A0A060XNT2_ONCMY Loading...

Prefoldin subunit 6

Binds specifically to cytosolic chaperonin (c-CPN) and transfers target proteins to it. Binds to nascent polypeptide chain and promotes folding in an environment in which there are many competing pathways for nonnative proteins.

AlphaFold DB (A0A4W5QH19), UniProt , Accession A0A060XNT2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 126 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
1M68.6Low88.7Confident204 Ų20497.2 Ų97.2100%1.00549%0.494SS*.  0-54.80-84.8-174.8-94.400112.1E3 A4 I5M1-E3 PolarHBondContact O-N 3.02Å; M1-A4 PolarHBondContact O-N 3.41Å; M1-I5 PolarHBondContact O-N 2.72Å
2A78.8Confident89.3Confident33 Ų3391.7 Ų91.727%0.27347%0.465SS..Hα-helixtrans-57.8-41.8179.700000114.4A4 I5 Q6A2-A4 PolarHBondContact O-N 2.94Å; A2-I5 PolarHBondContact O-N 2.9Å; A2-Q6 PolarHBondContact O-N 3.31Å
3E86Confident89.7Confident160 Ų16088.8 Ų88.875%0.74845%0.451SS*.Hα-helixtrans-64.3-36.9-180-167178.5-175.300113.3M1 Q6 K7M1-E3 PolarHBondContact O-N 3.02Å; E3-Q6 PolarHBondContact O-N 2.81Å; E3-K7 PolarHBondContact O-N 2.76Å
4A89.8Confident90.2Very high60 Ų6089.9 Ų89.950%0.49645%0.453SS..Hα-helixtrans-67.7-37.2175.900000111.9M1 A2 K8M1-A4 PolarHBondContact O-N 3.41Å; A2-A4 PolarHBondContact O-N 2.94Å; A4-K8 WeakPolarHBondContact O-CG 3.47Å; A4-K8 PolarHBondContact O-N 2.91Å; A4-K8 VanDerWaalsContact O-N 3.16Å
5I90.1Very high90.6Very high27 Ų2790.5 Ų90.514%0.13845%0.452CS..Hα-helixtrans-68.6-42.9175.5-62168.1000110.1M1 A2 K7 K8 L9 E114 Y115 A118M1-I5 PolarHBondContact O-N 2.72Å; A2-I5 PolarHBondContact O-N 2.9Å; I5-K7 VanDerWaalsContact C-N 3.33Å; I5-K7 PolarHBondContact O-N 3.37Å; I5-K8 PolarHBondContact O-N 2.95Å; I5-L9 WeakPolarHBondContact O-CB 3.37Å; I5-L9 PolarHBondContact O-N 3.35Å; I5-E114 HydrophobicContact CD1-CB 4.39Å; I5-Y115 HydrophobicContact CB-CD2 4.21Å; I5-Y115 HydrophobicContact CG2-CD2 3.98Å; I5-Y115 HydrophobicContact CG2-CG 4.32Å; I5-A118 HydrophobicContact CD1-CB 3.86Å
6Q90.3Very high90.9Very high105 Ų10587 Ų8749%0.49143%0.432SS..Hα-helixtrans-57.4-45175.3-170.5-179.9-0.900111.9A2 E3 K8 L9 Q10 Y115A2-Q6 PolarHBondContact O-N 3.31Å; E3-Q6 PolarHBondContact O-N 2.81Å; Q6-K8 PolarHBondContact O-N 2.97Å; Q6-L9 PolarHBondContact O-N 2.97Å; Q6-Q10 PolarHBondContact O-N 2.88Å; Q6-Y115 HydrophobicContact CB-CD2 4.48Å; Q6-Y115 HydrophobicContact CB-CE2 3.78Å; Q6-Y115 HydrophobicContact CG-CE2 4.33Å
7K94.1Very high91.1Very high168 Ų16887.4 Ų87.473%0.7343%0.432SS*.Hα-helixtrans-63.7-39.9177.8-169.9174.4-178.1176.30112.5E3 I5 S11E3-K7 PolarHBondContact O-N 2.76Å; I5-K7 VanDerWaalsContact C-N 3.33Å; I5-K7 PolarHBondContact O-N 3.37Å; K7-S11 PolarHBondContact O-N 3.28Å; K7-S11 VanDerWaalsContact O-N 3.09Å
8K93.9Very high91.4Very high132 Ų13287.2 Ų87.257%0.57443%0.43SS*.Hα-helixtrans-63.9-43.7174.3-74-179.6178.6-1760111.6A4 I5 Q6 S11 E12 L111A4-K8 WeakPolarHBondContact O-CG 3.47Å; A4-K8 PolarHBondContact O-N 2.91Å; A4-K8 VanDerWaalsContact O-N 3.16Å; I5-K8 PolarHBondContact O-N 2.95Å; Q6-K8 PolarHBondContact O-N 2.97Å; K8-S11 PolarHBondContact O-N 3.5Å; K8-E12 PolarHBondContact O-N 2.87Å; K8-L111 HydrophobicContact CB-CD1 4.17Å; K8-L111 HydrophobicContact CB-CD2 4.17Å; K8-L111 HydrophobicContact CD-CD2 4.36Å
9L93.6Very high91.6Very high35 Ų3584.1 Ų84.118%0.18342%0.415CS..Hα-helixtrans-61.9-45.3179-169.9146.9000111.6I5 Q6 S11 E12 L13 L111 Q112I5-L9 WeakPolarHBondContact O-CB 3.37Å; I5-L9 PolarHBondContact O-N 3.35Å; Q6-L9 PolarHBondContact O-N 2.97Å; L9-S11 PolarHBondContact O-N 3.44Å; L9-E12 PolarHBondContact O-N 3.4Å; L9-L13 VanDerWaalsContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CB 3.44Å; L9-L13 PolarHBondContact O-N 2.89Å; L9-L111 HydrophobicContact CD1-CB 4.35Å; L9-Q112 HydrophobicContact CD1-CB 4.44Å; L9-Q112 HydrophobicContact CD1-CG 3.64Å
10Q94.4Very high91.7Very high95 Ų9584.6 Ų84.644%0.44442%0.416SS..Hα-helixtrans-60.3-45.7175.3-177.160.930.500111.7Q6 L13 E14Q6-Q10 PolarHBondContact O-N 2.88Å; Q10-L13 PolarHBondContact O-N 2.86Å; Q10-E14 PolarHBondContact NE2-OE1 3.14Å; Q10-E14 WeakPolarHBondContact O-CG 3.32Å; Q10-E14 PolarHBondContact O-N 3.06Å
11S96.1Very high91.9Very high50 Ų5086.3 Ų86.335%0.3542%0.421SS..Hα-helixtrans-64.3-43.1179.8-176.10000112.8K7 K8 L9 L13 E14 K15K7-S11 PolarHBondContact O-N 3.28Å; K7-S11 VanDerWaalsContact O-N 3.09Å; K8-S11 PolarHBondContact O-N 3.5Å; L9-S11 PolarHBondContact O-N 3.44Å; S11-L13 VanDerWaalsContact C-N 3.33Å; S11-E14 PolarHBondContact O-N 3.29Å; S11-K15 WeakPolarHBondContact O-CG 3.42Å; S11-K15 PolarHBondContact O-N 2.77Å; S11-K15 VanDerWaalsContact O-N 3.14Å
12E95.9Very high93.2Very high31 Ų3179.2 Ų79.215%0.14539%0.387CS..Hα-helixtrans-67.9-34.1176.4-73.4-56.9133.900112.1K8 L9 K15 Y16 H104 V107 L108 L111K8-E12 PolarHBondContact O-N 2.87Å; L9-E12 PolarHBondContact O-N 3.4Å; E12-K15 PolarHBondContact O-N 2.97Å; E12-K15 IonicContact OE1-NZ 3.16Å; E12-K15 PolarHBondContact OE1-NZ 3.36Å; E12-Y16 WeakPolarHBondContact O-CB 3.37Å; E12-Y16 PolarHBondContact O-N 3.27Å; E12-H104 IonicContact OE2-CE1 2.71Å; E12-H104 PolarHBondContact OE2-CE1 3.15Å; E12-H104 IonicContact OE2-ND1 3.55Å; E12-H104 PolarHBondContact OE2-ND1 3.06Å; E12-V107 HydrophobicContact CG-CG1 3.99Å; E12-L108 HydrophobicContact CB-CD2 3.81Å; E12-L108 HydrophobicContact CB-CG 4.22Å; E12-L111 HydrophobicContact CB-CD1 4.38Å; E12-L111 HydrophobicContact CG-CD1 4.02Å
13L95.2Very high94Very high55 Ų5579.4 Ų79.429%0.28839%0.385SS..Hα-helixtrans-64.4-44.2175.6-174.269.4000111.3L9 Q10 S11 Y16 Q17 L108L9-L13 VanDerWaalsContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CB 3.44Å; L9-L13 PolarHBondContact O-N 2.89Å; Q10-L13 PolarHBondContact O-N 2.86Å; S11-L13 VanDerWaalsContact C-N 3.33Å; L13-Y16 PolarHBondContact O-N 3.41Å; L13-Q17 WeakPolarHBondContact O-CB 3.19Å; L13-Q17 VanDerWaalsContact O-CG 3.29Å; L13-Q17 WeakPolarHBondContact O-CG 3.19Å; L13-Q17 PolarHBondContact O-N 3.23Å; L13-L108 HydrophobicContact CB-CD2 4.28Å; L13-L108 HydrophobicContact CD1-CD1 4.49Å
14E96.3Very high94.5Very high103 Ų10375.1 Ų75.148%0.48137%0.373SS..Hα-helixtrans-61.3-43.8176.7-74.4168.5-171.200111.8Q10 S11 Q17 Q18Q10-E14 PolarHBondContact NE2-OE1 3.14Å; Q10-E14 WeakPolarHBondContact O-CG 3.32Å; Q10-E14 PolarHBondContact O-N 3.06Å; S11-E14 PolarHBondContact O-N 3.29Å; E14-Q17 PolarHBondContact O-N 3.42Å; E14-Q18 WeakPolarHBondContact O-CB 3.45Å; E14-Q18 PolarHBondContact O-N 2.93Å
15K95.3Very high94.9Very high99 Ų9978.3 Ų78.343%0.4338%0.376SS..Hα-helixtrans-61.3-45.8174.9-69.2174.4-166.4170.60111.7S11 E12 Q18 M19S11-K15 WeakPolarHBondContact O-CG 3.42Å; S11-K15 PolarHBondContact O-N 2.77Å; S11-K15 VanDerWaalsContact O-N 3.14Å; E12-K15 PolarHBondContact O-N 2.97Å; E12-K15 IonicContact OE1-NZ 3.16Å; E12-K15 PolarHBondContact OE1-NZ 3.36Å; K15-Q18 PolarHBondContact O-N 3.22Å; K15-M19 WeakPolarHBondContact O-CB 3.34Å; K15-M19 PolarHBondContact O-N 3.35Å
16Y95.4Very high95.2Very high35 Ų3577.7 Ų77.714%0.13737%0.374CS..Hα-helixtrans-63.1-42.2178.8-177.9-113.6000112.1E12 L13 M19 Q20 S101 H104 R105 L108E12-Y16 WeakPolarHBondContact O-CB 3.37Å; E12-Y16 PolarHBondContact O-N 3.27Å; L13-Y16 PolarHBondContact O-N 3.41Å; Y16-M19 PolarHBondContact O-N 2.9Å; Y16-Q20 HydrophobicContact CE1-CG 4.42Å; Y16-Q20 WeakPolarHBondContact O-CG 3.39Å; Y16-Q20 PolarHBondContact O-N 3.25Å; Y16-S101 WeakPolarHBondContact CE2-OG 3.48Å; Y16-H104 HydrophobicContact CD2-CB 3.74Å; Y16-H104 HydrophobicContact CG-CB 4.41Å; Y16-R105 HydrophobicContact CD2-CG 4.48Å; Y16-R105 HydrophobicContact CE1-CG 4.41Å; Y16-R105 HydrophobicContact CE2-CG 3.63Å; Y16-R105 WeakPolarHBondContact OH-CD 3.45Å; Y16-R105 PolarHBondContact OH-NE 3.29Å; Y16-L108 HydrophobicContact CD1-CD1 4.04Å; Y16-L108 HydrophobicContact CG-CD1 3.97Å
17Q95.5Very high95.5Very high93 Ų9377 Ų7744%0.43537%0.372SS..Hα-helixtrans-64-41.4175.1-74.5177.5-2.500112.2L13 E14 M19 Q20 K21L13-Q17 WeakPolarHBondContact O-CB 3.19Å; L13-Q17 VanDerWaalsContact O-CG 3.29Å; L13-Q17 WeakPolarHBondContact O-CG 3.19Å; L13-Q17 PolarHBondContact O-N 3.23Å; E14-Q17 PolarHBondContact O-N 3.42Å; Q17-M19 VanDerWaalsContact C-N 3.34Å; Q17-Q20 PolarHBondContact O-N 2.94Å; Q17-K21 WeakPolarHBondContact O-CG 3.33Å; Q17-K21 PolarHBondContact O-N 2.97Å
18Q95.2Very high95.7Very high84 Ų8471.7 Ų71.739%0.39336%0.355SS..Hα-helixtrans-62.9-44175.9-177.253.546.800111E14 K15 Q20 K21 D22E14-Q18 WeakPolarHBondContact O-CB 3.45Å; E14-Q18 PolarHBondContact O-N 2.93Å; K15-Q18 PolarHBondContact O-N 3.22Å; Q18-Q20 PolarHBondContact O-N 3.2Å; Q18-K21 WeakPolarHBondContact O-CB 3.48Å; Q18-K21 PolarHBondContact O-N 3.03Å; Q18-K21 VanDerWaalsContact O-N 3.14Å; Q18-D22 PolarHBondContact NE2-OD1 2.64Å; Q18-D22 VanDerWaalsContact NE2-OD1 3.13Å; Q18-D22 PolarHBondContact NE2-OD2 3.5Å; Q18-D22 PolarHBondContact O-N 3.12Å; Q18-D22 VanDerWaalsContact O-N 3.07Å
19M95.4Very high95.9Very high28 Ų2866.7 Ų66.714%0.13834%0.339CS..Hα-helixtrans-59.8-43.2176.6-171.7169.2-61.600112.6K15 Y16 Q17 K21 D22 V23 K100 S101 H104K15-M19 WeakPolarHBondContact O-CB 3.34Å; K15-M19 PolarHBondContact O-N 3.35Å; Y16-M19 PolarHBondContact O-N 2.9Å; Q17-M19 VanDerWaalsContact C-N 3.34Å; M19-K21 VanDerWaalsContact C-N 3.3Å; M19-K21 PolarHBondContact O-N 2.92Å; M19-D22 PolarHBondContact O-N 3.27Å; M19-D22 VanDerWaalsContact O-N 3.13Å; M19-V23 WeakPolarHBondContact O-CG2 3.43Å; M19-V23 PolarHBondContact O-N 3.21Å; M19-K100 HydrophobicContact CE-CB 3.66Å; M19-K100 HydrophobicContact CE-CD 4.25Å; M19-K100 HydrophobicContact SD-CB 3.56Å; M19-K100 VanDerWaalsContact SD-CB 3.56Å; M19-S101 PolarHBondContact SD-N 3.3Å; M19-S101 VanDerWaalsContact SD-N 3.39Å; M19-H104 WeakPolarHBondContact CE-CD2 3.45Å; M19-H104 VanDerWaalsContact CE-NE2 3.28Å; M19-H104 WeakPolarHBondContact CE-NE2 3.5Å
20Q94.7Very high96.1Very high95 Ų9568.1 Ų68.144%0.44434%0.342SS..Hα-helixtrans-59.8-39.4175.3-76-178.664.600112.6Y16 Q17 Q18 D22 V23 S24Y16-Q20 HydrophobicContact CE1-CG 4.42Å; Y16-Q20 WeakPolarHBondContact O-CG 3.39Å; Y16-Q20 PolarHBondContact O-N 3.25Å; Q17-Q20 PolarHBondContact O-N 2.94Å; Q18-Q20 PolarHBondContact O-N 3.2Å; Q20-D22 VanDerWaalsContact C-N 3.32Å; Q20-D22 PolarHBondContact O-N 3.06Å; Q20-V23 PolarHBondContact O-N 2.91Å; Q20-S24 PolarHBondContact O-N 3.25Å
21K96.3Very high96.2Very high121 Ų12168.8 Ų68.853%0.52635%0.345SS..Hα-helixtrans-62.9-41175-68.4173.4-175.9173.60111.3Q17 Q18 M19 S24 K25Q17-K21 WeakPolarHBondContact O-CG 3.33Å; Q17-K21 PolarHBondContact O-N 2.97Å; Q18-K21 WeakPolarHBondContact O-CB 3.48Å; Q18-K21 PolarHBondContact O-N 3.03Å; Q18-K21 VanDerWaalsContact O-N 3.14Å; M19-K21 VanDerWaalsContact C-N 3.3Å; M19-K21 PolarHBondContact O-N 2.92Å; K21-S24 PolarHBondContact O-N 3.44Å; K21-K25 WeakPolarHBondContact O-CG 2.97Å; K21-K25 PolarHBondContact O-N 3.49Å
22D95.3Very high96.3Very high54 Ų5473.5 Ų73.529%0.28936%0.359SS..Hα-helixtrans-74.1-32.8-178-63.9-28.5000112.4Q18 M19 Q20 K25 S26 M97Q18-D22 PolarHBondContact NE2-OD1 2.64Å; Q18-D22 VanDerWaalsContact NE2-OD1 3.13Å; Q18-D22 PolarHBondContact NE2-OD2 3.5Å; Q18-D22 PolarHBondContact O-N 3.12Å; Q18-D22 VanDerWaalsContact O-N 3.07Å; M19-D22 PolarHBondContact O-N 3.27Å; M19-D22 VanDerWaalsContact O-N 3.13Å; Q20-D22 VanDerWaalsContact C-N 3.32Å; Q20-D22 PolarHBondContact O-N 3.06Å; D22-K25 IonicContact OD1-NZ 3.36Å; D22-K25 PolarHBondContact OD1-NZ 3.48Å; D22-S26 VanDerWaalsContact O-CB 3.31Å; D22-S26 WeakPolarHBondContact O-CB 3.49Å; D22-S26 PolarHBondContact O-N 2.96Å; D22-S26 PolarHBondContact O-OG 3.22Å; D22-M97 HydrophobicContact CB-SD 4.26Å
23V96.1Very high96.4Very high37 Ų3773.2 Ų73.222%0.22436%0.358CS..Hα-helixtrans-58.9-52.2167.1169.80000110.4M19 Q20 K25 S26 M27 L94 M97M19-V23 WeakPolarHBondContact O-CG2 3.43Å; M19-V23 PolarHBondContact O-N 3.21Å; Q20-V23 PolarHBondContact O-N 2.91Å; V23-K25 PolarHBondContact O-N 2.96Å; V23-S26 PolarHBondContact O-N 3.2Å; V23-S26 VanDerWaalsContact O-N 3.15Å; V23-M27 HydrophobicContact CG1-CG 4.33Å; V23-M27 HydrophobicContact CG1-SD 4.01Å; V23-M27 WeakPolarHBondContact O-CG 3.41Å; V23-M27 PolarHBondContact O-N 3.15Å; V23-L94 HydrophobicContact CG1-CD2 4.15Å; V23-M97 HydrophobicContact CG2-CB 3.7Å; V23-M97 HydrophobicContact CG2-CE 4.38Å; V23-M97 HydrophobicContact CG2-CG 4.42Å; V23-M97 HydrophobicContact CG2-SD 3.98Å
24S96.3Very high96.6Very high70 Ų7073.7 Ų73.749%0.4936%0.359SS..Hα-helixtrans-58.1-46.1-179.9176.60000112.1Q20 K21 S26 M27 S28Q20-S24 PolarHBondContact O-N 3.25Å; K21-S24 PolarHBondContact O-N 3.44Å; S24-S26 PolarHBondContact O-N 3.45Å; S24-M27 PolarHBondContact O-N 2.89Å; S24-S28 PolarHBondContact O-N 3.47Å; S24-S28 PolarHBondContact O-OG 3.47Å
25K97.2Very high96.6Very high128 Ų12871.2 Ų71.256%0.55736%0.356SS*.Hα-helixtrans-59.4-44.9175.4-72171.7-173166.80112.3K21 D22 V23 S28 A29K21-K25 WeakPolarHBondContact O-CG 2.97Å; K21-K25 PolarHBondContact O-N 3.49Å; D22-K25 IonicContact OD1-NZ 3.36Å; D22-K25 PolarHBondContact OD1-NZ 3.48Å; V23-K25 PolarHBondContact O-N 2.96Å; K25-S28 PolarHBondContact O-N 2.9Å; K25-A29 WeakPolarHBondContact O-CB 3.3Å; K25-A29 PolarHBondContact O-N 3.35Å
26S97.1Very high96.8Very high14 Ų1470.4 Ų70.410%0.09835%0.354CS..Hα-helixtrans-66.6-39.7-178.9-59.90000111.6D22 V23 S24 A29 R30 M97D22-S26 VanDerWaalsContact O-CB 3.31Å; D22-S26 WeakPolarHBondContact O-CB 3.49Å; D22-S26 PolarHBondContact O-N 2.96Å; D22-S26 PolarHBondContact O-OG 3.22Å; V23-S26 PolarHBondContact O-N 3.2Å; V23-S26 VanDerWaalsContact O-N 3.15Å; S24-S26 PolarHBondContact O-N 3.45Å; S26-A29 PolarHBondContact O-N 3.32Å; S26-R30 WeakPolarHBondContact O-CB 3.45Å; S26-R30 PolarHBondContact O-N 2.88Å; S26-M97 VanDerWaalsContact OG-CE 3.27Å; S26-M97 WeakPolarHBondContact OG-CE 3.36Å
27M97.1Very high96.9Very high91 Ų9169.5 Ų69.545%0.44835%0.352SS..Hα-helixtrans-61.1-47.8173.2-72.6-178.468.600111.7V23 S24 A29 R30 Q31 L94V23-M27 HydrophobicContact CG1-CG 4.33Å; V23-M27 HydrophobicContact CG1-SD 4.01Å; V23-M27 WeakPolarHBondContact O-CG 3.41Å; V23-M27 PolarHBondContact O-N 3.15Å; S24-M27 PolarHBondContact O-N 2.89Å; M27-A29 VanDerWaalsContact C-N 3.31Å; M27-A29 PolarHBondContact O-N 3.35Å; M27-R30 PolarHBondContact O-N 3.44Å; M27-Q31 WeakPolarHBondContact O-CG 3.49Å; M27-Q31 PolarHBondContact O-N 2.97Å; M27-L94 HydrophobicContact CG-CD1 4.21Å; M27-L94 HydrophobicContact CG-CD2 3.73Å
28S97.5Very high97Very high55 Ų5569.1 Ų69.139%0.38536%0.356SS..Hα-helixtrans-63.2-36.8177.5-63.20000112.6S24 K25 K32S24-S28 PolarHBondContact O-N 3.47Å; S24-S28 PolarHBondContact O-OG 3.47Å; K25-S28 PolarHBondContact O-N 2.9Å; S28-K32 WeakPolarHBondContact O-CG 3.45Å; S28-K32 PolarHBondContact O-N 2.68Å
29A97.4Very high97.1Very high28 Ų2871 Ų7123%0.23137%0.365CS..Hα-helixtrans-64.9-44.9174.400000111.4K25 S26 M27 K32 L33 Y90K25-A29 WeakPolarHBondContact O-CB 3.3Å; K25-A29 PolarHBondContact O-N 3.35Å; S26-A29 PolarHBondContact O-N 3.32Å; M27-A29 VanDerWaalsContact C-N 3.31Å; M27-A29 PolarHBondContact O-N 3.35Å; A29-K32 PolarHBondContact O-N 3.44Å; A29-L33 PolarHBondContact O-N 2.78Å; A29-Y90 HydrophobicContact CB-CE1 3.92Å; A29-Y90 HydrophobicContact CB-CE2 4.19Å
30R97.7Very high97.2Very high64 Ų6470.4 Ų70.424%0.24236%0.362CS..Hα-helixtrans-60.6-46177.2-166-170.175.9122.814.1112.1S26 M27 K32 L33 E34 I87 Y90 E91S26-R30 WeakPolarHBondContact O-CB 3.45Å; S26-R30 PolarHBondContact O-N 2.88Å; M27-R30 PolarHBondContact O-N 3.44Å; R30-K32 VanDerWaalsContact C-N 3.28Å; R30-K32 PolarHBondContact O-N 3.05Å; R30-L33 WeakPolarHBondContact O-CB 3.28Å; R30-L33 PolarHBondContact O-N 3.03Å; R30-E34 IonicContact CZ-OE1 3.52Å; R30-E34 IonicContact NE-OE1 2.79Å; R30-E34 PolarHBondContact NE-OE1 3.05Å; R30-E34 IonicContact NH1-OE1 3.34Å; R30-E34 PolarHBondContact NH1-OE1 3.35Å; R30-E34 IonicContact NH2-OE1 2.73Å; R30-E34 PolarHBondContact NH2-OE1 2.96Å; R30-E34 IonicContact NH2-OE2 2.91Å; R30-E34 WeakPolarHBondContact O-CG 3.42Å; R30-E34 PolarHBondContact O-N 3.48Å; R30-I87 HydrophobicContact CG-CG2 4.48Å; R30-Y90 HydrophobicContact CB-CG 4.49Å; R30-E91 IonicContact NH1-OE1 3.38Å; R30-E91 PolarHBondContact NH1-OE1 2.79Å
31Q97.8Very high97.4Very high109 Ų10968.8 Ų68.851%0.50936%0.356SS..Hα-helixtrans-58.7-38.6177.9-76175.8-19.600112.7M27 L33 E34 A35M27-Q31 WeakPolarHBondContact O-CG 3.49Å; M27-Q31 PolarHBondContact O-N 2.97Å; Q31-L33 VanDerWaalsContact C-N 3.34Å; Q31-E34 PolarHBondContact O-N 2.99Å; Q31-A35 PolarHBondContact O-N 3.07Å; Q31-A35 VanDerWaalsContact O-N 3.12Å
32K98Very high97.5Very high150 Ų15067.3 Ų67.365%0.65235%0.354SS*.Hα-helixtrans-64.1-40.2174.5-71.7175.3-177.3-178.20112S28 A29 R30 A35 Q36S28-K32 WeakPolarHBondContact O-CG 3.45Å; S28-K32 PolarHBondContact O-N 2.68Å; A29-K32 PolarHBondContact O-N 3.44Å; R30-K32 VanDerWaalsContact C-N 3.28Å; R30-K32 PolarHBondContact O-N 3.05Å; K32-A35 PolarHBondContact O-N 3.38Å; K32-Q36 WeakPolarHBondContact O-CG 3.49Å; K32-Q36 PolarHBondContact O-N 2.96Å; K32-Q36 VanDerWaalsContact O-N 3.09Å
33L98.3Very high97.6Very high24 Ų2468 Ų6813%0.12636%0.359CS..Hα-helixtrans-67-39.1176.4-65.3170.3000111.4A29 R30 Q31 A35 Q36 V37 I83 E86 I87 Y90A29-L33 PolarHBondContact O-N 2.78Å; R30-L33 WeakPolarHBondContact O-CB 3.28Å; R30-L33 PolarHBondContact O-N 3.03Å; Q31-L33 VanDerWaalsContact C-N 3.34Å; L33-A35 VanDerWaalsContact C-N 3.34Å; L33-A35 PolarHBondContact O-N 3.4Å; L33-Q36 CarbonylContact O-C 3.59Å; L33-Q36 WeakPolarHBondContact O-CB 3.49Å; L33-Q36 PolarHBondContact O-N 3.27Å; L33-Q36 VanDerWaalsContact O-N 3.13Å; L33-V37 WeakPolarHBondContact O-CG2 3.26Å; L33-V37 PolarHBondContact O-N 3Å; L33-I83 HydrophobicContact CB-CG2 3.9Å; L33-I83 HydrophobicContact CD2-CG2 3.96Å; L33-I83 HydrophobicContact CG-CG2 4.48Å; L33-E86 HydrophobicContact CD1-CB 3.8Å; L33-I87 HydrophobicContact CB-CD1 4.1Å; L33-I87 HydrophobicContact CB-CG1 3.65Å; L33-I87 HydrophobicContact CD1-CG1 4.28Å; L33-Y90 HydrophobicContact CD1-CD2 3.63Å; L33-Y90 HydrophobicContact CD1-CE2 3.7Å
34E97.7Very high97.7Very high66 Ų6670 Ų7031%0.30837%0.365SS..Hα-helixtrans-59.7-43.1175.7-71.6171.6160.500112R30 Q31 V37 T38 I87R30-E34 IonicContact CZ-OE1 3.52Å; R30-E34 IonicContact NE-OE1 2.79Å; R30-E34 PolarHBondContact NE-OE1 3.05Å; R30-E34 IonicContact NH1-OE1 3.34Å; R30-E34 PolarHBondContact NH1-OE1 3.35Å; R30-E34 IonicContact NH2-OE1 2.73Å; R30-E34 PolarHBondContact NH2-OE1 2.96Å; R30-E34 IonicContact NH2-OE2 2.91Å; R30-E34 WeakPolarHBondContact O-CG 3.42Å; R30-E34 PolarHBondContact O-N 3.48Å; Q31-E34 PolarHBondContact O-N 2.99Å; E34-V37 PolarHBondContact O-N 3.31Å; E34-T38 PolarHBondContact O-N 2.83Å; E34-T38 VanDerWaalsContact O-N 3.07Å; E34-T38 PolarHBondContact O-OG1 3.07Å; E34-I87 HydrophobicContact CG-CD1 4.15Å
35A98Very high97.8Very high50 Ų5072.7 Ų72.741%0.41337%0.37SS..Hα-helixtrans-60.9-45.4172.900000111.4Q31 K32 L33 V37 T38 E39Q31-A35 PolarHBondContact O-N 3.07Å; Q31-A35 VanDerWaalsContact O-N 3.12Å; K32-A35 PolarHBondContact O-N 3.38Å; L33-A35 VanDerWaalsContact C-N 3.34Å; L33-A35 PolarHBondContact O-N 3.4Å; A35-V37 PolarHBondContact O-N 3.34Å; A35-T38 WeakPolarHBondContact O-CB 3.44Å; A35-T38 PolarHBondContact O-N 3.33Å; A35-E39 WeakPolarHBondContact O-CG 3.41Å; A35-E39 PolarHBondContact O-N 3.24Å
36Q98.1Very high97.8Very high83 Ų8372.2 Ų72.239%0.38837%0.37SS..Hα-helixtrans-63.4-39.9177.9-71.9179.7-10.500113.1K32 L33 T38 E39 N40 I83K32-Q36 WeakPolarHBondContact O-CG 3.49Å; K32-Q36 PolarHBondContact O-N 2.96Å; K32-Q36 VanDerWaalsContact O-N 3.09Å; L33-Q36 CarbonylContact O-C 3.59Å; L33-Q36 WeakPolarHBondContact O-CB 3.49Å; L33-Q36 PolarHBondContact O-N 3.27Å; L33-Q36 VanDerWaalsContact O-N 3.13Å; Q36-T38 VanDerWaalsContact C-N 3.31Å; Q36-E39 PolarHBondContact O-N 3.47Å; Q36-N40 WeakPolarHBondContact O-CB 3.39Å; Q36-N40 PolarHBondContact O-N 3.13Å; Q36-N40 PolarHBondContact O-ND2 3.35Å; Q36-I83 HydrophobicContact CB-CD1 4.07Å
37V98Very high97.8Very high15 Ų1572.3 Ų72.39%0.09137%0.369CS..Hα-helixtrans-59.7-46.1173.7169.40000110.3L33 E34 A35 E39 N40 N41 L80 I83 I87L33-V37 WeakPolarHBondContact O-CG2 3.26Å; L33-V37 PolarHBondContact O-N 3Å; E34-V37 PolarHBondContact O-N 3.31Å; A35-V37 PolarHBondContact O-N 3.34Å; V37-E39 PolarHBondContact O-N 2.91Å; V37-N40 PolarHBondContact O-N 3.39Å; V37-N41 WeakPolarHBondContact CG1-ND2 3.38Å; V37-N41 WeakPolarHBondContact O-CB 3.24Å; V37-N41 PolarHBondContact O-N 3.44Å; V37-N41 PolarHBondContact O-ND2 3.41Å; V37-L80 HydrophobicContact CG1-CD2 4.22Å; V37-I83 HydrophobicContact CB-CG2 4.48Å; V37-I83 HydrophobicContact CG2-CB 3.85Å; V37-I83 HydrophobicContact CG2-CG2 3.21Å; V37-I87 HydrophobicContact CB-CD1 4.48Å; V37-I87 HydrophobicContact CG2-CD1 3.54Å
38T97.9Very high97.7Very high85 Ų8571.7 Ų71.752%0.52137%0.368SS..Hα-helixtrans-59.6-49.3-179-54.50000110.8E34 A35 Q36 N40 N41 I42E34-T38 PolarHBondContact O-N 2.83Å; E34-T38 VanDerWaalsContact O-N 3.07Å; E34-T38 PolarHBondContact O-OG1 3.07Å; A35-T38 WeakPolarHBondContact O-CB 3.44Å; A35-T38 PolarHBondContact O-N 3.33Å; Q36-T38 VanDerWaalsContact C-N 3.31Å; T38-N40 PolarHBondContact O-N 3.2Å; T38-N41 PolarHBondContact O-N 2.83Å; T38-I42 HydrophobicContact CG2-CD1 4.49Å; T38-I42 WeakPolarHBondContact O-CG1 3.44Å; T38-I42 PolarHBondContact O-N 3.46Å; T38-I42 VanDerWaalsContact O-N 3.13Å
39E97.8Very high97.7Very high123 Ų12375.6 Ų75.658%0.57538%0.383SS*.Hα-helixtrans-60.1-43.5176.3-69.4172.1-169.800112.4A35 Q36 V37 I42 V43A35-E39 WeakPolarHBondContact O-CG 3.41Å; A35-E39 PolarHBondContact O-N 3.24Å; Q36-E39 PolarHBondContact O-N 3.47Å; V37-E39 PolarHBondContact O-N 2.91Å; E39-I42 PolarHBondContact O-N 3.13Å; E39-V43 WeakPolarHBondContact O-CG2 3.41Å; E39-V43 PolarHBondContact O-N 3.09Å
40N98.1Very high97.6Very high16 Ų1676.8 Ų76.89%0.08639%0.386CS..Hα-helixtrans-72.5-29.2-179.1-78.6-91.5000112.9Q36 V37 T38 V43 K44 V76 R79 L80Q36-N40 WeakPolarHBondContact O-CB 3.39Å; Q36-N40 PolarHBondContact O-N 3.13Å; Q36-N40 PolarHBondContact O-ND2 3.35Å; V37-N40 PolarHBondContact O-N 3.39Å; T38-N40 PolarHBondContact O-N 3.2Å; N40-V43 PolarHBondContact O-N 3.44Å; N40-K44 WeakPolarHBondContact O-CB 3.45Å; N40-K44 PolarHBondContact O-N 3.47Å; N40-V76 WeakPolarHBondContact O-CG1 3.4Å; N40-R79 VanDerWaalsContact OD1-CD 3.28Å; N40-R79 WeakPolarHBondContact OD1-CD 3.24Å; N40-L80 HydrophobicContact CB-CD2 3.56Å; N40-L80 HydrophobicContact CB-CG 3.91Å
41N98.3Very high97.3Very high61 Ų6177.9 Ų77.933%0.32640%0.396SS..Hα-helixtrans-65.5-43.6171.8-79-27.9000110.9V37 T38 V43 K44 E45 L80V37-N41 WeakPolarHBondContact CG1-ND2 3.38Å; V37-N41 WeakPolarHBondContact O-CB 3.24Å; V37-N41 PolarHBondContact O-N 3.44Å; V37-N41 PolarHBondContact O-ND2 3.41Å; T38-N41 PolarHBondContact O-N 2.83Å; N41-V43 VanDerWaalsContact C-N 3.34Å; N41-V43 PolarHBondContact O-N 3.04Å; N41-K44 WeakPolarHBondContact O-CB 3.3Å; N41-K44 PolarHBondContact O-N 2.96Å; N41-K44 VanDerWaalsContact O-N 3.15Å; N41-E45 WeakPolarHBondContact O-CG 3.38Å; N41-E45 PolarHBondContact O-N 3Å; N41-L80 WeakPolarHBondContact OD1-CD1 3.43Å; N41-L80 VanDerWaalsContact OD1-CD2 3.26Å; N41-L80 WeakPolarHBondContact OD1-CD2 3.28Å
42I98.1Very high96.9Very high91 Ų9178.8 Ų78.847%0.46741%0.41SS..Hα-helixtrans-58.6-47.7174.2-64.8165.1000110.1T38 E39 K44 E45 E46T38-I42 HydrophobicContact CG2-CD1 4.49Å; T38-I42 WeakPolarHBondContact O-CG1 3.44Å; T38-I42 PolarHBondContact O-N 3.46Å; T38-I42 VanDerWaalsContact O-N 3.13Å; E39-I42 PolarHBondContact O-N 3.13Å; I42-K44 VanDerWaalsContact C-N 3.29Å; I42-K44 PolarHBondContact O-N 3.49Å; I42-E45 PolarHBondContact O-N 3.02Å; I42-E46 WeakPolarHBondContact O-CG 3.45Å; I42-E46 PolarHBondContact O-N 3.41Å
43V97.4Very high96.6Very high68 Ų6879.4 Ų79.441%0.41242%0.415SS..Hα-helixtrans-60.1-40.5177174.60000111.6E39 N40 N41 E46 L47 V76E39-V43 WeakPolarHBondContact O-CG2 3.41Å; E39-V43 PolarHBondContact O-N 3.09Å; N40-V43 PolarHBondContact O-N 3.44Å; N41-V43 VanDerWaalsContact C-N 3.34Å; N41-V43 PolarHBondContact O-N 3.04Å; V43-E46 PolarHBondContact O-N 3.19Å; V43-L47 HydrophobicContact CG1-CD1 4.08Å; V43-L47 HydrophobicContact CG1-CG 4.35Å; V43-L47 WeakPolarHBondContact O-CB 3.24Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.47Å; V43-L47 PolarHBondContact O-N 3.04Å; V43-V76 HydrophobicContact CG1-CG1 4.48Å; V43-V76 HydrophobicContact CG1-CG2 3.91Å
44K97.8Very high96.5Very high79 Ų7981.7 Ų81.734%0.34343%0.427SS..Hα-helixtrans-62-47.4176.8-174.5-170.2169.7-63.30111N40 N41 I42 E46 L47 D48 V76 L80N40-K44 WeakPolarHBondContact O-CB 3.45Å; N40-K44 PolarHBondContact O-N 3.47Å; N41-K44 WeakPolarHBondContact O-CB 3.3Å; N41-K44 PolarHBondContact O-N 2.96Å; N41-K44 VanDerWaalsContact O-N 3.15Å; I42-K44 VanDerWaalsContact C-N 3.29Å; I42-K44 PolarHBondContact O-N 3.49Å; K44-E46 VanDerWaalsContact C-N 3.34Å; K44-E46 PolarHBondContact O-N 3.41Å; K44-L47 PolarHBondContact O-N 3.5Å; K44-D48 IonicContact NZ-OD2 3.4Å; K44-D48 PolarHBondContact NZ-OD2 2.92Å; K44-D48 WeakPolarHBondContact O-CB 3.36Å; K44-D48 VanDerWaalsContact O-CG 3.23Å; K44-D48 PolarHBondContact O-N 3.4Å; K44-V76 HydrophobicContact CB-CG1 3.84Å; K44-L80 HydrophobicContact CB-CD1 4.1Å; K44-L80 HydrophobicContact CD-CD1 3.77Å; K44-L80 HydrophobicContact CG-CD1 4.43Å
45E98Very high96.4Very high126 Ų12681.9 Ų81.959%0.58943%0.433SS*.Hα-helixtrans-58.6-46.2178.1-72.7171.7-16900111.1N41 I42 L47 D48 L49N41-E45 WeakPolarHBondContact O-CG 3.38Å; N41-E45 PolarHBondContact O-N 3Å; I42-E45 PolarHBondContact O-N 3.02Å; E45-L47 PolarHBondContact O-N 3.3Å; E45-D48 PolarHBondContact O-N 2.84Å; E45-L49 WeakPolarHBondContact O-CG 3.38Å; E45-L49 PolarHBondContact O-N 3.38Å
46E97.3Very high96.3Very high118 Ų11880.7 Ų80.755%0.55142%0.42SS*.Hα-helixtrans-61.9-42.8175.7-68.3-65.4157.700112.3I42 V43 K44 D48 L49I42-E46 WeakPolarHBondContact O-CG 3.45Å; I42-E46 PolarHBondContact O-N 3.41Å; V43-E46 PolarHBondContact O-N 3.19Å; K44-E46 VanDerWaalsContact C-N 3.34Å; K44-E46 PolarHBondContact O-N 3.41Å; E46-D48 VanDerWaalsContact C-N 3.29Å; E46-D48 PolarHBondContact O-N 3.35Å; E46-L49 PolarHBondContact O-N 2.86Å
47L96.6Very high96.2Very high17 Ų1783 Ų839%0.08943%0.426CS..Hα-helixtrans-64.7-33.4176.5-74.6176.1000112.6V43 K44 E45 L49 L50 V56 L69 A72 K73 V76V43-L47 HydrophobicContact CG1-CD1 4.08Å; V43-L47 HydrophobicContact CG1-CG 4.35Å; V43-L47 WeakPolarHBondContact O-CB 3.24Å; V43-L47 VanDerWaalsContact O-CG 3.3Å; V43-L47 WeakPolarHBondContact O-CG 3.47Å; V43-L47 PolarHBondContact O-N 3.04Å; K44-L47 PolarHBondContact O-N 3.5Å; E45-L47 PolarHBondContact O-N 3.3Å; L47-L49 PolarHBondContact O-N 2.77Å; L47-L50 HydrophobicContact CD2-CD1 3.91Å; L47-L50 WeakPolarHBondContact O-CB 3.42Å; L47-L50 PolarHBondContact O-N 2.9Å; L47-V56 HydrophobicContact CD2-CG1 4.48Å; L47-V56 HydrophobicContact CD2-CG2 4.34Å; L47-L69 HydrophobicContact CD2-CD1 4.13Å; L47-A72 HydrophobicContact CD1-CB 4.34Å; L47-A72 HydrophobicContact CD2-CB 4.4Å; L47-K73 HydrophobicContact CB-CG 4.07Å; L47-K73 HydrophobicContact CD1-CG 4.46Å; L47-K73 WeakPolarHBondContact O-CE 3.27Å; L47-V76 HydrophobicContact CD1-CB 4.33Å; L47-V76 HydrophobicContact CD1-CG2 3.73Å
48D96Very high96.1Very high78 Ų7887 Ų8742%0.41744%0.443SS..Hα-helixtrans-69.9-21.1179.2-73-20.3000112.5K44 E45 E46 L50K44-D48 IonicContact NZ-OD2 3.4Å; K44-D48 PolarHBondContact NZ-OD2 2.92Å; K44-D48 WeakPolarHBondContact O-CB 3.36Å; K44-D48 VanDerWaalsContact O-CG 3.23Å; K44-D48 PolarHBondContact O-N 3.4Å; E45-D48 PolarHBondContact O-N 2.84Å; E46-D48 VanDerWaalsContact C-N 3.29Å; E46-D48 PolarHBondContact O-N 3.35Å; D48-L50 VanDerWaalsContact C-N 3.33Å
49L96.6Very high96Very high136 Ų13688.7 Ų88.771%0.71245%0.448SS*.THydrogen-bonded Turntrans-78.5-15.3173.1-61.8175.8000113.5E45 E46 L47E45-L49 WeakPolarHBondContact O-CG 3.38Å; E45-L49 PolarHBondContact O-N 3.38Å; E46-L49 PolarHBondContact O-N 2.86Å; L47-L49 PolarHBondContact O-N 2.77Å
50L95.9Very high95.9Very high54 Ų5487 Ų8728%0.28344%0.442SS..  trans-82.7144.1-176.5-55.7-177.5000112.1L47 D48 N54 V56 L69L47-L50 HydrophobicContact CD2-CD1 3.91Å; L47-L50 WeakPolarHBondContact O-CB 3.42Å; L47-L50 PolarHBondContact O-N 2.9Å; D48-L50 VanDerWaalsContact C-N 3.33Å; L50-N54 HydrophobicContact CB-CB 4.18Å; L50-N54 HydrophobicContact CD2-CB 4.16Å; L50-V56 HydrophobicContact CD1-CG2 3.67Å; L50-L69 HydrophobicContact CB-CD1 3.97Å; L50-L69 HydrophobicContact CB-CD2 4.05Å; L50-L69 HydrophobicContact CD1-CD1 3.94Å
51D92.5Very high95.8Very high87 Ų8789.3 Ų89.347%0.46547%0.469SS..  trans-111.7179.717271.846.6000112Q53 N54D51-Q53 PolarHBondContact O-N 3.43Å; D51-Q53 VanDerWaalsContact O-N 3.15Å; D51-Q53 WeakPolarHBondContact OD1-CA 3.43Å; D51-Q53 WeakPolarHBondContact OD1-CB 3.4Å; D51-Q53 PolarHBondContact OD1-N 2.85Å; D51-N54 PolarHBondContact N-OD1 3.22Å; D51-N54 WeakPolarHBondContact O-CB 3.45Å; D51-N54 PolarHBondContact O-N 2.77Å; D51-N54 PolarHBondContact O-OD1 3.36Å
52T88.3Confident95.7Very high128 Ų12892.7 Ų92.779%0.78549%0.494SS*.THydrogen-bonded Turntrans-65.5-14.6-175.855.40000114.9
53Q92.4Very high95.7Very high162 Ų16292.2 Ų92.276%0.75750%0.496SS*.THydrogen-bonded Turntrans-81.6-20.5175.4-55.9-62.4-45.200111.6D51D51-Q53 PolarHBondContact O-N 3.43Å; D51-Q53 VanDerWaalsContact O-N 3.15Å; D51-Q53 WeakPolarHBondContact OD1-CA 3.43Å; D51-Q53 WeakPolarHBondContact OD1-CB 3.4Å; D51-Q53 PolarHBondContact OD1-N 2.85Å
54N95.1Very high95.8Very high72 Ų7294.6 Ų94.639%0.38551%0.505SS..SBendtrans-75.6144176.9-58.1112.6000111.2L50 D51L50-N54 HydrophobicContact CB-CB 4.18Å; L50-N54 HydrophobicContact CD2-CB 4.16Å; D51-N54 PolarHBondContact N-OD1 3.22Å; D51-N54 WeakPolarHBondContact O-CB 3.45Å; D51-N54 PolarHBondContact O-N 2.77Å; D51-N54 PolarHBondContact O-OD1 3.36Å
55T95.4Very high95.7Very high71 Ų7193.9 Ų93.944%0.43651%0.508SS..  trans-108.7122.8174-59.40000110.1Y57 K66T55-Y57 HydrophobicContact CG2-CD2 4.18Å; T55-Y57 HydrophobicContact CG2-CE1 4.35Å; T55-Y57 HydrophobicContact CG2-CE2 3.45Å; T55-Y57 VanDerWaalsContact CG2-CE2 3.45Å; T55-K66 HydrophobicContact CG2-CD 3.99Å; T55-K66 HydrophobicContact CG2-CG 4.01Å
56V96.3Very high95.7Very high25 Ų2594.9 Ų94.915%0.15251%0.51CS..EExtended strand (participates in β ladder)trans-99140.6177-178.70000110.1L47 L50 Q67 L69 A72L47-V56 HydrophobicContact CD2-CG1 4.48Å; L47-V56 HydrophobicContact CD2-CG2 4.34Å; L50-V56 HydrophobicContact CD1-CG2 3.67Å; V56-Q67 HydrophobicContact CG1-CB 4.48Å; V56-Q67 PolarHBondContact O-N 3.24Å; V56-L69 HydrophobicContact CG2-CD1 3.77Å; V56-A72 HydrophobicContact CG1-CB 4.23Å
57Y96.6Very high95.6Very high131 Ų13191 Ų9151%0.51449%0.492SS..EExtended strand (participates in β ladder)trans-124.1138.7173.7-64-90.4000110.4T55 L64 V65 K66T55-Y57 HydrophobicContact CG2-CD2 4.18Å; T55-Y57 HydrophobicContact CG2-CE1 4.35Å; T55-Y57 HydrophobicContact CG2-CE2 3.45Å; T55-Y57 VanDerWaalsContact CG2-CE2 3.45Å; Y57-L64 HydrophobicContact CD1-CB 4.39Å; Y57-V65 CarbonylContact C-O 3.54Å; Y57-V65 VanDerWaalsContact CA-O 3.32Å; Y57-V65 WeakPolarHBondContact CA-O 3.47Å; Y57-K66 HydrophobicContact CD1-CB 4.11Å; Y57-K66 HydrophobicContact CE1-CB 3.9Å; Y57-K66 HydrophobicContact CE1-CG 4.49Å
58K96.4Very high95.6Very high99 Ų9994.3 Ų94.343%0.4351%0.509SS..EExtended strand (participates in β ladder)trans-103.8131.5173.8-177.5177.5178.9177.90110I60 V65 Q67K58-I60 HydrophobicContact CD-CG1 4.48Å; K58-I60 HydrophobicContact CG-CG1 4.27Å; K58-V65 PolarHBondContact N-O 3.32Å; K58-V65 PolarHBondContact O-N 2.94Å; K58-Q67 HydrophobicContact CB-CB 4.15Å; K58-Q67 HydrophobicContact CB-CG 4.46Å
59L96.3Very high95.6Very high120 Ų12091.5 Ų91.563%0.62850%0.495SS*.EExtended strand (participates in β ladder)trans-75.7123.5172.2-17666.7000110.4G61 L64L59-G61 WeakPolarHBondContact CD1-O 3.37Å; L59-L64 HydrophobicContact CB-CD2 4.05Å; L59-L64 HydrophobicContact CD1-CD2 4.01Å
60I94.7Very high95.5Very high89 Ų8990.9 Ų90.946%0.45649%0.488SS..EExtended strand (participates in β ladder)trans-129.4105.2174.5-57.3-178.5000107.6K58 V63 V65K58-I60 HydrophobicContact CD-CG1 4.48Å; K58-I60 HydrophobicContact CG-CG1 4.27Å; I60-V63 PolarHBondContact N-O 2.92Å; I60-V63 WeakPolarHBondContact O-CG2 3.48Å; I60-V63 PolarHBondContact O-N 2.95Å; I60-V63 VanDerWaalsContact O-N 3.14Å; I60-V65 HydrophobicContact CD1-CB 4.32Å; I60-V65 HydrophobicContact CD1-CG2 4.03Å; I60-V65 HydrophobicContact CG1-CG2 4.44Å
61G96.1Very high95.5Very high63 Ų6393.7 Ų93.765%0.64950%0.499SS*.THydrogen-bonded Turntrans59-127-172.900000111L59L59-G61 WeakPolarHBondContact CD1-O 3.37Å
62P96.8Very high95.7Very high132 Ų13290.1 Ų90.186%0.85748%0.482SS*.THydrogen-bonded Turntrans-86.54.2178.235.2-34000114.4
63V97.8Very high96.1Very high82 Ų8286.2 Ų86.250%0.49745%0.454SS..EExtended strand (participates in β ladder)trans-120.9151.2-172.5-60.10000113.7I60 V65I60-V63 PolarHBondContact N-O 2.92Å; I60-V63 WeakPolarHBondContact O-CG2 3.48Å; I60-V63 PolarHBondContact O-N 2.95Å; I60-V63 VanDerWaalsContact O-N 3.14Å; V63-V65 HydrophobicContact CG2-CG2 4.26Å
64L98.2Very high96.3Very high117 Ų11781.3 Ų81.361%0.61344%0.442SS*.EExtended strand (participates in β ladder)trans-99.5124171.8-70.1176.8000110Y57 L59Y57-L64 HydrophobicContact CD1-CB 4.39Å; L59-L64 HydrophobicContact CB-CD2 4.05Å; L59-L64 HydrophobicContact CD1-CD2 4.01Å
65V97.6Very high96.4Very high65 Ų6581.5 Ų81.539%0.39445%0.446SS..EExtended strand (participates in β ladder)trans-111.9130179.3-177.30000108.7Y57 K58 I60 V63 Q67Y57-V65 CarbonylContact C-O 3.54Å; Y57-V65 VanDerWaalsContact CA-O 3.32Å; Y57-V65 WeakPolarHBondContact CA-O 3.47Å; K58-V65 PolarHBondContact N-O 3.32Å; K58-V65 PolarHBondContact O-N 2.94Å; I60-V65 HydrophobicContact CD1-CB 4.32Å; I60-V65 HydrophobicContact CD1-CG2 4.03Å; I60-V65 HydrophobicContact CG1-CG2 4.44Å; V63-V65 HydrophobicContact CG2-CG2 4.26Å; V65-Q67 PolarHBondContact O-N 3.29Å
66K97.1Very high96.5Very high146 Ų14678.9 Ų78.964%0.63543%0.429SS*.EExtended strand (participates in β ladder)trans-59.5129175.7-176.8173.5174.6172.10108.8T55 Y57T55-K66 HydrophobicContact CG2-CD 3.99Å; T55-K66 HydrophobicContact CG2-CG 4.01Å; Y57-K66 HydrophobicContact CD1-CB 4.11Å; Y57-K66 HydrophobicContact CE1-CB 3.9Å; Y57-K66 HydrophobicContact CE1-CG 4.49Å
67Q96.2Very high96.6Very high37 Ų3780 Ų8017%0.17344%0.441CS..EExtended strand (participates in β ladder)trans-120.3138.2-176-176.363.251.700108.4V56 K58 V65 E71 A72V56-Q67 HydrophobicContact CG1-CB 4.48Å; V56-Q67 PolarHBondContact O-N 3.24Å; K58-Q67 HydrophobicContact CB-CB 4.15Å; K58-Q67 HydrophobicContact CB-CG 4.46Å; V65-Q67 PolarHBondContact O-N 3.29Å; Q67-E71 PolarHBondContact NE2-OE2 3.38Å; Q67-A72 HydrophobicContact CG-CB 4.06Å
68D95.9Very high96.7Very high86 Ų8681.1 Ų81.146%0.4645%0.448SS..  trans-64139.3171.5177.3-95.1000110.6E70 E71 A72D68-E70 WeakPolarHBondContact OD1-CA 3.32Å; D68-E70 WeakPolarHBondContact OD1-CB 3.25Å; D68-E70 PolarHBondContact OD1-N 3.36Å; D68-E71 HydrophobicContact CB-CB 4.05Å; D68-E71 HydrophobicContact CB-CG 3.93Å; D68-E71 PolarHBondContact O-N 3.26Å; D68-E71 PolarHBondContact OD1-N 2.95Å; D68-A72 WeakPolarHBondContact O-CB 3.43Å; D68-A72 PolarHBondContact O-N 3.12Å
69L95.6Very high96.8Very high20 Ų2083.4 Ų83.411%0.10545%0.454CS..Hα-helixtrans-65.3-41.5-174.8177.160.6000111.7L47 L50 V56 A72 K73L47-L69 HydrophobicContact CD2-CD1 4.13Å; L50-L69 HydrophobicContact CB-CD1 3.97Å; L50-L69 HydrophobicContact CB-CD2 4.05Å; L50-L69 HydrophobicContact CD1-CD1 3.94Å; V56-L69 HydrophobicContact CG2-CD1 3.77Å; L69-A72 WeakPolarHBondContact O-CB 3.48Å; L69-A72 PolarHBondContact O-N 3.44Å; L69-K73 WeakPolarHBondContact O-CG 3.37Å; L69-K73 PolarHBondContact O-N 2.94Å
70E95.1Very high96.9Very high122 Ų12278.1 Ų78.157%0.5743%0.427SS*.Hα-helixtrans-68.9-40.1179.2-68-58.8133.400110.6D68 A72 K73 A74D68-E70 WeakPolarHBondContact OD1-CA 3.32Å; D68-E70 WeakPolarHBondContact OD1-CB 3.25Å; D68-E70 PolarHBondContact OD1-N 3.36Å; E70-A72 VanDerWaalsContact C-N 3.32Å; E70-A72 PolarHBondContact O-N 2.97Å; E70-K73 PolarHBondContact O-N 3.47Å; E70-A74 WeakPolarHBondContact O-CB 3.48Å; E70-A74 PolarHBondContact O-N 3.17Å
71E95.4Very high97.1Very high113 Ų11380.9 Ų80.953%0.52844%0.438SS..Hα-helixtrans-62.5-38.2172.5-69.1-174.4171.800112.6Q67 D68 T75Q67-E71 PolarHBondContact NE2-OE2 3.38Å; D68-E71 HydrophobicContact CB-CB 4.05Å; D68-E71 HydrophobicContact CB-CG 3.93Å; D68-E71 PolarHBondContact O-N 3.26Å; D68-E71 PolarHBondContact OD1-N 2.95Å; E71-T75 WeakPolarHBondContact O-CB 3.31Å; E71-T75 PolarHBondContact O-N 3.35Å; E71-T75 PolarHBondContact O-OG1 3.13Å
72A96.9Very high97.2Very high12 Ų1285 Ų8510%0.09944%0.435CS..Hα-helixtrans-63.3-48.4175.500000111.1L47 V56 Q67 D68 L69 E70 T75 V76L47-A72 HydrophobicContact CD1-CB 4.34Å; L47-A72 HydrophobicContact CD2-CB 4.4Å; V56-A72 HydrophobicContact CG1-CB 4.23Å; Q67-A72 HydrophobicContact CG-CB 4.06Å; D68-A72 WeakPolarHBondContact O-CB 3.43Å; D68-A72 PolarHBondContact O-N 3.12Å; L69-A72 WeakPolarHBondContact O-CB 3.48Å; L69-A72 PolarHBondContact O-N 3.44Å; E70-A72 VanDerWaalsContact C-N 3.32Å; E70-A72 PolarHBondContact O-N 2.97Å; A72-T75 PolarHBondContact O-N 2.82Å; A72-V76 WeakPolarHBondContact O-CG2 3.45Å; A72-V76 PolarHBondContact O-N 3.37Å
73K96.8Very high97.2Very high46 Ų4678.9 Ų78.920%0.240%0.395CS..Hα-helixtrans-58.5-48.8175.5-74.5178.1177.4177.60111.8L47 L69 E70 T75 V76 A77L47-K73 HydrophobicContact CB-CG 4.07Å; L47-K73 HydrophobicContact CD1-CG 4.46Å; L47-K73 WeakPolarHBondContact O-CE 3.27Å; L69-K73 WeakPolarHBondContact O-CG 3.37Å; L69-K73 PolarHBondContact O-N 2.94Å; E70-K73 PolarHBondContact O-N 3.47Å; K73-T75 VanDerWaalsContact C-N 3.3Å; K73-T75 PolarHBondContact O-N 3.24Å; K73-V76 PolarHBondContact O-N 2.85Å; K73-A77 WeakPolarHBondContact O-CB 3.43Å; K73-A77 PolarHBondContact O-N 2.73Å
74A97.2Very high97.3Very high60 Ų6078.4 Ų78.450%0.49639%0.39SS..Hα-helixtrans-60.8-39.1178.600000112.2E70 A77 K78E70-A74 WeakPolarHBondContact O-CB 3.48Å; E70-A74 PolarHBondContact O-N 3.17Å; A74-A77 PolarHBondContact O-N 3.38Å; A74-K78 WeakPolarHBondContact O-CB 3.31Å; A74-K78 PolarHBondContact O-N 3.11Å
75T96.9Very high97.3Very high76 Ų7674.8 Ų74.847%0.46638%0.381SS..Hα-helixtrans-63.9-46.2177.2-62.10000111.6E71 A72 K73 R79E71-T75 WeakPolarHBondContact O-CB 3.31Å; E71-T75 PolarHBondContact O-N 3.35Å; E71-T75 PolarHBondContact O-OG1 3.13Å; A72-T75 PolarHBondContact O-N 2.82Å; K73-T75 VanDerWaalsContact C-N 3.3Å; K73-T75 PolarHBondContact O-N 3.24Å; T75-R79 WeakPolarHBondContact O-CB 3.34Å; T75-R79 PolarHBondContact O-N 2.87Å
76V97.8Very high97.3Very high16 Ų1673.2 Ų73.210%0.09737%0.369CS..Hα-helixtrans-66.4-42.7178.6175.30000110.8N40 V43 K44 L47 A72 K73 R79 L80N40-V76 WeakPolarHBondContact O-CG1 3.4Å; V43-V76 HydrophobicContact CG1-CG1 4.48Å; V43-V76 HydrophobicContact CG1-CG2 3.91Å; K44-V76 HydrophobicContact CB-CG1 3.84Å; L47-V76 HydrophobicContact CD1-CB 4.33Å; L47-V76 HydrophobicContact CD1-CG2 3.73Å; A72-V76 WeakPolarHBondContact O-CG2 3.45Å; A72-V76 PolarHBondContact O-N 3.37Å; K73-V76 PolarHBondContact O-N 2.85Å; V76-R79 WeakPolarHBondContact O-CB 3.48Å; V76-R79 PolarHBondContact O-N 3.37Å; V76-L80 HydrophobicContact CG1-CD1 4.14Å; V76-L80 PolarHBondContact O-N 3.41Å
77A98Very high97.3Very high47 Ų4767 Ų6739%0.38834%0.343SS..Hα-helixtrans-59.6-48.6176.800000112.2K73 A74 R79 L80 E81K73-A77 WeakPolarHBondContact O-CB 3.43Å; K73-A77 PolarHBondContact O-N 2.73Å; A74-A77 PolarHBondContact O-N 3.38Å; A77-R79 VanDerWaalsContact C-N 3.27Å; A77-R79 PolarHBondContact O-N 3.13Å; A77-L80 PolarHBondContact O-N 3.38Å; A77-E81 PolarHBondContact O-N 2.89Å
78K98.3Very high97.4Very high155 Ų15570.6 Ų70.667%0.67436%0.359SS*.Hα-helixtrans-62.8-35177-172.3172.6-173.9174.70112.2A74 Y82A74-K78 WeakPolarHBondContact O-CB 3.31Å; A74-K78 PolarHBondContact O-N 3.11Å; K78-Y82 PolarHBondContact O-N 3.49Å; K78-Y82 VanDerWaalsContact O-N 3.12Å
79R98.1Very high97.5Very high147 Ų14772.9 Ų72.956%0.55536%0.361SS*.Hα-helixtrans-66.2-45.1175.5-164.5179.6-148.8175.43.5111.5N40 T75 V76 A77 Y82 I83N40-R79 VanDerWaalsContact OD1-CD 3.28Å; N40-R79 WeakPolarHBondContact OD1-CD 3.24Å; T75-R79 WeakPolarHBondContact O-CB 3.34Å; T75-R79 PolarHBondContact O-N 2.87Å; V76-R79 WeakPolarHBondContact O-CB 3.48Å; V76-R79 PolarHBondContact O-N 3.37Å; A77-R79 VanDerWaalsContact C-N 3.27Å; A77-R79 PolarHBondContact O-N 3.13Å; R79-Y82 PolarHBondContact O-N 3.42Å; R79-I83 HydrophobicContact CG-CD1 3.87Å; R79-I83 HydrophobicContact CG-CG1 4.41Å; R79-I83 VanDerWaalsContact O-CG1 3.24Å; R79-I83 WeakPolarHBondContact O-CG1 3.35Å; R79-I83 PolarHBondContact O-N 3.35Å
80L98.4Very high97.6Very high10 Ų1074.2 Ų74.25%0.05237%0.365CS..Hα-helixtrans-60.1-44.3175.7-77.5167.2000111.7V37 N40 N41 K44 V76 A77 Y82 I83 N84V37-L80 HydrophobicContact CG1-CD2 4.22Å; N40-L80 HydrophobicContact CB-CD2 3.56Å; N40-L80 HydrophobicContact CB-CG 3.91Å; N41-L80 WeakPolarHBondContact OD1-CD1 3.43Å; N41-L80 VanDerWaalsContact OD1-CD2 3.26Å; N41-L80 WeakPolarHBondContact OD1-CD2 3.28Å; K44-L80 HydrophobicContact CB-CD1 4.1Å; K44-L80 HydrophobicContact CD-CD1 3.77Å; K44-L80 HydrophobicContact CG-CD1 4.43Å; V76-L80 HydrophobicContact CG1-CD1 4.14Å; V76-L80 PolarHBondContact O-N 3.41Å; A77-L80 PolarHBondContact O-N 3.38Å; L80-Y82 PolarHBondContact O-N 2.91Å; L80-I83 PolarHBondContact O-N 3.42Å; L80-N84 VanDerWaalsContact O-CB 3.3Å; L80-N84 WeakPolarHBondContact O-CB 3.32Å; L80-N84 VanDerWaalsContact O-CG 3.28Å; L80-N84 PolarHBondContact O-N 3.07Å; L80-N84 PolarHBondContact O-ND2 3.39Å
81E98.4Very high97.7Very high146 Ų14670.9 Ų70.968%0.68235%0.35SS*.Hα-helixtrans-55.8-49.7175.4-174.7-174.7179.600111.5A77 N84 G85A77-E81 PolarHBondContact O-N 2.89Å; E81-N84 PolarHBondContact O-N 3.39Å; E81-G85 PolarHBondContact O-N 3.15Å
82Y98.3Very high97.8Very high150 Ų15069.2 Ų69.259%0.58835%0.347SS*.Hα-helixtrans-60.4-49.3178176.2-93.1000112.4K78 R79 L80 N84 G85 E86K78-Y82 PolarHBondContact O-N 3.49Å; K78-Y82 VanDerWaalsContact O-N 3.12Å; R79-Y82 PolarHBondContact O-N 3.42Å; L80-Y82 PolarHBondContact O-N 2.91Å; Y82-N84 PolarHBondContact O-N 3.3Å; Y82-G85 PolarHBondContact O-N 3.04Å; Y82-E86 HydrophobicContact CD1-CG 4.34Å; Y82-E86 HydrophobicContact CE1-CG 3.77Å; Y82-E86 HydrophobicContact CE2-CG 4.2Å; Y82-E86 PolarHBondContact O-N 3.2Å
83I98.1Very high97.8Very high3 Ų372.3 Ų72.32%0.01536%0.362CS..Hα-helixtrans-64.6-43-177.1-60.2164.3000110.3L33 Q36 V37 R79 L80 G85 E86 I87L33-I83 HydrophobicContact CB-CG2 3.9Å; L33-I83 HydrophobicContact CD2-CG2 3.96Å; L33-I83 HydrophobicContact CG-CG2 4.48Å; Q36-I83 HydrophobicContact CB-CD1 4.07Å; V37-I83 HydrophobicContact CB-CG2 4.48Å; V37-I83 HydrophobicContact CG2-CB 3.85Å; V37-I83 HydrophobicContact CG2-CG2 3.21Å; R79-I83 HydrophobicContact CG-CD1 3.87Å; R79-I83 HydrophobicContact CG-CG1 4.41Å; R79-I83 VanDerWaalsContact O-CG1 3.24Å; R79-I83 WeakPolarHBondContact O-CG1 3.35Å; R79-I83 PolarHBondContact O-N 3.35Å; L80-I83 PolarHBondContact O-N 3.42Å; I83-G85 VanDerWaalsContact C-N 3.32Å; I83-G85 PolarHBondContact O-N 3.49Å; I83-E86 PolarHBondContact O-N 3.01Å; I83-I87 HydrophobicContact CG2-CD1 4.27Å; I83-I87 WeakPolarHBondContact O-CG1 3.44Å; I83-I87 PolarHBondContact O-N 3.43Å
84N98.3Very high97.8Very high73 Ų7371.4 Ų71.439%0.3936%0.359SS..Hα-helixtrans-61.4-40.9176.5-75.4-37.2000111.8L80 E81 Y82 I87 Q88L80-N84 VanDerWaalsContact O-CB 3.3Å; L80-N84 WeakPolarHBondContact O-CB 3.32Å; L80-N84 VanDerWaalsContact O-CG 3.28Å; L80-N84 PolarHBondContact O-N 3.07Å; L80-N84 PolarHBondContact O-ND2 3.39Å; E81-N84 PolarHBondContact O-N 3.39Å; Y82-N84 PolarHBondContact O-N 3.3Å; N84-I87 PolarHBondContact O-N 3.14Å; N84-Q88 WeakPolarHBondContact O-CG 3.37Å; N84-Q88 PolarHBondContact O-N 2.93Å
85G98.4Very high97.8Very high41 Ų4174.7 Ų74.742%0.42336%0.362SS..Hα-helixtrans-60.6-43.7173.300000112.8E81 Y82 I83 Q88 R89E81-G85 PolarHBondContact O-N 3.15Å; Y82-G85 PolarHBondContact O-N 3.04Å; I83-G85 VanDerWaalsContact C-N 3.32Å; I83-G85 PolarHBondContact O-N 3.49Å; G85-Q88 PolarHBondContact O-N 3.01Å; G85-R89 PolarHBondContact O-N 3.02Å
86E98.2Very high97.8Very high32 Ų3274.5 Ų74.515%0.1536%0.358CS..Hα-helixtrans-66-38.1176.7-74.9-70.79700112.4L33 Y82 I83 R89 Y90L33-E86 HydrophobicContact CD1-CB 3.8Å; Y82-E86 HydrophobicContact CD1-CG 4.34Å; Y82-E86 HydrophobicContact CE1-CG 3.77Å; Y82-E86 HydrophobicContact CE2-CG 4.2Å; Y82-E86 PolarHBondContact O-N 3.2Å; I83-E86 PolarHBondContact O-N 3.01Å; E86-R89 VanDerWaalsContact CD-CZ 3.49Å; E86-R89 WeakPolarHBondContact O-CB 3.42Å; E86-R89 PolarHBondContact O-N 3.3Å; E86-R89 IonicContact OE1-CZ 2.77Å; E86-R89 IonicContact OE1-NE 2.9Å; E86-R89 IonicContact OE1-NH1 3.43Å; E86-R89 PolarHBondContact OE1-NH1 3.25Å; E86-R89 IonicContact OE1-NH2 3.22Å; E86-R89 PolarHBondContact OE1-NH2 2.92Å; E86-R89 IonicContact OE2-CZ 2.64Å; E86-R89 IonicContact OE2-NE 3.5Å; E86-R89 IonicContact OE2-NH1 3.07Å; E86-R89 PolarHBondContact OE2-NH1 3.46Å; E86-R89 IonicContact OE2-NH2 3.51Å; E86-R89 PolarHBondContact OE2-NH2 3.4Å; E86-Y90 VanDerWaalsContact O-CD2 3.24Å; E86-Y90 WeakPolarHBondContact O-CD2 3.4Å; E86-Y90 PolarHBondContact O-N 3Å
87I98Very high97.7Very high16 Ų1674.6 Ų74.68%0.08236%0.358CS..Hα-helixtrans-58.9-49.8173.1-71.7172.5000110.2R30 L33 E34 V37 I83 N84 R89 Y90 E91R30-I87 HydrophobicContact CG-CG2 4.48Å; L33-I87 HydrophobicContact CB-CD1 4.1Å; L33-I87 HydrophobicContact CB-CG1 3.65Å; L33-I87 HydrophobicContact CD1-CG1 4.28Å; E34-I87 HydrophobicContact CG-CD1 4.15Å; V37-I87 HydrophobicContact CB-CD1 4.48Å; V37-I87 HydrophobicContact CG2-CD1 3.54Å; I83-I87 HydrophobicContact CG2-CD1 4.27Å; I83-I87 WeakPolarHBondContact O-CG1 3.44Å; I83-I87 PolarHBondContact O-N 3.43Å; N84-I87 PolarHBondContact O-N 3.14Å; I87-R89 VanDerWaalsContact C-N 3.26Å; I87-R89 PolarHBondContact O-N 3.11Å; I87-Y90 PolarHBondContact O-N 3Å; I87-Y90 VanDerWaalsContact O-N 3.07Å; I87-E91 HydrophobicContact CG2-CG 4.35Å; I87-E91 WeakPolarHBondContact O-CG 3.33Å; I87-E91 PolarHBondContact O-N 3.12Å
88Q98Very high97.6Very high111 Ų11178 Ų7852%0.51937%0.366SS..Hα-helixtrans-59.1-38177.9-73.2-60.1-50.100112.3N84 G85 E91 T92N84-Q88 WeakPolarHBondContact O-CG 3.37Å; N84-Q88 PolarHBondContact O-N 2.93Å; G85-Q88 PolarHBondContact O-N 3.01Å; Q88-E91 PolarHBondContact NE2-OE2 2.93Å; Q88-E91 PolarHBondContact O-N 3.44Å; Q88-T92 PolarHBondContact O-N 3.33Å; Q88-T92 PolarHBondContact O-OG1 3.45Å
89R97.9Very high97.5Very high134 Ų13476.7 Ų76.751%0.50636%0.36SS..Hα-helixtrans-62.6-45.4173.8-165.5-17373.9-169-5.1111.7G85 E86 I87 T92 L93G85-R89 PolarHBondContact O-N 3.02Å; E86-R89 VanDerWaalsContact CD-CZ 3.49Å; E86-R89 WeakPolarHBondContact O-CB 3.42Å; E86-R89 PolarHBondContact O-N 3.3Å; E86-R89 IonicContact OE1-CZ 2.77Å; E86-R89 IonicContact OE1-NE 2.9Å; E86-R89 IonicContact OE1-NH1 3.43Å; E86-R89 PolarHBondContact OE1-NH1 3.25Å; E86-R89 IonicContact OE1-NH2 3.22Å; E86-R89 PolarHBondContact OE1-NH2 2.92Å; E86-R89 IonicContact OE2-CZ 2.64Å; E86-R89 IonicContact OE2-NE 3.5Å; E86-R89 IonicContact OE2-NH1 3.07Å; E86-R89 PolarHBondContact OE2-NH1 3.46Å; E86-R89 IonicContact OE2-NH2 3.51Å; E86-R89 PolarHBondContact OE2-NH2 3.4Å; I87-R89 VanDerWaalsContact C-N 3.26Å; I87-R89 PolarHBondContact O-N 3.11Å; R89-T92 PolarHBondContact O-N 3.29Å; R89-L93 WeakPolarHBondContact O-CB 3.37Å; R89-L93 PolarHBondContact O-N 3.09Å
90Y97.8Very high97.3Very high48 Ų4874.8 Ų74.819%0.18836%0.356CS..Hα-helixtrans-66.1-37.2176.6-83.9-68.2000112.7A29 R30 L33 E86 I87 L93 L94A29-Y90 HydrophobicContact CB-CE1 3.92Å; A29-Y90 HydrophobicContact CB-CE2 4.19Å; R30-Y90 HydrophobicContact CB-CG 4.49Å; L33-Y90 HydrophobicContact CD1-CD2 3.63Å; L33-Y90 HydrophobicContact CD1-CE2 3.7Å; E86-Y90 VanDerWaalsContact O-CD2 3.24Å; E86-Y90 WeakPolarHBondContact O-CD2 3.4Å; E86-Y90 PolarHBondContact O-N 3Å; I87-Y90 PolarHBondContact O-N 3Å; I87-Y90 VanDerWaalsContact O-N 3.07Å; Y90-L93 HydrophobicContact CD1-CD2 4.31Å; Y90-L93 PolarHBondContact O-N 3.46Å; Y90-L94 VanDerWaalsContact O-CB 3.31Å; Y90-L94 WeakPolarHBondContact O-CB 3.43Å; Y90-L94 VanDerWaalsContact O-CG 3.25Å; Y90-L94 WeakPolarHBondContact O-CG 3.4Å; Y90-L94 PolarHBondContact O-N 3.49Å
91E96.4Very high97.1Very high53 Ų5374.9 Ų74.925%0.24836%0.357CS..Hα-helixtrans-62.2-43.3175-73.2-175.9160.900111.9R30 I87 Q88 L94 K95R30-E91 IonicContact NH1-OE1 3.38Å; R30-E91 PolarHBondContact NH1-OE1 2.79Å; I87-E91 HydrophobicContact CG2-CG 4.35Å; I87-E91 WeakPolarHBondContact O-CG 3.33Å; I87-E91 PolarHBondContact O-N 3.12Å; Q88-E91 PolarHBondContact NE2-OE2 2.93Å; Q88-E91 PolarHBondContact O-N 3.44Å; E91-L94 PolarHBondContact O-N 3.39Å; E91-K95 WeakPolarHBondContact O-CG 3.37Å; E91-K95 PolarHBondContact O-N 3.34Å
92T97.7Very high96.9Very high78 Ų7871.3 Ų71.348%0.47934%0.343SS..Hα-helixtrans-63.5-47.8175.6-56.50000110.8Q88 R89 L94 K95 D96Q88-T92 PolarHBondContact O-N 3.33Å; Q88-T92 PolarHBondContact O-OG1 3.45Å; R89-T92 PolarHBondContact O-N 3.29Å; T92-L94 PolarHBondContact O-N 3.09Å; T92-K95 PolarHBondContact O-N 3.3Å; T92-D96 PolarHBondContact O-N 2.94Å
93L96.9Very high96.8Very high76 Ų7669.8 Ų69.840%0.39834%0.341SS..Hα-helixtrans-59.8-43.6178.5-179.566.1000112.1R89 Y90 D96 M97R89-L93 WeakPolarHBondContact O-CB 3.37Å; R89-L93 PolarHBondContact O-N 3.09Å; Y90-L93 HydrophobicContact CD1-CD2 4.31Å; Y90-L93 PolarHBondContact O-N 3.46Å; L93-D96 PolarHBondContact O-N 3.14Å; L93-M97 HydrophobicContact CD1-CE 4.36Å; L93-M97 HydrophobicContact CD2-CE 3.98Å; L93-M97 HydrophobicContact CG-CE 3.6Å; L93-M97 WeakPolarHBondContact O-CG 3.49Å; L93-M97 PolarHBondContact O-N 3.45Å
94L97.1Very high96.6Very high28 Ų2871.3 Ų71.315%0.14735%0.348CS..Hα-helixtrans-64.6-43.4178.3-77.2166.1000111.8V23 M27 Y90 E91 T92 D96 M97 E98V23-L94 HydrophobicContact CG1-CD2 4.15Å; M27-L94 HydrophobicContact CG-CD1 4.21Å; M27-L94 HydrophobicContact CG-CD2 3.73Å; Y90-L94 VanDerWaalsContact O-CB 3.31Å; Y90-L94 WeakPolarHBondContact O-CB 3.43Å; Y90-L94 VanDerWaalsContact O-CG 3.25Å; Y90-L94 WeakPolarHBondContact O-CG 3.4Å; Y90-L94 PolarHBondContact O-N 3.49Å; E91-L94 PolarHBondContact O-N 3.39Å; T92-L94 PolarHBondContact O-N 3.09Å; L94-D96 VanDerWaalsContact C-N 3.3Å; L94-D96 PolarHBondContact O-N 2.87Å; L94-M97 HydrophobicContact CD2-CE 3.91Å; L94-M97 HydrophobicContact CG-CE 4.37Å; L94-M97 PolarHBondContact O-N 3.31Å; L94-E98 WeakPolarHBondContact O-CB 3.28Å; L94-E98 PolarHBondContact O-N 3.4Å
95K97.1Very high96.4Very high128 Ų12873.5 Ų73.556%0.55735%0.351SS*.Hα-helixtrans-59.8-40.3174.6-75.6173.5-178.1173.10112.1E91 T92 E98 K99E91-K95 WeakPolarHBondContact O-CG 3.37Å; E91-K95 PolarHBondContact O-N 3.34Å; T92-K95 PolarHBondContact O-N 3.3Å; K95-E98 PolarHBondContact O-N 3.02Å; K95-K99 WeakPolarHBondContact O-CG 3.41Å; K95-K99 PolarHBondContact O-N 3.41Å; K95-K99 VanDerWaalsContact O-N 3.17Å
96D96.8Very high96.3Very high72 Ų7278.2 Ų78.239%0.38536%0.362SS..Hα-helixtrans-70.4-38.2177.5-73.2-16.1000112.1T92 L93 L94 K100T92-D96 PolarHBondContact O-N 2.94Å; L93-D96 PolarHBondContact O-N 3.14Å; L94-D96 VanDerWaalsContact C-N 3.3Å; L94-D96 PolarHBondContact O-N 2.87Å; D96-K100 WeakPolarHBondContact O-CG 3.34Å; D96-K100 PolarHBondContact O-N 3.42Å; D96-K100 VanDerWaalsContact O-N 3.11Å
97M96.2Very high96.2Very high18 Ų1879.8 Ų79.89%0.08937%0.373CS..Hα-helixtrans-66.8-35.8173.9-74-170.1-75.400112.4D22 V23 S26 L93 L94 K100 S101D22-M97 HydrophobicContact CB-SD 4.26Å; V23-M97 HydrophobicContact CG2-CB 3.7Å; V23-M97 HydrophobicContact CG2-CE 4.38Å; V23-M97 HydrophobicContact CG2-CG 4.42Å; V23-M97 HydrophobicContact CG2-SD 3.98Å; S26-M97 VanDerWaalsContact OG-CE 3.27Å; S26-M97 WeakPolarHBondContact OG-CE 3.36Å; L93-M97 HydrophobicContact CD1-CE 4.36Å; L93-M97 HydrophobicContact CD2-CE 3.98Å; L93-M97 HydrophobicContact CG-CE 3.6Å; L93-M97 WeakPolarHBondContact O-CG 3.49Å; L93-M97 PolarHBondContact O-N 3.45Å; L94-M97 HydrophobicContact CD2-CE 3.91Å; L94-M97 HydrophobicContact CG-CE 4.37Å; L94-M97 PolarHBondContact O-N 3.31Å; M97-K100 PolarHBondContact O-N 3Å; M97-S101 VanDerWaalsContact O-CB 3.24Å; M97-S101 WeakPolarHBondContact O-CB 3.44Å; M97-S101 PolarHBondContact O-N 2.92Å
98E94.4Very high96.1Very high120 Ų12079.6 Ų79.656%0.56137%0.373SS*.Hα-helixtrans-62-48.9174.8-175.2173.6-154.400111.3L94 K95 K100 S101 D102L94-E98 WeakPolarHBondContact O-CB 3.28Å; L94-E98 PolarHBondContact O-N 3.4Å; K95-E98 PolarHBondContact O-N 3.02Å; E98-K100 VanDerWaalsContact C-N 3.32Å; E98-K100 PolarHBondContact O-N 2.87Å; E98-S101 VanDerWaalsContact O-CB 3.28Å; E98-S101 WeakPolarHBondContact O-CB 3.29Å; E98-S101 PolarHBondContact O-N 3.48Å; E98-S101 VanDerWaalsContact O-N 3.12Å; E98-D102 PolarHBondContact O-N 2.95Å
99K96.3Very high95.9Very high126 Ų12676.9 Ų76.955%0.54837%0.366SS..Hα-helixtrans-57.6-44174.7-69.6172.2-174.4169.90112.5K95 S101 D102 Q103K95-K99 WeakPolarHBondContact O-CG 3.41Å; K95-K99 PolarHBondContact O-N 3.41Å; K95-K99 VanDerWaalsContact O-N 3.17Å; K99-S101 VanDerWaalsContact C-N 3.34Å; K99-D102 PolarHBondContact O-N 3.44Å; K99-Q103 WeakPolarHBondContact O-CG 3.47Å; K99-Q103 PolarHBondContact O-N 3.14Å; K99-Q103 VanDerWaalsContact O-N 3.11Å
100K95.3Very high95.8Very high108 Ų10873 Ų7347%0.4736%0.359SS..Hα-helixtrans-66.8-37.6177.5-70.7175.3-178.3175.50111.8M19 D96 M97 E98 D102 Q103 H104M19-K100 HydrophobicContact CE-CB 3.66Å; M19-K100 HydrophobicContact CE-CD 4.25Å; M19-K100 HydrophobicContact SD-CB 3.56Å; M19-K100 VanDerWaalsContact SD-CB 3.56Å; D96-K100 WeakPolarHBondContact O-CG 3.34Å; D96-K100 PolarHBondContact O-N 3.42Å; D96-K100 VanDerWaalsContact O-N 3.11Å; M97-K100 PolarHBondContact O-N 3Å; E98-K100 VanDerWaalsContact C-N 3.32Å; E98-K100 PolarHBondContact O-N 2.87Å; K100-D102 VanDerWaalsContact C-N 3.3Å; K100-D102 PolarHBondContact O-N 3.43Å; K100-Q103 PolarHBondContact O-N 2.71Å; K100-H104 PolarHBondContact O-CD2 2.94Å; K100-H104 PolarHBondContact O-N 3.5Å
101S93.7Very high95.6Very high12 Ų1271.4 Ų71.48%0.08435%0.354CS..Hα-helixtrans-59.7-42.5176179.30000111Y16 M19 M97 E98 K99 H104 R105Y16-S101 WeakPolarHBondContact CE2-OG 3.48Å; M19-S101 PolarHBondContact SD-N 3.3Å; M19-S101 VanDerWaalsContact SD-N 3.39Å; M97-S101 VanDerWaalsContact O-CB 3.24Å; M97-S101 WeakPolarHBondContact O-CB 3.44Å; M97-S101 PolarHBondContact O-N 2.92Å; E98-S101 VanDerWaalsContact O-CB 3.28Å; E98-S101 WeakPolarHBondContact O-CB 3.29Å; E98-S101 PolarHBondContact O-N 3.48Å; E98-S101 VanDerWaalsContact O-N 3.12Å; K99-S101 VanDerWaalsContact C-N 3.34Å; S101-H104 PolarHBondContact O-N 3.22Å; S101-R105 WeakPolarHBondContact O-CG 3.44Å; S101-R105 PolarHBondContact O-N 2.96Å
102D94.8Very high95.4Very high70 Ų7073.6 Ų73.637%0.37436%0.364SS..Hα-helixtrans-66.5-43.3176.4-66.5-16.2000112E98 K99 K100 H104 R105 E106E98-D102 PolarHBondContact O-N 2.95Å; K99-D102 PolarHBondContact O-N 3.44Å; K100-D102 VanDerWaalsContact C-N 3.3Å; K100-D102 PolarHBondContact O-N 3.43Å; D102-H104 PolarHBondContact O-N 3.33Å; D102-R105 WeakPolarHBondContact O-CB 3.5Å; D102-R105 PolarHBondContact O-N 3.16Å; D102-R105 VanDerWaalsContact O-N 3.14Å; D102-R105 IonicContact OD1-CZ 2.68Å; D102-R105 IonicContact OD1-NE 3.99Å; D102-R105 IonicContact OD1-NH2 3.38Å; D102-R105 PolarHBondContact OD1-NH2 2.91Å; D102-E106 WeakPolarHBondContact O-CG 3.45Å; D102-E106 PolarHBondContact O-N 3.48Å
103Q95.6Very high95.2Very high118 Ų11874.6 Ų74.655%0.55136%0.363SS*.Hα-helixtrans-58.7-45.5174-70.5172-9.500112.3K99 K100 R105 E106 V107K99-Q103 WeakPolarHBondContact O-CG 3.47Å; K99-Q103 PolarHBondContact O-N 3.14Å; K99-Q103 VanDerWaalsContact O-N 3.11Å; K100-Q103 PolarHBondContact O-N 2.71Å; Q103-R105 VanDerWaalsContact C-N 3.32Å; Q103-R105 PolarHBondContact O-N 3.42Å; Q103-E106 PolarHBondContact O-N 2.88Å; Q103-V107 WeakPolarHBondContact O-CG2 3.28Å; Q103-V107 PolarHBondContact O-N 2.9Å
104H94.2Very high94.9Very high35 Ų3574.8 Ų74.816%0.16236%0.362CS..Hα-helixtrans-63.7-37.4176.1-76.8-66.4000112.1E12 Y16 M19 K100 S101 D102 V107 L108E12-H104 IonicContact OE2-CE1 2.71Å; E12-H104 PolarHBondContact OE2-CE1 3.15Å; E12-H104 IonicContact OE2-ND1 3.55Å; E12-H104 PolarHBondContact OE2-ND1 3.06Å; Y16-H104 HydrophobicContact CD2-CB 3.74Å; Y16-H104 HydrophobicContact CG-CB 4.41Å; M19-H104 WeakPolarHBondContact CE-CD2 3.45Å; M19-H104 VanDerWaalsContact CE-NE2 3.28Å; M19-H104 WeakPolarHBondContact CE-NE2 3.5Å; K100-H104 PolarHBondContact O-CD2 2.94Å; K100-H104 PolarHBondContact O-N 3.5Å; S101-H104 PolarHBondContact O-N 3.22Å; D102-H104 PolarHBondContact O-N 3.33Å; H104-V107 PolarHBondContact O-N 2.96Å; H104-L108 VanDerWaalsContact O-CB 3.32Å; H104-L108 WeakPolarHBondContact O-CB 3.32Å; H104-L108 VanDerWaalsContact O-CG 3.28Å; H104-L108 WeakPolarHBondContact O-CG 3.33Å; H104-L108 PolarHBondContact O-N 2.97Å
105R94.3Very high94.6Very high120 Ų12076.1 Ų76.145%0.45337%0.366SS..Hα-helixtrans-62.9-42.7175.1-82.2-173.3-90.7-170.1-0.9112.2Y16 S101 D102 Q103 L108 S109Y16-R105 HydrophobicContact CD2-CG 4.48Å; Y16-R105 HydrophobicContact CE1-CG 4.41Å; Y16-R105 HydrophobicContact CE2-CG 3.63Å; Y16-R105 WeakPolarHBondContact OH-CD 3.45Å; Y16-R105 PolarHBondContact OH-NE 3.29Å; S101-R105 WeakPolarHBondContact O-CG 3.44Å; S101-R105 PolarHBondContact O-N 2.96Å; D102-R105 WeakPolarHBondContact O-CB 3.5Å; D102-R105 PolarHBondContact O-N 3.16Å; D102-R105 VanDerWaalsContact O-N 3.14Å; D102-R105 IonicContact OD1-CZ 2.68Å; D102-R105 IonicContact OD1-NE 3.99Å; D102-R105 IonicContact OD1-NH2 3.38Å; D102-R105 PolarHBondContact OD1-NH2 2.91Å; Q103-R105 VanDerWaalsContact C-N 3.32Å; Q103-R105 PolarHBondContact O-N 3.42Å; R105-L108 PolarHBondContact O-N 3.42Å; R105-S109 WeakPolarHBondContact O-CB 3.4Å; R105-S109 PolarHBondContact O-N 3.31Å
106E96.3Very high94.2Very high139 Ų13974.7 Ų74.765%0.6536%0.361SS*.Hα-helixtrans-62.6-46.7175.8-71.8178.3178.200111.7D102 Q103 L108 S109 S110D102-E106 WeakPolarHBondContact O-CG 3.45Å; D102-E106 PolarHBondContact O-N 3.48Å; Q103-E106 PolarHBondContact O-N 2.88Å; E106-L108 PolarHBondContact O-N 3.21Å; E106-S109 PolarHBondContact O-N 3.4Å; E106-S110 WeakPolarHBondContact O-CB 3.33Å; E106-S110 PolarHBondContact O-N 3.01Å
107V95.6Very high93.8Very high65 Ų6579.5 Ų79.539%0.39437%0.374SS..Hα-helixtrans-61.8-44.1177.3173.30000111.1E12 Q103 H104 S109 S110 L111E12-V107 HydrophobicContact CG-CG1 3.99Å; Q103-V107 WeakPolarHBondContact O-CG2 3.28Å; Q103-V107 PolarHBondContact O-N 2.9Å; H104-V107 PolarHBondContact O-N 2.96Å; V107-S109 PolarHBondContact O-N 2.92Å; V107-S110 PolarHBondContact O-N 3.39Å; V107-L111 HydrophobicContact CG1-CD1 3.84Å; V107-L111 HydrophobicContact CG1-CG 4.32Å; V107-L111 WeakPolarHBondContact O-CB 3.43Å; V107-L111 WeakPolarHBondContact O-CG 3.48Å; V107-L111 PolarHBondContact O-N 3.41Å
108L95.2Very high93.3Very high13 Ų1381 Ų817%0.06839%0.389CS..Hα-helixtrans-61.1-44.5176.6-80.1169.6000111.9E12 L13 Y16 H104 R105 E106 L111 Q112E12-L108 HydrophobicContact CB-CD2 3.81Å; E12-L108 HydrophobicContact CB-CG 4.22Å; L13-L108 HydrophobicContact CB-CD2 4.28Å; L13-L108 HydrophobicContact CD1-CD1 4.49Å; Y16-L108 HydrophobicContact CD1-CD1 4.04Å; Y16-L108 HydrophobicContact CG-CD1 3.97Å; H104-L108 VanDerWaalsContact O-CB 3.32Å; H104-L108 WeakPolarHBondContact O-CB 3.32Å; H104-L108 VanDerWaalsContact O-CG 3.28Å; H104-L108 WeakPolarHBondContact O-CG 3.33Å; H104-L108 PolarHBondContact O-N 2.97Å; R105-L108 PolarHBondContact O-N 3.42Å; E106-L108 PolarHBondContact O-N 3.21Å; L108-L111 PolarHBondContact O-N 3.45Å; L108-Q112 WeakPolarHBondContact O-CB 3.26Å; L108-Q112 VanDerWaalsContact O-CG 3.25Å; L108-Q112 WeakPolarHBondContact O-CG 3.25Å; L108-Q112 PolarHBondContact O-N 3.36Å
109S95.2Very high92.7Very high54 Ų5479.8 Ų79.838%0.37838%0.383SS..Hα-helixtrans-60-45.7176178.40000111.6R105 E106 V107 Q112 Q113R105-S109 WeakPolarHBondContact O-CB 3.4Å; R105-S109 PolarHBondContact O-N 3.31Å; E106-S109 PolarHBondContact O-N 3.4Å; V107-S109 PolarHBondContact O-N 2.92Å; S109-Q112 PolarHBondContact O-N 2.91Å; S109-Q113 WeakPolarHBondContact O-CG 3.4Å; S109-Q113 PolarHBondContact O-N 3.22Å
110S95.1Very high91.4Very high51 Ų5176.8 Ų76.836%0.35739%0.388SS..Hα-helixtrans-61.9-48.1176.9174.80000112.1E106 V107 Q112 Q113 E114E106-S110 WeakPolarHBondContact O-CB 3.33Å; E106-S110 PolarHBondContact O-N 3.01Å; V107-S110 PolarHBondContact O-N 3.39Å; S110-Q112 VanDerWaalsContact C-N 3.32Å; S110-Q112 PolarHBondContact O-N 3.33Å; S110-Q113 PolarHBondContact O-N 2.89Å; S110-E114 WeakPolarHBondContact O-CG 3.39Å; S110-E114 PolarHBondContact O-N 3.36Å
111L94.3Very high89.8Confident15 Ų1576.8 Ų76.88%0.07939%0.393CS..Hα-helixtrans-62.6-37.2177.7-72.6172000112.3K8 L9 E12 V107 L108 E114 Y115K8-L111 HydrophobicContact CB-CD1 4.17Å; K8-L111 HydrophobicContact CB-CD2 4.17Å; K8-L111 HydrophobicContact CD-CD2 4.36Å; L9-L111 HydrophobicContact CD1-CB 4.35Å; E12-L111 HydrophobicContact CB-CD1 4.38Å; E12-L111 HydrophobicContact CG-CD1 4.02Å; V107-L111 HydrophobicContact CG1-CD1 3.84Å; V107-L111 HydrophobicContact CG1-CG 4.32Å; V107-L111 WeakPolarHBondContact O-CB 3.43Å; V107-L111 WeakPolarHBondContact O-CG 3.48Å; V107-L111 PolarHBondContact O-N 3.41Å; L108-L111 PolarHBondContact O-N 3.45Å; L111-E114 PolarHBondContact O-N 3.41Å; L111-Y115 VanDerWaalsContact O-CB 3.26Å; L111-Y115 WeakPolarHBondContact O-CB 3.3Å; L111-Y115 PolarHBondContact O-N 3.38Å
112Q91.8Very high87.6Confident100 Ų10080.5 Ų80.547%0.46742%0.424SS..Hα-helixtrans-62.8-44.9174.9-78.6174.5-2.800111.7L9 L108 S109 S110 Y115 Q116L9-Q112 HydrophobicContact CD1-CB 4.44Å; L9-Q112 HydrophobicContact CD1-CG 3.64Å; L108-Q112 WeakPolarHBondContact O-CB 3.26Å; L108-Q112 VanDerWaalsContact O-CG 3.25Å; L108-Q112 WeakPolarHBondContact O-CG 3.25Å; L108-Q112 PolarHBondContact O-N 3.36Å; S109-Q112 PolarHBondContact O-N 2.91Å; S110-Q112 VanDerWaalsContact C-N 3.32Å; S110-Q112 PolarHBondContact O-N 3.33Å; Q112-Y115 PolarHBondContact O-N 2.82Å; Q112-Q116 WeakPolarHBondContact O-CG 3.3Å; Q112-Q116 PolarHBondContact O-N 2.86Å
113Q92.8Very high85.6Confident98 Ų9883.2 Ų83.246%0.45844%0.443SS..Hα-helixtrans-65.1-39.8176.9-69.2176.413.700112.5S109 S110 R117S109-Q113 WeakPolarHBondContact O-CG 3.4Å; S109-Q113 PolarHBondContact O-N 3.22Å; S110-Q113 PolarHBondContact O-N 2.89Å; Q113-R117 WeakPolarHBondContact O-CG 3.48Å; Q113-R117 PolarHBondContact O-N 3.21Å; Q113-R117 VanDerWaalsContact O-N 3.15Å; Q113-R117 PolarHBondContact O-NE 3.49Å
114E91.4Very high83.3Confident81 Ų8180.9 Ų80.938%0.37945%0.45SS..Hα-helixtrans-65.3-41.4175.4-74.2-178.3-171.200111.7I5 S110 L111 R117 A118I5-E114 HydrophobicContact CD1-CB 4.39Å; S110-E114 WeakPolarHBondContact O-CG 3.39Å; S110-E114 PolarHBondContact O-N 3.36Å; L111-E114 PolarHBondContact O-N 3.41Å; E114-R117 PolarHBondContact O-N 3.07Å; E114-A118 VanDerWaalsContact O-CB 3.3Å; E114-A118 WeakPolarHBondContact O-CB 3.36Å; E114-A118 PolarHBondContact O-N 3.41Å
115Y90.8Very high81.1Confident55 Ų5588.7 Ų88.722%0.21648%0.484CS..Hα-helixtrans-62.4-45.3177.9-173.3-114.5000112I5 Q6 L111 Q112 R117 A118 Q119I5-Y115 HydrophobicContact CB-CD2 4.21Å; I5-Y115 HydrophobicContact CG2-CD2 3.98Å; I5-Y115 HydrophobicContact CG2-CG 4.32Å; Q6-Y115 HydrophobicContact CB-CD2 4.48Å; Q6-Y115 HydrophobicContact CB-CE2 3.78Å; Q6-Y115 HydrophobicContact CG-CE2 4.33Å; L111-Y115 VanDerWaalsContact O-CB 3.26Å; L111-Y115 WeakPolarHBondContact O-CB 3.3Å; L111-Y115 PolarHBondContact O-N 3.38Å; Q112-Y115 PolarHBondContact O-N 2.82Å; Y115-R117 PolarHBondContact O-N 3.38Å; Y115-A118 PolarHBondContact O-N 3.31Å; Y115-Q119 HydrophobicContact CE2-CG 4.48Å; Y115-Q119 PolarHBondContact O-N 3.04Å; Y115-Q119 PolarHBondContact OH-NE2 3.37Å
116Q89.4Confident78.3Confident99 Ų9993.4 Ų93.446%0.46353%0.525SS..Hα-helixtrans-59.5-46.1175.7-72.3172.10.300111.6Q112 A118 Q119 L121Q112-Q116 WeakPolarHBondContact O-CG 3.3Å; Q112-Q116 PolarHBondContact O-N 2.86Å; Q116-A118 PolarHBondContact O-N 3.04Å; Q116-Q119 PolarHBondContact O-N 3.24Å; Q116-L121 PolarHBondContact O-N 3.47Å
117R88.3Confident77.4Confident172 Ų17291.1 Ų91.165%0.64952%0.519SS*.Hα-helixtrans-60.5-43.4175.1-78.6-176.6-92.2162.7-10.4112.1Q113 E114 Y115 Q119 G120Q113-R117 WeakPolarHBondContact O-CG 3.48Å; Q113-R117 PolarHBondContact O-N 3.21Å; Q113-R117 VanDerWaalsContact O-N 3.15Å; Q113-R117 PolarHBondContact O-NE 3.49Å; E114-R117 PolarHBondContact O-N 3.07Å; Y115-R117 PolarHBondContact O-N 3.38Å; R117-Q119 VanDerWaalsContact C-N 3.28Å; R117-Q119 PolarHBondContact O-N 3.36Å; R117-G120 PolarHBondContact O-N 3.15Å
118A85.4Confident76.4Confident49 Ų4992.5 Ų92.541%0.40553%0.525SS..Hα-helixtrans-69.1-22.6-179.200000113.9I5 E114 Y115 Q116 G120I5-A118 HydrophobicContact CD1-CB 3.86Å; E114-A118 VanDerWaalsContact O-CB 3.3Å; E114-A118 WeakPolarHBondContact O-CB 3.36Å; E114-A118 PolarHBondContact O-N 3.41Å; Y115-A118 PolarHBondContact O-N 3.31Å; Q116-A118 PolarHBondContact O-N 3.04Å; A118-G120 VanDerWaalsContact C-N 3.35Å
119Q82.1Confident75.4Confident95 Ų9596.9 Ų96.944%0.44455%0.551SS.*THydrogen-bonded Turntrans-85.3-2.7174.5-73.8-156.87.300114.1Y115 Q116 R117 L121Y115-Q119 HydrophobicContact CE2-CG 4.48Å; Y115-Q119 PolarHBondContact O-N 3.04Å; Y115-Q119 PolarHBondContact OH-NE2 3.37Å; Q116-Q119 PolarHBondContact O-N 3.24Å; R117-Q119 VanDerWaalsContact C-N 3.28Å; R117-Q119 PolarHBondContact O-N 3.36Å; Q119-L121 HydrophobicContact CB-CD1 4.31Å; Q119-L121 HydrophobicContact CB-CG 4.28Å; Q119-L121 PolarHBondContact O-N 3.35Å
120G69.1Low74.2Confident63 Ų6399.4 Ų99.465%0.64956%0.561SS**THydrogen-bonded Turntrans68.913-175.600000113.5R117 A118 A122R117-G120 PolarHBondContact O-N 3.15Å; A118-G120 VanDerWaalsContact C-N 3.35Å; G120-A122 PolarHBondContact O-N 2.81Å
121L60.8Low72.9Confident109 Ų109102.4 Ų102.457%0.57157%0.574SS**  trans-7183.8165.8-69.6169.7000107.1Q116 Q119 V123Q116-L121 PolarHBondContact O-N 3.47Å; Q119-L121 HydrophobicContact CB-CD1 4.31Å; Q119-L121 HydrophobicContact CB-CG 4.28Å; Q119-L121 PolarHBondContact O-N 3.35Å; L121-V123 PolarHBondContact O-N 3.25Å
122A47.8Very low71.5Confident89 Ų89108.3 Ų108.374%0.73661%0.607SS**  trans-55.6130.7167.100000108G120 G124G120-A122 PolarHBondContact O-N 2.81Å; A122-G124 VanDerWaalsContact C-N 3.31Å; A122-G124 PolarHBondContact O-N 2.87Å
123V52.9Low70.1Confident128 Ų128108.9 Ų108.978%0.77662%0.617SS**  trans-55.5101.9167.1176.90000106.2L121 K125L121-V123 PolarHBondContact O-N 3.25Å; V123-K125 PolarHBondContact O-N 2.97Å
124G47.4Very low68.3Low68 Ų68109.7 Ų109.770%0.70163%0.629SS**  trans-58.4108.5169.700000106.8A122 V126A122-G124 VanDerWaalsContact C-N 3.31Å; A122-G124 PolarHBondContact O-N 2.87Å; G124-V126 PolarHBondContact O-N 3.19Å
125K46.6Very low66.4Low200 Ų200112.1 Ų112.187%0.8765%0.65SS**  trans-58.5114.7162.4-76.5-178173.4-177.80107.5V123V123-K125 PolarHBondContact O-N 2.97Å
126V36.1Very low64.2Low218 Ų218117.3 Ų117.3100%1.32169%0.689SS**  trans-141.20143.6-173.10000107G124G124-V126 PolarHBondContact O-N 3.19Å

Retrieved 126 of 126 residues in 603.1 ms (Link to these results)

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