A0A078BTQ8_CAEEL Loading...

Neur_chan_memb domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BTQ8, Species CAEEL (Caenorhabditis elegans), Gene lgc-19, Length 102 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
1M50.4Low57.1Low217 Ų21795.4 Ų95.4100%1.06952%0.518SS*.  0-40.40-81.3-122.4-97.100113.4
2T57.2Low56.6Low112 Ų11295.4 Ų95.469%0.68752%0.517SS*.Hα-helixtrans-72.4-33.317834.50000114.2F5 I6T2-F5 PolarHBondContact O-N 3.24Å; T2-I6 WeakPolarHBondContact O-CD1 3.26Å; T2-I6 VanDerWaalsContact O-CG1 3.23Å; T2-I6 WeakPolarHBondContact O-CG1 3.31Å; T2-I6 PolarHBondContact O-N 3.48Å
3M58.5Low55.7Low142 Ų142101.2 Ų101.270%0.754%0.535SS*.Hα-helixtrans-70.5-38.2-175.9-120.8-169.3179.800114.3I6 L7M3-I6 PolarHBondContact O-N 3.04Å; M3-L7 PolarHBondContact O-N 3.42Å
4T63Low55.2Low31 Ų31103.7 Ų103.719%0.1955%0.546CS..Hα-helixtrans-70.6-33.7177.7-35.10000111.8G8 M34T4-G8 PolarHBondContact O-N 3.46Å; T4-M34 HydrophobicContact CG2-CE 4.3Å
5F53.5Low54.7Low153 Ų153100.3 Ų100.367%0.67153%0.532SS*.Hα-helixtrans-65.1-42.3170.1-178.4-102.9000111T2 L7 G8 V9T2-F5 PolarHBondContact O-N 3.24Å; F5-L7 PolarHBondContact O-N 3.36Å; F5-G8 PolarHBondContact O-N 2.79Å; F5-V9 HydrophobicContact CD1-CG2 4.11Å; F5-V9 HydrophobicContact CD2-CG2 4.39Å; F5-V9 HydrophobicContact CE1-CG2 3.81Å; F5-V9 HydrophobicContact CE2-CG2 4.11Å; F5-V9 HydrophobicContact CG-CG2 4.39Å; F5-V9 HydrophobicContact CZ-CG2 3.82Å; F5-V9 WeakPolarHBondContact O-CG2 3.06Å; F5-V9 PolarHBondContact O-N 3.03Å
6I58.1Low54.3Low87 Ų87109.6 Ų109.645%0.44656%0.558SS.*Hα-helixtrans-63.6-40.6176.2-70.8162.7000111.9T2 M3 V9 M10T2-I6 WeakPolarHBondContact O-CD1 3.26Å; T2-I6 VanDerWaalsContact O-CG1 3.23Å; T2-I6 WeakPolarHBondContact O-CG1 3.31Å; T2-I6 PolarHBondContact O-N 3.48Å; M3-I6 PolarHBondContact O-N 3.04Å; I6-V9 PolarHBondContact O-N 3.45Å; I6-M10 HydrophobicContact CG2-CG 4.2Å; I6-M10 VanDerWaalsContact O-CB 3.31Å; I6-M10 WeakPolarHBondContact O-CB 3.34Å; I6-M10 VanDerWaalsContact O-CG 3.29Å; I6-M10 WeakPolarHBondContact O-CG 3.34Å; I6-M10 PolarHBondContact O-N 2.9Å
7L59.9Low54.1Low46 Ų46110 Ų11024%0.24157%0.567CS.*Hα-helixtrans-63.6-40.6173.8-106.3109.7000112.3M3 F5 M10 A11 F90 M93M3-L7 PolarHBondContact O-N 3.42Å; F5-L7 PolarHBondContact O-N 3.36Å; L7-M10 PolarHBondContact O-N 3.48Å; L7-A11 WeakPolarHBondContact O-CB 2.87Å; L7-A11 PolarHBondContact O-N 2.83Å; L7-F90 HydrophobicContact CD1-CD2 4.22Å; L7-F90 HydrophobicContact CD1-CE2 4.45Å; L7-F90 HydrophobicContact CD2-CD2 4.26Å; L7-M93 HydrophobicContact CD2-CE 3.19Å; L7-M93 HydrophobicContact CD2-SD 3.21Å; L7-M93 WeakPolarHBondContact CD2-SD 3.42Å; L7-M93 HydrophobicContact CG-CE 4.44Å; L7-M93 HydrophobicContact CG-SD 4.49Å
8G59.9Low53.8Low39 Ų39107.7 Ų107.740%0.40258%0.575SS.*Hα-helixtrans-63-40.617300000113.1T4 F5 D12T4-G8 PolarHBondContact O-N 3.46Å; F5-G8 PolarHBondContact O-N 2.79Å; G8-D12 PolarHBondContact O-N 3.27Å
9V58.3Low53.6Low60 Ų60107.7 Ų107.736%0.36458%0.575SS.*Hα-helixtrans-78.4-28.1179.2-177.90000112.2F5 I6 D12 K13F5-V9 HydrophobicContact CD1-CG2 4.11Å; F5-V9 HydrophobicContact CD2-CG2 4.39Å; F5-V9 HydrophobicContact CE1-CG2 3.81Å; F5-V9 HydrophobicContact CE2-CG2 4.11Å; F5-V9 HydrophobicContact CG-CG2 4.39Å; F5-V9 HydrophobicContact CZ-CG2 3.82Å; F5-V9 WeakPolarHBondContact O-CG2 3.06Å; F5-V9 PolarHBondContact O-N 3.03Å; I6-V9 PolarHBondContact O-N 3.45Å; V9-D12 CarbonylContact O-C 3.59Å; V9-D12 WeakPolarHBondContact O-CB 3.33Å; V9-D12 PolarHBondContact O-N 2.82Å; V9-K13 WeakPolarHBondContact O-CG 3.29Å; V9-K13 PolarHBondContact O-N 3.46Å; V9-K13 VanDerWaalsContact O-N 3.08Å
10M54.8Low53.6Low124 Ų124109.4 Ų109.461%0.61158%0.582SS**Hα-helixtrans-71.8-37.8172.2-77.5-120.6-9600111.7I6 L7 D12 K13 I14I6-M10 HydrophobicContact CG2-CG 4.2Å; I6-M10 VanDerWaalsContact O-CB 3.31Å; I6-M10 WeakPolarHBondContact O-CB 3.34Å; I6-M10 VanDerWaalsContact O-CG 3.29Å; I6-M10 WeakPolarHBondContact O-CG 3.34Å; I6-M10 PolarHBondContact O-N 2.9Å; L7-M10 PolarHBondContact O-N 3.48Å; M10-D12 PolarHBondContact O-N 3.22Å; M10-K13 PolarHBondContact O-N 3.43Å; M10-I14 PolarHBondContact O-N 3.06Å
11A54.9Low53.6Low38 Ų38108.6 Ų108.631%0.31458%0.584SS.*Hα-helixtrans-60.8-31.9168.200000111.8L7 P15 L23L7-A11 WeakPolarHBondContact O-CB 2.87Å; L7-A11 PolarHBondContact O-N 2.83Å; A11-P15 VanDerWaalsContact O-CD 3.23Å; A11-P15 WeakPolarHBondContact O-CD 3.14Å; A11-L23 HydrophobicContact CB-CD1 4.08Å; A11-L23 WeakPolarHBondContact O-CD1 2.96Å
12D50.3Low54Low96 Ų96101.5 Ų101.551%0.51355%0.55SS..Hα-helixtrans-78.6-17.1177.1-160-89.8000114.2G8 V9 M10 P15G8-D12 PolarHBondContact O-N 3.27Å; V9-D12 CarbonylContact O-C 3.59Å; V9-D12 WeakPolarHBondContact O-CB 3.33Å; V9-D12 PolarHBondContact O-N 2.82Å; M10-D12 PolarHBondContact O-N 3.22Å; D12-P15 WeakPolarHBondContact O-CD 3.47Å; D12-P15 WeakPolarHBondContact O-CG 3.2Å
13K45.4Very low54.1Low171 Ų17198.2 Ų98.274%0.74353%0.528SS*.Hα-helixtrans-91.6-16.2173.4-68.5-66.5-177.7-1760114.3V9 M10V9-K13 WeakPolarHBondContact O-CG 3.29Å; V9-K13 PolarHBondContact O-N 3.46Å; V9-K13 VanDerWaalsContact O-N 3.08Å; M10-K13 PolarHBondContact O-N 3.43Å
14I48.2Very low54.1Low136 Ų13692.9 Ų92.970%0.69751%0.509SS*.SBendtrans-97.3-1.2174-62.4175.5000115.6M10 R16M10-I14 PolarHBondContact O-N 3.06Å; I14-R16 VanDerWaalsContact C-N 3.26Å; I14-R16 PolarHBondContact O-N 3.23Å; I14-R16 VanDerWaalsContact O-N 3.15Å
15P48.7Very low54.2Low52 Ų5296.1 Ų96.134%0.33852%0.524SS..  trans-9017.3-17041.1-35.7000112.7A11 D12 T17 L23A11-P15 VanDerWaalsContact O-CD 3.23Å; A11-P15 WeakPolarHBondContact O-CD 3.14Å; D12-P15 WeakPolarHBondContact O-CD 3.47Å; D12-P15 WeakPolarHBondContact O-CG 3.2Å; P15-T17 PolarHBondContact O-N 2.91Å; P15-L23 HydrophobicContact CB-CD1 4.16Å; P15-L23 HydrophobicContact CB-CD2 4.24Å
16R48.1Very low54.6Low249 Ų24992.5 Ų92.594%0.9451%0.506SS*.  trans-78.530.9-175.3-134.3-174.9-168.5-177.43.4113.3I14I14-R16 VanDerWaalsContact C-N 3.26Å; I14-R16 PolarHBondContact O-N 3.23Å; I14-R16 VanDerWaalsContact O-N 3.15Å
17T50.1Low55Low117 Ų11792.8 Ų92.872%0.71851%0.508SS*.SBendtrans-141.388.1178.89.70000108.9P15 N19P15-T17 PolarHBondContact O-N 2.91Å; T17-N19 VanDerWaalsContact C-N 3.27Å; T17-N19 PolarHBondContact O-N 3.42Å
18G49.3Very low55.5Low68 Ų6895.7 Ų95.770%0.70152%0.523SS*.SBendtrans62.2-26.715100000121.9I20G18-I20 PolarHBondContact O-N 3.47Å
19N50.7Low55.9Low108 Ų10897.9 Ų97.958%0.57852%0.524SS*.  trans-104.455.9-169.2-82.30.8000112.6T17 P21 L22T17-N19 VanDerWaalsContact C-N 3.27Å; T17-N19 PolarHBondContact O-N 3.42Å; N19-P21 VanDerWaalsContact C-N 3.3Å; N19-L22 HydrophobicContact CB-CD1 4.22Å; N19-L22 PolarHBondContact O-N 2.96Å
20I52.5Low56.4Low141 Ų14196.2 Ų96.272%0.72351%0.513SS*.Hα-helixtrans-53.8-32.4174.7-54.2150.7000113.9G18G18-I20 PolarHBondContact O-N 3.47Å
21P55Low56.9Low94 Ų9495.3 Ų95.361%0.6151%0.511SS*.Hα-helixtrans-77.8-27.518027.1-33000114.8N19N19-P21 VanDerWaalsContact C-N 3.3Å
22L57.4Low57.7Low68 Ų6897.2 Ų97.236%0.35652%0.518SS..Hα-helixtrans-69.7-44.6-179.1-99131.4000111.2N19 G24 I25 Y26N19-L22 HydrophobicContact CB-CD1 4.22Å; N19-L22 PolarHBondContact O-N 2.96Å; L22-G24 VanDerWaalsContact C-N 3.26Å; L22-G24 PolarHBondContact O-N 3.13Å; L22-I25 WeakPolarHBondContact O-CB 3.08Å; L22-I25 PolarHBondContact O-N 3.38Å; L22-I25 VanDerWaalsContact O-N 3.1Å; L22-Y26 HydrophobicContact CD2-CE2 4.33Å; L22-Y26 WeakPolarHBondContact O-CD2 3.36Å; L22-Y26 PolarHBondContact O-N 3.44Å
23L59.3Low58.6Low43 Ų4395.1 Ų95.123%0.22551%0.506CS..Hα-helixtrans-58.7-36.7177.9-159.393.3000112.8A11 P15 I25 Y26 I27A11-L23 HydrophobicContact CB-CD1 4.08Å; A11-L23 WeakPolarHBondContact O-CD1 2.96Å; P15-L23 HydrophobicContact CB-CD1 4.16Å; P15-L23 HydrophobicContact CB-CD2 4.24Å; L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 2.79Å; L23-Y26 WeakPolarHBondContact O-CB 3.28Å; L23-Y26 PolarHBondContact O-N 3.37Å; L23-I27 PolarHBondContact O-N 3.1Å; L23-I27 VanDerWaalsContact O-N 3.16Å
24G59.2Low59.9Low30 Ų3091.1 Ų91.131%0.30949%0.491SS..Hα-helixtrans-63.6-38.2177.400000112.7L22 Y26 I27 I28L22-G24 VanDerWaalsContact C-N 3.26Å; L22-G24 PolarHBondContact O-N 3.13Å; G24-Y26 VanDerWaalsContact C-N 3.33Å; G24-I27 PolarHBondContact O-N 3.32Å; G24-I28 VanDerWaalsContact O-CG1 3.31Å; G24-I28 WeakPolarHBondContact O-CG1 3.45Å; G24-I28 PolarHBondContact O-N 2.81Å; G24-I28 VanDerWaalsContact O-N 3.08Å
25I65.8Low61.2Low99 Ų9990.4 Ų90.451%0.50849%0.488SS..Hα-helixtrans-65.8-39.1176.5-66.8160.7000110.4L22 L23 I27 I28 I29L22-I25 WeakPolarHBondContact O-CB 3.08Å; L22-I25 PolarHBondContact O-N 3.38Å; L22-I25 VanDerWaalsContact O-N 3.1Å; L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 2.79Å; I25-I27 PolarHBondContact O-N 3.42Å; I25-I28 PolarHBondContact O-N 3.11Å; I25-I29 HydrophobicContact CG2-CD1 3.83Å; I25-I29 HydrophobicContact CG2-CG1 4.43Å; I25-I29 WeakPolarHBondContact O-CG1 3.24Å; I25-I29 PolarHBondContact O-N 3.15Å
26Y61Low62.4Low76 Ų7692 Ų9230%0.29849%0.493SS..Hα-helixtrans-59.4-44174.1-78.6-79.2000112.8L22 L23 G24 N30 F96L22-Y26 HydrophobicContact CD2-CE2 4.33Å; L22-Y26 WeakPolarHBondContact O-CD2 3.36Å; L22-Y26 PolarHBondContact O-N 3.44Å; L23-Y26 WeakPolarHBondContact O-CB 3.28Å; L23-Y26 PolarHBondContact O-N 3.37Å; G24-Y26 VanDerWaalsContact C-N 3.33Å; Y26-N30 VanDerWaalsContact O-CB 3.28Å; Y26-N30 WeakPolarHBondContact O-CB 3.5Å; Y26-N30 PolarHBondContact O-N 3.47Å; Y26-F96 WeakPolarHBondContact OH-CD1 2.88Å
27I67.4Low63.5Low93 Ų9380.9 Ų80.948%0.47745%0.454SS..Hα-helixtrans-65.5-41.5179-67.2171.6000110.8L23 G24 I25 N30 L31L23-I27 PolarHBondContact O-N 3.1Å; L23-I27 VanDerWaalsContact O-N 3.16Å; G24-I27 PolarHBondContact O-N 3.32Å; I25-I27 PolarHBondContact O-N 3.42Å; I27-N30 PolarHBondContact O-N 2.83Å; I27-L31 HydrophobicContact CG2-CD1 3.98Å; I27-L31 WeakPolarHBondContact O-CB 3.35Å; I27-L31 PolarHBondContact O-N 3.25Å
28I69.4Low64.5Low108 Ų10880.1 Ų80.155%0.55445%0.445SS*.Hα-helixtrans-64.5-47.2179.8-68.8169.9000110.9G24 I25 N30 L31 V32G24-I28 VanDerWaalsContact O-CG1 3.31Å; G24-I28 WeakPolarHBondContact O-CG1 3.45Å; G24-I28 PolarHBondContact O-N 2.81Å; G24-I28 VanDerWaalsContact O-N 3.08Å; I25-I28 PolarHBondContact O-N 3.11Å; I28-N30 VanDerWaalsContact C-N 3.34Å; I28-N30 PolarHBondContact O-N 2.89Å; I28-L31 WeakPolarHBondContact O-CB 3.26Å; I28-L31 PolarHBondContact O-N 3.29Å; I28-V32 VanDerWaalsContact O-CG2 3.31Å; I28-V32 WeakPolarHBondContact O-CG2 3.38Å; I28-V32 PolarHBondContact O-N 3.01Å
29I69.1Low65.9Low84 Ų8479.3 Ų79.343%0.43143%0.432SS..Hα-helixtrans-62.6-43.9179.3-67.7172.1000110.6I25 L31 V32 I33I25-I29 HydrophobicContact CG2-CD1 3.83Å; I25-I29 HydrophobicContact CG2-CG1 4.43Å; I25-I29 WeakPolarHBondContact O-CG1 3.24Å; I25-I29 PolarHBondContact O-N 3.15Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 2.8Å; I29-V32 PolarHBondContact O-N 3.42Å; I29-I33 HydrophobicContact CG2-CD1 3.76Å; I29-I33 HydrophobicContact CG2-CG1 4.47Å; I29-I33 WeakPolarHBondContact O-CG1 3.22Å; I29-I33 PolarHBondContact O-N 2.84Å
30N67Low66.9Low26 Ų2677.5 Ų77.514%0.13942%0.421CS..Hα-helixtrans-62.4-42177.7-164.4-12000111.6Y26 I27 I28 V32 I33 M34 N89Y26-N30 VanDerWaalsContact O-CB 3.28Å; Y26-N30 WeakPolarHBondContact O-CB 3.5Å; Y26-N30 PolarHBondContact O-N 3.47Å; I27-N30 PolarHBondContact O-N 2.83Å; I28-N30 VanDerWaalsContact C-N 3.34Å; I28-N30 PolarHBondContact O-N 2.89Å; N30-V32 PolarHBondContact O-N 3.45Å; N30-I33 PolarHBondContact O-N 3.02Å; N30-M34 WeakPolarHBondContact O-CB 3.45Å; N30-M34 PolarHBondContact O-N 2.84Å; N30-N89 PolarHBondContact OD1-ND2 3.32Å
31L65.9Low67.8Low105 Ų10572.7 Ų72.755%0.5540%0.398SS..Hα-helixtrans-60.7-43.3173.8-99.9159.3000112.5I27 I28 I29 M34 L35I27-L31 HydrophobicContact CG2-CD1 3.98Å; I27-L31 WeakPolarHBondContact O-CB 3.35Å; I27-L31 PolarHBondContact O-N 3.25Å; I28-L31 WeakPolarHBondContact O-CB 3.26Å; I28-L31 PolarHBondContact O-N 3.29Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 2.8Å; L31-M34 PolarHBondContact O-N 2.93Å; L31-L35 WeakPolarHBondContact O-CB 3.35Å; L31-L35 PolarHBondContact O-N 2.69Å
32V72.6Confident68.6Low77 Ų7771.5 Ų71.547%0.46739%0.389SS..Hα-helixtrans-64.9-46.4179.6170.10000111I28 I29 N30 M34 L35 I36I28-V32 VanDerWaalsContact O-CG2 3.31Å; I28-V32 WeakPolarHBondContact O-CG2 3.38Å; I28-V32 PolarHBondContact O-N 3.01Å; I29-V32 PolarHBondContact O-N 3.42Å; N30-V32 PolarHBondContact O-N 3.45Å; V32-M34 VanDerWaalsContact C-N 3.31Å; V32-M34 PolarHBondContact O-N 2.97Å; V32-L35 PolarHBondContact O-N 3.2Å; V32-I36 HydrophobicContact CG1-CD1 4.01Å; V32-I36 WeakPolarHBondContact O-CG1 3.29Å; V32-I36 PolarHBondContact O-N 2.75Å
33I69.6Low69.4Low52 Ų5270.7 Ų70.727%0.26739%0.393SS..Hα-helixtrans-62.4-41.7178.7-66.6167.4000110.5I29 N30 L35 I36 A37I29-I33 HydrophobicContact CG2-CD1 3.76Å; I29-I33 HydrophobicContact CG2-CG1 4.47Å; I29-I33 WeakPolarHBondContact O-CG1 3.22Å; I29-I33 PolarHBondContact O-N 2.84Å; N30-I33 PolarHBondContact O-N 3.02Å; I33-L35 PolarHBondContact O-N 3.47Å; I33-I36 PolarHBondContact O-N 3.38Å; I33-A37 WeakPolarHBondContact O-CB 3.32Å; I33-A37 PolarHBondContact O-N 3.39Å
34M70.9Confident69.8Low87 Ų8772.3 Ų72.343%0.42940%0.4SS..Hα-helixtrans-64.3-39.6176.3-165.4-177-51.400112.2T4 N30 L31 V32 A37 I38T4-M34 HydrophobicContact CG2-CE 4.3Å; N30-M34 WeakPolarHBondContact O-CB 3.45Å; N30-M34 PolarHBondContact O-N 2.84Å; L31-M34 PolarHBondContact O-N 2.93Å; V32-M34 VanDerWaalsContact C-N 3.31Å; V32-M34 PolarHBondContact O-N 2.97Å; M34-A37 WeakPolarHBondContact O-CB 3.39Å; M34-A37 PolarHBondContact O-N 3.46Å; M34-I38 HydrophobicContact CG-CD1 4.23Å; M34-I38 WeakPolarHBondContact O-CG1 3.25Å; M34-I38 PolarHBondContact O-N 3.34Å
35L75.3Confident70.2Confident122 Ų12274.1 Ų74.164%0.63941%0.405SS*.Hα-helixtrans-64.8-41.7177.4-168149.8000111.3L31 V32 I33 I38 A39L31-L35 WeakPolarHBondContact O-CB 3.35Å; L31-L35 PolarHBondContact O-N 2.69Å; V32-L35 PolarHBondContact O-N 3.2Å; I33-L35 PolarHBondContact O-N 3.47Å; L35-I38 PolarHBondContact O-N 3.31Å; L35-A39 WeakPolarHBondContact O-CB 3.43Å; L35-A39 PolarHBondContact O-N 3.49Å
36I75.7Confident70.3Confident85 Ų8574 Ų7444%0.43640%0.403SS..Hα-helixtrans-63.3-42.8173.8-65.4168.8000110.7V32 I33 I38 A39 I40V32-I36 HydrophobicContact CG1-CD1 4.01Å; V32-I36 WeakPolarHBondContact O-CG1 3.29Å; V32-I36 PolarHBondContact O-N 2.75Å; I33-I36 PolarHBondContact O-N 3.38Å; I36-I38 PolarHBondContact O-N 3.03Å; I36-A39 PolarHBondContact O-N 3.25Å; I36-I40 HydrophobicContact CG2-CD1 3.81Å; I36-I40 HydrophobicContact CG2-CG1 4.46Å; I36-I40 WeakPolarHBondContact O-CG1 3.45Å; I36-I40 PolarHBondContact O-N 2.82Å
37A70.2Confident70.6Confident15 Ų1576.5 Ų76.512%0.12442%0.421CS..Hα-helixtrans-58.9-48.8177.600000111.8I33 M34 A39 I40 V41 M85I33-A37 WeakPolarHBondContact O-CB 3.32Å; I33-A37 PolarHBondContact O-N 3.39Å; M34-A37 WeakPolarHBondContact O-CB 3.39Å; M34-A37 PolarHBondContact O-N 3.46Å; A37-A39 VanDerWaalsContact C-N 3.34Å; A37-A39 PolarHBondContact O-N 2.91Å; A37-I40 PolarHBondContact O-N 2.72Å; A37-V41 WeakPolarHBondContact O-CG2 3.33Å; A37-V41 PolarHBondContact O-N 2.81Å; A37-M85 HydrophobicContact CB-SD 3.33Å; A37-M85 WeakPolarHBondContact CB-SD 3.41Å
38I71.8Confident70.4Confident102 Ų10278.4 Ų78.452%0.52342%0.422SS..Hα-helixtrans-63.2-42.2177.2-67.3166.7000110.3M34 L35 I36 I40 V41 T42M34-I38 HydrophobicContact CG-CD1 4.23Å; M34-I38 WeakPolarHBondContact O-CG1 3.25Å; M34-I38 PolarHBondContact O-N 3.34Å; L35-I38 PolarHBondContact O-N 3.31Å; I36-I38 PolarHBondContact O-N 3.03Å; I38-I40 PolarHBondContact O-N 2.91Å; I38-V41 PolarHBondContact O-N 2.76Å; I38-T42 WeakPolarHBondContact O-CB 3.19Å; I38-T42 PolarHBondContact O-N 2.93Å; I38-T42 PolarHBondContact O-OG1 3.44Å
39A77.5Confident70.2Confident51 Ų5179.7 Ų79.742%0.42142%0.424SS..Hα-helixtrans-60.6-42.5177.800000112.3L35 I36 A37 T42 A43L35-A39 WeakPolarHBondContact O-CB 3.43Å; L35-A39 PolarHBondContact O-N 3.49Å; I36-A39 PolarHBondContact O-N 3.25Å; A37-A39 VanDerWaalsContact C-N 3.34Å; A37-A39 PolarHBondContact O-N 2.91Å; A39-T42 PolarHBondContact O-N 2.67Å; A39-A43 VanDerWaalsContact O-CB 3.24Å; A39-A43 WeakPolarHBondContact O-CB 3.27Å; A39-A43 PolarHBondContact O-N 3.41Å
40I73Confident69.9Low69 Ų6984.2 Ų84.235%0.35444%0.435SS..Hα-helixtrans-65-48.4177-69.7165000110.8I36 A37 I38 T42 A43 I44 M85I36-I40 HydrophobicContact CG2-CD1 3.81Å; I36-I40 HydrophobicContact CG2-CG1 4.46Å; I36-I40 WeakPolarHBondContact O-CG1 3.45Å; I36-I40 PolarHBondContact O-N 2.82Å; A37-I40 PolarHBondContact O-N 2.72Å; I38-I40 PolarHBondContact O-N 2.91Å; I40-T42 VanDerWaalsContact C-N 3.28Å; I40-T42 PolarHBondContact O-N 3.43Å; I40-A43 PolarHBondContact O-N 3.46Å; I40-I44 HydrophobicContact CG2-CD1 3.84Å; I40-I44 VanDerWaalsContact O-CG1 3.26Å; I40-I44 WeakPolarHBondContact O-CG1 3.17Å; I40-I44 PolarHBondContact O-N 2.8Å; I40-M85 HydrophobicContact CD1-CE 3.56Å
41V70.8Confident69.6Low41 Ų4184.2 Ų84.225%0.24844%0.439CS..Hα-helixtrans-60.9-41.1178.4172.30000110.9A37 I38 I44 T45 L82A37-V41 WeakPolarHBondContact O-CG2 3.33Å; A37-V41 PolarHBondContact O-N 2.81Å; I38-V41 PolarHBondContact O-N 2.76Å; V41-I44 PolarHBondContact O-N 3.31Å; V41-T45 PolarHBondContact O-N 3.48Å; V41-T45 PolarHBondContact O-OG1 3Å; V41-L82 HydrophobicContact CG2-CD1 4.23Å
42T71.9Confident69.1Low69 Ų6983.3 Ų83.342%0.42344%0.441SS..Hα-helixtrans-67.2-43.7177.9-56.60000111.1I38 A39 I40 I44 T45 E46I38-T42 WeakPolarHBondContact O-CB 3.19Å; I38-T42 PolarHBondContact O-N 2.93Å; I38-T42 PolarHBondContact O-OG1 3.44Å; A39-T42 PolarHBondContact O-N 2.67Å; I40-T42 VanDerWaalsContact C-N 3.28Å; I40-T42 PolarHBondContact O-N 3.43Å; T42-I44 VanDerWaalsContact C-N 3.33Å; T42-I44 PolarHBondContact O-N 3.32Å; T42-T45 VanDerWaalsContact CA-OG1 3.25Å; T42-T45 WeakPolarHBondContact CA-OG1 3.39Å; T42-T45 PolarHBondContact O-N 3.39Å; T42-T45 PolarHBondContact O-OG1 3.25Å; T42-E46 WeakPolarHBondContact O-CB 3.1Å; T42-E46 PolarHBondContact O-N 2.83Å
43A73.3Confident68.1Low51 Ų5183.5 Ų83.542%0.42144%0.444SS..Hα-helixtrans-61-42.6176.500000111.3A39 I40 E46 L47A39-A43 VanDerWaalsContact O-CB 3.24Å; A39-A43 WeakPolarHBondContact O-CB 3.27Å; A39-A43 PolarHBondContact O-N 3.41Å; I40-A43 PolarHBondContact O-N 3.46Å; A43-E46 PolarHBondContact O-N 2.73Å; A43-L47 VanDerWaalsContact O-CB 3.28Å; A43-L47 WeakPolarHBondContact O-CB 3.23Å; A43-L47 PolarHBondContact O-N 2.94Å
44I68.2Low67.4Low76 Ų7687.6 Ų87.639%0.3946%0.46SS..Hα-helixtrans-63.4-43.2176.5-68166000111.1I40 V41 T42 R48I40-I44 HydrophobicContact CG2-CD1 3.84Å; I40-I44 VanDerWaalsContact O-CG1 3.26Å; I40-I44 WeakPolarHBondContact O-CG1 3.17Å; I40-I44 PolarHBondContact O-N 2.8Å; V41-I44 PolarHBondContact O-N 3.31Å; T42-I44 VanDerWaalsContact C-N 3.33Å; T42-I44 PolarHBondContact O-N 3.32Å; I44-R48 PolarHBondContact O-N 3.37Å; I44-R48 VanDerWaalsContact O-N 3.1Å
45T68.2Low66.5Low68 Ų6885.7 Ų85.742%0.41745%0.451SS..Hα-helixtrans-70.6-36.1179.432.50000112.7V41 T42 R48 K49V41-T45 PolarHBondContact O-N 3.48Å; V41-T45 PolarHBondContact O-OG1 3Å; T42-T45 VanDerWaalsContact CA-OG1 3.25Å; T42-T45 WeakPolarHBondContact CA-OG1 3.39Å; T42-T45 PolarHBondContact O-N 3.39Å; T42-T45 PolarHBondContact O-OG1 3.25Å; T45-R48 WeakPolarHBondContact O-CB 3.34Å; T45-R48 PolarHBondContact O-N 2.99Å; T45-K49 PolarHBondContact O-N 3.21Å; T45-K49 VanDerWaalsContact O-N 3.11Å
46E68.2Low65.3Low96 Ų9690.7 Ų90.745%0.44946%0.462SS..Hα-helixtrans-76.3-36.5177.7-143.463-16600111.5T42 A43 R48 K49 W50T42-E46 WeakPolarHBondContact O-CB 3.1Å; T42-E46 PolarHBondContact O-N 2.83Å; A43-E46 PolarHBondContact O-N 2.73Å; E46-R48 PolarHBondContact O-N 3.46Å; E46-K49 PolarHBondContact O-N 2.92Å; E46-K49 VanDerWaalsContact O-N 3.15Å; E46-K49 IonicContact OE2-NZ 3.82Å; E46-W50 WeakPolarHBondContact O-CB 3.32Å; E46-W50 PolarHBondContact O-N 3.28Å
47L66.5Low64.3Low130 Ų13096 Ų9668%0.68148%0.481SS*.Hα-helixtrans-56.1-41.4168.7-118.2107.2000110.7A43 W50 A51A43-L47 VanDerWaalsContact O-CB 3.28Å; A43-L47 WeakPolarHBondContact O-CB 3.23Å; A43-L47 PolarHBondContact O-N 2.94Å; L47-W50 PolarHBondContact O-N 3.28Å; L47-A51 WeakPolarHBondContact O-CB 3.33Å; L47-A51 PolarHBondContact O-N 3.49Å
48R63.9Low63.2Low133 Ų133103.5 Ų103.550%0.50251%0.511SS..Hα-helixtrans-62.4-46.7176178-178.9-174.3-93.32.7111.8I44 T45 E46 W50 A51 S52 L70I44-R48 PolarHBondContact O-N 3.37Å; I44-R48 VanDerWaalsContact O-N 3.1Å; T45-R48 WeakPolarHBondContact O-CB 3.34Å; T45-R48 PolarHBondContact O-N 2.99Å; E46-R48 PolarHBondContact O-N 3.46Å; R48-W50 VanDerWaalsContact C-N 3.3Å; R48-W50 PolarHBondContact O-N 3.5Å; R48-A51 PolarHBondContact O-N 3.43Å; R48-S52 PolarHBondContact O-N 2.96Å; R48-L70 HydrophobicContact CB-CD2 4.38Å; R48-L70 HydrophobicContact CG-CD2 3.81Å
49K65.4Low62.1Low135 Ų135107.6 Ų107.659%0.58753%0.525SS*.Hα-helixtrans-62-37.2176.8-89.2-178.4-177.6167.30112.4T45 E46 P53T45-K49 PolarHBondContact O-N 3.21Å; T45-K49 VanDerWaalsContact O-N 3.11Å; E46-K49 PolarHBondContact O-N 2.92Å; E46-K49 VanDerWaalsContact O-N 3.15Å; E46-K49 IonicContact OE2-NZ 3.82Å; K49-P53 WeakPolarHBondContact O-CD 3.35Å
50W62.7Low61Low179 Ų179111 Ų11168%0.67854%0.541SS*.Hα-helixtrans-78.7-34179-121.961.1000113.1E46 L47 R48 P53 K54E46-W50 WeakPolarHBondContact O-CB 3.32Å; E46-W50 PolarHBondContact O-N 3.28Å; L47-W50 PolarHBondContact O-N 3.28Å; R48-W50 VanDerWaalsContact C-N 3.3Å; R48-W50 PolarHBondContact O-N 3.5Å; W50-P53 WeakPolarHBondContact O-CD 3.47Å; W50-K54 HydrophobicContact CE3-CD 4.38Å; W50-K54 HydrophobicContact CZ3-CD 4.45Å; W50-K54 WeakPolarHBondContact O-CB 3.34Å; W50-K54 PolarHBondContact O-N 3.43Å
51A59.4Low60.2Low25 Ų25111.4 Ų111.421%0.20756%0.555CS.*Hα-helixtrans-65.5-41.5175.300000111.1L47 R48 K54 L55L47-A51 WeakPolarHBondContact O-CB 3.33Å; L47-A51 PolarHBondContact O-N 3.49Å; R48-A51 PolarHBondContact O-N 3.43Å; A51-K54 PolarHBondContact O-N 3.41Å; A51-L55 HydrophobicContact CB-CD1 3.73Å; A51-L55 VanDerWaalsContact O-CB 3.29Å; A51-L55 WeakPolarHBondContact O-CB 3.34Å; A51-L55 WeakPolarHBondContact O-CD1 3.41Å; A51-L55 PolarHBondContact O-N 3.02Å
52S56.1Low59.6Low87 Ų87115.2 Ų115.261%0.60857%0.573SS**Hα-helixtrans-53.7-49.1-177.1-163.10000115.2R48R48-S52 PolarHBondContact O-N 2.96Å
53P52.2Low58.7Low80 Ų80118.2 Ų118.252%0.51958%0.576SS.*Hα-helixtrans-79.4-30.4176.130.4-35.2000113.4K49 W50 R56K49-P53 WeakPolarHBondContact O-CD 3.35Å; W50-P53 WeakPolarHBondContact O-CD 3.47Å; P53-R56 PolarHBondContact O-N 2.87Å
54K53.7Low57.9Low138 Ų138118.7 Ų118.760%0.658%0.58SS**Hα-helixtrans-77.5-27.5-178-147.4172.2-173.8176.40112.1W50 A51W50-K54 HydrophobicContact CE3-CD 4.38Å; W50-K54 HydrophobicContact CZ3-CD 4.45Å; W50-K54 WeakPolarHBondContact O-CB 3.34Å; W50-K54 PolarHBondContact O-N 3.43Å; A51-K54 PolarHBondContact O-N 3.41Å
55L51.6Low57.5Low47 Ų47121.9 Ų121.925%0.24659%0.594CS.*Hα-helixtrans-73.4-21.6172.2-94.286.7000113.8A51 K57 K58 R63 L66A51-L55 HydrophobicContact CB-CD1 3.73Å; A51-L55 VanDerWaalsContact O-CB 3.29Å; A51-L55 WeakPolarHBondContact O-CB 3.34Å; A51-L55 WeakPolarHBondContact O-CD1 3.41Å; A51-L55 PolarHBondContact O-N 3.02Å; L55-K57 PolarHBondContact O-N 3.44Å; L55-K58 PolarHBondContact O-N 3.34Å; L55-R63 HydrophobicContact CD2-CB 4.37Å; L55-R63 HydrophobicContact CD2-CG 4.46Å; L55-L66 HydrophobicContact CD2-CD2 4.13Å
56R51.5Low57Low228 Ų228122.1 Ų122.186%0.8659%0.592SS**THydrogen-bonded Turntrans-59.3-17173.3-83.1174.364.7174.7-0.8113.2P53P53-R56 PolarHBondContact O-N 2.87Å
57K54.1Low56.4Low195 Ų195122.8 Ų122.885%0.84860%0.595SS**THydrogen-bonded Turntrans-102.3-12.7-179.7-70.7-174.1177-178.10115.2L55L55-K57 PolarHBondContact O-N 3.44Å
58K47.1Very low55.9Low174 Ų174121.2 Ų121.276%0.75760%0.595SS**SBendtrans-133111.4-176.8-82-165.1174.7-165.70113.1L55L55-K58 PolarHBondContact O-N 3.34Å
59K49.8Very low55.5Low187 Ų187122.6 Ų122.681%0.81361%0.605SS**  trans39.1119.3159-76.1-170.3175.4-1700119.2A61K59-A61 VanDerWaalsContact C-N 3.28Å; K59-A61 PolarHBondContact O-N 3.09Å
60T54.6Low55.1Low123 Ų123118.3 Ų118.376%0.75559%0.588SS**Hα-helixtrans-46.2-24.3179.3-32.70000117.7A64T60-A64 PolarHBondContact O-N 2.77Å
61A55.6Low54.9Low77 Ų77112.3 Ų112.364%0.63658%0.582SS**Hα-helixtrans-78.7-41.8-174.500000114K59 R63 A64 Q65K59-A61 VanDerWaalsContact C-N 3.28Å; K59-A61 PolarHBondContact O-N 3.09Å; A61-R63 VanDerWaalsContact C-N 3.27Å; A61-R63 PolarHBondContact O-N 3.34Å; A61-A64 PolarHBondContact O-N 2.94Å; A61-Q65 PolarHBondContact O-N 3.5Å
62L57.3Low54.6Low121 Ų121122.3 Ų122.363%0.63462%0.615SS**Hα-helixtrans-70.4-29.7176.1-70.6-173.5000111.6L66L62-L66 VanDerWaalsContact O-CB 3.26Å; L62-L66 WeakPolarHBondContact O-CB 3.33Å; L62-L66 PolarHBondContact O-N 2.83Å
63R54Low54.7Low132 Ų132120.8 Ų120.850%0.49860%0.602SS.*Hα-helixtrans-63-43.2176.3-163.1-168.2158.3-172.3-1.9111.9L55 A61 L66 E67L55-R63 HydrophobicContact CD2-CB 4.37Å; L55-R63 HydrophobicContact CD2-CG 4.46Å; A61-R63 VanDerWaalsContact C-N 3.27Å; A61-R63 PolarHBondContact O-N 3.34Å; R63-L66 PolarHBondContact O-N 2.74Å; R63-E67 WeakPolarHBondContact CG-OE2 3.45Å; R63-E67 IonicContact CZ-OE1 3.47Å; R63-E67 IonicContact CZ-OE2 3.99Å; R63-E67 IonicContact NE-OE1 2.83Å; R63-E67 IonicContact NE-OE2 3.83Å; R63-E67 PolarHBondContact NE-OE2 3.46Å; R63-E67 IonicContact NH2-OE1 3.48Å; R63-E67 PolarHBondContact NH2-OE1 3.23Å; R63-E67 IonicContact NH2-OE2 3.27Å; R63-E67 PolarHBondContact NH2-OE2 3.28Å; R63-E67 VanDerWaalsContact O-CB 3.31Å; R63-E67 WeakPolarHBondContact O-CB 3.39Å; R63-E67 PolarHBondContact O-N 2.98Å
64A56.7Low55.2Low61 Ų61118.6 Ų118.650%0.50459%0.586SS.*Hα-helixtrans-67.9-42.2178.800000112.5T60 A61 S68T60-A64 PolarHBondContact O-N 2.77Å; A61-A64 PolarHBondContact O-N 2.94Å; A64-S68 WeakPolarHBondContact O-CB 3.47Å; A64-S68 PolarHBondContact O-N 3Å
65Q58.5Low55.6Low144 Ų144119.6 Ų119.667%0.67359%0.593SS**Hα-helixtrans-65.3-43.1174-91.7-151.9-66.300112A61 S68 F69A61-Q65 PolarHBondContact O-N 3.5Å; Q65-S68 PolarHBondContact O-N 3.43Å; Q65-F69 WeakPolarHBondContact O-CB 3.48Å; Q65-F69 PolarHBondContact O-N 2.92Å
66L57.9Low56.2Low73 Ų73125.3 Ų125.338%0.38261%0.612SS.*Hα-helixtrans-70.1-43.8179.8-140.476.3000111.3L55 L62 R63 S68 F69 L70L55-L66 HydrophobicContact CD2-CD2 4.13Å; L62-L66 VanDerWaalsContact O-CB 3.26Å; L62-L66 WeakPolarHBondContact O-CB 3.33Å; L62-L66 PolarHBondContact O-N 2.83Å; R63-L66 PolarHBondContact O-N 2.74Å; L66-S68 VanDerWaalsContact C-N 3.32Å; L66-S68 PolarHBondContact O-N 3.47Å; L66-F69 PolarHBondContact O-N 3.46Å; L66-L70 WeakPolarHBondContact O-CA 3.4Å; L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 2.99Å
67E55.6Low57Low109 Ų109117.2 Ų117.251%0.50959%0.589SS.*Hα-helixtrans-62-38.9174.3-86.1175125.300111.9R63 G71R63-E67 WeakPolarHBondContact CG-OE2 3.45Å; R63-E67 IonicContact CZ-OE1 3.47Å; R63-E67 IonicContact CZ-OE2 3.99Å; R63-E67 IonicContact NE-OE1 2.83Å; R63-E67 IonicContact NE-OE2 3.83Å; R63-E67 PolarHBondContact NE-OE2 3.46Å; R63-E67 IonicContact NH2-OE1 3.48Å; R63-E67 PolarHBondContact NH2-OE1 3.23Å; R63-E67 IonicContact NH2-OE2 3.27Å; R63-E67 PolarHBondContact NH2-OE2 3.28Å; R63-E67 VanDerWaalsContact O-CB 3.31Å; R63-E67 WeakPolarHBondContact O-CB 3.39Å; R63-E67 PolarHBondContact O-N 2.98Å; E67-G71 PolarHBondContact O-N 3.45Å; E67-G71 VanDerWaalsContact O-N 3.13Å
68S55.9Low57.4Low97 Ų97110.1 Ų110.168%0.67856%0.563SS**Hα-helixtrans-67.2-34.5175.4-177.10000112.8A64 Q65 L66A64-S68 WeakPolarHBondContact O-CB 3.47Å; A64-S68 PolarHBondContact O-N 3Å; Q65-S68 PolarHBondContact O-N 3.43Å; L66-S68 VanDerWaalsContact C-N 3.32Å; L66-S68 PolarHBondContact O-N 3.47Å
69F56.5Low58.5Low162 Ų162104.2 Ų104.271%0.71155%0.547SS*.Hα-helixtrans-84.8-26.2-179.1-151.1-97.3000112.5Q65 L66 P73Q65-F69 WeakPolarHBondContact O-CB 3.48Å; Q65-F69 PolarHBondContact O-N 2.92Å; L66-F69 PolarHBondContact O-N 3.46Å; F69-P73 WeakPolarHBondContact O-CG 3.31Å
70L55.6Low59.6Low46 Ų4698.4 Ų98.424%0.24152%0.524CS..Hα-helixtrans-110.8-1.5-167.2-139.982.4000114.1R48 L66 L74R48-L70 HydrophobicContact CB-CD2 4.38Å; R48-L70 HydrophobicContact CG-CD2 3.81Å; L66-L70 WeakPolarHBondContact O-CA 3.4Å; L66-L70 WeakPolarHBondContact O-CB 3.39Å; L66-L70 PolarHBondContact O-N 2.99Å; L70-L74 HydrophobicContact CD1-CD1 3.48Å; L70-L74 VanDerWaalsContact CD1-CD1 3.48Å; L70-L74 HydrophobicContact CG-CD1 3.81Å; L70-L74 HydrophobicContact CG-CD2 4.1Å; L70-L74 HydrophobicContact CG-CG 4.36Å; L70-L74 WeakPolarHBondContact O-CB 3.35Å
71G59.6Low60.4Low53 Ų5395.9 Ų95.955%0.54651%0.505SS..SBendtrans-76.5-75.8-177.600000114.2E67E67-G71 PolarHBondContact O-N 3.45Å; E67-G71 VanDerWaalsContact O-N 3.13Å
72R53.3Low61Low235 Ų23596.3 Ų96.389%0.88750%0.497SS*.SBendtrans-93.6-29.8179.1-69.1179.6-175.1148.61.2115.7L74R72-L74 VanDerWaalsContact C-N 3.3Å; R72-L74 PolarHBondContact O-N 3.06Å
73P58.3Low61.6Low54 Ų5497.7 Ų97.735%0.35150%0.5SS..Hα-helixtrans-74.8-22.6-179.1-11.126000112.2F69 Y76 T77F69-P73 WeakPolarHBondContact O-CG 3.31Å; P73-Y76 CarbonylContact O-C 3.51Å; P73-Y76 WeakPolarHBondContact O-CB 3.43Å; P73-Y76 PolarHBondContact O-N 3.26Å; P73-T77 PolarHBondContact O-N 3.14Å; P73-T77 PolarHBondContact O-OG1 3.11Å
74L61.8Low62.7Low35 Ų3597 Ų9718%0.18351%0.505CS..Hα-helixtrans-66.1-49.3-167-165.379.8000113.2L70 R72 Y76 T77 S78L70-L74 HydrophobicContact CD1-CD1 3.48Å; L70-L74 VanDerWaalsContact CD1-CD1 3.48Å; L70-L74 HydrophobicContact CG-CD1 3.81Å; L70-L74 HydrophobicContact CG-CD2 4.1Å; L70-L74 HydrophobicContact CG-CG 4.36Å; L70-L74 WeakPolarHBondContact O-CB 3.35Å; R72-L74 VanDerWaalsContact C-N 3.3Å; R72-L74 PolarHBondContact O-N 3.06Å; L74-Y76 PolarHBondContact O-N 3.25Å; L74-T77 VanDerWaalsContact CA-OG1 3.22Å; L74-T77 WeakPolarHBondContact CA-OG1 3.35Å; L74-T77 PolarHBondContact O-N 3.44Å; L74-T77 PolarHBondContact O-OG1 2.82Å; L74-S78 VanDerWaalsContact O-CB 3.29Å; L74-S78 WeakPolarHBondContact O-CB 3.48Å; L74-S78 PolarHBondContact O-N 2.95Å; L74-S78 PolarHBondContact O-OG 3.34Å
75E62Low63.1Low158 Ų15896.6 Ų96.674%0.73849%0.494SS*.Hα-helixtrans-57.9-42.9174.6-90.9179.913400110.3S78 A79E75-S78 WeakPolarHBondContact CA-OG 3.34Å; E75-S78 PolarHBondContact O-N 3.25Å; E75-S78 PolarHBondContact O-OG 3.26Å; E75-A79 WeakPolarHBondContact O-CB 3.36Å; E75-A79 PolarHBondContact O-N 3.29Å
76Y64.1Low63.6Low167 Ų16792.7 Ų92.766%0.65548%0.48SS*.Hα-helixtrans-65.4-44.6178.2-164.8-111.3000112.5P73 L74 S78 A79 I80P73-Y76 CarbonylContact O-C 3.51Å; P73-Y76 WeakPolarHBondContact O-CB 3.43Å; P73-Y76 PolarHBondContact O-N 3.26Å; L74-Y76 PolarHBondContact O-N 3.25Å; Y76-S78 VanDerWaalsContact C-N 3.34Å; Y76-S78 PolarHBondContact O-N 2.94Å; Y76-A79 PolarHBondContact O-N 2.94Å; Y76-I80 HydrophobicContact CD1-CD1 3.39Å; Y76-I80 HydrophobicContact CD1-CG1 4.35Å; Y76-I80 HydrophobicContact CE1-CD1 3.2Å; Y76-I80 HydrophobicContact CE1-CG1 4.21Å; Y76-I80 HydrophobicContact CG-CD1 4.18Å; Y76-I80 WeakPolarHBondContact O-CB 3.41Å; Y76-I80 VanDerWaalsContact O-CG1 3.23Å; Y76-I80 WeakPolarHBondContact O-CG1 3.38Å; Y76-I80 PolarHBondContact O-N 3.45Å
77T68.6Low64.2Low59 Ų5992.6 Ų92.636%0.36248%0.484SS..Hα-helixtrans-66.3-35.6173.6400000111.8P73 L74 I80 I81P73-T77 PolarHBondContact O-N 3.14Å; P73-T77 PolarHBondContact O-OG1 3.11Å; L74-T77 VanDerWaalsContact CA-OG1 3.22Å; L74-T77 WeakPolarHBondContact CA-OG1 3.35Å; L74-T77 PolarHBondContact O-N 3.44Å; L74-T77 PolarHBondContact O-OG1 2.82Å; T77-I80 PolarHBondContact O-N 3.16Å; T77-I81 VanDerWaalsContact O-CB 3.27Å; T77-I81 WeakPolarHBondContact O-CB 3.47Å; T77-I81 VanDerWaalsContact O-CD1 3.32Å; T77-I81 WeakPolarHBondContact O-CD1 3.48Å; T77-I81 WeakPolarHBondContact O-CG1 3.36Å; T77-I81 PolarHBondContact O-N 3.32Å
78S63.2Low64.9Low45 Ų4589.7 Ų89.732%0.31548%0.479SS..Hα-helixtrans-67.8-39.7176.373.80000110.8L74 E75 Y76 L82L74-S78 VanDerWaalsContact O-CB 3.29Å; L74-S78 WeakPolarHBondContact O-CB 3.48Å; L74-S78 PolarHBondContact O-N 2.95Å; L74-S78 PolarHBondContact O-OG 3.34Å; E75-S78 WeakPolarHBondContact CA-OG 3.34Å; E75-S78 PolarHBondContact O-N 3.25Å; E75-S78 PolarHBondContact O-OG 3.26Å; Y76-S78 VanDerWaalsContact C-N 3.34Å; Y76-S78 PolarHBondContact O-N 2.94Å; S78-L82 WeakPolarHBondContact O-CB 3.45Å; S78-L82 PolarHBondContact O-N 3.2Å
79A69.3Low65.4Low51 Ų5186.2 Ų86.242%0.42145%0.453SS..Hα-helixtrans-66.4-45.1174.400000111.2E75 Y76 L82 E83E75-A79 WeakPolarHBondContact O-CB 3.36Å; E75-A79 PolarHBondContact O-N 3.29Å; Y76-A79 PolarHBondContact O-N 2.94Å; A79-L82 PolarHBondContact O-N 3Å; A79-E83 WeakPolarHBondContact O-CB 3.21Å; A79-E83 PolarHBondContact O-N 3.15Å
80I73.3Confident65.8Low65 Ų6583.8 Ų83.833%0.33344%0.442SS..Hα-helixtrans-61.8-47175.8-72.9167.1000110.8Y76 T77 L82 E83 L84Y76-I80 HydrophobicContact CD1-CD1 3.39Å; Y76-I80 HydrophobicContact CD1-CG1 4.35Å; Y76-I80 HydrophobicContact CE1-CD1 3.2Å; Y76-I80 HydrophobicContact CE1-CG1 4.21Å; Y76-I80 HydrophobicContact CG-CD1 4.18Å; Y76-I80 WeakPolarHBondContact O-CB 3.41Å; Y76-I80 VanDerWaalsContact O-CG1 3.23Å; Y76-I80 WeakPolarHBondContact O-CG1 3.38Å; Y76-I80 PolarHBondContact O-N 3.45Å; T77-I80 PolarHBondContact O-N 3.16Å; I80-L82 VanDerWaalsContact C-N 3.29Å; I80-L82 PolarHBondContact O-N 3.06Å; I80-E83 PolarHBondContact O-N 3.47Å; I80-L84 WeakPolarHBondContact O-CB 3.47Å; I80-L84 PolarHBondContact O-N 3.16Å
81I71.6Confident66.3Low69 Ų6986.9 Ų86.935%0.35446%0.458SS..Hα-helixtrans-63-40.3-180-71.5162.9000110.2T77 L84 M85T77-I81 VanDerWaalsContact O-CB 3.27Å; T77-I81 WeakPolarHBondContact O-CB 3.47Å; T77-I81 VanDerWaalsContact O-CD1 3.32Å; T77-I81 WeakPolarHBondContact O-CD1 3.48Å; T77-I81 WeakPolarHBondContact O-CG1 3.36Å; T77-I81 PolarHBondContact O-N 3.32Å; I81-L84 PolarHBondContact O-N 3.08Å; I81-M85 WeakPolarHBondContact O-CB 3.28Å; I81-M85 WeakPolarHBondContact O-CG 3.31Å; I81-M85 PolarHBondContact O-N 3.21Å
82L68Low66.6Low87 Ų8788.1 Ų88.146%0.45546%0.455SS..Hα-helixtrans-64.2-44.6174.8-115.2142.3000112.1V41 S78 A79 I80 T86V41-L82 HydrophobicContact CG2-CD1 4.23Å; S78-L82 WeakPolarHBondContact O-CB 3.45Å; S78-L82 PolarHBondContact O-N 3.2Å; A79-L82 PolarHBondContact O-N 3Å; I80-L82 VanDerWaalsContact C-N 3.29Å; I80-L82 PolarHBondContact O-N 3.06Å; L82-T86 WeakPolarHBondContact O-CB 3.35Å; L82-T86 PolarHBondContact O-N 2.82Å; L82-T86 PolarHBondContact O-OG1 3.31Å
83E70.9Confident67.1Low150 Ų15079.8 Ų79.870%0.70143%0.427SS*.Hα-helixtrans-63.1-42.9174.8-86.6-150.5145.400111.8A79 I80 T86 C87A79-E83 WeakPolarHBondContact O-CB 3.21Å; A79-E83 PolarHBondContact O-N 3.15Å; I80-E83 PolarHBondContact O-N 3.47Å; E83-T86 CarbonylContact O-C 3.53Å; E83-T86 WeakPolarHBondContact O-CA 3.14Å; E83-T86 WeakPolarHBondContact O-CB 3.4Å; E83-T86 PolarHBondContact O-N 3.27Å; E83-T86 VanDerWaalsContact O-N 3.09Å; E83-C87 WeakPolarHBondContact O-CB 3.2Å; E83-C87 PolarHBondContact O-N 3.46Å
84L76Confident67.3Low116 Ų11679.5 Ų79.561%0.60742%0.424SS*.Hα-helixtrans-68.8-38.1-177.2-154149.8000110.9I80 I81 T86 C87 A88I80-L84 WeakPolarHBondContact O-CB 3.47Å; I80-L84 PolarHBondContact O-N 3.16Å; I81-L84 PolarHBondContact O-N 3.08Å; L84-T86 VanDerWaalsContact C-N 3.34Å; L84-C87 PolarHBondContact O-N 3.11Å; L84-A88 WeakPolarHBondContact O-CB 3.31Å; L84-A88 PolarHBondContact O-N 3.49Å
85M65.8Low67.4Low54 Ų5479.5 Ų79.527%0.26643%0.432SS..Hα-helixtrans-64.3-37.9168.7-79.8-137.3174.700112.6A37 I40 I81 C87 A88 N89A37-M85 HydrophobicContact CB-SD 3.33Å; A37-M85 WeakPolarHBondContact CB-SD 3.41Å; I40-M85 HydrophobicContact CD1-CE 3.56Å; I81-M85 WeakPolarHBondContact O-CB 3.28Å; I81-M85 WeakPolarHBondContact O-CG 3.31Å; I81-M85 PolarHBondContact O-N 3.21Å; M85-C87 VanDerWaalsContact C-N 3.33Å; M85-A88 PolarHBondContact O-N 3.09Å; M85-N89 PolarHBondContact O-N 2.98Å
86T69.4Low67.2Low61 Ų6176.8 Ų76.837%0.37442%0.418SS..Hα-helixtrans-66.9-37.9175.8-55.30000111.1L82 E83 L84 N89 F90L82-T86 WeakPolarHBondContact O-CB 3.35Å; L82-T86 PolarHBondContact O-N 2.82Å; L82-T86 PolarHBondContact O-OG1 3.31Å; E83-T86 CarbonylContact O-C 3.53Å; E83-T86 WeakPolarHBondContact O-CA 3.14Å; E83-T86 WeakPolarHBondContact O-CB 3.4Å; E83-T86 PolarHBondContact O-N 3.27Å; E83-T86 VanDerWaalsContact O-N 3.09Å; L84-T86 VanDerWaalsContact C-N 3.34Å; T86-N89 WeakPolarHBondContact O-CB 3.23Å; T86-N89 PolarHBondContact O-N 2.96Å; T86-F90 PolarHBondContact O-N 3.1Å; T86-F90 VanDerWaalsContact O-N 3.11Å
87C70Confident66.9Low71 Ų7176.5 Ų76.548%0.4842%0.416SS..Hα-helixtrans-67.4-41.9175.2-169.50000111.9E83 L84 M85 N89 F90 L91E83-C87 WeakPolarHBondContact O-CB 3.2Å; E83-C87 PolarHBondContact O-N 3.46Å; L84-C87 PolarHBondContact O-N 3.11Å; M85-C87 VanDerWaalsContact C-N 3.33Å; C87-N89 VanDerWaalsContact C-N 3.32Å; C87-N89 PolarHBondContact O-N 3.24Å; C87-F90 WeakPolarHBondContact O-CB 3.29Å; C87-F90 PolarHBondContact O-N 3.46Å; C87-F90 VanDerWaalsContact O-N 3.16Å; C87-L91 PolarHBondContact O-N 3.05Å
88A70.1Confident66.4Low48 Ų4880.2 Ų80.240%0.39743%0.427SS..Hα-helixtrans-61.1-40.5173.800000111.9L84 M85 F90 L91 V92L84-A88 WeakPolarHBondContact O-CB 3.31Å; L84-A88 PolarHBondContact O-N 3.49Å; M85-A88 PolarHBondContact O-N 3.09Å; A88-F90 VanDerWaalsContact C-N 3.31Å; A88-F90 PolarHBondContact O-N 3.27Å; A88-L91 PolarHBondContact O-N 3.49Å; A88-V92 WeakPolarHBondContact O-CG2 3.44Å; A88-V92 PolarHBondContact O-N 2.86Å
89N66.2Low66.1Low25 Ų2584.1 Ų84.113%0.13444%0.441CS..Hα-helixtrans-61.7-39.6174.5-164.919.4000112N30 M85 T86 C87 M93N30-N89 PolarHBondContact OD1-ND2 3.32Å; M85-N89 PolarHBondContact O-N 2.98Å; T86-N89 WeakPolarHBondContact O-CB 3.23Å; T86-N89 PolarHBondContact O-N 2.96Å; C87-N89 VanDerWaalsContact C-N 3.32Å; C87-N89 PolarHBondContact O-N 3.24Å; N89-M93 PolarHBondContact O-N 3.25Å; N89-M93 VanDerWaalsContact O-N 3.14Å
90F64.5Low65.2Low111 Ų11186.7 Ų86.749%0.48745%0.447SS..Hα-helixtrans-64.8-42.8174.5-175.3-99.7000112.1L7 T86 C87 A88 M93 V94L7-F90 HydrophobicContact CD1-CD2 4.22Å; L7-F90 HydrophobicContact CD1-CE2 4.45Å; L7-F90 HydrophobicContact CD2-CD2 4.26Å; T86-F90 PolarHBondContact O-N 3.1Å; T86-F90 VanDerWaalsContact O-N 3.11Å; C87-F90 WeakPolarHBondContact O-CB 3.29Å; C87-F90 PolarHBondContact O-N 3.46Å; C87-F90 VanDerWaalsContact O-N 3.16Å; A88-F90 VanDerWaalsContact C-N 3.31Å; A88-F90 PolarHBondContact O-N 3.27Å; F90-M93 PolarHBondContact O-N 3.2Å; F90-V94 HydrophobicContact CD1-CG2 4.09Å; F90-V94 HydrophobicContact CE1-CG2 3.7Å; F90-V94 HydrophobicContact CE2-CG2 4.39Å; F90-V94 HydrophobicContact CZ-CG2 3.87Å; F90-V94 WeakPolarHBondContact O-CG2 3.48Å; F90-V94 PolarHBondContact O-N 3.23Å
91L67.1Low64Low111 Ų11189.9 Ų89.958%0.58147%0.465SS*.Hα-helixtrans-64.2-40.9176.8-81.5167.6000112.9C87 A88 M93 V94 G95C87-L91 PolarHBondContact O-N 3.05Å; A88-L91 PolarHBondContact O-N 3.49Å; L91-M93 VanDerWaalsContact C-N 3.29Å; L91-M93 PolarHBondContact O-N 3.36Å; L91-V94 PolarHBondContact O-N 3Å; L91-G95 PolarHBondContact O-N 2.77Å
92V64.6Low62.6Low78 Ų7893.7 Ų93.747%0.47350%0.498SS..Hα-helixtrans-60.4-43174.7169.60000110.3A88 F96A88-V92 WeakPolarHBondContact O-CG2 3.44Å; A88-V92 PolarHBondContact O-N 2.86Å; V92-F96 WeakPolarHBondContact O-CB 3.23Å; V92-F96 PolarHBondContact O-N 3.48Å
93M63.7Low62.4Low60 Ų6094 Ų9430%0.29650%0.5SS..Hα-helixtrans-64.9-44.3177.1-169.7-178.5-57.700112.6L7 N89 F90 L91 W97L7-M93 HydrophobicContact CD2-CE 3.19Å; L7-M93 HydrophobicContact CD2-SD 3.21Å; L7-M93 WeakPolarHBondContact CD2-SD 3.42Å; L7-M93 HydrophobicContact CG-CE 4.44Å; L7-M93 HydrophobicContact CG-SD 4.49Å; N89-M93 PolarHBondContact O-N 3.25Å; N89-M93 VanDerWaalsContact O-N 3.14Å; F90-M93 PolarHBondContact O-N 3.2Å; L91-M93 VanDerWaalsContact C-N 3.29Å; L91-M93 PolarHBondContact O-N 3.36Å; M93-W97 WeakPolarHBondContact O-CB 3.46Å; M93-W97 PolarHBondContact O-N 3.08Å
94V63.3Low61.9Low49 Ų4991.1 Ų91.130%0.29749%0.489SS..Hα-helixtrans-65.8-43.3178.7171.70000111.3F90 L91 F96 W97 F98F90-V94 HydrophobicContact CD1-CG2 4.09Å; F90-V94 HydrophobicContact CE1-CG2 3.7Å; F90-V94 HydrophobicContact CE2-CG2 4.39Å; F90-V94 HydrophobicContact CZ-CG2 3.87Å; F90-V94 WeakPolarHBondContact O-CG2 3.48Å; F90-V94 PolarHBondContact O-N 3.23Å; L91-V94 PolarHBondContact O-N 3Å; V94-F96 PolarHBondContact O-N 3.02Å; V94-W97 PolarHBondContact O-N 3.49Å; V94-F98 HydrophobicContact CG1-CD2 3.99Å; V94-F98 HydrophobicContact CG1-CE2 4Å; V94-F98 WeakPolarHBondContact O-CD2 3.21Å; V94-F98 PolarHBondContact O-N 3.32Å; V94-F98 VanDerWaalsContact O-N 3.11Å
95G63.6Low61.1Low34 Ų3489.7 Ų89.735%0.35148%0.483SS..Hα-helixtrans-60.6-45.3178.100000112.2L91 F98 E99L91-G95 PolarHBondContact O-N 2.77Å; G95-F98 PolarHBondContact O-N 3.4Å; G95-E99 PolarHBondContact O-N 2.88Å
96F59.1Low60.9Low102 Ų10291.8 Ų91.845%0.44750%0.496SS..Hα-helixtrans-70.9-31.7178.5-132.4-89.2000112.9Y26 V92 V94 F98 E99 D100Y26-F96 WeakPolarHBondContact OH-CD1 2.88Å; V92-F96 WeakPolarHBondContact O-CB 3.23Å; V92-F96 PolarHBondContact O-N 3.48Å; V94-F96 PolarHBondContact O-N 3.02Å; F96-F98 VanDerWaalsContact C-N 3.29Å; F96-F98 PolarHBondContact O-N 2.71Å; F96-E99 PolarHBondContact O-N 3.15Å; F96-E99 VanDerWaalsContact O-N 3.15Å; F96-D100 PolarHBondContact O-N 3.31Å; F96-D100 VanDerWaalsContact O-N 3.09Å
97W56.9Low60.3Low160 Ų16093.7 Ų93.761%0.60650%0.503SS*.Hα-helixtrans-63.1-35.7172.7-173.365.4000112.1M93 V94M93-W97 WeakPolarHBondContact O-CB 3.46Å; M93-W97 PolarHBondContact O-N 3.08Å; V94-W97 PolarHBondContact O-N 3.49Å
98F57.5Low59.7Low137 Ų13795.2 Ų95.260%0.60151%0.505SS*.Hα-helixtrans-71.3-28172.6-89.5-73.4000113.5V94 G95 F96V94-F98 HydrophobicContact CG1-CD2 3.99Å; V94-F98 HydrophobicContact CG1-CE2 4Å; V94-F98 WeakPolarHBondContact O-CD2 3.21Å; V94-F98 PolarHBondContact O-N 3.32Å; V94-F98 VanDerWaalsContact O-N 3.11Å; G95-F98 PolarHBondContact O-N 3.4Å; F96-F98 VanDerWaalsContact C-N 3.29Å; F96-F98 PolarHBondContact O-N 2.71Å
99E56.9Low58.9Low127 Ų12798.6 Ų98.659%0.59351%0.512SS*.Hα-helixtrans-75.1-28.9175.5-109.6166.3103.700112.8G95 F96 D101 S102G95-E99 PolarHBondContact O-N 2.88Å; F96-E99 PolarHBondContact O-N 3.15Å; F96-E99 VanDerWaalsContact O-N 3.15Å; E99-D101 VanDerWaalsContact C-N 3.33Å; E99-S102 PolarHBondContact O-OG 3.2Å
100D50.2Low58.4Low105 Ų105104.2 Ų104.256%0.56154%0.542SS*.Hα-helixtrans-77.2-16.4174.5-106.3-17.5000113F96F96-D100 PolarHBondContact O-N 3.31Å; F96-D100 VanDerWaalsContact O-N 3.09Å
101D48.4Very low57.9Low132 Ų132103.7 Ų103.771%0.70655%0.546SS*.THydrogen-bonded Turntrans-92.2-2.1179.8-131.7-94.4000113.1E99E99-D101 VanDerWaalsContact C-N 3.33Å
102S43.1Very low57Low149 Ų149103 Ų103100%1.04254%0.543SS*.  trans-1080176.3690000113.2E99E99-S102 PolarHBondContact O-OG 3.2Å

Retrieved 102 of 102 residues in 27.9 ms (Link to these results)