHBondContact O-N 3.04Å; R424-A427 PolarHBondContact O-N 3.39Å; R424-V428 WeakPolarHBondContact O-CG2 3.45Å; R424-V428 PolarHBondContact O-N 3.5Å
425K93.9Very high91.6Very high125 Ų12569.8 Ų69.854%0.54335%0.346SS..Hα-helixtrans-60.4-39.3178.2-170.1178.2-173.21770112K421 A422 A423 R429K421-K425 WeakPolarHBondContact O-CB 3.5Å; K421-K425 PolarHBondContact O-N 3.23Å; A422-K425 PolarHBondContact O-N 2.95Å; A423-K425 PolarHBondContact O-N 3.46Å; K425-R429 WeakPolarHBondContact O-CG 3.48Å; K425-R429 PolarHBondContact O-N 3.33Å; K425-R429 VanDerWaalsContact O-N 3.11Å
426Q94Very high92.3Very high139 Ų13966.7 Ų66.765%0.6534%0.339SS*.Hα-helixtrans-66.3-42.9175.5-175.1177.2-2.800111.8A422 A423 R424 R429 L430A422-Q426 PolarHBondContact O-N 3.44Å; A423-Q426 PolarHBondContact O-N 3.38Å; R424-Q426 VanDerWaalsContact C-N 3.29Å; R424-Q426 PolarHBondContact O-N 3.04Å; Q426-R429 PolarHBondContact O-N 3.19Å; Q426-L430 PolarHBondContact O-N 2.84Å
427A95.8Very high93.2Very high0 Ų064.3 Ų64.30%031%0.313CS..Hα-helixtrans-63.6-39.9176.500000112.4V369 L373 L409 A423 R424 L430 A431V369-A427 HydrophobicContact CG1-CB 4.05Å; L373-A427 HydrophobicContact CD2-CB 3.79Å; L373-A427 HydrophobicContact CG-CB 4.24Å; L409-A427 HydrophobicContact CD1-CB 3.81Å; L409-A427 HydrophobicContact CD2-CB 3.65Å; L409-A427 HydrophobicContact CG-CB 4.41Å; A423-A427 PolarHBondContact O-N 2.84Å; R424-A427 PolarHBondContact O-N 3.39Å; A427-L430 PolarHBondContact O-N 3.18Å; A427-A431 PolarHBondContact O-N 3.34Å
428V97Very high93.9Very high29 Ų2960.7 Ų60.718%0.17630%0.296CS..Hα-helixtrans-61.4-47.2174.6170.50000110.8L406 L409 R424 L430 A431 Q432L406-V428 HydrophobicContact CD2-CG1 4.11Å; L409-V428 HydrophobicContact CB-CG2 3.97Å; L409-V428 HydrophobicContact CD1-CG2 3.82Å; L409-V428 HydrophobicContact CG-CG2 4.45Å; R424-V428 WeakPolarHBondContact O-CG2 3.45Å; R424-V428 PolarHBondContact O-N 3.5Å; V428-L430 VanDerWaalsContact C-N 3.3Å; V428-L430 PolarHBondContact O-N 2.93Å; V428-A431 PolarHBondContact O-N 2.65Å; V428-Q432 HydrophobicContact CG1-CG 4.42Å; V428-Q432 WeakPolarHBondContact O-CG 3.43Å; V428-Q432 PolarHBondContact O-N 3.12Å
429R96.6Very high94.2Very high137 Ų13756.8 Ų56.852%0.51728%0.279SS..Hα-helixtrans-59.1-41.9176.5-73.6172.3177.4173.4-6.3112K425 Q426 Q432 N433K425-R429 WeakPolarHBondContact O-CG 3.48Å; K425-R429 PolarHBondContact O-N 3.33Å; K425-R429 VanDerWaalsContact O-N 3.11Å; Q426-R429 PolarHBondContact O-N 3.19Å; R429-Q432 PolarHBondContact O-N 3.46Å; R429-N433 WeakPolarHBondContact O-CB 3.32Å; R429-N433 PolarHBondContact O-N 3.32Å; R429-N433 PolarHBondContact O-ND2 2.87Å; R429-N433 PolarHBondContact O-OD1 2.95Å
430L97.2Very high94.6Very high22 Ų2250.3 Ų50.312%0.11525%0.252CS..Hα-helixtrans-62.3-47.4176.7175.365.2000111.4L348 L373 L376 Q426 A427 V428 Q432 N433 I434L348-L430 HydrophobicContact CD1-CD2 3.95Å; L348-L430 HydrophobicContact CD2-CD2 3.79Å; L348-L430 HydrophobicContact CG-CD2 4.41Å; L373-L430 HydrophobicContact CD2-CD2 3.75Å; L376-L430 HydrophobicContact CB-CD2 4.49Å; L376-L430 HydrophobicContact CD1-CD2 4.15Å; L376-L430 HydrophobicContact CD1-CG 4.41Å; Q426-L430 PolarHBondContact O-N 2.84Å; A427-L430 PolarHBondContact O-N 3.18Å; V428-L430 VanDerWaalsContact C-N 3.3Å; V428-L430 PolarHBondContact O-N 2.93Å; L430-Q432 VanDerWaalsContact C-N 3.34Å; L430-Q432 PolarHBondContact O-N 3.41Å; L430-N433 PolarHBondContact O-N 3.07Å; L430-I434 HydrophobicContact CD1-CD1 4.06Å; L430-I434 HydrophobicContact CD1-CG1 4.3Å; L430-I434 HydrophobicContact CG-CD1 3.93Å; L430-I434 VanDerWaalsContact O-CG1 3.28Å; L430-I434 WeakPolarHBondContact O-CG1 3.45Å; L430-I434 PolarHBondContact O-N 3.04Å
431A97.5Very high94.8Very high1 Ų152.9 Ų52.91%0.00826%0.263CS..Hα-helixtrans-59.4-43.8176.900000112.1L376 L406 A427 V428 N433 I434 L435L376-A431 HydrophobicContact CD1-CB 4.03Å; L376-A431 HydrophobicContact CD2-CB 3.78Å; L406-A431 HydrophobicContact CD2-CB 3.66Å; L406-A431 HydrophobicContact CG-CB 4.07Å; A427-A431 PolarHBondContact O-N 3.34Å; V428-A431 PolarHBondContact O-N 2.65Å; A431-N433 PolarHBondContact O-N 3.36Å; A431-I434 PolarHBondContact O-N 3.36Å; A431-L435 PolarHBondContact O-N 3.24Å
432Q96.8Very high94.7Very high98 Ų9849.3 Ų49.346%0.45825%0.248SC..Hα-helixtrans-63.1-39175.4-72.2174.7-26.100112.6L406 V428 R429 L430 L435 S436L406-Q432 HydrophobicContact CD2-CG 4.32Å; V428-Q432 HydrophobicContact CG1-CG 4.42Å; V428-Q432 WeakPolarHBondContact O-CG 3.43Å; V428-Q432 PolarHBondContact O-N 3.12Å; R429-Q432 PolarHBondContact O-N 3.46Å; L430-Q432 VanDerWaalsContact C-N 3.34Å; L430-Q432 PolarHBondContact O-N 3.41Å; Q432-L435 PolarHBondContact O-N 3.47Å; Q432-S436 WeakPolarHBondContact O-CB 3.34Å; Q432-S436 PolarHBondContact O-N 2.92Å; Q432-S436 PolarHBondContact O-OG 3.15Å
433N96.8Very high94.5Very high98 Ų9848.1 Ų48.152%0.52423%0.234SC..Hα-helixtrans-66.6-40.8176.1-71.9-12.2000111.8R429 L430 A431 L435 S436 Y437R429-N433 WeakPolarHBondContact O-CB 3.32Å; R429-N433 PolarHBondContact O-N 3.32Å; R429-N433 PolarHBondContact O-ND2 2.87Å; R429-N433 PolarHBondContact O-OD1 2.95Å; L430-N433 PolarHBondContact O-N 3.07Å; A431-N433 PolarHBondContact O-N 3.36Å; N433-L435 VanDerWaalsContact C-N 3.34Å; N433-S436 PolarHBondContact O-N 3.35Å; N433-Y437 WeakPolarHBondContact O-CB 3.24Å; N433-Y437 PolarHBondContact O-N 3.48Å
434I97.6Very high94.2Very high2 Ų253 Ų531%0.0125%0.253CS..Hα-helixtrans-64.1-42.5176.4-63.3160.5000110.2L376 Q380 V383 L402 L430 A431 Y437 L438L376-I434 HydrophobicContact CB-CD1 4.21Å; L376-I434 HydrophobicContact CD2-CD1 4.18Å; Q380-I434 HydrophobicContact CB-CD1 3.88Å; Q380-I434 HydrophobicContact CB-CG1 4.17Å; Q380-I434 HydrophobicContact CB-CG2 4.46Å; Q380-I434 HydrophobicContact CG-CD1 4.24Å; Q380-I434 HydrophobicContact CG-CG1 4.05Å; V383-I434 HydrophobicContact CB-CG2 4.28Å; V383-I434 HydrophobicContact CG1-CG2 4.36Å; V383-I434 HydrophobicContact CG2-CG2 3.9Å; L402-I434 HydrophobicContact CD1-CG2 3.98Å; L402-I434 HydrophobicContact CD2-CB 4.02Å; L402-I434 HydrophobicContact CD2-CG2 3.7Å; L402-I434 HydrophobicContact CG-CG2 4.47Å; L430-I434 HydrophobicContact CD1-CD1 4.06Å; L430-I434 HydrophobicContact CD1-CG1 4.3Å; L430-I434 HydrophobicContact CG-CD1 3.93Å; L430-I434 VanDerWaalsContact O-CG1 3.28Å; L430-I434 WeakPolarHBondContact O-CG1 3.45Å; L430-I434 PolarHBondContact O-N 3.04Å; A431-I434 PolarHBondContact O-N 3.36Å; I434-Y437 PolarHBondContact O-N 3.38Å; I434-L438 PolarHBondContact O-N 3.47Å
435L96.3Very high94Very high34 Ų3450.9 Ų50.918%0.17825%0.246CC..Hα-helixtrans-62.7-49.1175.7-176.461.7000111.6E399 L402 A431 Q432 N433 Y437 L438 D439E399-L435 HydrophobicContact CB-CD1 4.48Å; E399-L435 HydrophobicContact CG-CD1 4.11Å; L402-L435 HydrophobicContact CD1-CB 4.04Å; L402-L435 HydrophobicContact CD1-CD1 3.96Å; A431-L435 PolarHBondContact O-N 3.24Å; Q432-L435 PolarHBondContact O-N 3.47Å; N433-L435 VanDerWaalsContact C-N 3.34Å; L435-Y437 PolarHBondContact O-N 3.25Å; L435-L438 WeakPolarHBondContact O-CB 3.27Å; L435-L438 PolarHBondContact O-N 3.38Å; L435-D439 PolarHBondContact O-N 3.28Å
436S95.3Very high93.7Very high69 Ų6948.4 Ų48.448%0.48324%0.236SC..Hα-helixtrans-59-34.5177-56.40000112.1Q432 N433 L440Q432-S436 WeakPolarHBondContact O-CB 3.34Å; Q432-S436 PolarHBondContact O-N 2.92Å; Q432-S436 PolarHBondContact O-OG 3.15Å; N433-S436 PolarHBondContact O-N 3.35Å; S436-L440 WeakPolarHBondContact O-CB 3.38Å; S436-L440 PolarHBondContact O-N 3.44Å
437Y96.6Very high93.2Very high4 Ų444.3 Ų44.32%0.01622%0.215CC..Hα-helixtrans-71.3-40.6175.9-178.6-114000112.5I337 E338 T341 V383 L384 N433 I434 L435 D439 L440 K441I337-Y437 HydrophobicContact CG2-CD2 3.86Å; I337-Y437 HydrophobicContact CG2-CE2 4.44Å; E338-Y437 HydrophobicContact CB-CE2 4.23Å; E338-Y437 HydrophobicContact CG-CE2 3.84Å; T341-Y437 HydrophobicContact CG2-CD1 3.57Å; T341-Y437 HydrophobicContact CG2-CD2 4.33Å; T341-Y437 HydrophobicContact CG2-CE1 3.79Å; T341-Y437 HydrophobicContact CG2-CG 3.85Å; T341-Y437 WeakPolarHBondContact OG1-CD2 3.2Å; V383-Y437 HydrophobicContact CG1-CD1 3.68Å; V383-Y437 HydrophobicContact CG1-CE1 4.2Å; L384-Y437 HydrophobicContact CD2-CE1 4.11Å; N433-Y437 WeakPolarHBondContact O-CB 3.24Å; N433-Y437 PolarHBondContact O-N 3.48Å; I434-Y437 PolarHBondContact O-N 3.38Å; L435-Y437 PolarHBondContact O-N 3.25Å; Y437-D439 VanDerWaalsContact C-N 3.32Å; Y437-L440 HydrophobicContact CD2-CD2 4.4Å; Y437-L440 HydrophobicContact CE2-CD2 4.4Å; Y437-L440 PolarHBondContact O-N 3.28Å; Y437-K441 HydrophobicContact CD1-CD 4.34Å; Y437-K441 HydrophobicContact CD1-CG 4.49Å; Y437-K441 HydrophobicContact CE1-CD 3.62Å; Y437-K441 HydrophobicContact CE1-CG 4.03Å; Y437-K441 HydrophobicContact CE2-CD 4.48Å; Y437-K441 HydrophobicContact CE2-CG 4.12Å; Y437-K441 WeakPolarHBondContact O-CG 3.27Å; Y437-K441 PolarHBondContact O-N 3.23Å
438L96.3Very high93.1Very high0 Ų046.5 Ų46.50%023%0.226CC..Hα-helixtrans-60.2-43.7172.7179.162.8000111.2V383 F386 Y395 L398 L402 I434 L435 L440 K441 S442V383-L438 HydrophobicContact CG1-CB 3.95Å; V383-L438 HydrophobicContact CG1-CD1 4.21Å; V383-L438 HydrophobicContact CG2-CB 4.5Å; V383-L438 HydrophobicContact CG2-CD1 4.39Å; F386-L438 HydrophobicContact CB-CD1 4.43Å; F386-L438 HydrophobicContact CD1-CD1 3.61Å; F386-L438 HydrophobicContact CE1-CD1 3.94Å; F386-L438 HydrophobicContact CG-CD1 3.93Å; Y395-L438 HydrophobicContact CD2-CD1 3.91Å; Y395-L438 HydrophobicContact CD2-CD2 4.15Å; Y395-L438 HydrophobicContact CD2-CG 3.78Å; Y395-L438 HydrophobicContact CE2-CD1 4.33Å; Y395-L438 HydrophobicContact CE2-CD2 4.17Å; Y395-L438 HydrophobicContact CE2-CG 3.73Å; L398-L438 HydrophobicContact CB-CD2 3.71Å; L398-L438 HydrophobicContact CD1-CD1 4.16Å; L402-L438 HydrophobicContact CD1-CD2 4.27Å; I434-L438 PolarHBondContact O-N 3.47Å; L435-L438 WeakPolarHBondContact O-CB 3.27Å; L435-L438 PolarHBondContact O-N 3.38Å; L438-L440 VanDerWaalsContact C-N 3.28Å; L438-L440 PolarHBondContact O-N 2.91Å; L438-K441 PolarHBondContact O-N 3.12Å; L438-S442 PolarHBondContact O-N 3.39Å; L438-S442 VanDerWaalsContact O-N 3.1Å; L438-S442 PolarHBondContact O-OG 3Å; L438-S442 VanDerWaalsContact O-OG 3.11Å
439D93.7Very high92.9Very high46 Ų4647.4 Ų47.425%0.24623%0.228CC..Hα-helixtrans-59.6-39.9174.8-67.6-19.7000112R390 Y395 L435 Y437 S442 D443R390-D439 PolarHBondContact NH2-O 3.05Å; Y395-D439 PolarHBondContact OH-OD1 3.23Å; L435-D439 PolarHBondContact O-N 3.28Å; Y437-D439 VanDerWaalsContact C-N 3.32Å; D439-S442 PolarHBondContact O-OG 3.04Å; D439-D443 PolarHBondContact O-N 2.99Å
440L93Very high92.7Very high26 Ų2642.4 Ų42.414%0.13621%0.212CC..Hα-helixtrans-70.2-40.3179.3-178.5141.4000112.4R334 I337 S436 Y437 L438 S442 D443R334-L440 HydrophobicContact CG-CD1 4.09Å; R334-L440 HydrophobicContact CG-CG 4.5Å; I337-L440 HydrophobicContact CD1-CD1 3.78Å; I337-L440 HydrophobicContact CG2-CD1 4.25Å; S436-L440 WeakPolarHBondContact O-CB 3.38Å; S436-L440 PolarHBondContact O-N 3.44Å; Y437-L440 HydrophobicContact CD2-CD2 4.4Å; Y437-L440 HydrophobicContact CE2-CD2 4.4Å; Y437-L440 PolarHBondContact O-N 3.28Å; L438-L440 VanDerWaalsContact C-N 3.28Å; L438-L440 PolarHBondContact O-N 2.91Å; L440-S442 VanDerWaalsContact C-N 3.28Å; L440-S442 PolarHBondContact O-N 3.32Å; L440-D443 WeakPolarHBondContact O-CB 3.25Å; L440-D443 PolarHBondContact O-N 3Å
441K90.9Very high92.4Very high55 Ų5543.6 Ų43.624%0.23922%0.218CC..Hα-helixtrans-66.2-32.1175.7-70.5-165.296.5-175.20112.6V383 L384 F386 Y437 L438 D443V383-K441 PolarHBondContact O-NZ 3.39Å; L384-K441 PolarHBondContact O-NZ 2.96Å; F386-K441 HydrophobicContact CD1-CB 4.4Å; F386-K441 WeakPolarHBondContact O-CE 3.47Å; F386-K441 PolarHBondContact O-NZ 3.34Å; Y437-K441 HydrophobicContact CD1-CD 4.34Å; Y437-K441 HydrophobicContact CD1-CG 4.49Å; Y437-K441 HydrophobicContact CE1-CD 3.62Å; Y437-K441 HydrophobicContact CE1-CG 4.03Å; Y437-K441 HydrophobicContact CE2-CD 4.48Å; Y437-K441 HydrophobicContact CE2-CG 4.12Å; Y437-K441 WeakPolarHBondContact O-CG 3.27Å; Y437-K441 PolarHBondContact O-N 3.23Å; L438-K441 PolarHBondContact O-N 3.12Å; K441-D443 VanDerWaalsContact C-N 3.3Å
442S88.9Confident92.1Very high3 Ų346.3 Ų46.32%0.02123%0.231CC..THydrogen-bonded Turntrans-850.718064.60000114.1R390 Y395 L438 D439 L440 E444R390-S442 VanDerWaalsContact CG-OG 3.3Å; R390-S442 WeakPolarHBondContact CG-OG 3.45Å; R390-S442 PolarHBondContact NE-OG 2.97Å; Y395-S442 VanDerWaalsContact CE2-OG 3.31Å; Y395-S442 WeakPolarHBondContact CE2-OG 3.23Å; L438-S442 PolarHBondContact O-N 3.39Å; L438-S442 VanDerWaalsContact O-N 3.1Å; L438-S442 PolarHBondContact O-OG 3Å; L438-S442 VanDerWaalsContact O-OG 3.11Å; D439-S442 PolarHBondContact O-OG 3.04Å; L440-S442 VanDerWaalsContact C-N 3.28Å; L440-S442 PolarHBondContact O-N 3.32Å; S442-E444 VanDerWaalsContact C-N 3.35Å; S442-E444 PolarHBondContact O-N 3.16Å
443D86.1Confident91.8Very high29 Ų2942.9 Ų42.916%0.15522%0.216CC..SBendtrans-80.7-4.1-166.4-166.927.6000114.8K138 R334 D439 L440 K441 W445K138-D443 WeakPolarHBondContact CD-O 3.47Å; K138-D443 WeakPolarHBondContact CE-O 3.31Å; K138-D443 WeakPolarHBondContact CE-OD1 3.36Å; K138-D443 PolarHBondContact NZ-O 3.38Å; K138-D443 IonicContact NZ-OD1 3.77Å; K138-D443 PolarHBondContact NZ-OD1 3.34Å; R334-D443 IonicContact CZ-OD2 3.27Å; R334-D443 IonicContact NH1-OD2 2.83Å; R334-D443 PolarHBondContact NH1-OD2 3.28Å; R334-D443 IonicContact NH2-OD2 3.19Å; R334-D443 PolarHBondContact NH2-OD2 3.42Å; D439-D443 PolarHBondContact O-N 2.99Å; L440-D443 WeakPolarHBondContact O-CB 3.25Å; L440-D443 PolarHBondContact O-N 3Å; K441-D443 VanDerWaalsContact C-N 3.3Å; D443-W445 PolarHBondContact O-N 3.44Å
444E83.9Confident91.4Very high122 Ų12238.9 Ų38.957%0.5719%0.194SC*.  trans49.617.3176.8-60-178.4164.600115.1N389 S442N389-E444 WeakPolarHBondContact CB-OE1 3.22Å; S442-E444 VanDerWaalsContact C-N 3.35Å; S442-E444 PolarHBondContact O-N 3.16Å
445W90.4Very high91Very high30 Ų3041.8 Ų41.811%0.11421%0.208CC..  trans-75.6138.2-175.8177.191.1000110.2T135 E330 A331 D443T135-W445 HydrophobicContact CG2-CZ2 4.41Å; T135-W445 PolarHBondContact O-NE1 3.09Å; E330-W445 HydrophobicContact CB-CH2 3.94Å; E330-W445 HydrophobicContact CB-CZ2 3.82Å; E330-W445 HydrophobicContact CG-CD2 4.44Å; E330-W445 HydrophobicContact CG-CH2 3.84Å; E330-W445 HydrophobicContact CG-CZ2 3.61Å; E330-W445 HydrophobicContact CG-CZ3 4.36Å; A331-W445 HydrophobicContact CB-CH2 4.14Å; A331-W445 HydrophobicContact CB-CZ3 4.26Å; D443-W445 PolarHBondContact O-N 3.44Å
446E86.3Confident90.5Very high73 Ų7342.4 Ų42.434%0.34121%0.21SC..  trans-128.4150.6176.6-62.6-179.5165.800110G141 R149G141-E446 WeakPolarHBondContact CA-OE2 3.19Å; G141-E446 PolarHBondContact N-OE2 3.09Å; R149-E446 PolarHBondContact NH1-O 3.46Å; R149-E446 PolarHBondContact NH2-O 2.78Å
447Y84.8Confident90.1Very high52 Ų5240 Ų4020%0.20419%0.186CC..  trans-76.80175.350.8-109.1000113.9R146 R149 L270 R271 I276R146-Y447 VanDerWaalsContact CD-O 3.28Å; R146-Y447 WeakPolarHBondContact CD-O 3.35Å; R149-Y447 PolarHBondContact NH2-OXT 3.04Å; L270-Y447 HydrophobicContact CB-CD2 3.76Å; L270-Y447 HydrophobicContact CB-CE2 4.3Å; R271-Y447 HydrophobicContact CG-CE2 4.03Å; I276-Y447 HydrophobicContact CD1-CD1 4.18Å; I276-Y447 HydrophobicContact CD1-CG 4.2Å; I276-Y447 HydrophobicContact CG2-CD1 4.31Å; I276-Y447 HydrophobicContact CG2-CE1 3.71Å; I276-Y447 HydrophobicContact CG2-CE2 3.91Å; I276-Y447 VanDerWaalsContact CG2-CZ 3.47Å

Retrieved 447 of 447 residues in 141.5 ms (Link to these results)

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