A0A4W5QH19_9TELE 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 , UniProt , Accession A0A4W5QH19, Species 9TELE (Hucho hucho, huchen), Gene n/a, Length 126 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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 212.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).