A0A061I619_CRIGR Loading...

Peroxisomal biogenesis factor 11 gamma

AlphaFold DB , UniProt , Accession A0A061I619, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100771214, Length 241 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
1M69.6Low79.2Confident170 Ų17091.1 Ų91.184%0.83754%0.539SS*.  0-57.60-63.5-53.7-87.300112.5L3 L4 N5M1-L3 PolarHBondContact O-N 3.19Å; M1-L4 PolarHBondContact O-N 3.44Å; M1-L4 VanDerWaalsContact O-N 3.16Å; M1-N5 PolarHBondContact O-N 2.95Å
2A75.5Confident80Confident83 Ų8396.1 Ų96.169%0.68655%0.553SS**Hα-helixtrans-56.8-46.5-178.600000115L4 N5 S6A2-L4 VanDerWaalsContact C-N 3.34Å; A2-L4 PolarHBondContact O-N 3.43Å; A2-N5 PolarHBondContact O-N 3.01Å; A2-S6 WeakPolarHBondContact O-CB 3.49Å; A2-S6 PolarHBondContact O-N 2.78Å
3L75Confident80.7Confident155 Ų15592.5 Ų92.581%0.81254%0.538SS*.Hα-helixtrans-62.9-37.9176.4-73169.5000113.1M1 S6 L7M1-L3 PolarHBondContact O-N 3.19Å; L3-S6 PolarHBondContact O-N 3.45Å; L3-L7 WeakPolarHBondContact O-CB 3.26Å; L3-L7 PolarHBondContact O-N 3.17Å
4L78.1Confident81.2Confident110 Ų11092 Ų9258%0.57652%0.523SS*.Hα-helixtrans-67.6-41177.5-75.6167000111.1M1 A2 L7 A8M1-L4 PolarHBondContact O-N 3.44Å; M1-L4 VanDerWaalsContact O-N 3.16Å; A2-L4 VanDerWaalsContact C-N 3.34Å; A2-L4 PolarHBondContact O-N 3.43Å; L4-L7 PolarHBondContact O-N 3.27Å; L4-A8 WeakPolarHBondContact O-CB 3.36Å; L4-A8 PolarHBondContact O-N 2.98Å
5N80.4Confident81.6Confident103 Ų10397.9 Ų97.955%0.55153%0.533SS*.Hα-helixtrans-66.5-40.2176.5-68.1-6.6000111.8M1 A2 A8 S9M1-N5 PolarHBondContact O-N 2.95Å; A2-N5 PolarHBondContact O-N 3.01Å; N5-A8 PolarHBondContact O-N 2.95Å; N5-S9 PolarHBondContact O-N 3.11Å; N5-S9 PolarHBondContact O-OG 3.42Å
6S76.9Confident82.1Confident75 Ų7592 Ų9252%0.52450%0.503SS..Hα-helixtrans-66.5-38.9175.3178.80000112.5A2 L3 S9 S10A2-S6 WeakPolarHBondContact O-CB 3.49Å; A2-S6 PolarHBondContact O-N 2.78Å; L3-S6 PolarHBondContact O-N 3.45Å; S6-S9 PolarHBondContact O-OG 3.33Å; S6-S9 VanDerWaalsContact O-OG 3.05Å; S6-S10 WeakPolarHBondContact O-CB 3.4Å; S6-S10 PolarHBondContact O-N 3.14Å
7L78.8Confident82.7Confident95 Ų9594.7 Ų94.750%0.49750%0.504SS..Hα-helixtrans-62.7-48.3172.1-173.388.3000110.5L3 L4 S10 L11L3-L7 WeakPolarHBondContact O-CB 3.26Å; L3-L7 PolarHBondContact O-N 3.17Å; L4-L7 PolarHBondContact O-N 3.27Å; L7-S10 PolarHBondContact O-N 3.14Å; L7-L11 HydrophobicContact CD2-CD1 4.23Å; L7-L11 HydrophobicContact CG-CD1 4.05Å; L7-L11 VanDerWaalsContact O-CG 3.28Å; L7-L11 WeakPolarHBondContact O-CG 3.39Å; L7-L11 PolarHBondContact O-N 3.42Å
8A84.2Confident83.3Confident47 Ų4791.2 Ų91.239%0.38849%0.485SS..Hα-helixtrans-59.2-48.6-179.500000111.7L4 N5 S10 L11 E12L4-A8 WeakPolarHBondContact O-CB 3.36Å; L4-A8 PolarHBondContact O-N 2.98Å; N5-A8 PolarHBondContact O-N 2.95Å; A8-S10 VanDerWaalsContact C-N 3.33Å; A8-S10 PolarHBondContact O-N 3.15Å; A8-L11 CarbonylContact O-C 3.53Å; A8-L11 PolarHBondContact O-N 3.25Å; A8-L11 VanDerWaalsContact O-N 3.09Å; A8-E12 PolarHBondContact O-N 2.96Å
9S83.6Confident83.8Confident67 Ų6790.5 Ų90.547%0.46948%0.475SS..Hα-helixtrans-63.6-37.4177.765.80000112.5N5 S6 L11 E12N5-S9 PolarHBondContact O-N 3.11Å; N5-S9 PolarHBondContact O-OG 3.42Å; S6-S9 PolarHBondContact O-OG 3.33Å; S6-S9 VanDerWaalsContact O-OG 3.05Å; S9-L11 VanDerWaalsContact C-N 3.31Å; S9-L11 PolarHBondContact O-N 3.46Å; S9-E12 PolarHBondContact O-N 2.94Å
10S82.3Confident84.2Confident48 Ų4889 Ų8934%0.33647%0.467SS..Hα-helixtrans-61.9-41.9173.1-166.60000111.4S6 L7 A8 E12 S13 G16S6-S10 WeakPolarHBondContact O-CB 3.4Å; S6-S10 PolarHBondContact O-N 3.14Å; L7-S10 PolarHBondContact O-N 3.14Å; A8-S10 VanDerWaalsContact C-N 3.33Å; A8-S10 PolarHBondContact O-N 3.15Å; S10-E12 VanDerWaalsContact C-N 3.26Å; S10-E12 PolarHBondContact O-N 3.19Å; S10-S13 WeakPolarHBondContact O-CB 3.49Å; S10-S13 PolarHBondContact O-N 3.41Å; S10-S13 VanDerWaalsContact O-N 3.11Å; S10-S13 PolarHBondContact O-OG 2.94Å; S10-G16 WeakPolarHBondContact O-CA 3.32Å
11L86.4Confident84.8Confident49 Ų4986.2 Ų86.226%0.25745%0.452SS..Hα-helixtrans-72.4-12.2178.1-67.8175.1000114.2L7 A8 S9 S13 R17 L20L7-L11 HydrophobicContact CD2-CD1 4.23Å; L7-L11 HydrophobicContact CG-CD1 4.05Å; L7-L11 VanDerWaalsContact O-CG 3.28Å; L7-L11 WeakPolarHBondContact O-CG 3.39Å; L7-L11 PolarHBondContact O-N 3.42Å; A8-L11 CarbonylContact O-C 3.53Å; A8-L11 PolarHBondContact O-N 3.25Å; A8-L11 VanDerWaalsContact O-N 3.09Å; S9-L11 VanDerWaalsContact C-N 3.31Å; S9-L11 PolarHBondContact O-N 3.46Å; L11-S13 VanDerWaalsContact C-N 3.27Å; L11-R17 HydrophobicContact CD2-CG 4.46Å; L11-R17 WeakPolarHBondContact O-CD 3.29Å; L11-R17 WeakPolarHBondContact O-CG 3.33Å; L11-R17 PolarHBondContact O-NE 3.43Å; L11-R17 PolarHBondContact O-NH2 2.96Å; L11-L20 HydrophobicContact CD1-CD2 4.16Å; L11-L20 HydrophobicContact CD2-CB 3.97Å; L11-L20 HydrophobicContact CD2-CD2 3.43Å; L11-L20 VanDerWaalsContact CD2-CD2 3.43Å; L11-L20 HydrophobicContact CD2-CG 4.3Å; L11-L20 HydrophobicContact CG-CD2 4.4Å
12E89.6Confident86.1Confident151 Ų15179.5 Ų79.571%0.70642%0.418SS*.Hα-helixtrans-73.7-24.9168.8-72.4174.6173.300111.6A8 S9 S10A8-E12 PolarHBondContact O-N 2.96Å; S9-E12 PolarHBondContact O-N 2.94Å; S10-E12 VanDerWaalsContact C-N 3.26Å; S10-E12 PolarHBondContact O-N 3.19Å
13S88.6Confident87.1Confident50 Ų5076.2 Ų76.235%0.3539%0.389SS..SBendtrans-82.8141.8176.978.50000112.5S10 L11 R15 G16 R17S10-S13 WeakPolarHBondContact O-CB 3.49Å; S10-S13 PolarHBondContact O-N 3.41Å; S10-S13 VanDerWaalsContact O-N 3.11Å; S10-S13 PolarHBondContact O-OG 2.94Å; L11-S13 VanDerWaalsContact C-N 3.27Å; S13-R15 VanDerWaalsContact C-N 3.32Å; S13-R15 PolarHBondContact O-N 2.88Å; S13-G16 PolarHBondContact O-N 3.46Å; S13-G16 WeakPolarHBondContact OG-CA 3.49Å; S13-G16 PolarHBondContact OG-N 3.29Å; S13-R17 PolarHBondContact O-N 3.41Å
14Y88.3Confident88.2Confident85 Ų8572.7 Ų72.733%0.33337%0.371SS..Hα-helixtrans-52.7-48.8173172.6-102.2000112G16 R17 D18 L63 D67Y14-G16 VanDerWaalsContact C-N 3.34Å; Y14-G16 PolarHBondContact O-N 2.79Å; Y14-R17 PolarHBondContact O-N 3.26Å; Y14-D18 PolarHBondContact O-N 3.49Å; Y14-L63 HydrophobicContact CE2-CB 4.04Å; Y14-L63 HydrophobicContact CE2-CD2 4.3Å; Y14-L63 PolarHBondContact OH-O 3.46Å; Y14-D67 WeakPolarHBondContact CE1-OD1 3.47Å; Y14-D67 PolarHBondContact OH-OD1 3.25Å; Y14-D67 PolarHBondContact OH-OD2 2.89Å
15R87.6Confident89.1Confident180 Ų18067.6 Ų67.668%0.67935%0.345SS*.Hα-helixtrans-66.1-32.2-179.2-69.5-165177.5173.40.3113.6S13 R19S13-R15 VanDerWaalsContact C-N 3.32Å; S13-R15 PolarHBondContact O-N 2.88Å; R15-R19 WeakPolarHBondContact O-CB 3.5Å; R15-R19 WeakPolarHBondContact O-CG 3.47Å; R15-R19 PolarHBondContact O-N 3.43Å; R15-R19 VanDerWaalsContact O-N 3.16Å; R15-R19 PolarHBondContact O-NE 2.92Å
16G89.3Confident90Very high4 Ų463.1 Ų63.14%0.04132%0.32CS..Hα-helixtrans-70.5-42.2175.300000111.7S10 S13 Y14 R19 L20S10-G16 WeakPolarHBondContact O-CA 3.32Å; S13-G16 PolarHBondContact O-N 3.46Å; S13-G16 WeakPolarHBondContact OG-CA 3.49Å; S13-G16 PolarHBondContact OG-N 3.29Å; Y14-G16 VanDerWaalsContact C-N 3.34Å; Y14-G16 PolarHBondContact O-N 2.79Å; G16-R19 PolarHBondContact O-N 3.25Å; G16-L20 PolarHBondContact O-N 3.24Å
17R92.3Very high91Very high138 Ų13861.7 Ų61.752%0.52131%0.309SS..Hα-helixtrans-59.9-50.5172.6-68.2-176.1-175.7167.67.2111.9L11 S13 Y14 R19 L20 I21L11-R17 HydrophobicContact CD2-CG 4.46Å; L11-R17 WeakPolarHBondContact O-CD 3.29Å; L11-R17 WeakPolarHBondContact O-CG 3.33Å; L11-R17 PolarHBondContact O-NE 3.43Å; L11-R17 PolarHBondContact O-NH2 2.96Å; S13-R17 PolarHBondContact O-N 3.41Å; Y14-R17 PolarHBondContact O-N 3.26Å; R17-R19 VanDerWaalsContact C-N 3.33Å; R17-R19 PolarHBondContact O-N 2.96Å; R17-L20 PolarHBondContact O-N 2.87Å; R17-L20 VanDerWaalsContact O-N 3.17Å; R17-I21 HydrophobicContact CB-CD1 4.47Å; R17-I21 VanDerWaalsContact O-CG1 3.23Å; R17-I21 WeakPolarHBondContact O-CG1 3.29Å; R17-I21 PolarHBondContact O-N 3.08Å
18D92.9Very high91.9Very high31 Ų3158.2 Ų58.217%0.16629%0.293CS..Hα-helixtrans-58.7-44.9-179.8-179.665000111.7Y14 L20 I21 R22 R60Y14-D18 PolarHBondContact O-N 3.49Å; D18-L20 VanDerWaalsContact C-N 3.34Å; D18-L20 PolarHBondContact O-N 3.48Å; D18-I21 PolarHBondContact O-N 3.4Å; D18-R22 VanDerWaalsContact O-CB 3.25Å; D18-R22 WeakPolarHBondContact O-CB 3.39Å; D18-R22 PolarHBondContact O-N 3.34Å; D18-R60 IonicContact OD1-CZ 2.64Å; D18-R60 IonicContact OD1-NE 3.91Å; D18-R60 PolarHBondContact OD1-NE 2.94Å; D18-R60 IonicContact OD1-NH2 3.47Å; D18-R60 PolarHBondContact OD1-NH2 3.45Å; D18-R60 IonicContact OD2-CZ 2.8Å; D18-R60 IonicContact OD2-NE 3.48Å; D18-R60 IonicContact OD2-NH2 3.45Å; D18-R60 PolarHBondContact OD2-NH2 2.92Å
19R92.7Very high92.5Very high79 Ų7957.4 Ų57.430%0.29828%0.281SS..Hα-helixtrans-59.4-42.1176.3-81.8-175.8-105.5150.5-10.8112.7R15 G16 R17 T23 M226 A229R15-R19 WeakPolarHBondContact O-CB 3.5Å; R15-R19 WeakPolarHBondContact O-CG 3.47Å; R15-R19 PolarHBondContact O-N 3.43Å; R15-R19 VanDerWaalsContact O-N 3.16Å; R15-R19 PolarHBondContact O-NE 2.92Å; G16-R19 PolarHBondContact O-N 3.25Å; R17-R19 VanDerWaalsContact C-N 3.33Å; R17-R19 PolarHBondContact O-N 2.96Å; R19-T23 WeakPolarHBondContact O-CB 3.45Å; R19-T23 PolarHBondContact O-N 3.41Å; R19-T23 PolarHBondContact O-OG1 3.46Å; R19-M226 HydrophobicContact CB-CG 4.26Å; R19-A229 VanDerWaalsContact CZ-CB 3.5Å
20L93.1Very high93.2Very high60 Ų6056 Ų5631%0.31427%0.268SS..Hα-helixtrans-67-48.9177.3-177.865.9000111.2L11 G16 R17 D18 R22 T23 L24L11-L20 HydrophobicContact CD1-CD2 4.16Å; L11-L20 HydrophobicContact CD2-CB 3.97Å; L11-L20 HydrophobicContact CD2-CD2 3.43Å; L11-L20 VanDerWaalsContact CD2-CD2 3.43Å; L11-L20 HydrophobicContact CD2-CG 4.3Å; L11-L20 HydrophobicContact CG-CD2 4.4Å; G16-L20 PolarHBondContact O-N 3.24Å; R17-L20 PolarHBondContact O-N 2.87Å; R17-L20 VanDerWaalsContact O-N 3.17Å; D18-L20 VanDerWaalsContact C-N 3.34Å; D18-L20 PolarHBondContact O-N 3.48Å; L20-R22 VanDerWaalsContact C-N 3.28Å; L20-R22 PolarHBondContact O-N 3.01Å; L20-T23 PolarHBondContact O-N 3.32Å; L20-L24 HydrophobicContact CD1-CD1 4Å; L20-L24 HydrophobicContact CD1-CG 4.02Å; L20-L24 HydrophobicContact CD2-CD1 4.25Å; L20-L24 HydrophobicContact CG-CD1 3.83Å; L20-L24 HydrophobicContact CG-CG 4.24Å; L20-L24 WeakPolarHBondContact O-CB 3.45Å; L20-L24 WeakPolarHBondContact O-CG 3.41Å; L20-L24 PolarHBondContact O-N 2.93Å
21I96Very high93.9Very high30 Ų3057.2 Ų57.215%0.15427%0.273CS..Hα-helixtrans-58.6-43.8-180-65.3165.3000109.9R17 D18 G25 L56 R60 L63R17-I21 HydrophobicContact CB-CD1 4.47Å; R17-I21 VanDerWaalsContact O-CG1 3.23Å; R17-I21 WeakPolarHBondContact O-CG1 3.29Å; R17-I21 PolarHBondContact O-N 3.08Å; D18-I21 PolarHBondContact O-N 3.4Å; I21-G25 PolarHBondContact O-N 3.33Å; I21-L56 HydrophobicContact CG2-CB 4Å; I21-L56 HydrophobicContact CG2-CD2 3.99Å; I21-R60 HydrophobicContact CB-CG 4.17Å; I21-R60 HydrophobicContact CG2-CG 3.45Å; I21-R60 VanDerWaalsContact CG2-CG 3.45Å; I21-L63 HydrophobicContact CD1-CD1 3.72Å
22R96.8Very high94.4Very high30 Ų3054.9 Ų54.911%0.11326%0.261CS..Hα-helixtrans-57.7-51.9175.1-176.5175.5165100.711.7111.7D18 L20 G25 Y26 R60 D191 S221 S222D18-R22 VanDerWaalsContact O-CB 3.25Å; D18-R22 WeakPolarHBondContact O-CB 3.39Å; D18-R22 PolarHBondContact O-N 3.34Å; L20-R22 VanDerWaalsContact C-N 3.28Å; L20-R22 PolarHBondContact O-N 3.01Å; R22-G25 PolarHBondContact O-N 3.28Å; R22-Y26 HydrophobicContact CG-CD2 3.82Å; R22-Y26 HydrophobicContact CG-CE2 3.8Å; R22-Y26 VanDerWaalsContact CZ-CE2 3.47Å; R22-Y26 WeakPolarHBondContact O-CD2 3.38Å; R22-Y26 PolarHBondContact O-N 2.99Å; R22-R60 VanDerWaalsContact CG-CZ 3.5Å; R22-D191 IonicContact CZ-OD1 3.77Å; R22-D191 IonicContact CZ-OD2 2.78Å; R22-D191 IonicContact NH1-OD1 3.52Å; R22-D191 PolarHBondContact NH1-OD1 2.8Å; R22-D191 IonicContact NH2-OD1 3.05Å; R22-D191 PolarHBondContact NH2-OD1 3.35Å; R22-D191 IonicContact NH2-OD2 3.89Å; R22-D191 PolarHBondContact NH2-OD2 3.34Å; R22-S221 PolarHBondContact NH2-OG 3.24Å; R22-S222 WeakPolarHBondContact CD-OG 3.27Å; R22-S222 VanDerWaalsContact CG-OG 3.3Å; R22-S222 WeakPolarHBondContact CG-OG 3.44Å; R22-S222 PolarHBondContact NE-OG 3.05Å
23T96.8Very high94.8Very high13 Ų1347.8 Ų47.88%0.0823%0.229CC..Hα-helixtrans-62.7-48.2-176.5-56.60000110.7R19 L20 G25 Y26 C27 S222 M226R19-T23 WeakPolarHBondContact O-CB 3.45Å; R19-T23 PolarHBondContact O-N 3.41Å; R19-T23 PolarHBondContact O-OG1 3.46Å; L20-T23 PolarHBondContact O-N 3.32Å; T23-G25 VanDerWaalsContact C-N 3.34Å; T23-G25 PolarHBondContact O-N 3Å; T23-Y26 PolarHBondContact O-N 3.4Å; T23-C27 WeakPolarHBondContact O-CB 3.35Å; T23-C27 PolarHBondContact O-N 3.11Å; T23-C27 PolarHBondContact O-SG 3.45Å; T23-S222 WeakPolarHBondContact OG1-CB 3.49Å; T23-M226 HydrophobicContact CG2-CE 3.74Å; T23-M226 WeakPolarHBondContact OG1-CE 3.28Å
24L97.1Very high95.1Very high82 Ų8247.7 Ų47.743%0.42923%0.226SC..Hα-helixtrans-62.1-42.8177.1-69.4176.6000111.4L20 Y26 C27 C28 L56L20-L24 HydrophobicContact CD1-CD1 4Å; L20-L24 HydrophobicContact CD1-CG 4.02Å; L20-L24 HydrophobicContact CD2-CD1 4.25Å; L20-L24 HydrophobicContact CG-CD1 3.83Å; L20-L24 HydrophobicContact CG-CG 4.24Å; L20-L24 WeakPolarHBondContact O-CB 3.45Å; L20-L24 WeakPolarHBondContact O-CG 3.41Å; L20-L24 PolarHBondContact O-N 2.93Å; L24-Y26 PolarHBondContact O-N 3.21Å; L24-C27 PolarHBondContact O-N 3.47Å; L24-C28 WeakPolarHBondContact O-CB 3.43Å; L24-C28 PolarHBondContact O-N 2.9Å; L24-C28 PolarHBondContact O-SG 2.63Å; L24-L56 HydrophobicContact CB-CD1 3.91Å
25G97.8Very high95.4Very high3 Ų346.4 Ų46.43%0.03122%0.224CC..Hα-helixtrans-56-49.517800000112.3I21 R22 T23 Q29 S53I21-G25 PolarHBondContact O-N 3.33Å; R22-G25 PolarHBondContact O-N 3.28Å; T23-G25 VanDerWaalsContact C-N 3.34Å; T23-G25 PolarHBondContact O-N 3Å; G25-Q29 PolarHBondContact O-N 2.92Å; G25-S53 VanDerWaalsContact O-CB 3.24Å; G25-S53 WeakPolarHBondContact O-CB 3.35Å; G25-S53 PolarHBondContact O-OG 3.46Å
26Y98.3Very high95.8Very high9 Ų940.2 Ų40.24%0.03521%0.206CC..Hα-helixtrans-74.5-34.6178.6-73.8-59.1000113.9R22 T23 L24 Q29 L30 W198 G218R22-Y26 HydrophobicContact CG-CD2 3.82Å; R22-Y26 HydrophobicContact CG-CE2 3.8Å; R22-Y26 VanDerWaalsContact CZ-CE2 3.47Å; R22-Y26 WeakPolarHBondContact O-CD2 3.38Å; R22-Y26 PolarHBondContact O-N 2.99Å; T23-Y26 PolarHBondContact O-N 3.4Å; L24-Y26 PolarHBondContact O-N 3.21Å; Y26-Q29 WeakPolarHBondContact O-CB 3.36Å; Y26-Q29 PolarHBondContact O-N 3.15Å; Y26-Q29 VanDerWaalsContact O-N 3.15Å; Y26-L30 WeakPolarHBondContact O-CB 3.33Å; Y26-L30 PolarHBondContact O-N 2.95Å; Y26-W198 WeakPolarHBondContact OH-CH2 3.34Å; Y26-G218 VanDerWaalsContact CD2-C 3.47Å; Y26-G218 VanDerWaalsContact CD2-CA 3.48Å; Y26-G218 WeakPolarHBondContact CD2-O 3.49Å; Y26-G218 VanDerWaalsContact CG-CA 3.42Å
27C97.9Very high95.9Very high44 Ų4445.7 Ų45.730%0.29723%0.231SC..Hα-helixtrans-62.5-43.3172.8-73.60000111.6T23 L24 Q29 L30 V31 T219T23-C27 WeakPolarHBondContact O-CB 3.35Å; T23-C27 PolarHBondContact O-N 3.11Å; T23-C27 PolarHBondContact O-SG 3.45Å; L24-C27 PolarHBondContact O-N 3.47Å; C27-Q29 VanDerWaalsContact C-N 3.3Å; C27-Q29 PolarHBondContact O-N 3.39Å; C27-L30 PolarHBondContact O-N 3.39Å; C27-V31 WeakPolarHBondContact O-CG2 3.43Å; C27-V31 PolarHBondContact O-N 2.93Å; C27-T219 PolarHBondContact N-OG1 3.4Å
28C97.8Very high95.8Very high23 Ų2345.8 Ų45.816%0.15524%0.237CC..Hα-helixtrans-61.7-39.3172.2-72.40000111.4L24 G32L24-C28 WeakPolarHBondContact O-CB 3.43Å; L24-C28 PolarHBondContact O-N 2.9Å; L24-C28 PolarHBondContact O-SG 2.63Å; C28-G32 WeakPolarHBondContact O-CA 3.15Å; C28-G32 PolarHBondContact O-N 3.07Å
29Q98.1Very high95.5Very high30 Ų3047.5 Ų47.514%0.1425%0.251CS..Hα-helixtrans-64.7-42.9176.3-156174.3-9.400112.5G25 Y26 C27 G33 L50 S53 V214G25-Q29 PolarHBondContact O-N 2.92Å; Y26-Q29 WeakPolarHBondContact O-CB 3.36Å; Y26-Q29 PolarHBondContact O-N 3.15Å; Y26-Q29 VanDerWaalsContact O-N 3.15Å; C27-Q29 VanDerWaalsContact C-N 3.3Å; C27-Q29 PolarHBondContact O-N 3.39Å; Q29-G33 WeakPolarHBondContact O-CA 3.41Å; Q29-G33 PolarHBondContact O-N 2.95Å; Q29-L50 HydrophobicContact CG-CD2 4.2Å; Q29-S53 VanDerWaalsContact CB-OG 3.31Å; Q29-S53 WeakPolarHBondContact CB-OG 3.34Å; Q29-V214 VanDerWaalsContact NE2-CG1 3.27Å
30L98.2Very high94.7Very high38 Ų3848.7 Ų48.720%0.19927%0.269CS..Hα-helixtrans-62.9-58.4178.7173.357.2000110.4Y26 C27 G32 G33 V34 W212 L216Y26-L30 WeakPolarHBondContact O-CB 3.33Å; Y26-L30 PolarHBondContact O-N 2.95Å; C27-L30 PolarHBondContact O-N 3.39Å; L30-G32 PolarHBondContact O-N 3.44Å; L30-G33 PolarHBondContact O-N 2.76Å; L30-V34 HydrophobicContact CD1-CG2 4.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.35Å; L30-V34 PolarHBondContact O-N 2.88Å; L30-W212 HydrophobicContact CD1-CB 4.38Å; L30-W212 VanDerWaalsContact CD1-O 3.25Å; L30-W212 WeakPolarHBondContact CD1-O 3.39Å; L30-L216 HydrophobicContact CD1-CB 3.95Å; L30-L216 HydrophobicContact CD1-CD1 4.48Å; L30-L216 HydrophobicContact CD2-CD1 4.28Å
31V97.3Very high93.6Very high73 Ų7351.2 Ų51.244%0.44229%0.292SS..Hα-helixtrans-64.4-44.9-177.8177.90000110.4C27 G33 V34 L35 L49C27-V31 WeakPolarHBondContact O-CG2 3.43Å; C27-V31 PolarHBondContact O-N 2.93Å; V31-G33 VanDerWaalsContact C-N 3.34Å; V31-G33 PolarHBondContact O-N 3.39Å; V31-V34 PolarHBondContact O-N 3.47Å; V31-L35 HydrophobicContact CG1-CD1 3.89Å; V31-L35 HydrophobicContact CG1-CG 4.3Å; V31-L35 WeakPolarHBondContact O-CB 3.37Å; V31-L35 VanDerWaalsContact O-CG 3.23Å; V31-L35 WeakPolarHBondContact O-CG 3.31Å; V31-L35 PolarHBondContact O-N 2.89Å; V31-L49 HydrophobicContact CB-CD1 4.13Å; V31-L49 HydrophobicContact CG1-CD1 3.65Å
32G96.7Very high92.1Very high0 Ų060.4 Ų60.40%032%0.324CS..Hα-helixtrans-59.6-44.6176.900000112.4C28 L30 L35 V36C28-G32 WeakPolarHBondContact O-CA 3.15Å; C28-G32 PolarHBondContact O-N 3.07Å; L30-G32 PolarHBondContact O-N 3.44Å; G32-L35 PolarHBondContact O-N 3.43Å; G32-V36 WeakPolarHBondContact O-CG2 3.42Å; G32-V36 PolarHBondContact O-N 2.94Å
33G96.4Very high91.4Very high2 Ų260 Ų602%0.02133%0.326CS..Hα-helixtrans-62.8-45.6176.700000112.8Q29 L30 V31 L35 V36 E37Q29-G33 WeakPolarHBondContact O-CA 3.41Å; Q29-G33 PolarHBondContact O-N 2.95Å; L30-G33 PolarHBondContact O-N 2.76Å; V31-G33 VanDerWaalsContact C-N 3.34Å; V31-G33 PolarHBondContact O-N 3.39Å; G33-L35 VanDerWaalsContact C-N 3.35Å; G33-L35 PolarHBondContact O-N 2.95Å; G33-V36 PolarHBondContact O-N 3.39Å; G33-E37 WeakPolarHBondContact O-CB 3.26Å; G33-E37 PolarHBondContact O-N 3.23Å
34V96.4Very high91.1Very high48 Ų4863 Ų6329%0.29134%0.339SS..Hα-helixtrans-62.1-45177.8170.30000110.6L30 V31 V36 E37 Q38 W212L30-V34 HydrophobicContact CD1-CG2 4.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.35Å; L30-V34 PolarHBondContact O-N 2.88Å; V31-V34 PolarHBondContact O-N 3.47Å; V34-V36 VanDerWaalsContact C-N 3.33Å; V34-V36 PolarHBondContact O-N 2.91Å; V34-E37 PolarHBondContact O-N 3.43Å; V34-Q38 HydrophobicContact CG1-CG 4.32Å; V34-Q38 WeakPolarHBondContact O-CB 3.34Å; V34-Q38 WeakPolarHBondContact O-CG 3.31Å; V34-Q38 PolarHBondContact O-N 2.86Å; V34-W212 HydrophobicContact CG2-CB 3.79Å; V34-W212 HydrophobicContact CG2-CG 4.38Å
35L94.9Very high90.9Very high58 Ų5864.7 Ų64.730%0.30435%0.346SS..Hα-helixtrans-65.8-35.6-178.6-71.4175.3000112.6V31 G32 G33 C39 S43 M45 L49V31-L35 HydrophobicContact CG1-CD1 3.89Å; V31-L35 HydrophobicContact CG1-CG 4.3Å; V31-L35 WeakPolarHBondContact O-CB 3.37Å; V31-L35 VanDerWaalsContact O-CG 3.23Å; V31-L35 WeakPolarHBondContact O-CG 3.31Å; V31-L35 PolarHBondContact O-N 2.89Å; G32-L35 PolarHBondContact O-N 3.43Å; G33-L35 VanDerWaalsContact C-N 3.35Å; G33-L35 PolarHBondContact O-N 2.95Å; L35-C39 PolarHBondContact O-N 2.94Å; L35-S43 VanDerWaalsContact CB-OG 3.29Å; L35-S43 WeakPolarHBondContact CB-OG 3.32Å; L35-S43 WeakPolarHBondContact O-CB 3.34Å; L35-S43 PolarHBondContact O-OG 2.99Å; L35-M45 HydrophobicContact CD1-CG 4.32Å; L35-L49 HydrophobicContact CD1-CD1 4.03Å
36V94.5Very high90.7Very high49 Ų4964.6 Ų64.630%0.29735%0.345SS..Hα-helixtrans-72.9-40.1175.5170.90000111G32 G33 V34 C39 P40 L50G32-V36 WeakPolarHBondContact O-CG2 3.42Å; G32-V36 PolarHBondContact O-N 2.94Å; G33-V36 PolarHBondContact O-N 3.39Å; V34-V36 VanDerWaalsContact C-N 3.33Å; V34-V36 PolarHBondContact O-N 2.91Å; V36-C39 CarbonylContact O-C 3.48Å; V36-P40 VanDerWaalsContact O-CA 3.23Å; V36-P40 WeakPolarHBondContact O-CA 3.47Å; V36-P40 WeakPolarHBondContact O-CD 3.34Å; V36-P40 WeakPolarHBondContact O-CG 3.32Å; V36-P40 VanDerWaalsContact O-N 3.15Å; V36-L50 HydrophobicContact CG2-CD1 3.99Å
37E92.6Very high90.6Very high119 Ų11970.7 Ų70.756%0.55637%0.368SS*.Hα-helixtrans-63.2-44.6178.7-167.972.1-165.900111.9G33 V34G33-E37 WeakPolarHBondContact O-CB 3.26Å; G33-E37 PolarHBondContact O-N 3.23Å; V34-E37 PolarHBondContact O-N 3.43Å
38Q90.4Very high90.5Very high141 Ų14175.4 Ų75.466%0.65938%0.379SS*.Hα-helixtrans-72.5-38-178.2-71.1178.8-12.600112.9V34V34-Q38 HydrophobicContact CG1-CG 4.32Å; V34-Q38 WeakPolarHBondContact O-CB 3.34Å; V34-Q38 WeakPolarHBondContact O-CG 3.31Å; V34-Q38 PolarHBondContact O-N 2.86Å
39C85.3Confident90.5Very high67 Ų6776.1 Ų76.145%0.45338%0.381SS..  trans-135.771.8-175.1-74.40000111.9L35 V36 S41 R42 S43L35-C39 PolarHBondContact O-N 2.94Å; V36-C39 CarbonylContact O-C 3.48Å; C39-S41 VanDerWaalsContact C-N 3.26Å; C39-S41 PolarHBondContact O-N 3.27Å; C39-S41 VanDerWaalsContact O-N 3.15Å; C39-R42 PolarHBondContact O-N 3.3Å; C39-S43 VanDerWaalsContact O-CB 3.27Å; C39-S43 WeakPolarHBondContact O-CB 3.44Å; C39-S43 PolarHBondContact O-N 2.86Å; C39-S43 VanDerWaalsContact O-N 3.16Å
40P75.6Confident90.4Very high104 Ų10476.9 Ų76.968%0.67539%0.386SS*.THydrogen-bonded Turntrans-59.4-32.7-172.4-24.833.2000114.4V36V36-P40 VanDerWaalsContact O-CA 3.23Å; V36-P40 WeakPolarHBondContact O-CA 3.47Å; V36-P40 WeakPolarHBondContact O-CD 3.34Å; V36-P40 WeakPolarHBondContact O-CG 3.32Å; V36-P40 VanDerWaalsContact O-N 3.15Å
41S70Confident90.4Very high113 Ų11378.7 Ų78.779%0.7940%0.398SS*.THydrogen-bonded Turntrans-91.4-7.7-17456.50000115C39C39-S41 VanDerWaalsContact C-N 3.26Å; C39-S41 PolarHBondContact O-N 3.27Å; C39-S41 VanDerWaalsContact O-N 3.15Å
42R65.9Low90.5Very high223 Ų22378.4 Ų78.484%0.84240%0.397SS*.THydrogen-bonded Turntrans-132.3-4.9-173.5-73.1-171.3175.6-172.5-0.6115.2C39 E44C39-R42 PolarHBondContact O-N 3.3Å; R42-E44 VanDerWaalsContact C-N 3.32Å; R42-E44 PolarHBondContact O-N 2.88Å
43S80.8Confident90.5Very high21 Ų2178.6 Ų78.615%0.14740%0.398CS..  trans-87.765.7-172.6-165.50000113.7L35 C39 M45 G46 R47L35-S43 VanDerWaalsContact CB-OG 3.29Å; L35-S43 WeakPolarHBondContact CB-OG 3.32Å; L35-S43 WeakPolarHBondContact O-CB 3.34Å; L35-S43 PolarHBondContact O-OG 2.99Å; C39-S43 VanDerWaalsContact O-CB 3.27Å; C39-S43 WeakPolarHBondContact O-CB 3.44Å; C39-S43 PolarHBondContact O-N 2.86Å; C39-S43 VanDerWaalsContact O-N 3.16Å; S43-M45 PolarHBondContact O-N 3.12Å; S43-G46 PolarHBondContact O-N 3.24Å; S43-G46 VanDerWaalsContact O-N 3.15Å; S43-G46 WeakPolarHBondContact OG-CA 3.33Å; S43-G46 PolarHBondContact OG-N 3.25Å; S43-R47 PolarHBondContact O-N 3.39Å; S43-R47 VanDerWaalsContact O-N 3.09Å
44E91.9Very high90.6Very high76 Ų7681.2 Ų81.236%0.35542%0.419SS..Hα-helixtrans-60.1-36.6173.3174.357.1-165.800111.3R42 R47 R48R42-E44 VanDerWaalsContact C-N 3.32Å; R42-E44 PolarHBondContact O-N 2.88Å; E44-R47 VanDerWaalsContact CD-NH2 3.29Å; E44-R47 PolarHBondContact O-N 3.41Å; E44-R47 IonicContact OE1-CZ 3.68Å; E44-R47 IonicContact OE1-NH2 3.8Å; E44-R47 PolarHBondContact OE1-NH2 3.41Å; E44-R47 IonicContact OE2-CZ 2.69Å; E44-R47 IonicContact OE2-NE 3.48Å; E44-R47 PolarHBondContact OE2-NE 3.34Å; E44-R47 IonicContact OE2-NH2 2.63Å; E44-R47 PolarHBondContact OE2-NH2 2.93Å; E44-R48 VanDerWaalsContact O-CG 3.28Å; E44-R48 WeakPolarHBondContact O-CG 2.98Å; E44-R48 PolarHBondContact O-N 2.86Å; E44-R48 IonicContact OE1-CZ 3.41Å; E44-R48 IonicContact OE1-NE 2.8Å; E44-R48 PolarHBondContact OE1-NE 3.44Å; E44-R48 IonicContact OE1-NH2 3.14Å; E44-R48 PolarHBondContact OE1-NH2 3.28Å; E44-R48 VanDerWaalsContact OE1-NH2 3.14Å
45M92.1Very high90.6Very high118 Ų11885 Ų8558%0.58143%0.434SS*.Hα-helixtrans-62.9-43.8173.4-175.963.179.100111.9L35 S43 R47 R48 L49L35-M45 HydrophobicContact CD1-CG 4.32Å; S43-M45 PolarHBondContact O-N 3.12Å; M45-R47 VanDerWaalsContact C-N 3.34Å; M45-R47 PolarHBondContact O-N 2.97Å; M45-R48 PolarHBondContact O-N 3.44Å; M45-L49 HydrophobicContact CG-CD1 4.28Å; M45-L49 WeakPolarHBondContact O-CG 3.32Å; M45-L49 PolarHBondContact O-N 3.27Å
46G94.3Very high90.8Very high0 Ų084.2 Ų84.20%043%0.43CS..Hα-helixtrans-60.5-45178.800000111.8S43 R48 L49 L50S43-G46 PolarHBondContact O-N 3.24Å; S43-G46 VanDerWaalsContact O-N 3.15Å; S43-G46 WeakPolarHBondContact OG-CA 3.33Å; S43-G46 PolarHBondContact OG-N 3.25Å; G46-R48 PolarHBondContact O-N 2.94Å; G46-L49 PolarHBondContact O-N 3.46Å; G46-L50 WeakPolarHBondContact O-CG 3.47Å; G46-L50 PolarHBondContact O-N 2.95Å
47R95.1Very high90.8Very high137 Ų13784 Ų8452%0.51743%0.431SS..Hα-helixtrans-60.2-43174.7-167.4-177.76885.21.9112.3S43 E44 M45 L50 V51S43-R47 PolarHBondContact O-N 3.39Å; S43-R47 VanDerWaalsContact O-N 3.09Å; E44-R47 VanDerWaalsContact CD-NH2 3.29Å; E44-R47 PolarHBondContact O-N 3.41Å; E44-R47 IonicContact OE1-CZ 3.68Å; E44-R47 IonicContact OE1-NH2 3.8Å; E44-R47 PolarHBondContact OE1-NH2 3.41Å; E44-R47 IonicContact OE2-CZ 2.69Å; E44-R47 IonicContact OE2-NE 3.48Å; E44-R47 PolarHBondContact OE2-NE 3.34Å; E44-R47 IonicContact OE2-NH2 2.63Å; E44-R47 PolarHBondContact OE2-NH2 2.93Å; M45-R47 VanDerWaalsContact C-N 3.34Å; M45-R47 PolarHBondContact O-N 2.97Å; R47-L50 PolarHBondContact O-N 2.9Å; R47-V51 WeakPolarHBondContact O-CG2 3.26Å; R47-V51 PolarHBondContact O-N 3.46Å
48R96.4Very high91Very high144 Ų14483 Ų8354%0.54343%0.426SS..Hα-helixtrans-61.9-42.7175.8-72173.2-172.3-166.53.3112.2E44 M45 G46 L50 V51 V52E44-R48 VanDerWaalsContact O-CG 3.28Å; E44-R48 WeakPolarHBondContact O-CG 2.98Å; E44-R48 PolarHBondContact O-N 2.86Å; E44-R48 IonicContact OE1-CZ 3.41Å; E44-R48 IonicContact OE1-NE 2.8Å; E44-R48 PolarHBondContact OE1-NE 3.44Å; E44-R48 IonicContact OE1-NH2 3.14Å; E44-R48 PolarHBondContact OE1-NH2 3.28Å; E44-R48 VanDerWaalsContact OE1-NH2 3.14Å; M45-R48 PolarHBondContact O-N 3.44Å; G46-R48 PolarHBondContact O-N 2.94Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 3.31Å; R48-V51 WeakPolarHBondContact O-CB 3.14Å; R48-V51 PolarHBondContact O-N 3.23Å; R48-V52 WeakPolarHBondContact O-CG2 3.5Å; R48-V52 PolarHBondContact O-N 2.87Å
49L97.2Very high91.3Very high38 Ų3878.8 Ų78.820%0.19941%0.411CS..Hα-helixtrans-64.1-38.4176.8-71.5173.2000112.2V31 L35 M45 G46 V51 V52 S53V31-L49 HydrophobicContact CB-CD1 4.13Å; V31-L49 HydrophobicContact CG1-CD1 3.65Å; L35-L49 HydrophobicContact CD1-CD1 4.03Å; M45-L49 HydrophobicContact CG-CD1 4.28Å; M45-L49 WeakPolarHBondContact O-CG 3.32Å; M45-L49 PolarHBondContact O-N 3.27Å; G46-L49 PolarHBondContact O-N 3.46Å; L49-V51 VanDerWaalsContact C-N 3.34Å; L49-V52 PolarHBondContact O-N 3.43Å; L49-S53 WeakPolarHBondContact O-CB 3.5Å; L49-S53 PolarHBondContact O-N 3.3Å
50L96.9Very high91.8Very high46 Ų4676.9 Ų76.924%0.24140%0.395CS..Hα-helixtrans-64.1-38.2173.5-67.7176.3000112Q29 V36 G46 R47 R48 S53 A54 P211Q29-L50 HydrophobicContact CG-CD2 4.2Å; V36-L50 HydrophobicContact CG2-CD1 3.99Å; G46-L50 WeakPolarHBondContact O-CG 3.47Å; G46-L50 PolarHBondContact O-N 2.95Å; R47-L50 PolarHBondContact O-N 2.9Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 3.31Å; L50-S53 WeakPolarHBondContact O-CB 3.41Å; L50-S53 PolarHBondContact O-N 3.34Å; L50-A54 PolarHBondContact O-N 2.9Å; L50-P211 HydrophobicContact CD2-CB 4.08Å
51V97.9Very high92.8Very high75 Ų7572.5 Ų72.546%0.45537%0.366SS..Hα-helixtrans-63.5-45.1173.4172.50000111.1R47 R48 L49 S53 A54 Q55R47-V51 WeakPolarHBondContact O-CG2 3.26Å; R47-V51 PolarHBondContact O-N 3.46Å; R48-V51 WeakPolarHBondContact O-CB 3.14Å; R48-V51 PolarHBondContact O-N 3.23Å; L49-V51 VanDerWaalsContact C-N 3.34Å; V51-S53 VanDerWaalsContact C-N 3.32Å; V51-S53 PolarHBondContact O-N 3.47Å; V51-A54 PolarHBondContact O-N 2.93Å; V51-Q55 WeakPolarHBondContact O-CG 3.25Å; V51-Q55 PolarHBondContact O-N 3.37Å
52V97.9Very high94Very high67 Ų6769.4 Ų69.441%0.40634%0.342SS..Hα-helixtrans-59.4-44.6175.51720000110.8R48 L49 A54 Q55 L56R48-V52 WeakPolarHBondContact O-CG2 3.5Å; R48-V52 PolarHBondContact O-N 2.87Å; L49-V52 PolarHBondContact O-N 3.43Å; V52-A54 VanDerWaalsContact C-N 3.33Å; V52-A54 PolarHBondContact O-N 2.86Å; V52-Q55 PolarHBondContact O-N 2.66Å; V52-L56 HydrophobicContact CG1-CD1 3.88Å; V52-L56 HydrophobicContact CG1-CG 4.31Å; V52-L56 WeakPolarHBondContact O-CG 3.45Å; V52-L56 PolarHBondContact O-N 3.43Å
53S98Very high95.4Very high4 Ų460.8 Ų60.83%0.02831%0.313CS..Hα-helixtrans-57.2-44.2175.9177.60000112.6G25 Q29 L49 L50 V51 L56 S57G25-S53 VanDerWaalsContact O-CB 3.24Å; G25-S53 WeakPolarHBondContact O-CB 3.35Å; G25-S53 PolarHBondContact O-OG 3.46Å; Q29-S53 VanDerWaalsContact CB-OG 3.31Å; Q29-S53 WeakPolarHBondContact CB-OG 3.34Å; L49-S53 WeakPolarHBondContact O-CB 3.5Å; L49-S53 PolarHBondContact O-N 3.3Å; L50-S53 WeakPolarHBondContact O-CB 3.41Å; L50-S53 PolarHBondContact O-N 3.34Å; V51-S53 VanDerWaalsContact C-N 3.32Å; V51-S53 PolarHBondContact O-N 3.47Å; S53-L56 PolarHBondContact O-N 3.37Å; S53-S57 WeakPolarHBondContact O-CB 3.45Å; S53-S57 PolarHBondContact O-N 3.43Å; S53-S57 PolarHBondContact O-OG 3.29Å
54A97.3Very high96Very high57 Ų5761.5 Ų61.547%0.47131%0.312SS..Hα-helixtrans-63.6-43.317700000112.1L50 V51 V52 S57 H58L50-A54 PolarHBondContact O-N 2.9Å; V51-A54 PolarHBondContact O-N 2.93Å; V52-A54 VanDerWaalsContact C-N 3.33Å; V52-A54 PolarHBondContact O-N 2.86Å; A54-S57 PolarHBondContact O-N 3.43Å; A54-H58 PolarHBondContact O-N 3.05Å
55Q98.1Very high96.1Very high129 Ų12959.7 Ų59.760%0.60331%0.305SS*.Hα-helixtrans-62.2-43.9176.6-69.6-64.5-3700112.1V51 V52 H58 C59V51-Q55 WeakPolarHBondContact O-CG 3.25Å; V51-Q55 PolarHBondContact O-N 3.37Å; V52-Q55 PolarHBondContact O-N 2.66Å; Q55-H58 PolarHBondContact O-N 3.45Å; Q55-C59 WeakPolarHBondContact O-CB 3.5Å; Q55-C59 PolarHBondContact O-N 3.01Å
56L97.8Very high96.2Very high40 Ų4061.1 Ų61.121%0.20931%0.308CS..Hα-helixtrans-65-40.2176.7-66.9172.8000111.4I21 L24 V52 S53 C59 R60I21-L56 HydrophobicContact CG2-CB 4Å; I21-L56 HydrophobicContact CG2-CD2 3.99Å; L24-L56 HydrophobicContact CB-CD1 3.91Å; V52-L56 HydrophobicContact CG1-CD1 3.88Å; V52-L56 HydrophobicContact CG1-CG 4.31Å; V52-L56 WeakPolarHBondContact O-CG 3.45Å; V52-L56 PolarHBondContact O-N 3.43Å; S53-L56 PolarHBondContact O-N 3.37Å; L56-C59 WeakPolarHBondContact O-CB 3.26Å; L56-C59 PolarHBondContact O-N 3.28Å; L56-R60 WeakPolarHBondContact O-CG 3.41Å; L56-R60 PolarHBondContact O-N 3.43Å
57S95.9Very high96.1Very high46 Ų4662.2 Ų62.232%0.32231%0.314SS..Hα-helixtrans-64.2-40.9176-590000112.2S53 A54 R60 T61S53-S57 WeakPolarHBondContact O-CB 3.45Å; S53-S57 PolarHBondContact O-N 3.43Å; S53-S57 PolarHBondContact O-OG 3.29Å; A54-S57 PolarHBondContact O-N 3.43Å; S57-R60 PolarHBondContact O-N 2.97Å; S57-T61 PolarHBondContact O-N 3.45Å; S57-T61 PolarHBondContact O-OG1 2.86Å; S57-T61 VanDerWaalsContact O-OG1 3.12Å
58H96.1Very high95.9Very high96 Ų9658 Ų5844%0.44430%0.302SS..Hα-helixtrans-65.9-43174.2-171.860.4000111.9A54 Q55 R60 T61 V62 W111A54-H58 PolarHBondContact O-N 3.05Å; Q55-H58 PolarHBondContact O-N 3.45Å; H58-R60 VanDerWaalsContact C-N 3.27Å; H58-R60 PolarHBondContact O-N 3.38Å; H58-T61 WeakPolarHBondContact O-CA 3.35Å; H58-T61 VanDerWaalsContact O-CB 3.3Å; H58-T61 WeakPolarHBondContact O-CB 3.4Å; H58-T61 PolarHBondContact O-N 3.3Å; H58-V62 PolarHBondContact O-N 3.4Å; H58-W111 AromaticContact CE1-CD1 3.85Å; H58-W111 AromaticContact CE1-NE1 3.68Å
59C96.7Very high95.6Very high53 Ų5355.3 Ų55.336%0.35830%0.303SS..Hα-helixtrans-53.9-44.3174.1176.80000111.6Q55 L56 T61 V62 L63Q55-C59 WeakPolarHBondContact O-CB 3.5Å; Q55-C59 PolarHBondContact O-N 3.01Å; L56-C59 WeakPolarHBondContact O-CB 3.26Å; L56-C59 PolarHBondContact O-N 3.28Å; C59-T61 VanDerWaalsContact C-N 3.31Å; C59-T61 PolarHBondContact O-N 2.89Å; C59-V62 PolarHBondContact O-N 2.84Å; C59-L63 WeakPolarHBondContact O-CG 3.3Å; C59-L63 PolarHBondContact O-N 2.98Å
60R95.9Very high95.3Very high28 Ų2856.3 Ų56.311%0.10632%0.317CS..Hα-helixtrans-63.5-35.3176-66-177.471.3-143.5-2.9113.6D18 I21 R22 L56 S57 H58 V62 L63 R64D18-R60 IonicContact OD1-CZ 2.64Å; D18-R60 IonicContact OD1-NE 3.91Å; D18-R60 PolarHBondContact OD1-NE 2.94Å; D18-R60 IonicContact OD1-NH2 3.47Å; D18-R60 PolarHBondContact OD1-NH2 3.45Å; D18-R60 IonicContact OD2-CZ 2.8Å; D18-R60 IonicContact OD2-NE 3.48Å; D18-R60 IonicContact OD2-NH2 3.45Å; D18-R60 PolarHBondContact OD2-NH2 2.92Å; I21-R60 HydrophobicContact CB-CG 4.17Å; I21-R60 HydrophobicContact CG2-CG 3.45Å; I21-R60 VanDerWaalsContact CG2-CG 3.45Å; R22-R60 VanDerWaalsContact CG-CZ 3.5Å; L56-R60 WeakPolarHBondContact O-CG 3.41Å; L56-R60 PolarHBondContact O-N 3.43Å; S57-R60 PolarHBondContact O-N 2.97Å; H58-R60 VanDerWaalsContact C-N 3.27Å; H58-R60 PolarHBondContact O-N 3.38Å; R60-V62 VanDerWaalsContact C-N 3.34Å; R60-L63 PolarHBondContact O-N 3.13Å; R60-R64 WeakPolarHBondContact O-CG 3.47Å; R60-R64 PolarHBondContact O-N 3.33Å; R60-R64 PolarHBondContact O-NE 3.11Å
61T95.9Very high95Very high12 Ų1255 Ų557%0.07431%0.309CS..Hα-helixtrans-64.1-43.3175.1-55.40000110.5S57 H58 C59 R64 E107 W111 W126S57-T61 PolarHBondContact O-N 3.45Å; S57-T61 PolarHBondContact O-OG1 2.86Å; S57-T61 VanDerWaalsContact O-OG1 3.12Å; H58-T61 WeakPolarHBondContact O-CA 3.35Å; H58-T61 VanDerWaalsContact O-CB 3.3Å; H58-T61 WeakPolarHBondContact O-CB 3.4Å; H58-T61 PolarHBondContact O-N 3.3Å; C59-T61 VanDerWaalsContact C-N 3.31Å; C59-T61 PolarHBondContact O-N 2.89Å; T61-R64 PolarHBondContact O-N 3.49Å; T61-R64 PolarHBondContact OG1-NH2 3.39Å; T61-E107 HydrophobicContact CG2-CG 4.35Å; T61-W111 HydrophobicContact CG2-CB 4.3Å; T61-W111 HydrophobicContact CG2-CG 4.38Å; T61-W126 HydrophobicContact CG2-CH2 3.7Å; T61-W126 HydrophobicContact CG2-CZ2 4.39Å
62V95.7Very high94.7Very high48 Ų4857 Ų5729%0.29131%0.312SS..Hα-helixtrans-65-39.9175.4176.60000111.5H58 C59 R60 R64 L65H58-V62 PolarHBondContact O-N 3.4Å; C59-V62 PolarHBondContact O-N 2.84Å; R60-V62 VanDerWaalsContact C-N 3.34Å; V62-R64 VanDerWaalsContact C-N 3.32Å; V62-R64 PolarHBondContact O-N 2.91Å; V62-L65 HydrophobicContact CG1-CD1 4.45Å; V62-L65 VanDerWaalsContact O-CB 3.24Å; V62-L65 WeakPolarHBondContact O-CB 3.2Å; V62-L65 VanDerWaalsContact O-CG 3.29Å; V62-L65 WeakPolarHBondContact O-CG 3.32Å; V62-L65 PolarHBondContact O-N 2.87Å
63L94.7Very high94.5Very high42 Ų4257.2 Ų57.222%0.2231%0.314CS..Hα-helixtrans-63.5-37.4176.2-72175.8000112.3Y14 I21 C59 R60 L65 F66Y14-L63 HydrophobicContact CE2-CB 4.04Å; Y14-L63 HydrophobicContact CE2-CD2 4.3Å; Y14-L63 PolarHBondContact OH-O 3.46Å; I21-L63 HydrophobicContact CD1-CD1 3.72Å; C59-L63 WeakPolarHBondContact O-CG 3.3Å; C59-L63 PolarHBondContact O-N 2.98Å; R60-L63 PolarHBondContact O-N 3.13Å; L63-L65 PolarHBondContact O-N 3.49Å; L63-L65 VanDerWaalsContact O-N 3.17Å; L63-F66 WeakPolarHBondContact O-CD2 3.27Å; L63-F66 PolarHBondContact O-N 3.31Å
64R94.9Very high94Very high35 Ų3562.6 Ų62.613%0.13233%0.334CS..Hα-helixtrans-64.5-14.2175.6-80.5179.3-99.3125-6.9114.4R60 T61 V62 F66 D67 Y103 Y104 E107 H108R60-R64 WeakPolarHBondContact O-CG 3.47Å; R60-R64 PolarHBondContact O-N 3.33Å; R60-R64 PolarHBondContact O-NE 3.11Å; T61-R64 PolarHBondContact O-N 3.49Å; T61-R64 PolarHBondContact OG1-NH2 3.39Å; V62-R64 VanDerWaalsContact C-N 3.32Å; V62-R64 PolarHBondContact O-N 2.91Å; R64-F66 PolarHBondContact O-N 3.44Å; R64-D67 WeakPolarHBondContact CG-OD2 3.34Å; R64-D67 PolarHBondContact O-N 3.47Å; R64-Y103 PolarHBondContact NH1-OH 3.29Å; R64-Y104 HydrophobicContact CB-CD1 4.39Å; R64-Y104 HydrophobicContact CB-CE1 4.22Å; R64-Y104 HydrophobicContact CG-CE1 4.1Å; R64-E107 IonicContact CZ-OE1 2.88Å; R64-E107 IonicContact CZ-OE2 3.9Å; R64-E107 IonicContact NH1-OE1 3.01Å; R64-E107 PolarHBondContact NH1-OE1 3.42Å; R64-E107 IonicContact NH1-OE2 2.92Å; R64-E107 PolarHBondContact NH1-OE2 2.71Å; R64-H108 PolarHBondContact O-NE2 3.23Å; R64-H108 VanDerWaalsContact O-NE2 3.16Å
65L93.8Very high93.7Very high39 Ų3961.6 Ų61.620%0.20432%0.322CS..THydrogen-bonded Turntrans-61.5-21.1169.2-58-178.8000112.5V62 L63 H108 W111V62-L65 HydrophobicContact CG1-CD1 4.45Å; V62-L65 VanDerWaalsContact O-CB 3.24Å; V62-L65 WeakPolarHBondContact O-CB 3.2Å; V62-L65 VanDerWaalsContact O-CG 3.29Å; V62-L65 WeakPolarHBondContact O-CG 3.32Å; V62-L65 PolarHBondContact O-N 2.87Å; L63-L65 PolarHBondContact O-N 3.49Å; L63-L65 VanDerWaalsContact O-N 3.17Å; L65-H108 WeakPolarHBondContact CA-NE2 3.28Å; L65-H108 HydrophobicContact CD2-CB 4.18Å; L65-H108 WeakPolarHBondContact CD2-CD2 3.39Å; L65-W111 HydrophobicContact CD1-CD2 3.99Å; L65-W111 HydrophobicContact CD1-CE3 3.87Å; L65-W111 HydrophobicContact CD1-CH2 3.83Å; L65-W111 HydrophobicContact CD1-CZ2 3.94Å; L65-W111 HydrophobicContact CD1-CZ3 3.79Å; L65-W111 HydrophobicContact CD2-CD2 4.3Å; L65-W111 HydrophobicContact CD2-CE3 4.12Å
66F93.4Very high93.4Very high147 Ų14762.9 Ų62.965%0.64533%0.326SS*.THydrogen-bonded Turntrans-98.33.2-179.3-55.9-77.8000113.3L63 R64 P69L63-F66 WeakPolarHBondContact O-CD2 3.27Å; L63-F66 PolarHBondContact O-N 3.31Å; R64-F66 PolarHBondContact O-N 3.44Å; F66-P69 WeakPolarHBondContact O-CD 3.41Å
67D91.6Very high93.1Very high24 Ų2468.3 Ų68.313%0.12835%0.35CS..  trans-85.9-16.8-174.4-77.1-22.7000114.1Y14 R64 A70 M71 Y104Y14-D67 WeakPolarHBondContact CE1-OD1 3.47Å; Y14-D67 PolarHBondContact OH-OD1 3.25Å; Y14-D67 PolarHBondContact OH-OD2 2.89Å; R64-D67 WeakPolarHBondContact CG-OD2 3.34Å; R64-D67 PolarHBondContact O-N 3.47Å; D67-A70 PolarHBondContact O-N 2.98Å; D67-M71 WeakPolarHBondContact O-CB 3.31Å; D67-M71 PolarHBondContact O-N 3.34Å; D67-Y104 HydrophobicContact CB-CD1 4.18Å; D67-Y104 HydrophobicContact CB-CE1 3.67Å
68D90.8Very high92.8Very high48 Ų4868.1 Ų68.126%0.25734%0.343SS..Hα-helixtrans-56.2-45.9-176.6-59.2-55.3000114A70 M71 F72 Y104 H108D68-A70 VanDerWaalsContact C-N 3.32Å; D68-A70 PolarHBondContact O-N 3.46Å; D68-M71 PolarHBondContact O-N 2.87Å; D68-F72 VanDerWaalsContact O-CB 3.31Å; D68-F72 WeakPolarHBondContact O-CB 3.47Å; D68-F72 PolarHBondContact O-N 3.47Å; D68-Y104 WeakPolarHBondContact OD1-CB 3.36Å; D68-H108 IonicContact OD1-CE1 3.4Å; D68-H108 PolarHBondContact OD1-CE1 3.12Å; D68-H108 IonicContact OD2-CE1 3.36Å; D68-H108 PolarHBondContact OD2-CE1 2.97Å; D68-H108 IonicContact OD2-ND1 3.91Å
69P91.8Very high92.5Very high87 Ų8765.3 Ų65.357%0.56534%0.34SS*.Hα-helixtrans-64.5-40.3-178.7-21.234.8000111.4F66 F72 V73F66-P69 WeakPolarHBondContact O-CD 3.41Å; P69-F72 PolarHBondContact O-N 3.46Å; P69-V73 WeakPolarHBondContact O-CB 3.47Å; P69-V73 VanDerWaalsContact O-CG2 3.28Å; P69-V73 WeakPolarHBondContact O-CG2 3.2Å; P69-V73 PolarHBondContact O-N 2.9Å
70A89.8Confident92Very high60 Ų6068.3 Ų68.350%0.49635%0.352SS..Hα-helixtrans-65.9-42.3177.500000111.1D67 D68 V73 Y74D67-A70 PolarHBondContact O-N 2.98Å; D68-A70 VanDerWaalsContact C-N 3.32Å; D68-A70 PolarHBondContact O-N 3.46Å; A70-V73 PolarHBondContact O-N 3.35Å; A70-Y74 WeakPolarHBondContact O-CB 3.47Å; A70-Y74 PolarHBondContact O-N 3.26Å
71M90.8Very high91.4Very high17 Ų1767 Ų678%0.08435%0.348CS..Hα-helixtrans-65.6-41.4177.4-171.662.7-148.400112D67 D68 Y74 T75 D100 Y104D67-M71 WeakPolarHBondContact O-CB 3.31Å; D67-M71 PolarHBondContact O-N 3.34Å; D68-M71 PolarHBondContact O-N 2.87Å; M71-Y74 HydrophobicContact CE-CD1 3.95Å; M71-Y74 HydrophobicContact CE-CE1 4.48Å; M71-Y74 PolarHBondContact O-N 2.89Å; M71-Y74 HydrophobicContact SD-CD1 4.38Å; M71-T75 WeakPolarHBondContact CE-OG1 3.3Å; M71-T75 WeakPolarHBondContact O-CB 3.3Å; M71-T75 PolarHBondContact O-N 2.91Å; M71-T75 PolarHBondContact O-OG1 3.42Å; M71-D100 HydrophobicContact CE-CB 3.47Å; M71-D100 VanDerWaalsContact CE-CB 3.47Å; M71-D100 HydrophobicContact SD-CB 4.07Å; M71-Y104 HydrophobicContact CB-CD2 4.28Å; M71-Y104 HydrophobicContact CB-CE2 4.05Å; M71-Y104 HydrophobicContact CG-CD2 4.01Å; M71-Y104 HydrophobicContact CG-CE2 3.77Å; M71-Y104 HydrophobicContact SD-CE2 4.02Å
72F91.8Very high90.8Very high118 Ų11872 Ų7252%0.51838%0.378SS..Hα-helixtrans-64.4-46.5176.9178.4-100.8000111.7D68 P69 Y74 T75 K76D68-F72 VanDerWaalsContact O-CB 3.31Å; D68-F72 WeakPolarHBondContact O-CB 3.47Å; D68-F72 PolarHBondContact O-N 3.47Å; P69-F72 PolarHBondContact O-N 3.46Å; F72-Y74 VanDerWaalsContact C-N 3.32Å; F72-Y74 PolarHBondContact O-N 2.97Å; F72-T75 PolarHBondContact O-N 3.37Å; F72-K76 HydrophobicContact CE1-CD 4.28Å; F72-K76 VanDerWaalsContact O-CB 3.27Å; F72-K76 WeakPolarHBondContact O-CB 3.22Å; F72-K76 PolarHBondContact O-N 3.26Å
73V92.8Very high90Very high72 Ų7278.6 Ų78.644%0.43641%0.406SS..Hα-helixtrans-60.8-43.9176.31700000110.6P69 A70 K76 Q77P69-V73 WeakPolarHBondContact O-CB 3.47Å; P69-V73 VanDerWaalsContact O-CG2 3.28Å; P69-V73 WeakPolarHBondContact O-CG2 3.2Å; P69-V73 PolarHBondContact O-N 2.9Å; A70-V73 PolarHBondContact O-N 3.35Å; V73-K76 PolarHBondContact O-N 2.93Å; V73-Q77 HydrophobicContact CG1-CG 4.29Å; V73-Q77 WeakPolarHBondContact O-CB 3.44Å; V73-Q77 VanDerWaalsContact O-CG 3.27Å; V73-Q77 WeakPolarHBondContact O-CG 3.46Å; V73-Q77 PolarHBondContact O-N 3.29Å
74Y89.3Confident89.5Confident117 Ų11779.7 Ų79.746%0.45941%0.41SS..Hα-helixtrans-59.2-50.8176.3175.2-101.4000111.9A70 M71 F72 K76 Q77 Y78 N97A70-Y74 WeakPolarHBondContact O-CB 3.47Å; A70-Y74 PolarHBondContact O-N 3.26Å; M71-Y74 HydrophobicContact CE-CD1 3.95Å; M71-Y74 HydrophobicContact CE-CE1 4.48Å; M71-Y74 PolarHBondContact O-N 2.89Å; M71-Y74 HydrophobicContact SD-CD1 4.38Å; F72-Y74 VanDerWaalsContact C-N 3.32Å; F72-Y74 PolarHBondContact O-N 2.97Å; Y74-K76 VanDerWaalsContact C-N 3.31Å; Y74-K76 PolarHBondContact O-N 2.65Å; Y74-Q77 PolarHBondContact O-N 3.23Å; Y74-Y78 WeakPolarHBondContact O-CB 3.01Å; Y74-Y78 PolarHBondContact O-N 2.82Å; Y74-N97 WeakPolarHBondContact CE1-OD1 3.08Å
75T90.7Very high88.8Confident36 Ų3687.1 Ų87.122%0.22145%0.446CS..Hα-helixtrans-60.7-41.3178.2-60.60000111.6M71 F72 Y78 G79 N97M71-T75 WeakPolarHBondContact CE-OG1 3.3Å; M71-T75 WeakPolarHBondContact O-CB 3.3Å; M71-T75 PolarHBondContact O-N 2.91Å; M71-T75 PolarHBondContact O-OG1 3.42Å; F72-T75 PolarHBondContact O-N 3.37Å; T75-Y78 PolarHBondContact O-N 2.98Å; T75-G79 PolarHBondContact O-N 3.17Å; T75-N97 HydrophobicContact CG2-CB 4.2Å
76K91.4Very high88.6Confident155 Ų15586.3 Ų86.367%0.67444%0.442SS*.Hα-helixtrans-65.4-42.4177.8-176.2-179.5178.3-1780112.2F72 V73 Y74 G79F72-K76 HydrophobicContact CE1-CD 4.28Å; F72-K76 VanDerWaalsContact O-CB 3.27Å; F72-K76 WeakPolarHBondContact O-CB 3.22Å; F72-K76 PolarHBondContact O-N 3.26Å; V73-K76 PolarHBondContact O-N 2.93Å; Y74-K76 VanDerWaalsContact C-N 3.31Å; Y74-K76 PolarHBondContact O-N 2.65Å; K76-G79 PolarHBondContact O-N 3.42Å
77Q90.8Very high88.4Confident155 Ų15586 Ų8672%0.72445%0.445SS*.Hα-helixtrans-65.7-41.2176.9-76.3174.9-9.300111.5V73 Y74 G79V73-Q77 HydrophobicContact CG1-CG 4.29Å; V73-Q77 WeakPolarHBondContact O-CB 3.44Å; V73-Q77 VanDerWaalsContact O-CG 3.27Å; V73-Q77 WeakPolarHBondContact O-CG 3.46Å; V73-Q77 PolarHBondContact O-N 3.29Å; Y74-Q77 PolarHBondContact O-N 3.23Å; Q77-G79 VanDerWaalsContact C-N 3.3Å; Q77-G79 PolarHBondContact O-N 3.11Å
78Y89.7Confident88.5Confident41 Ų4188.6 Ų88.616%0.16146%0.456CS..Hα-helixtrans-64.6-37.2173.9-170.6-99.5000111.8Y74 T75 L80 G81 E84 S93 V94 N97Y74-Y78 WeakPolarHBondContact O-CB 3.01Å; Y74-Y78 PolarHBondContact O-N 2.82Å; T75-Y78 PolarHBondContact O-N 2.98Å; Y78-L80 PolarHBondContact O-N 3.24Å; Y78-G81 PolarHBondContact O-N 3.23Å; Y78-E84 WeakPolarHBondContact OH-CG 3.35Å; Y78-S93 WeakPolarHBondContact OH-CB 3.35Å; Y78-S93 PolarHBondContact OH-OG 2.88Å; Y78-V94 HydrophobicContact CE1-CG2 4.01Å; Y78-N97 WeakPolarHBondContact CD1-ND2 3.4Å
79G90.3Very high88.5Confident38 Ų3886.7 Ų86.739%0.39245%0.446SS..THydrogen-bonded Turntrans57.9-123-179.400000110.8T75 K76 Q77T75-G79 PolarHBondContact O-N 3.17Å; K76-G79 PolarHBondContact O-N 3.42Å; Q77-G79 VanDerWaalsContact C-N 3.3Å; Q77-G79 PolarHBondContact O-N 3.11Å
80L86.9Confident88.6Confident115 Ų11586.7 Ų86.760%0.60243%0.434SS*.THydrogen-bonded Turntrans-96.89.7173.9-62.4177000113Y78 R90Y78-L80 PolarHBondContact O-N 3.24Å; L80-R90 WeakPolarHBondContact O-CD 3.49Å; L80-R90 WeakPolarHBondContact O-CG 3.42Å; L80-R90 PolarHBondContact O-NE 2.93Å; L80-R90 PolarHBondContact O-NH2 3.05Å
81G83.4Confident88.8Confident2 Ų288.3 Ų88.32%0.02143%0.434CS..  trans73.442.2179.800000113.6Y78 E83 E84 R90Y78-G81 PolarHBondContact O-N 3.23Å; G81-E83 PolarHBondContact O-N 3.31Å; G81-E84 PolarHBondContact O-N 2.97Å; G81-E84 VanDerWaalsContact O-N 3.11Å; G81-R90 WeakPolarHBondContact O-CD 3.48Å
82T81.6Confident88.9Confident117 Ų11788.1 Ų88.172%0.71843%0.433SS*.THydrogen-bonded Turntrans-64.5-16.9179.846.80000113.9
83E80.3Confident89Confident186 Ų18683.2 Ų83.287%0.86941%0.414SS*.THydrogen-bonded Turntrans-81.2-14.9175.2-57.2-162.5152.100113.2G81G81-E83 PolarHBondContact O-N 3.31Å
84E84Confident89.1Confident64 Ų6481.3 Ų81.330%0.29940%0.402SS..  trans-85.1118.7178.5-64.8-73-176.800110.5Y78 G81 D86 I89 R90Y78-E84 WeakPolarHBondContact OH-CG 3.35Å; G81-E84 PolarHBondContact O-N 2.97Å; G81-E84 VanDerWaalsContact O-N 3.11Å; E84-D86 VanDerWaalsContact C-N 3.25Å; E84-D86 PolarHBondContact O-N 3.46Å; E84-I89 HydrophobicContact CG-CG2 4.43Å; E84-R90 HydrophobicContact CB-CB 4.1Å
85E80.8Confident89.4Confident192 Ų19279.2 Ų79.290%0.89740%0.399SS*.SBendtrans-67.8-27175.3-66.2-177.517100112.7
86D88.6Confident89.5Confident22 Ų2278.6 Ų78.612%0.11840%0.395CS..  trans-95111.1-175.7-165.9-42.9000110.9E84 F88 I89 R90 W146 K150E84-D86 VanDerWaalsContact C-N 3.25Å; E84-D86 PolarHBondContact O-N 3.46Å; D86-F88 PolarHBondContact O-N 2.99Å; D86-F88 WeakPolarHBondContact OD1-CB 3.42Å; D86-F88 PolarHBondContact OD1-N 2.92Å; D86-I89 HydrophobicContact CB-CB 4Å; D86-I89 HydrophobicContact CB-CD1 3.82Å; D86-I89 HydrophobicContact CB-CG1 3.85Å; D86-I89 PolarHBondContact O-N 3.32Å; D86-I89 VanDerWaalsContact O-N 3.15Å; D86-I89 PolarHBondContact OD1-N 3.32Å; D86-R90 WeakPolarHBondContact O-CB 3.14Å; D86-R90 PolarHBondContact O-N 3Å; D86-W146 PolarHBondContact OD2-NE1 3.18Å; D86-K150 IonicContact OD2-NZ 2.97Å; D86-K150 PolarHBondContact OD2-NZ 3.42Å
87I90.4Very high89.7Confident140 Ų14071.6 Ų71.672%0.71837%0.365SS*.Hα-helixtrans-56.8-34.6-179.5-59.3171.8000111.4R90 L91I87-R90 WeakPolarHBondContact O-CB 3.38Å; I87-L91 WeakPolarHBondContact O-CB 3.35Å; I87-L91 PolarHBondContact O-N 3.39Å
88F92Very high89.8Confident79 Ų7969.4 Ų69.435%0.34636%0.357SS..Hα-helixtrans-71.6-43.9-180-172.7-115.3000111.3D86 R90 L91 L92 V142 W146D86-F88 PolarHBondContact O-N 2.99Å; D86-F88 WeakPolarHBondContact OD1-CB 3.42Å; D86-F88 PolarHBondContact OD1-N 2.92Å; F88-R90 VanDerWaalsContact C-N 3.32Å; F88-R90 PolarHBondContact O-N 3.16Å; F88-L91 PolarHBondContact O-N 3.22Å; F88-L92 HydrophobicContact CD1-CD1 3.92Å; F88-L92 HydrophobicContact CE1-CD1 3.62Å; F88-L92 HydrophobicContact CE1-CG 4.34Å; F88-L92 HydrophobicContact CZ-CD1 4.04Å; F88-L92 HydrophobicContact CZ-CD2 4.37Å; F88-L92 HydrophobicContact CZ-CG 4.35Å; F88-L92 VanDerWaalsContact O-CG 3.31Å; F88-L92 WeakPolarHBondContact O-CG 3.37Å; F88-L92 PolarHBondContact O-N 3.5Å; F88-V142 HydrophobicContact CE1-CG1 3.98Å; F88-V142 HydrophobicContact CZ-CG1 4.02Å; F88-W146 HydrophobicContact CD1-CB 4.37Å; F88-W146 AromaticContact CD1-CD1 3.92Å; F88-W146 AromaticContact CD1-CD2 3.72Å; F88-W146 HydrophobicContact CD1-CD2 3.72Å; F88-W146 AromaticContact CD1-CE2 3.9Å; F88-W146 HydrophobicContact CD1-CE3 4.25Å; F88-W146 AromaticContact CD1-CG 3.76Å; F88-W146 HydrophobicContact CD1-CG 3.76Å; F88-W146 AromaticContact CD1-NE1 3.98Å; F88-W146 HydrophobicContact CE1-CB 4.33Å; F88-W146 HydrophobicContact CE1-CD2 4.07Å; F88-W146 HydrophobicContact CE1-CE3 4.23Å; F88-W146 HydrophobicContact CE1-CG 4.12Å
89I92.1Very high90.1Very high8 Ų867.7 Ų67.74%0.04135%0.351CS..Hα-helixtrans-61.1-44.4174-63.7-179.6000110.3E84 D86 L91 L92 S93 R143E84-I89 HydrophobicContact CG-CG2 4.43Å; D86-I89 HydrophobicContact CB-CB 4Å; D86-I89 HydrophobicContact CB-CD1 3.82Å; D86-I89 HydrophobicContact CB-CG1 3.85Å; D86-I89 PolarHBondContact O-N 3.32Å; D86-I89 VanDerWaalsContact O-N 3.15Å; D86-I89 PolarHBondContact OD1-N 3.32Å; I89-L91 PolarHBondContact O-N 3.48Å; I89-L92 PolarHBondContact O-N 2.93Å; I89-S93 WeakPolarHBondContact O-CB 3.47Å; I89-S93 PolarHBondContact O-N 3.41Å; I89-S93 PolarHBondContact O-OG 3.37Å; I89-S93 VanDerWaalsContact O-OG 3.07Å; I89-R143 HydrophobicContact CG2-CG 4.11Å
90R93.1Very high90.3Very high86 Ų8667.5 Ų67.533%0.32534%0.341SS..Hα-helixtrans-55.7-49.2176.3-179.1-178.7169.8169.56.9111.7L80 G81 E84 D86 I87 F88 S93 V94L80-R90 WeakPolarHBondContact O-CD 3.49Å; L80-R90 WeakPolarHBondContact O-CG 3.42Å; L80-R90 PolarHBondContact O-NE 2.93Å; L80-R90 PolarHBondContact O-NH2 3.05Å; G81-R90 WeakPolarHBondContact O-CD 3.48Å; E84-R90 HydrophobicContact CB-CB 4.1Å; D86-R90 WeakPolarHBondContact O-CB 3.14Å; D86-R90 PolarHBondContact O-N 3Å; I87-R90 WeakPolarHBondContact O-CB 3.38Å; F88-R90 VanDerWaalsContact C-N 3.32Å; F88-R90 PolarHBondContact O-N 3.16Å; R90-S93 PolarHBondContact O-N 3.4Å; R90-V94 WeakPolarHBondContact O-CG2 3.42Å; R90-V94 PolarHBondContact O-N 2.81Å
91L93.9Very high90.6Very high95 Ų9564.6 Ų64.650%0.49732%0.324SS..Hα-helixtrans-60.6-48177.6178.163.6000111.6I87 F88 I89 S93 V94 L95I87-L91 WeakPolarHBondContact O-CB 3.35Å; I87-L91 PolarHBondContact O-N 3.39Å; F88-L91 PolarHBondContact O-N 3.22Å; I89-L91 PolarHBondContact O-N 3.48Å; L91-S93 VanDerWaalsContact C-N 3.32Å; L91-S93 PolarHBondContact O-N 3.38Å; L91-V94 PolarHBondContact O-N 2.88Å; L91-L95 HydrophobicContact CD1-CD1 4.19Å; L91-L95 HydrophobicContact CD1-CG 4.28Å; L91-L95 HydrophobicContact CG-CD1 4.09Å; L91-L95 WeakPolarHBondContact O-CG 3.47Å; L91-L95 PolarHBondContact O-N 3.31Å
92L94.2Very high91.1Very high12 Ų1269.2 Ų69.26%0.06335%0.348CS..Hα-helixtrans-58.9-43.4179-70.5175.5000112.1F88 I89 L95 S96 L139 V142 R143F88-L92 HydrophobicContact CD1-CD1 3.92Å; F88-L92 HydrophobicContact CE1-CD1 3.62Å; F88-L92 HydrophobicContact CE1-CG 4.34Å; F88-L92 HydrophobicContact CZ-CD1 4.04Å; F88-L92 HydrophobicContact CZ-CD2 4.37Å; F88-L92 HydrophobicContact CZ-CG 4.35Å; F88-L92 VanDerWaalsContact O-CG 3.31Å; F88-L92 WeakPolarHBondContact O-CG 3.37Å; F88-L92 PolarHBondContact O-N 3.5Å; I89-L92 PolarHBondContact O-N 2.93Å; L92-L95 PolarHBondContact O-N 2.8Å; L92-S96 WeakPolarHBondContact O-CB 3.49Å; L92-S96 PolarHBondContact O-N 3.13Å; L92-L139 HydrophobicContact CD2-CD2 3.62Å; L92-V142 HydrophobicContact CD1-CB 4.33Å; L92-V142 HydrophobicContact CD1-CG1 3.8Å; L92-V142 HydrophobicContact CD2-CG1 4.19Å; L92-R143 HydrophobicContact CB-CB 4.48Å; L92-R143 HydrophobicContact CD1-CB 3.96Å
93S93.1Very high91.8Very high15 Ų1564.9 Ų64.911%0.10532%0.318CS..Hα-helixtrans-68.2-40.1179.5-64.90000112.5Y78 I89 R90 L91 S96 N97Y78-S93 WeakPolarHBondContact OH-CB 3.35Å; Y78-S93 PolarHBondContact OH-OG 2.88Å; I89-S93 WeakPolarHBondContact O-CB 3.47Å; I89-S93 PolarHBondContact O-N 3.41Å; I89-S93 PolarHBondContact O-OG 3.37Å; I89-S93 VanDerWaalsContact O-OG 3.07Å; R90-S93 PolarHBondContact O-N 3.4Å; L91-S93 VanDerWaalsContact C-N 3.32Å; L91-S93 PolarHBondContact O-N 3.38Å; S93-S96 PolarHBondContact O-N 3.33Å; S93-N97 VanDerWaalsContact O-CG 3.27Å; S93-N97 PolarHBondContact O-N 3.15Å; S93-N97 PolarHBondContact O-OD1 3.09Å
94V94.5Very high92.4Very high33 Ų3358 Ų5820%0.229%0.285CS..Hα-helixtrans-61.8-45.5173.5171.30000110.7Y78 R90 L91 S96 N97 M98Y78-V94 HydrophobicContact CE1-CG2 4.01Å; R90-V94 WeakPolarHBondContact O-CG2 3.42Å; R90-V94 PolarHBondContact O-N 2.81Å; L91-V94 PolarHBondContact O-N 2.88Å; V94-S96 VanDerWaalsContact C-N 3.31Å; V94-S96 PolarHBondContact O-N 3.38Å; V94-N97 PolarHBondContact O-N 2.97Å; V94-M98 HydrophobicContact CG1-SD 4.25Å; V94-M98 WeakPolarHBondContact O-CG 3.43Å; V94-M98 PolarHBondContact O-N 2.96Å
95L95.3Very high92.9Very high73 Ų7357.8 Ų57.838%0.38229%0.289SS..Hα-helixtrans-63.2-37.6176.7-69.1173.9000112.1L91 L92 M98 A99 L139L91-L95 HydrophobicContact CD1-CD1 4.19Å; L91-L95 HydrophobicContact CD1-CG 4.28Å; L91-L95 HydrophobicContact CG-CD1 4.09Å; L91-L95 WeakPolarHBondContact O-CG 3.47Å; L91-L95 PolarHBondContact O-N 3.31Å; L92-L95 PolarHBondContact O-N 2.8Å; L95-M98 PolarHBondContact O-N 3.45Å; L95-A99 WeakPolarHBondContact O-CB 3.36Å; L95-A99 PolarHBondContact O-N 3.24Å; L95-L139 HydrophobicContact CB-CD1 3.64Å; L95-L139 HydrophobicContact CB-CD2 4.22Å; L95-L139 HydrophobicContact CD1-CD2 4.28Å
96S94.2Very high93.7Very high22 Ų2249.2 Ų49.215%0.15425%0.25CS..Hα-helixtrans-63.5-48.3176.2-161.90000110.6L92 S93 V94 M98 A99 D100 S136L92-S96 WeakPolarHBondContact O-CB 3.49Å; L92-S96 PolarHBondContact O-N 3.13Å; S93-S96 PolarHBondContact O-N 3.33Å; V94-S96 VanDerWaalsContact C-N 3.31Å; V94-S96 PolarHBondContact O-N 3.38Å; S96-M98 VanDerWaalsContact C-N 3.29Å; S96-M98 PolarHBondContact O-N 3.3Å; S96-A99 WeakPolarHBondContact O-CB 3.28Å; S96-A99 PolarHBondContact O-N 3.38Å; S96-A99 VanDerWaalsContact O-N 3.12Å; S96-D100 VanDerWaalsContact O-CG 3.26Å; S96-D100 PolarHBondContact O-N 2.98Å; S96-S136 PolarHBondContact OG-OG 3.39Å
97N94Very high94Very high8 Ų848.4 Ų48.44%0.04325%0.246CC..Hα-helixtrans-61.3-38.6177.6-68.3-6.4000111.8Y74 T75 Y78 S93 V94 D100 Q101Y74-N97 WeakPolarHBondContact CE1-OD1 3.08Å; T75-N97 HydrophobicContact CG2-CB 4.2Å; Y78-N97 WeakPolarHBondContact CD1-ND2 3.4Å; S93-N97 VanDerWaalsContact O-CG 3.27Å; S93-N97 PolarHBondContact O-N 3.15Å; S93-N97 PolarHBondContact O-OD1 3.09Å; V94-N97 PolarHBondContact O-N 2.97Å; N97-D100 PolarHBondContact O-N 3.49Å; N97-Q101 VanDerWaalsContact O-CB 3.28Å; N97-Q101 WeakPolarHBondContact O-CB 3.26Å; N97-Q101 PolarHBondContact O-N 2.82Å
98M94.5Very high94.3Very high110 Ų11043.3 Ų43.354%0.54222%0.219SC..Hα-helixtrans-63.8-44.3174.2-72.2178.76800111.9V94 L95 S96 D100 Q101 L102V94-M98 HydrophobicContact CG1-SD 4.25Å; V94-M98 WeakPolarHBondContact O-CG 3.43Å; V94-M98 PolarHBondContact O-N 2.96Å; L95-M98 PolarHBondContact O-N 3.45Å; S96-M98 VanDerWaalsContact C-N 3.29Å; S96-M98 PolarHBondContact O-N 3.3Å; M98-D100 VanDerWaalsContact C-N 3.35Å; M98-Q101 PolarHBondContact O-N 3.48Å; M98-L102 WeakPolarHBondContact O-CG 3.17Å; M98-L102 PolarHBondContact O-N 2.87Å; M98-L102 VanDerWaalsContact O-N 3.11Å
99A95.6Very high94.6Very high4 Ų441.2 Ų41.23%0.03321%0.212CC..Hα-helixtrans-61.1-45176.600000111.2L95 S96 L102 Y103 L135L95-A99 WeakPolarHBondContact O-CB 3.36Å; L95-A99 PolarHBondContact O-N 3.24Å; S96-A99 WeakPolarHBondContact O-CB 3.28Å; S96-A99 PolarHBondContact O-N 3.38Å; S96-A99 VanDerWaalsContact O-N 3.12Å; A99-L102 PolarHBondContact O-N 3.37Å; A99-Y103 VanDerWaalsContact O-CB 3.31Å; A99-Y103 WeakPolarHBondContact O-CB 3.27Å; A99-Y103 PolarHBondContact O-N 3.34Å; A99-L135 HydrophobicContact CB-CD2 4.19Å; A99-L135 HydrophobicContact CB-CG 4.35Å
100D93.3Very high94.8Very high34 Ų3440.8 Ų40.818%0.18221%0.21CC..Hα-helixtrans-65.3-39.8178.5-65.5-22.2000111.7M71 S96 N97 M98 L102 Y103 Y104 S136M71-D100 HydrophobicContact CE-CB 3.47Å; M71-D100 VanDerWaalsContact CE-CB 3.47Å; M71-D100 HydrophobicContact SD-CB 4.07Å; S96-D100 VanDerWaalsContact O-CG 3.26Å; S96-D100 PolarHBondContact O-N 2.98Å; N97-D100 PolarHBondContact O-N 3.49Å; M98-D100 VanDerWaalsContact C-N 3.35Å; D100-L102 VanDerWaalsContact C-N 3.28Å; D100-L102 PolarHBondContact O-N 3.46Å; D100-Y103 WeakPolarHBondContact O-CB 3.37Å; D100-Y103 PolarHBondContact O-N 2.87Å; D100-Y104 WeakPolarHBondContact O-CD2 3.38Å; D100-Y104 PolarHBondContact O-N 2.96Å; D100-S136 VanDerWaalsContact OD1-CB 3.22Å; D100-S136 WeakPolarHBondContact OD1-CB 3.48Å; D100-S136 PolarHBondContact OD1-OG 3.16Å
101Q93.7Very high95Very high55 Ų5539.9 Ų39.926%0.25721%0.207SC..Hα-helixtrans-67.2-28.8177.9-163.466.642.700112.9N97 M98 P105N97-Q101 VanDerWaalsContact O-CB 3.28Å; N97-Q101 WeakPolarHBondContact O-CB 3.26Å; N97-Q101 PolarHBondContact O-N 2.82Å; M98-Q101 PolarHBondContact O-N 3.48Å; Q101-P105 WeakPolarHBondContact O-CD 3.48Å; Q101-P105 WeakPolarHBondContact O-CG 3.23Å
102L94.8Very high95.2Very high99 Ų9936 Ų3652%0.51819%0.188SC..Hα-helixtrans-83.7-30.3173.7-67.4173.2000112.1M98 A99 D100 P105 C106 L132M98-L102 WeakPolarHBondContact O-CG 3.17Å; M98-L102 PolarHBondContact O-N 2.87Å; M98-L102 VanDerWaalsContact O-N 3.11Å; A99-L102 PolarHBondContact O-N 3.37Å; D100-L102 VanDerWaalsContact C-N 3.28Å; D100-L102 PolarHBondContact O-N 3.46Å; L102-P105 WeakPolarHBondContact O-CD 3.44Å; L102-C106 PolarHBondContact O-N 3.26Å; L102-C106 PolarHBondContact O-SG 3.49Å; L102-L132 HydrophobicContact CB-CD1 3.71Å; L102-L132 HydrophobicContact CB-CD2 4.07Å; L102-L132 HydrophobicContact CD1-CD2 4.3Å
103Y94.9Very high95.3Very high25 Ų2535.5 Ų35.510%0.09819%0.186CC..Hα-helixtrans-59.8-52.2-178.3162.4-103.8000111.8R64 A99 D100 C106 E107 S129 W133R64-Y103 PolarHBondContact NH1-OH 3.29Å; A99-Y103 VanDerWaalsContact O-CB 3.31Å; A99-Y103 WeakPolarHBondContact O-CB 3.27Å; A99-Y103 PolarHBondContact O-N 3.34Å; D100-Y103 WeakPolarHBondContact O-CB 3.37Å; D100-Y103 PolarHBondContact O-N 2.87Å; Y103-C106 PolarHBondContact O-N 3.32Å; Y103-E107 VanDerWaalsContact CZ-OE2 3.3Å; Y103-E107 PolarHBondContact O-N 2.76Å; Y103-E107 VanDerWaalsContact OH-CD 3.28Å; Y103-E107 PolarHBondContact OH-OE1 2.87Å; Y103-E107 PolarHBondContact OH-OE2 2.95Å; Y103-S129 VanDerWaalsContact CD2-O 3.23Å; Y103-S129 WeakPolarHBondContact CD2-O 3.39Å; Y103-W133 HydrophobicContact CD2-CB 3.98Å; Y103-W133 HydrophobicContact CE2-CB 3.97Å; Y103-W133 HydrophobicContact CE2-CG 4.49Å
104Y93.5Very high95.4Very high42 Ų4238.9 Ų38.917%0.16520%0.203CC..Hα-helixtrans-59.9-51.1-175.6-68.5-76.4000112.8R64 D67 D68 M71 D100 C106 E107 H108R64-Y104 HydrophobicContact CB-CD1 4.39Å; R64-Y104 HydrophobicContact CB-CE1 4.22Å; R64-Y104 HydrophobicContact CG-CE1 4.1Å; D67-Y104 HydrophobicContact CB-CD1 4.18Å; D67-Y104 HydrophobicContact CB-CE1 3.67Å; D68-Y104 WeakPolarHBondContact OD1-CB 3.36Å; M71-Y104 HydrophobicContact CB-CD2 4.28Å; M71-Y104 HydrophobicContact CB-CE2 4.05Å; M71-Y104 HydrophobicContact CG-CD2 4.01Å; M71-Y104 HydrophobicContact CG-CE2 3.77Å; M71-Y104 HydrophobicContact SD-CE2 4.02Å; D100-Y104 WeakPolarHBondContact O-CD2 3.38Å; D100-Y104 PolarHBondContact O-N 2.96Å; Y104-C106 VanDerWaalsContact C-N 3.3Å; Y104-C106 PolarHBondContact O-N 2.89Å; Y104-E107 WeakPolarHBondContact O-CB 3.33Å; Y104-E107 PolarHBondContact O-N 3.25Å; Y104-E107 VanDerWaalsContact O-N 3.11Å; Y104-H108 PolarHBondContact O-CD2 3.49Å; Y104-H108 PolarHBondContact O-N 2.9Å
105P94.8Very high95.5Very high59 Ų5939.8 Ų39.838%0.38321%0.214SC..Hα-helixtrans-58.1-39.9176.4-26.534.9000113.5Q101 L102 E107 H108 V109Q101-P105 WeakPolarHBondContact O-CD 3.48Å; Q101-P105 WeakPolarHBondContact O-CG 3.23Å; L102-P105 WeakPolarHBondContact O-CD 3.44Å; P105-E107 VanDerWaalsContact C-N 3.32Å; P105-E107 PolarHBondContact O-N 2.92Å; P105-H108 PolarHBondContact O-N 3.04Å; P105-V109 WeakPolarHBondContact O-CG2 3.33Å; P105-V109 PolarHBondContact O-N 3.41Å
106C96.4Very high95.5Very high13 Ų1344.5 Ų44.59%0.08823%0.231CC..Hα-helixtrans-63.1-42.4177.8-67.50000111.4L102 Y103 Y104 V109 A110 W125 L128 L132L102-C106 PolarHBondContact O-N 3.26Å; L102-C106 PolarHBondContact O-SG 3.49Å; Y103-C106 PolarHBondContact O-N 3.32Å; Y104-C106 VanDerWaalsContact C-N 3.3Å; Y104-C106 PolarHBondContact O-N 2.89Å; C106-V109 PolarHBondContact O-N 3.01Å; C106-A110 PolarHBondContact O-N 3.37Å; C106-W125 HydrophobicContact CB-CE3 4.15Å; C106-L128 HydrophobicContact CB-CD2 4.48Å; C106-L128 HydrophobicContact CB-CG 4.43Å; C106-L128 VanDerWaalsContact SG-CD2 3.56Å; C106-L132 HydrophobicContact CB-CD1 4.38Å
107E96.3Very high95.7Very high4 Ų448.3 Ų48.32%0.01925%0.253CS..Hα-helixtrans-66.2-38176-177.3169.98800112.5T61 R64 Y103 Y104 P105 V109 A110 W111 W126T61-E107 HydrophobicContact CG2-CG 4.35Å; R64-E107 IonicContact CZ-OE1 2.88Å; R64-E107 IonicContact CZ-OE2 3.9Å; R64-E107 IonicContact NH1-OE1 3.01Å; R64-E107 PolarHBondContact NH1-OE1 3.42Å; R64-E107 IonicContact NH1-OE2 2.92Å; R64-E107 PolarHBondContact NH1-OE2 2.71Å; Y103-E107 VanDerWaalsContact CZ-OE2 3.3Å; Y103-E107 PolarHBondContact O-N 2.76Å; Y103-E107 VanDerWaalsContact OH-CD 3.28Å; Y103-E107 PolarHBondContact OH-OE1 2.87Å; Y103-E107 PolarHBondContact OH-OE2 2.95Å; Y104-E107 WeakPolarHBondContact O-CB 3.33Å; Y104-E107 PolarHBondContact O-N 3.25Å; Y104-E107 VanDerWaalsContact O-N 3.11Å; P105-E107 VanDerWaalsContact C-N 3.32Å; P105-E107 PolarHBondContact O-N 2.92Å; E107-V109 VanDerWaalsContact C-N 3.34Å; E107-V109 PolarHBondContact O-N 2.89Å; E107-A110 WeakPolarHBondContact O-CB 3.49Å; E107-A110 PolarHBondContact O-N 2.94Å; E107-W111 WeakPolarHBondContact O-CB 3.27Å; E107-W111 PolarHBondContact O-N 3.29Å; E107-W126 HydrophobicContact CG-CH2 4Å; E107-W126 HydrophobicContact CG-CZ3 3.81Å
108H96.6Very high95.7Very high33 Ų3351.5 Ų51.515%0.15327%0.27CS..Hα-helixtrans-64.8-40.7177.9-64.1-179.1000111.5R64 L65 D68 Y104 P105 W111 A112R64-H108 PolarHBondContact O-NE2 3.23Å; R64-H108 VanDerWaalsContact O-NE2 3.16Å; L65-H108 WeakPolarHBondContact CA-NE2 3.28Å; L65-H108 HydrophobicContact CD2-CB 4.18Å; L65-H108 WeakPolarHBondContact CD2-CD2 3.39Å; D68-H108 IonicContact OD1-CE1 3.4Å; D68-H108 PolarHBondContact OD1-CE1 3.12Å; D68-H108 IonicContact OD2-CE1 3.36Å; D68-H108 PolarHBondContact OD2-CE1 2.97Å; D68-H108 IonicContact OD2-ND1 3.91Å; Y104-H108 PolarHBondContact O-CD2 3.49Å; Y104-H108 PolarHBondContact O-N 2.9Å; P105-H108 PolarHBondContact O-N 3.04Å; H108-W111 PolarHBondContact O-N 3.36Å; H108-A112 VanDerWaalsContact O-CB 3.24Å; H108-A112 WeakPolarHBondContact O-CB 3.4Å; H108-A112 PolarHBondContact O-N 3.27Å
109V97.5Very high95.7Very high35 Ų3556 Ų5621%0.21229%0.29CS..Hα-helixtrans-64.6-41.6173.3178.80000110.8P105 C106 E107 A112 A113 L118 V120 W125P105-V109 WeakPolarHBondContact O-CG2 3.33Å; P105-V109 PolarHBondContact O-N 3.41Å; C106-V109 PolarHBondContact O-N 3.01Å; E107-V109 VanDerWaalsContact C-N 3.34Å; E107-V109 PolarHBondContact O-N 2.89Å; V109-A112 PolarHBondContact O-N 3.4Å; V109-A113 VanDerWaalsContact O-CB 3.32Å; V109-A113 WeakPolarHBondContact O-CB 3.44Å; V109-A113 PolarHBondContact O-N 2.88Å; V109-L118 HydrophobicContact CG1-CD1 4.15Å; V109-V120 HydrophobicContact CG1-CG2 3.86Å; V109-W125 HydrophobicContact CB-CD2 3.88Å; V109-W125 HydrophobicContact CB-CE3 3.97Å; V109-W125 HydrophobicContact CB-CG 4.2Å; V109-W125 HydrophobicContact CB-CZ3 4.39Å; V109-W125 HydrophobicContact CG1-CD2 3.48Å; V109-W125 VanDerWaalsContact CG1-CD2 3.48Å; V109-W125 VanDerWaalsContact CG1-CE2 3.41Å; V109-W125 HydrophobicContact CG1-CE3 4.05Å; V109-W125 HydrophobicContact CG1-CG 3.69Å; V109-W125 HydrophobicContact CG1-CH2 4.43Å; V109-W125 HydrophobicContact CG1-CZ2 3.92Å; V109-W125 HydrophobicContact CG1-CZ3 4.48Å; V109-W125 HydrophobicContact CG2-CZ3 4.45Å
110A97Very high95.7Very high0 Ų059.1 Ų59.10%031%0.308CS..Hα-helixtrans-60.4-48.3176.400000111.8C106 E107 A113 D114 W125 W126C106-A110 PolarHBondContact O-N 3.37Å; E107-A110 WeakPolarHBondContact O-CB 3.49Å; E107-A110 PolarHBondContact O-N 2.94Å; A110-A113 PolarHBondContact O-N 3.48Å; A110-D114 PolarHBondContact O-N 3.14Å; A110-W125 HydrophobicContact CB-CB 3.61Å; A110-W126 HydrophobicContact CB-CB 4.44Å; A110-W126 HydrophobicContact CB-CD2 3.6Å; A110-W126 HydrophobicContact CB-CE3 4.18Å; A110-W126 HydrophobicContact CB-CG 3.72Å; A110-W126 HydrophobicContact CB-CZ2 4.22Å
111W97.5Very high95.8Very high67 Ų6761 Ų6125%0.25432%0.318SS..Hα-helixtrans-61.8-44.9176.5173.485.9000112.1H58 T61 L65 E107 H108 A113 D114 A115H58-W111 AromaticContact CE1-CD1 3.85Å; H58-W111 AromaticContact CE1-NE1 3.68Å; T61-W111 HydrophobicContact CG2-CB 4.3Å; T61-W111 HydrophobicContact CG2-CG 4.38Å; L65-W111 HydrophobicContact CD1-CD2 3.99Å; L65-W111 HydrophobicContact CD1-CE3 3.87Å; L65-W111 HydrophobicContact CD1-CH2 3.83Å; L65-W111 HydrophobicContact CD1-CZ2 3.94Å; L65-W111 HydrophobicContact CD1-CZ3 3.79Å; L65-W111 HydrophobicContact CD2-CD2 4.3Å; L65-W111 HydrophobicContact CD2-CE3 4.12Å; E107-W111 WeakPolarHBondContact O-CB 3.27Å; E107-W111 PolarHBondContact O-N 3.29Å; H108-W111 PolarHBondContact O-N 3.36Å; W111-A113 VanDerWaalsContact C-N 3.29Å; W111-A113 PolarHBondContact O-N 3.15Å; W111-D114 PolarHBondContact O-N 2.8Å; W111-A115 WeakPolarHBondContact O-CB 3.33Å; W111-A115 PolarHBondContact O-N 3.2Å
112A97.1Very high95.9Very high12 Ų1259 Ų5910%0.09931%0.312CS..Hα-helixtrans-65.4-33.5178.900000112.2H108 V109 K116 V117 L118H108-A112 VanDerWaalsContact O-CB 3.24Å; H108-A112 WeakPolarHBondContact O-CB 3.4Å; H108-A112 PolarHBondContact O-N 3.27Å; V109-A112 PolarHBondContact O-N 3.4Å; A112-K116 PolarHBondContact O-N 3.26Å; A112-V117 HydrophobicContact CB-CB 4.28Å; A112-V117 WeakPolarHBondContact O-CB 3.42Å; A112-V117 PolarHBondContact O-N 3.31Å; A112-L118 HydrophobicContact CB-CD1 3.85Å; A112-L118 HydrophobicContact CB-CG 4Å; A112-L118 PolarHBondContact O-N 2.91Å
113A96.8Very high95.9Very high3 Ų357.2 Ų57.23%0.02531%0.311CS..Hα-helixtrans-68.5-41.7173.900000112.2V109 A110 W111 A115 K116 V120 A122V109-A113 VanDerWaalsContact O-CB 3.32Å; V109-A113 WeakPolarHBondContact O-CB 3.44Å; V109-A113 PolarHBondContact O-N 2.88Å; A110-A113 PolarHBondContact O-N 3.48Å; W111-A113 VanDerWaalsContact C-N 3.29Å; W111-A113 PolarHBondContact O-N 3.15Å; A113-A115 VanDerWaalsContact C-N 3.34Å; A113-K116 PolarHBondContact O-N 3.46Å; A113-K116 VanDerWaalsContact O-N 3.14Å; A113-V120 HydrophobicContact CB-CG2 3.66Å; A113-A122 HydrophobicContact CB-CB 3.7Å
114D95.8Very high96Very high86 Ų8664.7 Ų64.746%0.4634%0.339SS..Hα-helixtrans-63.1-40.9173.3-81.9-18.4000111.9A110 W111 K116 A122 W126A110-D114 PolarHBondContact O-N 3.14Å; W111-D114 PolarHBondContact O-N 2.8Å; D114-K116 PolarHBondContact O-N 2.93Å; D114-K116 VanDerWaalsContact O-N 3.17Å; D114-A122 VanDerWaalsContact OD1-CB 3.24Å; D114-A122 WeakPolarHBondContact OD1-CB 3.42Å; D114-W126 PolarHBondContact OD2-NE1 3.26Å
115A96Very high96.2Very high51 Ų5166.7 Ų66.742%0.42135%0.346SS..THydrogen-bonded Turntrans-720.5175.600000114W111 A113 V117W111-A115 WeakPolarHBondContact O-CB 3.33Å; W111-A115 PolarHBondContact O-N 3.2Å; A113-A115 VanDerWaalsContact C-N 3.34Å; A115-V117 HydrophobicContact CB-CG2 4.05Å; A115-V117 PolarHBondContact O-N 2.81Å
116K95.9Very high96.3Very high172 Ų17267.1 Ų67.175%0.74834%0.34SS*.THydrogen-bonded Turntrans60.619.6-177.8-50.6-57.8176.7-164.10114.5A112 A113 D114A112-K116 PolarHBondContact O-N 3.26Å; A113-K116 PolarHBondContact O-N 3.46Å; A113-K116 VanDerWaalsContact O-N 3.14Å; D114-K116 PolarHBondContact O-N 2.93Å; D114-K116 VanDerWaalsContact O-N 3.17Å
117V96.8Very high96.3Very high103 Ų10368.7 Ų68.762%0.62435%0.349SS*.SBendtrans-73.8-38.5171.7179.10000110A112 A115A112-V117 HydrophobicContact CB-CB 4.28Å; A112-V117 WeakPolarHBondContact O-CB 3.42Å; A112-V117 PolarHBondContact O-N 3.31Å; A115-V117 HydrophobicContact CB-CG2 4.05Å; A115-V117 PolarHBondContact O-N 2.81Å
118L95.6Very high96.4Very high75 Ų7572.3 Ų72.339%0.39337%0.368SS..SBendtrans-115.2139176.7-63.1178.2000111.2V109 A112 V120V109-L118 HydrophobicContact CG1-CD1 4.15Å; A112-L118 HydrophobicContact CB-CD1 3.85Å; A112-L118 HydrophobicContact CB-CG 4Å; A112-L118 PolarHBondContact O-N 2.91Å; L118-V120 VanDerWaalsContact C-N 3.32Å; L118-V120 HydrophobicContact CB-CG2 4.09Å; L118-V120 PolarHBondContact O-N 2.92Å
119Q94.9Very high96.4Very high205 Ų20570.8 Ų70.896%0.95836%0.361SS*.  trans-91.364.2174.2-63.7-169.6200111
120V95.7Very high96.3Very high68 Ų6869.7 Ų69.741%0.41236%0.355SS..SBendtrans-127.1165.8176.4-61.10000110.6V109 A113 L118 A122V109-V120 HydrophobicContact CG1-CG2 3.86Å; A113-V120 HydrophobicContact CB-CG2 3.66Å; L118-V120 VanDerWaalsContact C-N 3.32Å; L118-V120 HydrophobicContact CB-CG2 4.09Å; L118-V120 PolarHBondContact O-N 2.92Å; V120-A122 PolarHBondContact O-N 3.18Å; V120-A122 VanDerWaalsContact O-N 3.1Å
121D95.2Very high96.4Very high73 Ų7371.8 Ų71.839%0.3937%0.373SS..  trans-74.598.7179.7-174.7-18.1000111.1A123 R124 W125D121-A123 VanDerWaalsContact C-N 3.25Å; D121-A123 PolarHBondContact O-N 2.64Å; D121-A123 WeakPolarHBondContact OD1-CB 3.4Å; D121-A123 PolarHBondContact OD1-N 3.36Å; D121-R124 HydrophobicContact CB-CB 4.36Å; D121-R124 HydrophobicContact CB-CG 4.12Å; D121-R124 PolarHBondContact O-N 3.45Å; D121-R124 PolarHBondContact OD1-N 3.29Å; D121-R124 WeakPolarHBondContact OD2-CD 3.45Å; D121-R124 WeakPolarHBondContact OD2-CG 3.37Å; D121-R124 IonicContact OD2-CZ 3.47Å; D121-R124 IonicContact OD2-NE 3.66Å; D121-R124 PolarHBondContact OD2-NE 3.15Å; D121-R124 IonicContact OD2-NH2 3.74Å; D121-W125 PolarHBondContact O-N 3.26Å
122A95.3Very high96.4Very high15 Ų1569.7 Ų69.712%0.12437%0.366CS..Hα-helixtrans-56.1-37.8-18000000112.8A113 D114 V120 R124 W125 W126A113-A122 HydrophobicContact CB-CB 3.7Å; D114-A122 VanDerWaalsContact OD1-CB 3.24Å; D114-A122 WeakPolarHBondContact OD1-CB 3.42Å; V120-A122 PolarHBondContact O-N 3.18Å; V120-A122 VanDerWaalsContact O-N 3.1Å; A122-R124 VanDerWaalsContact C-N 3.33Å; A122-R124 PolarHBondContact O-N 3.01Å; A122-W125 PolarHBondContact O-N 3.44Å; A122-W126 WeakPolarHBondContact O-CB 3.49Å; A122-W126 PolarHBondContact O-N 2.95Å
123A95.4Very high96.4Very high61 Ų6171.1 Ų71.150%0.50437%0.369SS..Hα-helixtrans-65.8-36.6-176.100000111.9D121 T127D121-A123 VanDerWaalsContact C-N 3.25Å; D121-A123 PolarHBondContact O-N 2.64Å; D121-A123 WeakPolarHBondContact OD1-CB 3.4Å; D121-A123 PolarHBondContact OD1-N 3.36Å; A123-T127 WeakPolarHBondContact O-CB 3.26Å; A123-T127 PolarHBondContact O-N 3.19Å; A123-T127 PolarHBondContact O-OG1 3.34Å
124R96.3Very high96.4Very high182 Ų18272 Ų7269%0.68737%0.373SS*.Hα-helixtrans-65.1-44.3175-69179.1-162-163.2-3.9111.8D121 A122 T127 L128D121-R124 HydrophobicContact CB-CB 4.36Å; D121-R124 HydrophobicContact CB-CG 4.12Å; D121-R124 PolarHBondContact O-N 3.45Å; D121-R124 PolarHBondContact OD1-N 3.29Å; D121-R124 WeakPolarHBondContact OD2-CD 3.45Å; D121-R124 WeakPolarHBondContact OD2-CG 3.37Å; D121-R124 IonicContact OD2-CZ 3.47Å; D121-R124 IonicContact OD2-NE 3.66Å; D121-R124 PolarHBondContact OD2-NE 3.15Å; D121-R124 IonicContact OD2-NH2 3.74Å; A122-R124 VanDerWaalsContact C-N 3.33Å; A122-R124 PolarHBondContact O-N 3.01Å; R124-T127 PolarHBondContact O-N 3.46Å; R124-L128 WeakPolarHBondContact O-CB 3.36Å; R124-L128 PolarHBondContact O-N 3.24Å
125W97.4Very high96.5Very high84 Ų8471.8 Ų71.832%0.31837%0.371SS..Hα-helixtrans-68.4-39.5179.9-71.3105.1000112.2C106 V109 A110 D121 A122 T127 L128 S129C106-W125 HydrophobicContact CB-CE3 4.15Å; V109-W125 HydrophobicContact CB-CD2 3.88Å; V109-W125 HydrophobicContact CB-CE3 3.97Å; V109-W125 HydrophobicContact CB-CG 4.2Å; V109-W125 HydrophobicContact CB-CZ3 4.39Å; V109-W125 HydrophobicContact CG1-CD2 3.48Å; V109-W125 VanDerWaalsContact CG1-CD2 3.48Å; V109-W125 VanDerWaalsContact CG1-CE2 3.41Å; V109-W125 HydrophobicContact CG1-CE3 4.05Å; V109-W125 HydrophobicContact CG1-CG 3.69Å; V109-W125 HydrophobicContact CG1-CH2 4.43Å; V109-W125 HydrophobicContact CG1-CZ2 3.92Å; V109-W125 HydrophobicContact CG1-CZ3 4.48Å; V109-W125 HydrophobicContact CG2-CZ3 4.45Å; A110-W125 HydrophobicContact CB-CB 3.61Å; D121-W125 PolarHBondContact O-N 3.26Å; A122-W125 PolarHBondContact O-N 3.44Å; W125-T127 VanDerWaalsContact C-N 3.33Å; W125-T127 PolarHBondContact O-N 3.45Å; W125-L128 HydrophobicContact CE3-CD2 4.23Å; W125-L128 HydrophobicContact CZ3-CD2 4.2Å; W125-L128 PolarHBondContact O-N 3.02Å; W125-S129 PolarHBondContact O-N 3.32Å; W125-S129 PolarHBondContact O-OG 3.48Å
126W96.9Very high96.6Very high67 Ų6770 Ų7025%0.25436%0.356SS..Hα-helixtrans-61.3-40.4170.4-81.9122.2000112.8T61 E107 A110 D114 A122 S129 T130T61-W126 HydrophobicContact CG2-CH2 3.7Å; T61-W126 HydrophobicContact CG2-CZ2 4.39Å; E107-W126 HydrophobicContact CG-CH2 4Å; E107-W126 HydrophobicContact CG-CZ3 3.81Å; A110-W126 HydrophobicContact CB-CB 4.44Å; A110-W126 HydrophobicContact CB-CD2 3.6Å; A110-W126 HydrophobicContact CB-CE3 4.18Å; A110-W126 HydrophobicContact CB-CG 3.72Å; A110-W126 HydrophobicContact CB-CZ2 4.22Å; D114-W126 PolarHBondContact OD2-NE1 3.26Å; A122-W126 WeakPolarHBondContact O-CB 3.49Å; A122-W126 PolarHBondContact O-N 2.95Å; W126-S129 PolarHBondContact O-OG 2.93Å; W126-S129 VanDerWaalsContact O-OG 3.04Å; W126-T130 VanDerWaalsContact O-CB 3.26Å; W126-T130 WeakPolarHBondContact O-CB 3.31Å; W126-T130 PolarHBondContact O-N 3.01Å; W126-T130 PolarHBondContact O-OG1 3.44Å
127T96.8Very high96.6Very high46 Ų4662.3 Ų62.328%0.28232%0.323SS..Hα-helixtrans-64.8-43.2176.2-59.60000110.8A123 R124 W125 T130 A131 L199 P200A123-T127 WeakPolarHBondContact O-CB 3.26Å; A123-T127 PolarHBondContact O-N 3.19Å; A123-T127 PolarHBondContact O-OG1 3.34Å; R124-T127 PolarHBondContact O-N 3.46Å; W125-T127 VanDerWaalsContact C-N 3.33Å; W125-T127 PolarHBondContact O-N 3.45Å; T127-T130 PolarHBondContact O-N 2.92Å; T127-A131 WeakPolarHBondContact O-CB 3.35Å; T127-A131 PolarHBondContact O-N 3.43Å; T127-L199 HydrophobicContact CG2-CD2 4.28Å; T127-P200 HydrophobicContact CG2-CG 3.74Å
128L97.3Very high96.7Very high80 Ų8061.2 Ų61.242%0.41931%0.313SS..Hα-helixtrans-65.8-46179.4-178.759.8000112C106 R124 W125 T130 A131 L132C106-L128 HydrophobicContact CB-CD2 4.48Å; C106-L128 HydrophobicContact CB-CG 4.43Å; C106-L128 VanDerWaalsContact SG-CD2 3.56Å; R124-L128 WeakPolarHBondContact O-CB 3.36Å; R124-L128 PolarHBondContact O-N 3.24Å; W125-L128 HydrophobicContact CE3-CD2 4.23Å; W125-L128 HydrophobicContact CZ3-CD2 4.2Å; W125-L128 PolarHBondContact O-N 3.02Å; L128-T130 VanDerWaalsContact C-N 3.34Å; L128-T130 PolarHBondContact O-N 3.05Å; L128-A131 PolarHBondContact O-N 3.26Å; L128-L132 HydrophobicContact CD1-CD1 4.46Å; L128-L132 HydrophobicContact CG-CD1 4.28Å; L128-L132 WeakPolarHBondContact O-CG 3.4Å; L128-L132 PolarHBondContact O-N 3.31Å
129S97Very high96.8Very high1 Ų158.7 Ų58.71%0.00730%0.3CS..Hα-helixtrans-61.6-44.2175.3660000110.6Y103 W125 W126 A131 L132 W133Y103-S129 VanDerWaalsContact CD2-O 3.23Å; Y103-S129 WeakPolarHBondContact CD2-O 3.39Å; W125-S129 PolarHBondContact O-N 3.32Å; W125-S129 PolarHBondContact O-OG 3.48Å; W126-S129 PolarHBondContact O-OG 2.93Å; W126-S129 VanDerWaalsContact O-OG 3.04Å; S129-A131 VanDerWaalsContact C-N 3.32Å; S129-A131 PolarHBondContact O-N 3.29Å; S129-L132 PolarHBondContact O-N 3.49Å; S129-W133 WeakPolarHBondContact O-CB 3.44Å; S129-W133 PolarHBondContact O-N 3.05Å
130T96.7Very high96.8Very high13 Ų1349.2 Ų49.28%0.0826%0.257CS..Hα-helixtrans-60.7-40.3175.9-56.40000112W126 T127 L128 W133 I134 A195 W198 L199W126-T130 VanDerWaalsContact O-CB 3.26Å; W126-T130 WeakPolarHBondContact O-CB 3.31Å; W126-T130 PolarHBondContact O-N 3.01Å; W126-T130 PolarHBondContact O-OG1 3.44Å; T127-T130 PolarHBondContact O-N 2.92Å; L128-T130 VanDerWaalsContact C-N 3.34Å; L128-T130 PolarHBondContact O-N 3.05Å; T130-W133 PolarHBondContact O-N 3.31Å; T130-I134 HydrophobicContact CG2-CD1 4.18Å; T130-I134 VanDerWaalsContact O-CG1 3.3Å; T130-I134 WeakPolarHBondContact O-CG1 3.5Å; T130-I134 PolarHBondContact O-N 3.27Å; T130-A195 VanDerWaalsContact CG2-O 3.28Å; T130-A195 WeakPolarHBondContact CG2-O 3.44Å; T130-W198 HydrophobicContact CG2-CB 4.25Å; T130-L199 HydrophobicContact CG2-CD2 3.93Å; T130-L199 HydrophobicContact CG2-CG 4.2Å
131A97.4Very high96.9Very high44 Ų4446.8 Ų46.836%0.36424%0.242SC..Hα-helixtrans-65.7-40.817700000112.7T127 L128 S129 W133 I134 L135T127-A131 WeakPolarHBondContact O-CB 3.35Å; T127-A131 PolarHBondContact O-N 3.43Å; L128-A131 PolarHBondContact O-N 3.26Å; S129-A131 VanDerWaalsContact C-N 3.32Å; S129-A131 PolarHBondContact O-N 3.29Å; A131-W133 VanDerWaalsContact C-N 3.34Å; A131-I134 PolarHBondContact O-N 2.99Å; A131-L135 PolarHBondContact O-N 3.43Å
132L97.6Very high97Very high22 Ų2246.2 Ų46.212%0.11524%0.241CC..Hα-helixtrans-64.6-40.3174.2-71.7165.7000111.5L102 C106 L128 S129 L135 S136L102-L132 HydrophobicContact CB-CD1 3.71Å; L102-L132 HydrophobicContact CB-CD2 4.07Å; L102-L132 HydrophobicContact CD1-CD2 4.3Å; C106-L132 HydrophobicContact CB-CD1 4.38Å; L128-L132 HydrophobicContact CD1-CD1 4.46Å; L128-L132 HydrophobicContact CG-CD1 4.28Å; L128-L132 WeakPolarHBondContact O-CG 3.4Å; L128-L132 PolarHBondContact O-N 3.31Å; S129-L132 PolarHBondContact O-N 3.49Å; L132-L135 WeakPolarHBondContact O-CB 3.41Å; L132-L135 PolarHBondContact O-N 3.48Å; L132-S136 PolarHBondContact O-N 3.43Å
133W97.4Very high97Very high43 Ų4348.3 Ų48.316%0.16325%0.246CC..Hα-helixtrans-63.7-43.2174.8-176.138.7000111.9Y103 S129 T130 A131 L135 S136 L137 D191 A195 W198Y103-W133 HydrophobicContact CD2-CB 3.98Å; Y103-W133 HydrophobicContact CE2-CB 3.97Å; Y103-W133 HydrophobicContact CE2-CG 4.49Å; S129-W133 WeakPolarHBondContact O-CB 3.44Å; S129-W133 PolarHBondContact O-N 3.05Å; T130-W133 PolarHBondContact O-N 3.31Å; A131-W133 VanDerWaalsContact C-N 3.34Å; W133-L135 VanDerWaalsContact C-N 3.32Å; W133-L135 PolarHBondContact O-N 3.29Å; W133-S136 PolarHBondContact O-N 3.02Å; W133-L137 HydrophobicContact CD2-CD1 4.05Å; W133-L137 HydrophobicContact CG-CD1 4.29Å; W133-L137 HydrophobicContact CZ2-CD1 4.09Å; W133-L137 VanDerWaalsContact O-CG 3.3Å; W133-L137 WeakPolarHBondContact O-CG 3.31Å; W133-L137 PolarHBondContact O-N 2.95Å; W133-D191 HydrophobicContact CH2-CB 4.47Å; W133-D191 HydrophobicContact CZ2-CB 4.01Å; W133-A195 HydrophobicContact CD2-CB 4.21Å; W133-A195 HydrophobicContact CE3-CB 3.48Å; W133-A195 VanDerWaalsContact CE3-CB 3.48Å; W133-A195 HydrophobicContact CH2-CB 4.11Å; W133-A195 HydrophobicContact CZ3-CB 3.39Å; W133-W198 HydrophobicContact CE3-CE3 4.36Å; W133-W198 HydrophobicContact CE3-CZ3 4.26Å; W133-W198 HydrophobicContact CH2-CE3 4.34Å; W133-W198 HydrophobicContact CH2-CH2 4.34Å; W133-W198 AromaticContact CH2-CZ3 3.65Å; W133-W198 HydrophobicContact CH2-CZ3 3.65Å; W133-W198 AromaticContact CZ3-CE3 3.53Å; W133-W198 HydrophobicContact CZ3-CE3 3.53Å; W133-W198 HydrophobicContact CZ3-CH2 4.29Å; W133-W198 AromaticContact CZ3-CZ3 3.23Å; W133-W198 HydrophobicContact CZ3-CZ3 3.23Å
134I97.9Very high97Very high20 Ų2045.4 Ų45.410%0.10322%0.222CC..Hα-helixtrans-57.8-44.6172.6-73.8167.9000111.3T130 A131 L137 L138 L192 A195 V196 L199T130-I134 HydrophobicContact CG2-CD1 4.18Å; T130-I134 VanDerWaalsContact O-CG1 3.3Å; T130-I134 WeakPolarHBondContact O-CG1 3.5Å; T130-I134 PolarHBondContact O-N 3.27Å; A131-I134 PolarHBondContact O-N 2.99Å; I134-L137 PolarHBondContact O-N 2.92Å; I134-L138 HydrophobicContact CG2-CD1 3.94Å; I134-L138 HydrophobicContact CG2-CG 4.36Å; I134-L138 WeakPolarHBondContact O-CB 3.28Å; I134-L138 WeakPolarHBondContact O-CG 3.47Å; I134-L138 PolarHBondContact O-N 3.4Å; I134-L192 HydrophobicContact CB-CD1 4.35Å; I134-L192 HydrophobicContact CG1-CD1 4.28Å; I134-L192 HydrophobicContact CG2-CD1 3.82Å; I134-A195 HydrophobicContact CD1-CB 4.18Å; I134-A195 HydrophobicContact CG1-CB 3.5Å; I134-A195 VanDerWaalsContact CG1-CB 3.5Å; I134-V196 HydrophobicContact CD1-CG2 4.06Å; I134-L199 HydrophobicContact CD1-CD1 3.45Å; I134-L199 VanDerWaalsContact CD1-CD1 3.45Å; I134-L199 HydrophobicContact CD1-CD2 4.12Å; I134-L199 HydrophobicContact CD1-CG 3.71Å
135L97.8Very high96.9Very high83 Ų8340.6 Ų40.644%0.43521%0.21SC..Hα-helixtrans-59.6-47.4177.417761.7000111.2A99 A131 L132 W133 L137 L138 L139A99-L135 HydrophobicContact CB-CD2 4.19Å; A99-L135 HydrophobicContact CB-CG 4.35Å; A131-L135 PolarHBondContact O-N 3.43Å; L132-L135 WeakPolarHBondContact O-CB 3.41Å; L132-L135 PolarHBondContact O-N 3.48Å; W133-L135 VanDerWaalsContact C-N 3.32Å; W133-L135 PolarHBondContact O-N 3.29Å; L135-L137 PolarHBondContact O-N 2.95Å; L135-L138 PolarHBondContact O-N 3.3Å; L135-L139 HydrophobicContact CD1-CD1 4.21Å; L135-L139 HydrophobicContact CD1-CG 4.27Å; L135-L139 HydrophobicContact CG-CD1 4.06Å; L135-L139 VanDerWaalsContact O-CG 3.26Å; L135-L139 WeakPolarHBondContact O-CG 3.41Å; L135-L139 PolarHBondContact O-N 3.5Å
136S96.9Very high96.8Very high14 Ų1441.8 Ų41.810%0.09821%0.214CC..Hα-helixtrans-58.5-45.1176.3-175.90000111.7S96 D100 L132 W133 L138 L139 G140S96-S136 PolarHBondContact OG-OG 3.39Å; D100-S136 VanDerWaalsContact OD1-CB 3.22Å; D100-S136 WeakPolarHBondContact OD1-CB 3.48Å; D100-S136 PolarHBondContact OD1-OG 3.16Å; L132-S136 PolarHBondContact O-N 3.43Å; W133-S136 PolarHBondContact O-N 3.02Å; S136-L138 PolarHBondContact O-N 2.7Å; S136-L139 PolarHBondContact O-N 3.26Å; S136-G140 PolarHBondContact O-N 3.23Å
137L97.4Very high96.5Very high10 Ų1039 Ų395%0.05221%0.205CC..Hα-helixtrans-61.9-43.3176.4-69.6168.5000112.5W133 I134 L135 G140 V141 N188 D191 L192 A195W133-L137 HydrophobicContact CD2-CD1 4.05Å; W133-L137 HydrophobicContact CG-CD1 4.29Å; W133-L137 HydrophobicContact CZ2-CD1 4.09Å; W133-L137 VanDerWaalsContact O-CG 3.3Å; W133-L137 WeakPolarHBondContact O-CG 3.31Å; W133-L137 PolarHBondContact O-N 2.95Å; I134-L137 PolarHBondContact O-N 2.92Å; L135-L137 PolarHBondContact O-N 2.95Å; L137-G140 PolarHBondContact O-N 3.39Å; L137-V141 WeakPolarHBondContact O-CG2 3.42Å; L137-V141 PolarHBondContact O-N 3.28Å; L137-N188 HydrophobicContact CD2-CB 4.23Å; L137-D191 HydrophobicContact CD1-CB 4.01Å; L137-D191 HydrophobicContact CD2-CB 3.77Å; L137-L192 HydrophobicContact CB-CB 4.39Å; L137-L192 HydrophobicContact CB-CD1 4.27Å; L137-L192 HydrophobicContact CD1-CB 4.27Å; L137-A195 HydrophobicContact CD1-CB 3.99Å
138L97.8Very high96.2Very high80 Ų8037.5 Ų37.542%0.41920%0.197SC..Hα-helixtrans-63.5-45176.9-74.5172.6000111.7I134 L135 S136 G140 V141 V142 L192I134-L138 HydrophobicContact CG2-CD1 3.94Å; I134-L138 HydrophobicContact CG2-CG 4.36Å; I134-L138 WeakPolarHBondContact O-CB 3.28Å; I134-L138 WeakPolarHBondContact O-CG 3.47Å; I134-L138 PolarHBondContact O-N 3.4Å; L135-L138 PolarHBondContact O-N 3.3Å; S136-L138 PolarHBondContact O-N 2.7Å; L138-G140 VanDerWaalsContact C-N 3.29Å; L138-G140 PolarHBondContact O-N 3.05Å; L138-V141 PolarHBondContact O-N 3.28Å; L138-V142 WeakPolarHBondContact O-CG2 3.37Å; L138-V142 PolarHBondContact O-N 3.19Å; L138-L192 HydrophobicContact CD2-CD1 4.3Å; L138-L192 HydrophobicContact CD2-CD2 3.67Å; L138-L192 HydrophobicContact CG-CD1 4.2Å; L138-L192 HydrophobicContact CG-CD2 4.4Å
139L97.2Very high96Very high21 Ų2138.2 Ų38.211%0.1120%0.201CC..Hα-helixtrans-59.5-42.5174.8-68.4168.9000110.9L92 L95 L135 S136 V142 R143L92-L139 HydrophobicContact CD2-CD2 3.62Å; L95-L139 HydrophobicContact CB-CD1 3.64Å; L95-L139 HydrophobicContact CB-CD2 4.22Å; L95-L139 HydrophobicContact CD1-CD2 4.28Å; L135-L139 HydrophobicContact CD1-CD1 4.21Å; L135-L139 HydrophobicContact CD1-CG 4.27Å; L135-L139 HydrophobicContact CG-CD1 4.06Å; L135-L139 VanDerWaalsContact O-CG 3.26Å; L135-L139 WeakPolarHBondContact O-CG 3.41Å; L135-L139 PolarHBondContact O-N 3.5Å; S136-L139 PolarHBondContact O-N 3.26Å; L139-V142 PolarHBondContact O-N 3.48Å; L139-R143 WeakPolarHBondContact O-CB 3.33Å; L139-R143 PolarHBondContact O-N 3.28Å
140G96.1Very high95.6Very high7 Ų741.2 Ų41.27%0.07221%0.214CC..Hα-helixtrans-61.4-43.7174.200000113.5S136 L137 L138 R143 S144S136-G140 PolarHBondContact O-N 3.23Å; L137-G140 PolarHBondContact O-N 3.39Å; L138-G140 VanDerWaalsContact C-N 3.29Å; L138-G140 PolarHBondContact O-N 3.05Å; G140-R143 PolarHBondContact O-N 3.23Å; G140-S144 PolarHBondContact O-N 2.91Å; G140-S144 PolarHBondContact O-OG 3.1Å
141V97.3Very high95.1Very high16 Ų1641.3 Ų41.310%0.09721%0.213CC..Hα-helixtrans-59.5-49.4174.7164.40000110.8L137 L138 R143 S144 L145 L185 N188 L189L137-V141 WeakPolarHBondContact O-CG2 3.42Å; L137-V141 PolarHBondContact O-N 3.28Å; L138-V141 PolarHBondContact O-N 3.28Å; V141-R143 VanDerWaalsContact C-N 3.34Å; V141-R143 PolarHBondContact O-N 3.29Å; V141-S144 PolarHBondContact O-N 3.38Å; V141-L145 HydrophobicContact CG1-CD1 3.85Å; V141-L145 WeakPolarHBondContact O-CB 3.3Å; V141-L145 WeakPolarHBondContact O-CG 3.37Å; V141-L145 PolarHBondContact O-N 3.03Å; V141-L185 HydrophobicContact CB-CD1 4.16Å; V141-L185 HydrophobicContact CG1-CD1 3.71Å; V141-L185 HydrophobicContact CG2-CD1 4.12Å; V141-N188 HydrophobicContact CG2-CB 3.77Å; V141-L189 HydrophobicContact CG1-CD2 4.31Å; V141-L189 HydrophobicContact CG2-CD2 3.92Å; V141-L189 HydrophobicContact CG2-CG 4.15Å
142V97.3Very high94.6Very high61 Ų6145.1 Ų45.137%0.3722%0.218SC..Hα-helixtrans-61.9-43.6178.9176.20000110.6F88 L92 L138 L139 L145 W146F88-V142 HydrophobicContact CE1-CG1 3.98Å; F88-V142 HydrophobicContact CZ-CG1 4.02Å; L92-V142 HydrophobicContact CD1-CB 4.33Å; L92-V142 HydrophobicContact CD1-CG1 3.8Å; L92-V142 HydrophobicContact CD2-CG1 4.19Å; L138-V142 WeakPolarHBondContact O-CG2 3.37Å; L138-V142 PolarHBondContact O-N 3.19Å; L139-V142 PolarHBondContact O-N 3.48Å; V142-L145 PolarHBondContact O-N 3.48Å; V142-W146 WeakPolarHBondContact O-CB 3.29Å; V142-W146 PolarHBondContact O-N 3.04Å
143R95Very high94Very high60 Ų6050.6 Ų50.623%0.22624%0.243CC..Hα-helixtrans-60.5-48.1178-171.1-171.266.671.27.7111.8I89 L92 L139 G140 V141 W146 T147 E181I89-R143 HydrophobicContact CG2-CG 4.11Å; L92-R143 HydrophobicContact CB-CB 4.48Å; L92-R143 HydrophobicContact CD1-CB 3.96Å; L139-R143 WeakPolarHBondContact O-CB 3.33Å; L139-R143 PolarHBondContact O-N 3.28Å; G140-R143 PolarHBondContact O-N 3.23Å; V141-R143 VanDerWaalsContact C-N 3.34Å; V141-R143 PolarHBondContact O-N 3.29Å; R143-W146 PolarHBondContact O-N 3.47Å; R143-T147 WeakPolarHBondContact O-CB 3.33Å; R143-T147 PolarHBondContact O-N 3.48Å; R143-T147 PolarHBondContact O-OG1 3.3Å; R143-E181 IonicContact NH1-OE1 3.75Å; R143-E181 PolarHBondContact NH1-OE1 3.43Å; R143-E181 IonicContact NH1-OE2 3.75Å; R143-E181 IonicContact NH2-OE2 2.79Å
144S94.7Very high93.2Very high0 Ų053.5 Ų53.50%026%0.26CS..Hα-helixtrans-67.4-38.8-179.9-73.60000112.5G140 V141 A148 E181G140-S144 PolarHBondContact O-N 2.91Å; G140-S144 PolarHBondContact O-OG 3.1Å; V141-S144 PolarHBondContact O-N 3.38Å; S144-A148 VanDerWaalsContact O-CB 3.26Å; S144-A148 WeakPolarHBondContact O-CB 3.46Å; S144-A148 PolarHBondContact O-N 2.82Å; S144-E181 WeakPolarHBondContact CA-OE2 3.44Å; S144-E181 VanDerWaalsContact CB-OE2 3.3Å; S144-E181 WeakPolarHBondContact CB-OE2 3.5Å; S144-E181 PolarHBondContact OG-OE2 3.27Å
145L95.1Very high92.2Very high80 Ų8055.6 Ų55.642%0.41927%0.271SS..Hα-helixtrans-62.9-48.5173.3-75.9170.7000111.7V141 V142 T147 A148 L149 L185V141-L145 HydrophobicContact CG1-CD1 3.85Å; V141-L145 WeakPolarHBondContact O-CB 3.3Å; V141-L145 WeakPolarHBondContact O-CG 3.37Å; V141-L145 PolarHBondContact O-N 3.03Å; V142-L145 PolarHBondContact O-N 3.48Å; L145-T147 PolarHBondContact O-N 2.87Å; L145-A148 PolarHBondContact O-N 3.11Å; L145-L149 WeakPolarHBondContact O-CB 3.27Å; L145-L149 VanDerWaalsContact O-CG 3.29Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 2.59Å; L145-L185 HydrophobicContact CD1-CD1 4.41Å; L145-L185 HydrophobicContact CD2-CD1 4.29Å; L145-L185 HydrophobicContact CD2-CD2 3.62Å; L145-L185 HydrophobicContact CG-CD1 3.95Å; L145-L185 HydrophobicContact CG-CD2 4.15Å
146W94.6Very high91.1Very high110 Ų11061.3 Ų61.342%0.41729%0.287SS..Hα-helixtrans-59.2-47.4178.4-177.1-101.7000111.6D86 F88 V142 R143 A148 L149 K150D86-W146 PolarHBondContact OD2-NE1 3.18Å; F88-W146 HydrophobicContact CD1-CB 4.37Å; F88-W146 AromaticContact CD1-CD1 3.92Å; F88-W146 AromaticContact CD1-CD2 3.72Å; F88-W146 HydrophobicContact CD1-CD2 3.72Å; F88-W146 AromaticContact CD1-CE2 3.9Å; F88-W146 HydrophobicContact CD1-CE3 4.25Å; F88-W146 AromaticContact CD1-CG 3.76Å; F88-W146 HydrophobicContact CD1-CG 3.76Å; F88-W146 AromaticContact CD1-NE1 3.98Å; F88-W146 HydrophobicContact CE1-CB 4.33Å; F88-W146 HydrophobicContact CE1-CD2 4.07Å; F88-W146 HydrophobicContact CE1-CE3 4.23Å; F88-W146 HydrophobicContact CE1-CG 4.12Å; V142-W146 WeakPolarHBondContact O-CB 3.29Å; V142-W146 PolarHBondContact O-N 3.04Å; R143-W146 PolarHBondContact O-N 3.47Å; W146-A148 PolarHBondContact O-N 3.03Å; W146-L149 PolarHBondContact O-N 2.69Å; W146-K150 WeakPolarHBondContact O-CB 3.45Å; W146-K150 PolarHBondContact O-N 2.85Å
147T91.7Very high89.5Confident8 Ų863.1 Ų63.15%0.04930%0.299CS..Hα-helixtrans-60.9-44.4178.2-54.40000111.2R143 L145 K150 L151 E181R143-T147 WeakPolarHBondContact O-CB 3.33Å; R143-T147 PolarHBondContact O-N 3.48Å; R143-T147 PolarHBondContact O-OG1 3.3Å; L145-T147 PolarHBondContact O-N 2.87Å; T147-K150 PolarHBondContact O-N 3.36Å; T147-L151 VanDerWaalsContact O-CB 3.31Å; T147-L151 WeakPolarHBondContact O-CB 3.37Å; T147-L151 PolarHBondContact O-N 2.97Å; T147-E181 HydrophobicContact CG2-CG 3.82Å
148A91.2Very high87.3Confident15 Ų1568.9 Ų68.912%0.12434%0.337CS..Hα-helixtrans-64.8-40177.700000112.5S144 L145 W146 L151 R152S144-A148 VanDerWaalsContact O-CB 3.26Å; S144-A148 WeakPolarHBondContact O-CB 3.46Å; S144-A148 PolarHBondContact O-N 2.82Å; L145-A148 PolarHBondContact O-N 3.11Å; W146-A148 PolarHBondContact O-N 3.03Å; A148-L151 PolarHBondContact O-N 3.28Å; A148-R152 WeakPolarHBondContact O-CB 3.42Å; A148-R152 VanDerWaalsContact O-CG 3.29Å; A148-R152 WeakPolarHBondContact O-CG 3.25Å; A148-R152 PolarHBondContact O-N 2.58Å
149L91.1Very high85Confident94 Ų9469.3 Ų69.349%0.49234%0.344SS..Hα-helixtrans-64.2-47.5176.2-74.2176.9000111.6L145 W146 L151 R152 Q153L145-L149 WeakPolarHBondContact O-CB 3.27Å; L145-L149 VanDerWaalsContact O-CG 3.29Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 2.59Å; W146-L149 PolarHBondContact O-N 2.69Å; L149-L151 VanDerWaalsContact C-N 3.32Å; L149-L151 PolarHBondContact O-N 2.96Å; L149-R152 PolarHBondContact O-N 3.44Å; L149-Q153 WeakPolarHBondContact O-CG 3.35Å; L149-Q153 PolarHBondContact O-N 2.63Å
150K89.3Confident82.7Confident65 Ų6569.9 Ų69.928%0.28336%0.355SS..Hα-helixtrans-59.6-44177-171.4176.3-172.91750111.2D86 W146 T147 R152 Q153 M154D86-K150 IonicContact OD2-NZ 2.97Å; D86-K150 PolarHBondContact OD2-NZ 3.42Å; W146-K150 WeakPolarHBondContact O-CB 3.45Å; W146-K150 PolarHBondContact O-N 2.85Å; T147-K150 PolarHBondContact O-N 3.36Å; K150-R152 PolarHBondContact O-N 3.45Å; K150-Q153 PolarHBondContact O-N 3.32Å; K150-M154 HydrophobicContact CG-CE 4.3Å; K150-M154 WeakPolarHBondContact O-CG 3.44Å; K150-M154 PolarHBondContact O-N 2.95Å
151L86.9Confident80.4Confident14 Ų1473.4 Ų73.47%0.07338%0.383CS..Hα-helixtrans-66.9-38179.1-155.264.4000112.1T147 A148 L149 M154 L155 M174 R177 M178T147-L151 VanDerWaalsContact O-CB 3.31Å; T147-L151 WeakPolarHBondContact O-CB 3.37Å; T147-L151 PolarHBondContact O-N 2.97Å; A148-L151 PolarHBondContact O-N 3.28Å; L149-L151 VanDerWaalsContact C-N 3.32Å; L149-L151 PolarHBondContact O-N 2.96Å; L151-M154 PolarHBondContact O-N 3.14Å; L151-L155 WeakPolarHBondContact O-CG 3.32Å; L151-L155 PolarHBondContact O-N 3.46Å; L151-L155 VanDerWaalsContact O-N 3.08Å; L151-M174 HydrophobicContact CD1-CB 4.34Å; L151-M174 HydrophobicContact CD1-CE 3.62Å; L151-M174 HydrophobicContact CD1-CG 4.22Å; L151-M174 VanDerWaalsContact CD2-O 3.32Å; L151-M174 WeakPolarHBondContact CD2-O 3.3Å; L151-M174 HydrophobicContact CG-CE 4.24Å; L151-R177 HydrophobicContact CD2-CB 4.13Å; L151-R177 HydrophobicContact CD2-CG 4.27Å; L151-M178 HydrophobicContact CD2-CB 3.85Å
152R86.5Confident78.2Confident125 Ų12579.6 Ų79.647%0.47241%0.409SS..Hα-helixtrans-65.3-39.2172.2-78.3-178.8179.1-162.92.1112.6A148 L149 K150 L155 R156 M178A148-R152 WeakPolarHBondContact O-CB 3.42Å; A148-R152 VanDerWaalsContact O-CG 3.29Å; A148-R152 WeakPolarHBondContact O-CG 3.25Å; A148-R152 PolarHBondContact O-N 2.58Å; L149-R152 PolarHBondContact O-N 3.44Å; K150-R152 PolarHBondContact O-N 3.45Å; R152-L155 PolarHBondContact O-N 2.99Å; R152-R156 WeakPolarHBondContact O-CB 3.34Å; R152-R156 WeakPolarHBondContact O-CG 3.36Å; R152-R156 PolarHBondContact O-N 3.48Å; R152-M178 HydrophobicContact CG-SD 4.14Å
153Q85.6Confident76Confident136 Ų13679.3 Ų79.364%0.63641%0.407SS*.Hα-helixtrans-63.5-43.6175.2-74.3173.3-6.900111.1L149 K150 L155 R156 S157L149-Q153 WeakPolarHBondContact O-CG 3.35Å; L149-Q153 PolarHBondContact O-N 2.63Å; K150-Q153 PolarHBondContact O-N 3.32Å; Q153-L155 VanDerWaalsContact C-N 3.26Å; Q153-L155 PolarHBondContact O-N 3.4Å; Q153-R156 PolarHBondContact O-N 3.34Å; Q153-R156 VanDerWaalsContact O-N 3.11Å; Q153-S157 PolarHBondContact O-N 2.84Å
154M80.7Confident73.9Confident104 Ų10481.1 Ų81.151%0.51243%0.429SS..Hα-helixtrans-59.5-36.1173.9-70.7-178.3173.300112.6K150 L151 M174K150-M154 HydrophobicContact CG-CE 4.3Å; K150-M154 WeakPolarHBondContact O-CG 3.44Å; K150-M154 PolarHBondContact O-N 2.95Å; L151-M154 PolarHBondContact O-N 3.14Å; M154-M174 HydrophobicContact CB-CE 3.92Å
155L76.1Confident72.1Confident64 Ų6487.9 Ų87.934%0.33546%0.461SS..Hα-helixtrans-75-25.6176.2-72.8165.2000113.9L151 R152 Q153 M174L151-L155 WeakPolarHBondContact O-CG 3.32Å; L151-L155 PolarHBondContact O-N 3.46Å; L151-L155 VanDerWaalsContact O-N 3.08Å; R152-L155 PolarHBondContact O-N 2.99Å; Q153-L155 VanDerWaalsContact C-N 3.26Å; Q153-L155 PolarHBondContact O-N 3.4Å; L155-M174 HydrophobicContact CD2-CE 4.24Å; L155-M174 HydrophobicContact CG-CE 4.14Å
156R74.5Confident70.7Confident203 Ų20387 Ų8777%0.76646%0.456SS*.Hα-helixtrans-99.5-12.3-175.9-75.3-178.1175.4178.1-2.8114.5R152 Q153R152-R156 WeakPolarHBondContact O-CB 3.34Å; R152-R156 WeakPolarHBondContact O-CG 3.36Å; R152-R156 PolarHBondContact O-N 3.48Å; Q153-R156 PolarHBondContact O-N 3.34Å; Q153-R156 VanDerWaalsContact O-N 3.11Å
157S64.1Low69.7Low52 Ų5284.8 Ų84.836%0.36446%0.456SS..  trans-58.3136.6-174.5-172.60000112.3Q153 T159Q153-S157 PolarHBondContact O-N 2.84Å; S157-T159 PolarHBondContact O-N 3.39Å; S157-T159 PolarHBondContact OG-OG1 3.37Å
158P51.2Low69.1Low131 Ų13193.5 Ų93.585%0.85149%0.488SS*.SBendtrans-68.64.5-179.2-7.620.6000115G160P158-G160 PolarHBondContact O-N 3.39Å
159T49.1Very low68.5Low90 Ų9096.7 Ų96.755%0.55251%0.51SS*.  trans-67.636.8160.1-310000111S157 A161 F162 T163S157-T159 PolarHBondContact O-N 3.39Å; S157-T159 PolarHBondContact OG-OG1 3.37Å; T159-A161 PolarHBondContact O-N 3.12Å; T159-F162 HydrophobicContact CG2-CB 4.17Å; T159-F162 WeakPolarHBondContact O-CB 3.24Å; T159-F162 PolarHBondContact O-N 2.98Å; T159-T163 PolarHBondContact O-N 2.81Å
160G48.6Very low68.1Low33 Ų3398.2 Ų98.234%0.3451%0.512SS..Hα-helixtrans-63.9-21.9-171.400000113.7P158 F162 T163 S164P158-G160 PolarHBondContact O-N 3.39Å; G160-F162 VanDerWaalsContact C-N 3.26Å; G160-F162 PolarHBondContact O-N 2.93Å; G160-T163 VanDerWaalsContact CA-OG1 3.26Å; G160-T163 WeakPolarHBondContact CA-OG1 3.48Å; G160-T163 PolarHBondContact O-OG1 3.1Å; G160-S164 PolarHBondContact O-N 3.04Å; G160-S164 PolarHBondContact O-OG 3.37Å
161A47.8Very low67.6Low81 Ų81102 Ų10267%0.66953%0.525SS*.Hα-helixtrans-68.3-23.417200000112.9T159 S164T159-A161 PolarHBondContact O-N 3.12Å; A161-S164 PolarHBondContact O-OG 2.79Å
162F50.8Low67.5Low145 Ų145108.2 Ų108.264%0.63655%0.547SS*.Hα-helixtrans-93.3-29.2176.4-128-93.4000112.1T159 G160 Q165 L166T159-F162 HydrophobicContact CG2-CB 4.17Å; T159-F162 WeakPolarHBondContact O-CB 3.24Å; T159-F162 PolarHBondContact O-N 2.98Å; G160-F162 VanDerWaalsContact C-N 3.26Å; G160-F162 PolarHBondContact O-N 2.93Å; F162-Q165 CarbonylContact O-C 3.47Å; F162-Q165 WeakPolarHBondContact O-CA 3.24Å; F162-Q165 WeakPolarHBondContact O-CB 3.29Å; F162-Q165 PolarHBondContact O-N 2.95Å; F162-Q165 VanDerWaalsContact O-N 3.14Å; F162-L166 PolarHBondContact O-N 2.89Å; F162-L166 VanDerWaalsContact O-N 3.14Å
163T51.3Low67.5Low55 Ų55105.2 Ų105.234%0.33755%0.549SS..Hα-helixtrans-76-24.5177.252.40000114T159 G160 Q165 L166T159-T163 PolarHBondContact O-N 2.81Å; G160-T163 VanDerWaalsContact CA-OG1 3.26Å; G160-T163 WeakPolarHBondContact CA-OG1 3.48Å; G160-T163 PolarHBondContact O-OG1 3.1Å; T163-Q165 PolarHBondContact O-N 3.23Å; T163-L166 HydrophobicContact CG2-CD1 4.11Å; T163-L166 PolarHBondContact O-N 3.1Å
164S51.8Low67.4Low98 Ų98100.7 Ų100.769%0.68553%0.528SS*.THydrogen-bonded Turntrans-69-20166.258.40000112.3G160 A161G160-S164 PolarHBondContact O-N 3.04Å; G160-S164 PolarHBondContact O-OG 3.37Å; A161-S164 PolarHBondContact O-OG 2.79Å
165Q55.7Low67.7Low142 Ų14299.2 Ų99.266%0.66452%0.52SS*.THydrogen-bonded Turntrans-97.6-1.6175.1-67.7-169.2-21.900114F162 T163 P167F162-Q165 CarbonylContact O-C 3.47Å; F162-Q165 WeakPolarHBondContact O-CA 3.24Å; F162-Q165 WeakPolarHBondContact O-CB 3.29Å; F162-Q165 PolarHBondContact O-N 2.95Å; F162-Q165 VanDerWaalsContact O-N 3.14Å; T163-Q165 PolarHBondContact O-N 3.23Å; Q165-P167 WeakPolarHBondContact O-CD 3.29Å
166L65.6Low68.3Low62 Ų6298 Ų9833%0.32552%0.519SS..SBendtrans-66.2127.6175.6-111.8111.8000109.1F162 T163 R168 K170 M174F162-L166 PolarHBondContact O-N 2.89Å; F162-L166 VanDerWaalsContact O-N 3.14Å; T163-L166 HydrophobicContact CG2-CD1 4.11Å; T163-L166 PolarHBondContact O-N 3.1Å; L166-R168 PolarHBondContact O-N 2.93Å; L166-K170 HydrophobicContact CD2-CB 3.65Å; L166-K170 HydrophobicContact CD2-CD 4.03Å; L166-K170 HydrophobicContact CD2-CG 4.49Å; L166-M174 HydrophobicContact CD2-SD 4.39Å
167P74.3Confident69Low64 Ų6494.6 Ų94.642%0.41651%0.507SS..  trans-50.2135.4176.6-27.432.9000111Q165 S169 K170 R171Q165-P167 WeakPolarHBondContact O-CD 3.29Å; P167-S169 PolarHBondContact O-N 3.41Å; P167-K170 HydrophobicContact CB-CG 4.41Å; P167-K170 HydrophobicContact CG-CD 4.41Å; P167-K170 HydrophobicContact CG-CG 4.48Å; P167-K170 PolarHBondContact O-N 2.88Å; P167-R171 PolarHBondContact O-N 3.05Å
168R78.1Confident70.3Confident191 Ų19194.1 Ų94.172%0.72150%0.499SS*.Hα-helixtrans-51.1-30.9-179.7-167.1177-175.5-178.90.8112.4L166 R172L166-R168 PolarHBondContact O-N 2.93Å; R168-R172 WeakPolarHBondContact O-CG 3.47Å; R168-R172 PolarHBondContact O-N 2.76Å; R168-R172 VanDerWaalsContact O-N 3.12Å
169S80.1Confident72.2Confident82 Ų8295 Ų9557%0.57349%0.485SS*.Hα-helixtrans-62.6-48.2173.352.60000113P167 R171 R172 A173P167-S169 PolarHBondContact O-N 3.41Å; S169-R171 PolarHBondContact O-N 3.32Å; S169-R172 PolarHBondContact O-N 3.4Å; S169-A173 WeakPolarHBondContact O-CB 3.24Å; S169-A173 PolarHBondContact O-N 3.26Å
170K81.5Confident74.2Confident126 Ų12692.7 Ų92.755%0.54847%0.473SS..Hα-helixtrans-63.8-40.4178.4-70.4-166.8-177.2-177.60111.7L166 P167 A173 M174L166-K170 HydrophobicContact CD2-CB 3.65Å; L166-K170 HydrophobicContact CD2-CD 4.03Å; L166-K170 HydrophobicContact CD2-CG 4.49Å; P167-K170 HydrophobicContact CB-CG 4.41Å; P167-K170 HydrophobicContact CG-CD 4.41Å; P167-K170 HydrophobicContact CG-CG 4.48Å; P167-K170 PolarHBondContact O-N 2.88Å; K170-A173 PolarHBondContact O-N 3.48Å; K170-M174 WeakPolarHBondContact O-CG 3.48Å; K170-M174 PolarHBondContact O-N 3.16Å
171R79.9Confident76.4Confident144 Ų14491.9 Ų91.954%0.54346%0.46SS..Hα-helixtrans-61.8-46.6175.7-164.8-176.3-147.4-131.512.2111.8P167 S169 A173 M174 E175P167-R171 PolarHBondContact O-N 3.05Å; S169-R171 PolarHBondContact O-N 3.32Å; R171-A173 VanDerWaalsContact C-N 3.33Å; R171-A173 PolarHBondContact O-N 3.02Å; R171-M174 PolarHBondContact O-N 3.21Å; R171-E175 IonicContact NH1-OE1 3.28Å; R171-E175 WeakPolarHBondContact O-CG 3.43Å; R171-E175 PolarHBondContact O-N 3.2Å
172R84Confident78.6Confident145 Ų14590.3 Ų90.355%0.54744%0.442SS..Hα-helixtrans-60.9-41.1175.2-75.6176.3176.6178.6-1.9112R168 S169 E175 A176R168-R172 WeakPolarHBondContact O-CG 3.47Å; R168-R172 PolarHBondContact O-N 2.76Å; R168-R172 VanDerWaalsContact O-N 3.12Å; S169-R172 PolarHBondContact O-N 3.4Å; R172-E175 PolarHBondContact O-N 3.12Å; R172-A176 VanDerWaalsContact O-CB 3.27Å; R172-A176 WeakPolarHBondContact O-CB 3.03Å; R172-A176 PolarHBondContact O-N 3.32Å
173A86Confident80.7Confident62 Ų6284.3 Ų84.351%0.51242%0.417SS..Hα-helixtrans-63.2-42.1176.400000111.9S169 K170 R171 A176 R177S169-A173 WeakPolarHBondContact O-CB 3.24Å; S169-A173 PolarHBondContact O-N 3.26Å; K170-A173 PolarHBondContact O-N 3.48Å; R171-A173 VanDerWaalsContact C-N 3.33Å; R171-A173 PolarHBondContact O-N 3.02Å; A173-A176 PolarHBondContact O-N 3.4Å; A173-R177 WeakPolarHBondContact O-CB 3.43Å; A173-R177 PolarHBondContact O-N 3.2Å
174M85.1Confident82.8Confident40 Ų4082.9 Ų82.920%0.19741%0.408CS..Hα-helixtrans-64.1-46.2174.3-69.1176.37500111.9L151 M154 L155 L166 K170 R171 A176 R177 M178L151-M174 HydrophobicContact CD1-CB 4.34Å; L151-M174 HydrophobicContact CD1-CE 3.62Å; L151-M174 HydrophobicContact CD1-CG 4.22Å; L151-M174 VanDerWaalsContact CD2-O 3.32Å; L151-M174 WeakPolarHBondContact CD2-O 3.3Å; L151-M174 HydrophobicContact CG-CE 4.24Å; M154-M174 HydrophobicContact CB-CE 3.92Å; L155-M174 HydrophobicContact CD2-CE 4.24Å; L155-M174 HydrophobicContact CG-CE 4.14Å; L166-M174 HydrophobicContact CD2-SD 4.39Å; K170-M174 WeakPolarHBondContact O-CG 3.48Å; K170-M174 PolarHBondContact O-N 3.16Å; R171-M174 PolarHBondContact O-N 3.21Å; M174-A176 VanDerWaalsContact C-N 3.31Å; M174-A176 PolarHBondContact O-N 3.02Å; M174-R177 PolarHBondContact O-N 3.2Å; M174-M178 PolarHBondContact O-N 3.17Å
175E86.3Confident84.9Confident73 Ų7379.6 Ų79.634%0.34138%0.382SS..Hα-helixtrans-59.9-42.7175.5-73.3171-17200111.3R171 R172 R177 M178 W179R171-E175 IonicContact NH1-OE1 3.28Å; R171-E175 WeakPolarHBondContact O-CG 3.43Å; R171-E175 PolarHBondContact O-N 3.2Å; R172-E175 PolarHBondContact O-N 3.12Å; E175-R177 PolarHBondContact O-N 2.99Å; E175-M178 WeakPolarHBondContact O-CB 3.45Å; E175-M178 PolarHBondContact O-N 3.17Å; E175-W179 VanDerWaalsContact O-CD1 3.3Å; E175-W179 PolarHBondContact O-N 3.38Å
176A88.6Confident86.9Confident38 Ų3877 Ų7731%0.31437%0.373SS..Hα-helixtrans-63-40.8176.200000112.2R172 A173 M174 W179 S180 R231R172-A176 VanDerWaalsContact O-CB 3.27Å; R172-A176 WeakPolarHBondContact O-CB 3.03Å; R172-A176 PolarHBondContact O-N 3.32Å; A173-A176 PolarHBondContact O-N 3.4Å; M174-A176 VanDerWaalsContact C-N 3.31Å; M174-A176 PolarHBondContact O-N 3.02Å; A176-W179 PolarHBondContact O-N 2.78Å; A176-S180 PolarHBondContact O-N 3.31Å; A176-R231 PolarHBondContact O-NH2 3Å
177R89.4Confident88.3Confident133 Ų13374.2 Ų74.250%0.50236%0.358SS..Hα-helixtrans-64.4-43.7174.2-172.3173.5-175.81762.6111.3L151 A173 M174 E175 W179 S180 E181L151-R177 HydrophobicContact CD2-CB 4.13Å; L151-R177 HydrophobicContact CD2-CG 4.27Å; A173-R177 WeakPolarHBondContact O-CB 3.43Å; A173-R177 PolarHBondContact O-N 3.2Å; M174-R177 PolarHBondContact O-N 3.2Å; E175-R177 PolarHBondContact O-N 2.99Å; R177-W179 VanDerWaalsContact C-N 3.35Å; R177-W179 PolarHBondContact O-N 3.38Å; R177-S180 WeakPolarHBondContact O-CB 3.39Å; R177-S180 PolarHBondContact O-N 2.93Å; R177-S180 VanDerWaalsContact O-N 3.13Å; R177-E181 PolarHBondContact O-N 2.96Å
178M90.3Very high89.4Confident41 Ų4172.5 Ų72.520%0.20235%0.346CS..Hα-helixtrans-58.6-47175.2-169.7173.258.100111.4L151 R152 M174 E175 S180 E181 V182L151-M178 HydrophobicContact CD2-CB 3.85Å; R152-M178 HydrophobicContact CG-SD 4.14Å; M174-M178 PolarHBondContact O-N 3.17Å; E175-M178 WeakPolarHBondContact O-CB 3.45Å; E175-M178 PolarHBondContact O-N 3.17Å; M178-S180 VanDerWaalsContact C-N 3.29Å; M178-S180 PolarHBondContact O-N 2.78Å; M178-E181 PolarHBondContact O-N 3.16Å; M178-V182 WeakPolarHBondContact O-CG2 3.31Å; M178-V182 PolarHBondContact O-N 3.39Å
179W91.4Very high90.4Very high150 Ų15067.1 Ų67.157%0.56833%0.331SS*.Hα-helixtrans-60.8-39.7175.5-90.1106.6000112E175 A176 R177 V182 L183E175-W179 VanDerWaalsContact O-CD1 3.3Å; E175-W179 PolarHBondContact O-N 3.38Å; A176-W179 PolarHBondContact O-N 2.78Å; R177-W179 VanDerWaalsContact C-N 3.35Å; R177-W179 PolarHBondContact O-N 3.38Å; W179-V182 PolarHBondContact O-N 2.98Å; W179-L183 WeakPolarHBondContact O-CD1 3.49Å; W179-L183 WeakPolarHBondContact O-CG 3.4Å; W179-L183 PolarHBondContact O-N 3.36Å
180S92.3Very high91.2Very high42 Ų4263.6 Ų63.629%0.29431%0.307SS..Hα-helixtrans-59.7-48.1175.9-164.70000111.2A176 R177 M178 V182 L183 T184 Q228A176-S180 PolarHBondContact O-N 3.31Å; R177-S180 WeakPolarHBondContact O-CB 3.39Å; R177-S180 PolarHBondContact O-N 2.93Å; R177-S180 VanDerWaalsContact O-N 3.13Å; M178-S180 VanDerWaalsContact C-N 3.29Å; M178-S180 PolarHBondContact O-N 2.78Å; S180-V182 PolarHBondContact O-N 3.2Å; S180-L183 PolarHBondContact O-N 2.7Å; S180-T184 PolarHBondContact O-N 2.87Å; S180-T184 PolarHBondContact O-OG1 3.04Å; S180-T184 VanDerWaalsContact O-OG1 3.09Å; S180-Q228 PolarHBondContact O-NE2 2.96Å; S180-Q228 VanDerWaalsContact O-NE2 3.15Å
181E93.6Very high92Very high16 Ų1658.2 Ų58.28%0.07528%0.284CS..Hα-helixtrans-65.1-36.5179.6-65.8-60.7162.200112.6R143 S144 T147 R177 M178 T184 L185R143-E181 IonicContact NH1-OE1 3.75Å; R143-E181 PolarHBondContact NH1-OE1 3.43Å; R143-E181 IonicContact NH1-OE2 3.75Å; R143-E181 IonicContact NH2-OE2 2.79Å; S144-E181 WeakPolarHBondContact CA-OE2 3.44Å; S144-E181 VanDerWaalsContact CB-OE2 3.3Å; S144-E181 WeakPolarHBondContact CB-OE2 3.5Å; S144-E181 PolarHBondContact OG-OE2 3.27Å; T147-E181 HydrophobicContact CG2-CG 3.82Å; R177-E181 PolarHBondContact O-N 2.96Å; M178-E181 PolarHBondContact O-N 3.16Å; E181-T184 PolarHBondContact O-N 3.36Å; E181-L185 VanDerWaalsContact O-CB 3.26Å; E181-L185 WeakPolarHBondContact O-CB 3.46Å; E181-L185 PolarHBondContact O-N 3.31Å
182V94.4Very high92.8Very high47 Ų4752.3 Ų52.329%0.28526%0.263SS..Hα-helixtrans-64.2-44175.1170.40000111.3M178 W179 S180 T184 L185 L186M178-V182 WeakPolarHBondContact O-CG2 3.31Å; M178-V182 PolarHBondContact O-N 3.39Å; W179-V182 PolarHBondContact O-N 2.98Å; S180-V182 PolarHBondContact O-N 3.2Å; V182-T184 VanDerWaalsContact C-N 3.35Å; V182-L185 WeakPolarHBondContact O-CB 3.24Å; V182-L185 PolarHBondContact O-N 2.86Å; V182-L186 HydrophobicContact CG1-CD1 4.18Å; V182-L186 WeakPolarHBondContact O-CG 3.44Å; V182-L186 PolarHBondContact O-N 2.84Å
183L94.9Very high93.5Very high19 Ų1946.2 Ų46.210%0.09924%0.244CC..Hα-helixtrans-65.3-40.6178.3-65.8166.8000111.1W179 S180 L186 S187 L224 Y227 Q228W179-L183 WeakPolarHBondContact O-CD1 3.49Å; W179-L183 WeakPolarHBondContact O-CG 3.4Å; W179-L183 PolarHBondContact O-N 3.36Å; S180-L183 PolarHBondContact O-N 2.7Å; L183-L186 PolarHBondContact O-N 3.33Å; L183-S187 WeakPolarHBondContact O-CB 3.25Å; L183-S187 PolarHBondContact O-N 2.88Å; L183-L224 HydrophobicContact CD2-CD2 3.61Å; L183-Y227 HydrophobicContact CD1-CD1 3.82Å; L183-Y227 HydrophobicContact CD1-CE1 3.69Å; L183-Q228 HydrophobicContact CB-CG 4.17Å; L183-Q228 HydrophobicContact CD1-CG 4.21Å
184T94.8Very high94Very high25 Ų2543.2 Ų43.215%0.15322%0.219CC..Hα-helixtrans-63.9-44175.2-60.90000111.2S180 E181 V182 L186 S187 N188 Q228S180-T184 PolarHBondContact O-N 2.87Å; S180-T184 PolarHBondContact O-OG1 3.04Å; S180-T184 VanDerWaalsContact O-OG1 3.09Å; E181-T184 PolarHBondContact O-N 3.36Å; V182-T184 VanDerWaalsContact C-N 3.35Å; T184-L186 PolarHBondContact O-N 2.76Å; T184-S187 PolarHBondContact O-N 3.41Å; T184-N188 WeakPolarHBondContact O-CB 3.47Å; T184-N188 VanDerWaalsContact O-CG 3.3Å; T184-N188 PolarHBondContact O-N 2.75Å; T184-Q228 VanDerWaalsContact N-NE2 3.11Å; T184-Q228 PolarHBondContact OG1-NE2 3.48Å
185L96.4Very high94.6Very high29 Ų2941.3 Ų41.315%0.15221%0.21CC..Hα-helixtrans-57.9-50175.9175.363.6000111.5V141 L145 E181 V182 S187 N188 L189V141-L185 HydrophobicContact CB-CD1 4.16Å; V141-L185 HydrophobicContact CG1-CD1 3.71Å; V141-L185 HydrophobicContact CG2-CD1 4.12Å; L145-L185 HydrophobicContact CD1-CD1 4.41Å; L145-L185 HydrophobicContact CD2-CD1 4.29Å; L145-L185 HydrophobicContact CD2-CD2 3.62Å; L145-L185 HydrophobicContact CG-CD1 3.95Å; L145-L185 HydrophobicContact CG-CD2 4.15Å; E181-L185 VanDerWaalsContact O-CB 3.26Å; E181-L185 WeakPolarHBondContact O-CB 3.46Å; E181-L185 PolarHBondContact O-N 3.31Å; V182-L185 WeakPolarHBondContact O-CB 3.24Å; V182-L185 PolarHBondContact O-N 2.86Å; L185-S187 VanDerWaalsContact C-N 3.33Å; L185-S187 PolarHBondContact O-N 3.17Å; L185-N188 PolarHBondContact O-N 3.03Å; L185-L189 HydrophobicContact CD1-CD1 4Å; L185-L189 HydrophobicContact CD1-CG 4.19Å; L185-L189 HydrophobicContact CG-CD1 4.01Å; L185-L189 WeakPolarHBondContact O-CB 3.41Å; L185-L189 VanDerWaalsContact O-CG 3.25Å; L185-L189 WeakPolarHBondContact O-CG 3.38Å; L185-L189 PolarHBondContact O-N 3.36Å
186L97.2Very high95.1Very high87 Ų8738.1 Ų38.146%0.45520%0.195SC..Hα-helixtrans-62.7-40.6179-70.7175.1000112V182 L183 T184 L189 A190 L224V182-L186 HydrophobicContact CG1-CD1 4.18Å; V182-L186 WeakPolarHBondContact O-CG 3.44Å; V182-L186 PolarHBondContact O-N 2.84Å; L183-L186 PolarHBondContact O-N 3.33Å; T184-L186 PolarHBondContact O-N 2.76Å; L186-L189 PolarHBondContact O-N 3.4Å; L186-A190 WeakPolarHBondContact O-CB 3.42Å; L186-A190 PolarHBondContact O-N 3.17Å; L186-L224 HydrophobicContact CB-CD1 3.75Å
187S96.8Very high95.4Very high4 Ų437.8 Ų37.83%0.02819%0.187CC..Hα-helixtrans-62.4-49.6176.3-162.40000111.3L183 T184 L185 L189 A190 D191 S221L183-S187 WeakPolarHBondContact O-CB 3.25Å; L183-S187 PolarHBondContact O-N 2.88Å; T184-S187 PolarHBondContact O-N 3.41Å; L185-S187 VanDerWaalsContact C-N 3.33Å; L185-S187 PolarHBondContact O-N 3.17Å; S187-L189 VanDerWaalsContact C-N 3.33Å; S187-L189 PolarHBondContact O-N 3.05Å; S187-A190 PolarHBondContact O-N 3.46Å; S187-D191 PolarHBondContact O-N 3.38Å; S187-S221 WeakPolarHBondContact OG-CA 3.4Å; S187-S221 WeakPolarHBondContact OG-CB 3.39Å; S187-S221 PolarHBondContact OG-O 2.88Å
188N97.2Very high95.7Very high29 Ų2936.8 Ų36.816%0.15518%0.183CC..Hα-helixtrans-63.1-37.4179.4-71.9-8.9000112.3L137 V141 T184 L185 L192L137-N188 HydrophobicContact CD2-CB 4.23Å; V141-N188 HydrophobicContact CG2-CB 3.77Å; T184-N188 WeakPolarHBondContact O-CB 3.47Å; T184-N188 VanDerWaalsContact O-CG 3.3Å; T184-N188 PolarHBondContact O-N 2.75Å; L185-N188 PolarHBondContact O-N 3.03Å; N188-L192 WeakPolarHBondContact O-CB 3.39Å; N188-L192 PolarHBondContact O-N 2.83Å
189L98Very high95.9Very high77 Ų7736.1 Ų36.140%0.40318%0.18SC..Hα-helixtrans-67-40.6176.2-72.7171.9000112.1V141 L185 L186 S187 L192 A193V141-L189 HydrophobicContact CG1-CD2 4.31Å; V141-L189 HydrophobicContact CG2-CD2 3.92Å; V141-L189 HydrophobicContact CG2-CG 4.15Å; L185-L189 HydrophobicContact CD1-CD1 4Å; L185-L189 HydrophobicContact CD1-CG 4.19Å; L185-L189 HydrophobicContact CG-CD1 4.01Å; L185-L189 WeakPolarHBondContact O-CB 3.41Å; L185-L189 VanDerWaalsContact O-CG 3.25Å; L185-L189 WeakPolarHBondContact O-CG 3.38Å; L185-L189 PolarHBondContact O-N 3.36Å; L186-L189 PolarHBondContact O-N 3.4Å; S187-L189 VanDerWaalsContact C-N 3.33Å; S187-L189 PolarHBondContact O-N 3.05Å; L189-L192 PolarHBondContact O-N 3.15Å; L189-A193 PolarHBondContact O-N 2.83Å
190A97.8Very high96Very high8 Ų831.9 Ų31.97%0.06617%0.172CC..Hα-helixtrans-65.8-43.2175.900000111.4L186 S187 A193 N194 M217L186-A190 WeakPolarHBondContact O-CB 3.42Å; L186-A190 PolarHBondContact O-N 3.17Å; S187-A190 PolarHBondContact O-N 3.46Å; A190-A193 WeakPolarHBondContact O-CB 3.37Å; A190-A193 PolarHBondContact O-N 2.85Å; A190-N194 PolarHBondContact O-N 2.9Å; A190-M217 HydrophobicContact CB-CB 4.28Å; A190-M217 WeakPolarHBondContact CB-O 3.43Å; A190-M217 HydrophobicContact CB-SD 4.3Å
191D97.8Very high95.8Very high13 Ų1340.3 Ų40.37%0.0720%0.197CC..Hα-helixtrans-64.3-39.5173.7-89.4-41.7000112.4R22 W133 L137 S187 A193 N194 A195R22-D191 IonicContact CZ-OD1 3.77Å; R22-D191 IonicContact CZ-OD2 2.78Å; R22-D191 IonicContact NH1-OD1 3.52Å; R22-D191 PolarHBondContact NH1-OD1 2.8Å; R22-D191 IonicContact NH2-OD1 3.05Å; R22-D191 PolarHBondContact NH2-OD1 3.35Å; R22-D191 IonicContact NH2-OD2 3.89Å; R22-D191 PolarHBondContact NH2-OD2 3.34Å; W133-D191 HydrophobicContact CH2-CB 4.47Å; W133-D191 HydrophobicContact CZ2-CB 4.01Å; L137-D191 HydrophobicContact CD1-CB 4.01Å; L137-D191 HydrophobicContact CD2-CB 3.77Å; S187-D191 PolarHBondContact O-N 3.38Å; D191-A193 VanDerWaalsContact C-N 3.31Å; D191-A193 PolarHBondContact O-N 3.33Å; D191-N194 PolarHBondContact O-N 3.43Å; D191-N194 VanDerWaalsContact O-N 3.16Å; D191-A195 WeakPolarHBondContact O-CB 3.4Å; D191-A195 PolarHBondContact O-N 3.21Å
192L97.7Very high95.6Very high21 Ų2143.3 Ų43.311%0.1123%0.233CC..Hα-helixtrans-62.6-39.3177-179.765.5000111.6I134 L137 L138 N188 L189 N194 A195 V196I134-L192 HydrophobicContact CB-CD1 4.35Å; I134-L192 HydrophobicContact CG1-CD1 4.28Å; I134-L192 HydrophobicContact CG2-CD1 3.82Å; L137-L192 HydrophobicContact CB-CB 4.39Å; L137-L192 HydrophobicContact CB-CD1 4.27Å; L137-L192 HydrophobicContact CD1-CB 4.27Å; L138-L192 HydrophobicContact CD2-CD1 4.3Å; L138-L192 HydrophobicContact CD2-CD2 3.67Å; L138-L192 HydrophobicContact CG-CD1 4.2Å; L138-L192 HydrophobicContact CG-CD2 4.4Å; N188-L192 WeakPolarHBondContact O-CB 3.39Å; N188-L192 PolarHBondContact O-N 2.83Å; L189-L192 PolarHBondContact O-N 3.15Å; L192-N194 VanDerWaalsContact C-N 3.29Å; L192-N194 PolarHBondContact O-N 3.01Å; L192-A195 PolarHBondContact O-N 3.47Å; L192-V196 HydrophobicContact CD1-CG2 4.21Å; L192-V196 WeakPolarHBondContact O-CG2 3.23Å; L192-V196 PolarHBondContact O-N 3.32Å
193A97.2Very high95.3Very high16 Ų1644.2 Ų44.213%0.13224%0.239CC..Hα-helixtrans-58.2-43.6174.900000111.6L189 A190 D191 H197 W205 F209 M217L189-A193 PolarHBondContact O-N 2.83Å; A190-A193 WeakPolarHBondContact O-CB 3.37Å; A190-A193 PolarHBondContact O-N 2.85Å; D191-A193 VanDerWaalsContact C-N 3.31Å; D191-A193 PolarHBondContact O-N 3.33Å; A193-H197 PolarHBondContact O-N 3.02Å; A193-W205 PolarHBondContact O-NE1 3.27Å; A193-F209 HydrophobicContact CB-CE2 3.81Å; A193-F209 HydrophobicContact CB-CZ 4.11Å; A193-F209 WeakPolarHBondContact O-CE2 3.4Å; A193-M217 HydrophobicContact CB-CG 4.27Å
194N97.3Very high95.3Very high0 Ų049.5 Ų49.50%027%0.266CS..Hα-helixtrans-70.6-42175.6-79.3-5.3000113A190 D191 L192 V196 H197 W198 V214 M217 G218A190-N194 PolarHBondContact O-N 2.9Å; D191-N194 PolarHBondContact O-N 3.43Å; D191-N194 VanDerWaalsContact O-N 3.16Å; L192-N194 VanDerWaalsContact C-N 3.29Å; L192-N194 PolarHBondContact O-N 3.01Å; N194-V196 PolarHBondContact O-N 2.95Å; N194-H197 WeakPolarHBondContact O-CB 3.37Å; N194-H197 PolarHBondContact O-N 3.48Å; N194-H197 VanDerWaalsContact O-N 3.11Å; N194-W198 PolarHBondContact O-N 2.98Å; N194-W198 VanDerWaalsContact O-N 3.14Å; N194-V214 PolarHBondContact ND2-O 3.44Å; N194-V214 WeakPolarHBondContact OD1-CA 3.34Å; N194-V214 PolarHBondContact OD1-O 3.3Å; N194-M217 WeakPolarHBondContact OD1-CB 3.33Å; N194-G218 PolarHBondContact ND2-N 3.48Å
195A96.8Very high95.3Very high0 Ų052.8 Ų52.80%028%0.276CS..Hα-helixtrans-61.5-45-179.600000111.5T130 W133 I134 L137 D191 L192 H197 W198 L199T130-A195 VanDerWaalsContact CG2-O 3.28Å; T130-A195 WeakPolarHBondContact CG2-O 3.44Å; W133-A195 HydrophobicContact CD2-CB 4.21Å; W133-A195 HydrophobicContact CE3-CB 3.48Å; W133-A195 VanDerWaalsContact CE3-CB 3.48Å; W133-A195 HydrophobicContact CH2-CB 4.11Å; W133-A195 HydrophobicContact CZ3-CB 3.39Å; I134-A195 HydrophobicContact CD1-CB 4.18Å; I134-A195 HydrophobicContact CG1-CB 3.5Å; I134-A195 VanDerWaalsContact CG1-CB 3.5Å; L137-A195 HydrophobicContact CD1-CB 3.99Å; D191-A195 WeakPolarHBondContact O-CB 3.4Å; D191-A195 PolarHBondContact O-N 3.21Å; L192-A195 PolarHBondContact O-N 3.47Å; A195-H197 VanDerWaalsContact C-N 3.29Å; A195-H197 PolarHBondContact O-N 3.43Å; A195-W198 PolarHBondContact O-N 3.36Å; A195-W198 VanDerWaalsContact O-N 3.15Å; A195-L199 PolarHBondContact O-N 2.93Å
196V96.6Very high95.2Very high5 Ų551.4 Ų51.43%0.0327%0.269CS..Hα-helixtrans-63.8-36.5174.7173.30000111.2I134 L192 N194 W198 L199 L204 W205 A206I134-V196 HydrophobicContact CD1-CG2 4.06Å; L192-V196 HydrophobicContact CD1-CG2 4.21Å; L192-V196 WeakPolarHBondContact O-CG2 3.23Å; L192-V196 PolarHBondContact O-N 3.32Å; N194-V196 PolarHBondContact O-N 2.95Å; V196-W198 PolarHBondContact O-N 3.44Å; V196-L199 WeakPolarHBondContact O-CB 3.47Å; V196-L199 PolarHBondContact O-N 3.38Å; V196-L204 HydrophobicContact CG1-CB 3.73Å; V196-L204 HydrophobicContact CG1-CD1 3.86Å; V196-L204 HydrophobicContact CG1-CG 4.41Å; V196-L204 HydrophobicContact CG2-CD1 4.32Å; V196-W205 HydrophobicContact CB-CD2 4.39Å; V196-W205 HydrophobicContact CB-CH2 4.32Å; V196-W205 HydrophobicContact CB-CZ2 3.5Å; V196-W205 HydrophobicContact CG1-CD2 3.7Å; V196-W205 HydrophobicContact CG1-CE3 4.22Å; V196-W205 HydrophobicContact CG1-CG 4.1Å; V196-W205 HydrophobicContact CG1-CH2 4.15Å; V196-W205 HydrophobicContact CG1-CZ2 3.61Å; V196-W205 HydrophobicContact CG1-CZ3 4.43Å; V196-W205 HydrophobicContact CG2-CH2 4.21Å; V196-W205 HydrophobicContact CG2-CZ2 3.74Å; V196-A206 WeakPolarHBondContact O-CA 3.29Å
197H96.4Very high95Very high31 Ų3148.8 Ų48.814%0.14426%0.263CS..Hα-helixtrans-59.7-34.1175.1169.767.1000112.6A193 N194 A195 L199 G207 F209 V214A193-H197 PolarHBondContact O-N 3.02Å; N194-H197 WeakPolarHBondContact O-CB 3.37Å; N194-H197 PolarHBondContact O-N 3.48Å; N194-H197 VanDerWaalsContact O-N 3.11Å; A195-H197 VanDerWaalsContact C-N 3.29Å; A195-H197 PolarHBondContact O-N 3.43Å; H197-L199 VanDerWaalsContact C-N 3.34Å; H197-G207 WeakPolarHBondContact ND1-CA 3.48Å; H197-G207 PolarHBondContact ND1-N 3.14Å; H197-G207 PolarHBondContact O-N 2.9Å; H197-F209 HydrophobicContact CB-CB 4.33Å; H197-F209 HydrophobicContact CB-CD2 4Å; H197-F209 HydrophobicContact CB-CG 4.16Å; H197-F209 PolarHBondContact CE1-O 3.46Å; H197-F209 PolarHBondContact ND1-N 2.92Å; H197-V214 VanDerWaalsContact CD2-CG2 3.4Å; H197-V214 WeakPolarHBondContact CD2-CG2 3.44Å
198W94.8Very high94.9Very high112 Ų11255.2 Ų55.242%0.42429%0.292SS..THydrogen-bonded Turntrans-81.8-5.1-179.9-62.9-27.2000115.2Y26 T130 W133 N194 A195 V196 V214Y26-W198 WeakPolarHBondContact OH-CH2 3.34Å; T130-W198 HydrophobicContact CG2-CB 4.25Å; W133-W198 HydrophobicContact CE3-CE3 4.36Å; W133-W198 HydrophobicContact CE3-CZ3 4.26Å; W133-W198 HydrophobicContact CH2-CE3 4.34Å; W133-W198 HydrophobicContact CH2-CH2 4.34Å; W133-W198 AromaticContact CH2-CZ3 3.65Å; W133-W198 HydrophobicContact CH2-CZ3 3.65Å; W133-W198 AromaticContact CZ3-CE3 3.53Å; W133-W198 HydrophobicContact CZ3-CE3 3.53Å; W133-W198 HydrophobicContact CZ3-CH2 4.29Å; W133-W198 AromaticContact CZ3-CZ3 3.23Å; W133-W198 HydrophobicContact CZ3-CZ3 3.23Å; N194-W198 PolarHBondContact O-N 2.98Å; N194-W198 VanDerWaalsContact O-N 3.14Å; A195-W198 PolarHBondContact O-N 3.36Å; A195-W198 VanDerWaalsContact O-N 3.15Å; V196-W198 PolarHBondContact O-N 3.44Å; W198-V214 HydrophobicContact CZ2-CG1 4.25Å
199L95Very high94.8Very high27 Ų2755.9 Ų55.914%0.14129%0.294CS..SBendtrans-67.4164.1171.8-75.1177.8000112.2T127 T130 I134 A195 V196 H197 V203 A206T127-L199 HydrophobicContact CG2-CD2 4.28Å; T130-L199 HydrophobicContact CG2-CD2 3.93Å; T130-L199 HydrophobicContact CG2-CG 4.2Å; I134-L199 HydrophobicContact CD1-CD1 3.45Å; I134-L199 VanDerWaalsContact CD1-CD1 3.45Å; I134-L199 HydrophobicContact CD1-CD2 4.12Å; I134-L199 HydrophobicContact CD1-CG 3.71Å; A195-L199 PolarHBondContact O-N 2.93Å; V196-L199 WeakPolarHBondContact O-CB 3.47Å; V196-L199 PolarHBondContact O-N 3.38Å; H197-L199 VanDerWaalsContact C-N 3.34Å; L199-V203 HydrophobicContact CB-CB 4.44Å; L199-V203 HydrophobicContact CD1-CB 4.27Å; L199-V203 HydrophobicContact CD1-CG1 3.77Å; L199-A206 HydrophobicContact CB-CB 4.11Å; L199-A206 WeakPolarHBondContact O-CB 3.23Å
200P92.6Very high94.7Very high61 Ų6153.9 Ų53.940%0.39629%0.286SS..PPolyproline II helixtrans-56.3144170.5-25.334.7000112.3T127 G202 V203 A206T127-P200 HydrophobicContact CG2-CG 3.74Å; P200-G202 PolarHBondContact O-N 3.45Å; P200-V203 PolarHBondContact O-N 3.32Å; P200-A206 WeakPolarHBondContact O-CB 3.41Å
201R89.7Confident94.6Very high219 Ų21956.3 Ų56.383%0.82630%0.3SS*.THydrogen-bonded Turntrans-55.3139.2176.3-71.9-175.8173.3167.7-1.5110.7
202G87.9Confident94.6Very high80 Ų8059.5 Ų59.583%0.82531%0.312SS*.THydrogen-bonded Turntrans106.1-9.3-176.300000114.2P200P200-G202 PolarHBondContact O-N 3.45Å
203V89.3Confident94.6Very high66 Ų6660.3 Ų60.340%0.432%0.316SS..SBendtrans-102113.4172.7-174.70000110.3L199 P200 W205 A206L199-V203 HydrophobicContact CB-CB 4.44Å; L199-V203 HydrophobicContact CD1-CB 4.27Å; L199-V203 HydrophobicContact CD1-CG1 3.77Å; P200-V203 PolarHBondContact O-N 3.32Å; V203-W205 PolarHBondContact O-N 3.5Å; V203-A206 HydrophobicContact CB-CB 4.39Å; V203-A206 WeakPolarHBondContact O-CB 3.38Å; V203-A206 PolarHBondContact O-N 2.99Å
204L93.6Very high94.6Very high130 Ų13059.5 Ų59.568%0.68131%0.309SS*.THydrogen-bonded Turntrans49.5-120.2176.9-59.6173000112.2V196V196-L204 HydrophobicContact CG1-CB 3.73Å; V196-L204 HydrophobicContact CG1-CD1 3.86Å; V196-L204 HydrophobicContact CG1-CG 4.41Å; V196-L204 HydrophobicContact CG2-CD1 4.32Å
205W95.3Very high94.6Very high93 Ų9359.5 Ų59.535%0.35231%0.309SS..THydrogen-bonded Turntrans-100.519.7176.761.385.3000113.5A193 V196 V203 G207 H208 F209A193-W205 PolarHBondContact O-NE1 3.27Å; V196-W205 HydrophobicContact CB-CD2 4.39Å; V196-W205 HydrophobicContact CB-CH2 4.32Å; V196-W205 HydrophobicContact CB-CZ2 3.5Å; V196-W205 HydrophobicContact CG1-CD2 3.7Å; V196-W205 HydrophobicContact CG1-CE3 4.22Å; V196-W205 HydrophobicContact CG1-CG 4.1Å; V196-W205 HydrophobicContact CG1-CH2 4.15Å; V196-W205 HydrophobicContact CG1-CZ2 3.61Å; V196-W205 HydrophobicContact CG1-CZ3 4.43Å; V196-W205 HydrophobicContact CG2-CH2 4.21Å; V196-W205 HydrophobicContact CG2-CZ2 3.74Å; V203-W205 PolarHBondContact O-N 3.5Å; W205-G207 PolarHBondContact O-N 3.17Å; W205-H208 HydrophobicContact CB-CB 4.45Å; W205-H208 WeakPolarHBondContact O-CB 3.46Å; W205-H208 PolarHBondContact O-N 2.95Å; W205-H208 PolarHBondContact O-ND1 3.26Å; W205-F209 HydrophobicContact CB-CE1 4.37Å; W205-F209 AromaticContact CD1-CD1 3.79Å; W205-F209 AromaticContact CD1-CE1 3.27Å; W205-F209 AromaticContact CD1-CZ 3.48Å; W205-F209 VanDerWaalsContact CD1-CZ 3.48Å; W205-F209 AromaticContact CG-CE1 3.85Å; W205-F209 HydrophobicContact CG-CE1 3.85Å; W205-F209 HydrophobicContact CG-CZ 4.27Å; W205-F209 AromaticContact NE1-CE1 3.75Å; W205-F209 AromaticContact NE1-CE2 3.94Å; W205-F209 AromaticContact NE1-CZ 3.42Å
206A94.6Very high94.7Very high0 Ų062.2 Ų62.20%032%0.324CS..THydrogen-bonded Turntrans-48.1127.9176.500000111.9V196 L199 P200 V203 H208V196-A206 WeakPolarHBondContact O-CA 3.29Å; L199-A206 HydrophobicContact CB-CB 4.11Å; L199-A206 WeakPolarHBondContact O-CB 3.23Å; P200-A206 WeakPolarHBondContact O-CB 3.41Å; V203-A206 HydrophobicContact CB-CB 4.39Å; V203-A206 WeakPolarHBondContact O-CB 3.38Å; V203-A206 PolarHBondContact O-N 2.99Å; A206-H208 PolarHBondContact O-N 3.23Å; A206-H208 PolarHBondContact O-ND1 3.18Å
207G93.4Very high94.7Very high33 Ų3363.9 Ų63.934%0.3433%0.331SS..THydrogen-bonded Turntrans70.52.8-179.300000116.8H197 W205H197-G207 WeakPolarHBondContact ND1-CA 3.48Å; H197-G207 PolarHBondContact ND1-N 3.14Å; H197-G207 PolarHBondContact O-N 2.9Å; W205-G207 PolarHBondContact O-N 3.17Å
208H94.3Very high94.8Very high139 Ų13962.4 Ų62.464%0.64432%0.324SS*.THydrogen-bonded Turntrans-92.3-19.9-176.7-68.175.4000114.6W205 A206W205-H208 HydrophobicContact CB-CB 4.45Å; W205-H208 WeakPolarHBondContact O-CB 3.46Å; W205-H208 PolarHBondContact O-N 2.95Å; W205-H208 PolarHBondContact O-ND1 3.26Å; A206-H208 PolarHBondContact O-N 3.23Å; A206-H208 PolarHBondContact O-ND1 3.18Å
209F95.6Very high94.9Very high43 Ų4357.7 Ų57.719%0.18931%0.308CS..SBendtrans-71.1131.9-180-72.74.7000110.9A193 H197 W205 L213 V214A193-F209 HydrophobicContact CB-CE2 3.81Å; A193-F209 HydrophobicContact CB-CZ 4.11Å; A193-F209 WeakPolarHBondContact O-CE2 3.4Å; H197-F209 HydrophobicContact CB-CB 4.33Å; H197-F209 HydrophobicContact CB-CD2 4Å; H197-F209 HydrophobicContact CB-CG 4.16Å; H197-F209 PolarHBondContact CE1-O 3.46Å; H197-F209 PolarHBondContact ND1-N 2.92Å; W205-F209 HydrophobicContact CB-CE1 4.37Å; W205-F209 AromaticContact CD1-CD1 3.79Å; W205-F209 AromaticContact CD1-CE1 3.27Å; W205-F209 AromaticContact CD1-CZ 3.48Å; W205-F209 VanDerWaalsContact CD1-CZ 3.48Å; W205-F209 AromaticContact CG-CE1 3.85Å; W205-F209 HydrophobicContact CG-CE1 3.85Å; W205-F209 HydrophobicContact CG-CZ 4.27Å; W205-F209 AromaticContact NE1-CE1 3.75Å; W205-F209 AromaticContact NE1-CE2 3.94Å; W205-F209 AromaticContact NE1-CZ 3.42Å; F209-L213 HydrophobicContact CB-CB 4.41Å; F209-L213 HydrophobicContact CB-CD2 4.19Å; F209-L213 HydrophobicContact CB-CG 4.45Å; F209-L213 HydrophobicContact CD1-CD2 3.68Å; F209-L213 HydrophobicContact CD2-CD2 3.96Å; F209-L213 HydrophobicContact CD2-CG 3.98Å; F209-L213 HydrophobicContact CE1-CD2 3.92Å; F209-L213 HydrophobicContact CE2-CD2 4.19Å; F209-L213 HydrophobicContact CE2-CG 4.29Å; F209-L213 HydrophobicContact CG-CD2 3.69Å; F209-L213 HydrophobicContact CG-CG 4.12Å; F209-L213 HydrophobicContact CZ-CD2 4.17Å; F209-V214 HydrophobicContact CB-CG2 3.67Å; F209-V214 HydrophobicContact CD2-CG2 4.26Å
210P95.6Very high95.1Very high35 Ų3559.5 Ų59.523%0.22732%0.317CS..  trans-68.5156.516829.8-34.9000110.2W212 L213 V214P210-W212 HydrophobicContact CB-CG 4.46Å; P210-W212 HydrophobicContact CG-CD2 4.16Å; P210-W212 VanDerWaalsContact CG-CE2 3.43Å; P210-W212 HydrophobicContact CG-CG 4.31Å; P210-W212 HydrophobicContact CG-CZ2 3.79Å; P210-W212 PolarHBondContact O-N 3.02Å; P210-W212 VanDerWaalsContact O-N 3.12Å; P210-L213 HydrophobicContact CG-CB 3.84Å; P210-L213 PolarHBondContact O-N 2.9Å; P210-V214 PolarHBondContact O-N 3.24Å
211P95.1Very high95.3Very high58 Ų5856.6 Ų56.638%0.37730%0.299SS..Hα-helixtrans-54.8-36.4-176.5-27.534.7000114L50 L213 V214 G215L50-P211 HydrophobicContact CD2-CB 4.08Å; P211-L213 VanDerWaalsContact C-N 3.32Å; P211-L213 PolarHBondContact O-N 3.29Å; P211-V214 PolarHBondContact O-N 3.01Å; P211-G215 PolarHBondContact O-N 3.21Å
212W97.1Very high95.6Very high81 Ų8146.3 Ų46.331%0.30726%0.26SS..Hα-helixtrans-65.5-34.9178.667.1-101.9000112.6L30 V34 P210 G215 L216L30-W212 HydrophobicContact CD1-CB 4.38Å; L30-W212 VanDerWaalsContact CD1-O 3.25Å; L30-W212 WeakPolarHBondContact CD1-O 3.39Å; V34-W212 HydrophobicContact CG2-CB 3.79Å; V34-W212 HydrophobicContact CG2-CG 4.38Å; P210-W212 HydrophobicContact CB-CG 4.46Å; P210-W212 HydrophobicContact CG-CD2 4.16Å; P210-W212 VanDerWaalsContact CG-CE2 3.43Å; P210-W212 HydrophobicContact CG-CG 4.31Å; P210-W212 HydrophobicContact CG-CZ2 3.79Å; P210-W212 PolarHBondContact O-N 3.02Å; P210-W212 VanDerWaalsContact O-N 3.12Å; W212-G215 PolarHBondContact O-N 3.06Å; W212-L216 HydrophobicContact CZ3-CD2 4.24Å; W212-L216 WeakPolarHBondContact O-CB 3.39Å; W212-L216 PolarHBondContact O-N 3.34Å
213L97.7Very high96Very high37 Ų3746.9 Ų46.919%0.19424%0.244CC..Hα-helixtrans-72.8-40.2-179.3-179.658.7000110.5F209 P210 P211 G215 L216 M217F209-L213 HydrophobicContact CB-CB 4.41Å; F209-L213 HydrophobicContact CB-CD2 4.19Å; F209-L213 HydrophobicContact CB-CG 4.45Å; F209-L213 HydrophobicContact CD1-CD2 3.68Å; F209-L213 HydrophobicContact CD2-CD2 3.96Å; F209-L213 HydrophobicContact CD2-CG 3.98Å; F209-L213 HydrophobicContact CE1-CD2 3.92Å; F209-L213 HydrophobicContact CE2-CD2 4.19Å; F209-L213 HydrophobicContact CE2-CG 4.29Å; F209-L213 HydrophobicContact CG-CD2 3.69Å; F209-L213 HydrophobicContact CG-CG 4.12Å; F209-L213 HydrophobicContact CZ-CD2 4.17Å; P210-L213 HydrophobicContact CG-CB 3.84Å; P210-L213 PolarHBondContact O-N 2.9Å; P211-L213 VanDerWaalsContact C-N 3.32Å; P211-L213 PolarHBondContact O-N 3.29Å; L213-G215 VanDerWaalsContact C-N 3.29Å; L213-G215 PolarHBondContact O-N 2.91Å; L213-L216 HydrophobicContact CD1-CD2 4.33Å; L213-L216 WeakPolarHBondContact O-CB 3.38Å; L213-L216 PolarHBondContact O-N 3.36Å; L213-M217 HydrophobicContact CD1-CE 3.97Å; L213-M217 HydrophobicContact CD1-CG 4.45Å; L213-M217 WeakPolarHBondContact O-CG 3.13Å; L213-M217 PolarHBondContact O-N 3.04Å
214V97.6Very high96.2Very high0 Ų045.1 Ų45.10%023%0.232CC..Hα-helixtrans-59-45.6172-177.80000110.4Q29 N194 H197 W198 F209 P210 P211 G218Q29-V214 VanDerWaalsContact NE2-CG1 3.27Å; N194-V214 PolarHBondContact ND2-O 3.44Å; N194-V214 WeakPolarHBondContact OD1-CA 3.34Å; N194-V214 PolarHBondContact OD1-O 3.3Å; H197-V214 VanDerWaalsContact CD2-CG2 3.4Å; H197-V214 WeakPolarHBondContact CD2-CG2 3.44Å; W198-V214 HydrophobicContact CZ2-CG1 4.25Å; F209-V214 HydrophobicContact CB-CG2 3.67Å; F209-V214 HydrophobicContact CD2-CG2 4.26Å; P210-V214 PolarHBondContact O-N 3.24Å; P211-V214 PolarHBondContact O-N 3.01Å; V214-G218 PolarHBondContact O-N 3.21Å
215G97.7Very high96.1Very high0 Ų040.9 Ų40.90%021%0.213CC..Hα-helixtrans-58.1-46173.100000112.9P211 W212 L213 G218 T219P211-G215 PolarHBondContact O-N 3.21Å; W212-G215 PolarHBondContact O-N 3.06Å; L213-G215 VanDerWaalsContact C-N 3.29Å; L213-G215 PolarHBondContact O-N 2.91Å; G215-G218 PolarHBondContact O-N 3.06Å; G215-T219 WeakPolarHBondContact O-CB 3.34Å; G215-T219 PolarHBondContact O-N 3.36Å; G215-T219 PolarHBondContact O-OG1 3.23Å
216L98.3Very high95.9Very high57 Ų5739.2 Ų39.230%0.29821%0.21SC..Hα-helixtrans-60-51.7-179.9-178.662.7000112L30 W212 L213 G218 T219 I220L30-L216 HydrophobicContact CD1-CB 3.95Å; L30-L216 HydrophobicContact CD1-CD1 4.48Å; L30-L216 HydrophobicContact CD2-CD1 4.28Å; W212-L216 HydrophobicContact CZ3-CD2 4.24Å; W212-L216 WeakPolarHBondContact O-CB 3.39Å; W212-L216 PolarHBondContact O-N 3.34Å; L213-L216 HydrophobicContact CD1-CD2 4.33Å; L213-L216 WeakPolarHBondContact O-CB 3.38Å; L213-L216 PolarHBondContact O-N 3.36Å; L216-G218 VanDerWaalsContact C-N 3.3Å; L216-G218 PolarHBondContact O-N 3Å; L216-T219 PolarHBondContact O-N 2.87Å; L216-I220 HydrophobicContact CD1-CD1 4.08Å; L216-I220 HydrophobicContact CD1-CG1 4.42Å; L216-I220 HydrophobicContact CG-CD1 3.98Å; L216-I220 VanDerWaalsContact O-CG1 3.31Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 3.44Å
217M98.1Very high95.7Very high39 Ų3945.3 Ų45.319%0.19223%0.234CC..Hα-helixtrans-61.9-41.1179.4-66-58.3107.300111.3A190 A193 N194 L213 I220 S221A190-M217 HydrophobicContact CB-CB 4.28Å; A190-M217 WeakPolarHBondContact CB-O 3.43Å; A190-M217 HydrophobicContact CB-SD 4.3Å; A193-M217 HydrophobicContact CB-CG 4.27Å; N194-M217 WeakPolarHBondContact OD1-CB 3.33Å; L213-M217 HydrophobicContact CD1-CE 3.97Å; L213-M217 HydrophobicContact CD1-CG 4.45Å; L213-M217 WeakPolarHBondContact O-CG 3.13Å; L213-M217 PolarHBondContact O-N 3.04Å; M217-I220 HydrophobicContact CE-CD1 4.08Å; M217-I220 PolarHBondContact O-N 2.88Å; M217-S221 PolarHBondContact O-N 3.11Å; M217-S221 PolarHBondContact O-OG 3.09Å
218G97.4Very high95.5Very high0 Ų045.8 Ų45.80%023%0.227CC..Hα-helixtrans-66.8-37.9176.500000113.2Y26 N194 V214 G215 L216 S221 S222Y26-G218 VanDerWaalsContact CD2-C 3.47Å; Y26-G218 VanDerWaalsContact CD2-CA 3.48Å; Y26-G218 WeakPolarHBondContact CD2-O 3.49Å; Y26-G218 VanDerWaalsContact CG-CA 3.42Å; N194-G218 PolarHBondContact ND2-N 3.48Å; V214-G218 PolarHBondContact O-N 3.21Å; G215-G218 PolarHBondContact O-N 3.06Å; L216-G218 VanDerWaalsContact C-N 3.3Å; L216-G218 PolarHBondContact O-N 3Å; G218-S221 WeakPolarHBondContact CA-OG 3.35Å; G218-S221 PolarHBondContact O-OG 2.94Å; G218-S222 VanDerWaalsContact O-CB 3.29Å; G218-S222 WeakPolarHBondContact O-CB 3.42Å; G218-S222 PolarHBondContact O-N 3.45Å; G218-S222 PolarHBondContact O-OG 2.93Å
219T98.1Very high95.2Very high13 Ų1340.5 Ų40.58%0.0821%0.208CC..Hα-helixtrans-67.4-45.1174.9-66.70000110.8C27 G215 L216 S222 L223C27-T219 PolarHBondContact N-OG1 3.4Å; G215-T219 WeakPolarHBondContact O-CB 3.34Å; G215-T219 PolarHBondContact O-N 3.36Å; G215-T219 PolarHBondContact O-OG1 3.23Å; L216-T219 PolarHBondContact O-N 2.87Å; T219-S222 PolarHBondContact O-N 3.41Å; T219-L223 HydrophobicContact CG2-CD1 3.82Å; T219-L223 HydrophobicContact CG2-CG 4.22Å; T219-L223 WeakPolarHBondContact O-CB 3.23Å; T219-L223 VanDerWaalsContact O-CG 3.27Å; T219-L223 WeakPolarHBondContact O-CG 3.28Å; T219-L223 PolarHBondContact O-N 3.33Å
220I97.5Very high94.7Very high66 Ų6641.9 Ų41.934%0.33823%0.227SC..Hα-helixtrans-57.7-55.1178-70.7167.2000110.5L216 M217 S222 L223 L224L216-I220 HydrophobicContact CD1-CD1 4.08Å; L216-I220 HydrophobicContact CD1-CG1 4.42Å; L216-I220 HydrophobicContact CG-CD1 3.98Å; L216-I220 VanDerWaalsContact O-CG1 3.31Å; L216-I220 WeakPolarHBondContact O-CG1 3.47Å; L216-I220 PolarHBondContact O-N 3.44Å; M217-I220 HydrophobicContact CE-CD1 4.08Å; M217-I220 PolarHBondContact O-N 2.88Å; I220-S222 VanDerWaalsContact C-N 3.29Å; I220-S222 PolarHBondContact O-N 3.27Å; I220-L223 PolarHBondContact O-N 2.95Å; I220-L224 HydrophobicContact CG2-CD1 3.89Å; I220-L224 HydrophobicContact CG2-CG 4.38Å; I220-L224 VanDerWaalsContact O-CG 3.26Å; I220-L224 WeakPolarHBondContact O-CG 3.42Å; I220-L224 PolarHBondContact O-N 3.31Å
221S97.3Very high94.2Very high0 Ų044.4 Ų44.40%023%0.232CC..Hα-helixtrans-56.2-43.4178.349.10000112R22 S187 M217 G218 L223 L224 S225R22-S221 PolarHBondContact NH2-OG 3.24Å; S187-S221 WeakPolarHBondContact OG-CA 3.4Å; S187-S221 WeakPolarHBondContact OG-CB 3.39Å; S187-S221 PolarHBondContact OG-O 2.88Å; M217-S221 PolarHBondContact O-N 3.11Å; M217-S221 PolarHBondContact O-OG 3.09Å; G218-S221 WeakPolarHBondContact CA-OG 3.35Å; G218-S221 PolarHBondContact O-OG 2.94Å; S221-L223 PolarHBondContact O-N 2.96Å; S221-L224 PolarHBondContact O-N 3.36Å; S221-S225 PolarHBondContact O-N 3.04Å; S221-S225 PolarHBondContact O-OG 3.44Å
222S96.3Very high93.4Very high2 Ų244.7 Ų44.71%0.01424%0.239CC..Hα-helixtrans-64.4-43.2-179.9-54.10000113R22 T23 G218 T219 I220 S225 M226R22-S222 WeakPolarHBondContact CD-OG 3.27Å; R22-S222 VanDerWaalsContact CG-OG 3.3Å; R22-S222 WeakPolarHBondContact CG-OG 3.44Å; R22-S222 PolarHBondContact NE-OG 3.05Å; T23-S222 WeakPolarHBondContact OG1-CB 3.49Å; G218-S222 VanDerWaalsContact O-CB 3.29Å; G218-S222 WeakPolarHBondContact O-CB 3.42Å; G218-S222 PolarHBondContact O-N 3.45Å; G218-S222 PolarHBondContact O-OG 2.93Å; T219-S222 PolarHBondContact O-N 3.41Å; I220-S222 VanDerWaalsContact C-N 3.29Å; I220-S222 PolarHBondContact O-N 3.27Å; S222-S225 PolarHBondContact O-N 3.45Å; S222-M226 WeakPolarHBondContact O-CG 3.48Å; S222-M226 PolarHBondContact O-N 2.88Å
223L95.4Very high92.1Very high92 Ų9242.7 Ų42.748%0.48224%0.244SC..Hα-helixtrans-64.5-41.4176.5-69.7174.1000111.4T219 I220 S221 M226 Y227T219-L223 HydrophobicContact CG2-CD1 3.82Å; T219-L223 HydrophobicContact CG2-CG 4.22Å; T219-L223 WeakPolarHBondContact O-CB 3.23Å; T219-L223 VanDerWaalsContact O-CG 3.27Å; T219-L223 WeakPolarHBondContact O-CG 3.28Å; T219-L223 PolarHBondContact O-N 3.33Å; I220-L223 PolarHBondContact O-N 2.95Å; S221-L223 PolarHBondContact O-N 2.96Å; L223-M226 HydrophobicContact CD2-CE 3.67Å; L223-M226 PolarHBondContact O-N 3.01Å; L223-Y227 WeakPolarHBondContact O-CB 3.43Å; L223-Y227 PolarHBondContact O-N 3.49Å
224L94.8Very high90.5Very high30 Ų3043 Ų4316%0.15726%0.256CS..Hα-helixtrans-62.1-46.7176.2-67.3175.4000111.4L183 L186 I220 S221 M226 Y227 Q228L183-L224 HydrophobicContact CD2-CD2 3.61Å; L186-L224 HydrophobicContact CB-CD1 3.75Å; I220-L224 HydrophobicContact CG2-CD1 3.89Å; I220-L224 HydrophobicContact CG2-CG 4.38Å; I220-L224 VanDerWaalsContact O-CG 3.26Å; I220-L224 WeakPolarHBondContact O-CG 3.42Å; I220-L224 PolarHBondContact O-N 3.31Å; S221-L224 PolarHBondContact O-N 3.36Å; L224-M226 PolarHBondContact O-N 3.25Å; L224-Y227 PolarHBondContact O-N 2.94Å; L224-Q228 WeakPolarHBondContact O-CG 3.17Å; L224-Q228 PolarHBondContact O-N 3.48Å
225S91Very high88.7Confident41 Ų4146.7 Ų46.729%0.28728%0.278SS..Hα-helixtrans-63.5-39.7177-64.20000112.8S221 S222 A229S221-S225 PolarHBondContact O-N 3.04Å; S221-S225 PolarHBondContact O-OG 3.44Å; S222-S225 PolarHBondContact O-N 3.45Å; S225-A229 WeakPolarHBondContact O-CB 3.41Å; S225-A229 PolarHBondContact O-N 3.09Å
226M90.5Very high86.6Confident57 Ų5749.7 Ų49.728%0.28130%0.303SS..Hα-helixtrans-65.1-43.5174.7-75.4-164.5-60.100111.9R19 T23 S222 L223 L224 Q228 A229 A230R19-M226 HydrophobicContact CB-CG 4.26Å; T23-M226 HydrophobicContact CG2-CE 3.74Å; T23-M226 WeakPolarHBondContact OG1-CE 3.28Å; S222-M226 WeakPolarHBondContact O-CG 3.48Å; S222-M226 PolarHBondContact O-N 2.88Å; L223-M226 HydrophobicContact CD2-CE 3.67Å; L223-M226 PolarHBondContact O-N 3.01Å; L224-M226 PolarHBondContact O-N 3.25Å; M226-Q228 PolarHBondContact O-N 2.91Å; M226-A229 PolarHBondContact O-N 3.15Å; M226-A230 WeakPolarHBondContact O-CB 3.33Å; M226-A230 PolarHBondContact O-N 3.36Å
227Y91.1Very high84.5Confident129 Ų12953.6 Ų53.651%0.50632%0.32SS..Hα-helixtrans-60.3-45.7177.1174.8-99.5000111.6L183 L223 L224 A229 A230 R231L183-Y227 HydrophobicContact CD1-CD1 3.82Å; L183-Y227 HydrophobicContact CD1-CE1 3.69Å; L223-Y227 WeakPolarHBondContact O-CB 3.43Å; L223-Y227 PolarHBondContact O-N 3.49Å; L224-Y227 PolarHBondContact O-N 2.94Å; Y227-A229 PolarHBondContact O-N 3.14Å; Y227-A230 PolarHBondContact O-N 3.36Å; Y227-R231 PolarHBondContact O-N 3.41Å
228Q90.1Very high82.2Confident43 Ų4354.8 Ų54.820%0.20134%0.336CS..Hα-helixtrans-60.8-44.2175.8-74.6179.3-25.700112S180 L183 T184 L224 M226 R231 A232S180-Q228 PolarHBondContact O-NE2 2.96Å; S180-Q228 VanDerWaalsContact O-NE2 3.15Å; L183-Q228 HydrophobicContact CB-CG 4.17Å; L183-Q228 HydrophobicContact CD1-CG 4.21Å; T184-Q228 VanDerWaalsContact N-NE2 3.11Å; T184-Q228 PolarHBondContact OG1-NE2 3.48Å; L224-Q228 WeakPolarHBondContact O-CG 3.17Å; L224-Q228 PolarHBondContact O-N 3.48Å; M226-Q228 PolarHBondContact O-N 2.91Å; Q228-R231 PolarHBondContact O-N 3.05Å; Q228-A232 PolarHBondContact O-N 3.29Å
229A86.7Confident79.7Confident28 Ų2861.5 Ų61.523%0.23137%0.372CS..Hα-helixtrans-67.4-38.9-179.900000112.9R19 S225 M226 Y227 R231 A232 G233R19-A229 VanDerWaalsContact CZ-CB 3.5Å; S225-A229 WeakPolarHBondContact O-CB 3.41Å; S225-A229 PolarHBondContact O-N 3.09Å; M226-A229 PolarHBondContact O-N 3.15Å; Y227-A229 PolarHBondContact O-N 3.14Å; A229-R231 VanDerWaalsContact C-N 3.31Å; A229-A232 PolarHBondContact O-N 3.19Å; A229-G233 PolarHBondContact O-N 3.43Å
230A85.6Confident77.1Confident71 Ų7165.4 Ų65.459%0.58740%0.399SS*.Hα-helixtrans-63.1-40174.100000111.3M226 Y227 G233 G234M226-A230 WeakPolarHBondContact O-CB 3.33Å; M226-A230 PolarHBondContact O-N 3.36Å; Y227-A230 PolarHBondContact O-N 3.36Å; A230-G233 PolarHBondContact O-N 3.27Å; A230-G234 PolarHBondContact O-N 2.69Å; A230-G234 VanDerWaalsContact O-N 3.1Å
231R84.6Confident74.4Confident89 Ų8969.6 Ų69.634%0.33644%0.435SS..Hα-helixtrans-66.1-42.7176.6-155.1174.689.2171.14.4111.9A176 Y227 Q228 A229 T235A176-R231 PolarHBondContact O-NH2 3Å; Y227-R231 PolarHBondContact O-N 3.41Å; Q228-R231 PolarHBondContact O-N 3.05Å; A229-R231 VanDerWaalsContact C-N 3.31Å; R231-T235 PolarHBondContact O-N 3.15Å; R231-T235 PolarHBondContact O-OG1 3.16Å
232A78.6Confident73.2Confident63 Ų6373.1 Ų73.152%0.52146%0.457SS..Hα-helixtrans-63.1-42.9176.700000112.2Q228 A229 T235 A236Q228-A232 PolarHBondContact O-N 3.29Å; A229-A232 PolarHBondContact O-N 3.19Å; A232-T235 PolarHBondContact O-N 3.38Å; A232-A236 PolarHBondContact O-N 3.31Å; A232-A236 VanDerWaalsContact O-N 3.15Å
233G69.6Low72Confident40 Ų4076.8 Ų76.841%0.41248%0.48SS..Hα-helixtrans-61.7-45.817700000113.1A229 A230 T235 A236 E237A229-G233 PolarHBondContact O-N 3.43Å; A230-G233 PolarHBondContact O-N 3.27Å; G233-T235 PolarHBondContact O-N 3.43Å; G233-A236 PolarHBondContact O-N 3.01Å; G233-E237 PolarHBondContact O-N 2.8Å; G233-E237 VanDerWaalsContact O-N 3.14Å
234G63.8Low70.7Confident43 Ų4376 Ų7644%0.44348%0.48SS..Hα-helixtrans-66.4-21.1177.200000114.3A230A230-G234 PolarHBondContact O-N 2.69Å; A230-G234 VanDerWaalsContact O-N 3.1Å
235T59.7Low69.3Low77 Ų7778.7 Ų78.747%0.47250%0.499SS..Hα-helixtrans-79.7-41.7175.1-35.80000110.8R231 A232 G233 E237 A238 D239R231-T235 PolarHBondContact O-N 3.15Å; R231-T235 PolarHBondContact O-OG1 3.16Å; A232-T235 PolarHBondContact O-N 3.38Å; G233-T235 PolarHBondContact O-N 3.43Å; T235-E237 PolarHBondContact O-N 3.14Å; T235-A238 PolarHBondContact O-N 2.92Å; T235-D239 PolarHBondContact O-N 2.88Å; T235-D239 VanDerWaalsContact O-N 3.16Å
236A54.4Low67.9Low64 Ų6481.1 Ų81.153%0.52951%0.512SS..Hα-helixtrans-65.4-35.6178.300000113.1A232 G233 S240A232-A236 PolarHBondContact O-N 3.31Å; A232-A236 VanDerWaalsContact O-N 3.15Å; G233-A236 PolarHBondContact O-N 3.01Å; A236-S240 PolarHBondContact O-N 3.04Å; A236-S240 PolarHBondContact O-OG 3.01Å
237E53.1Low66.4Low139 Ų13982.7 Ų82.765%0.6553%0.527SS*.Hα-helixtrans-71.2-36.5178.7-157.4168.6-165.500111.8G233 T235 S240 S241G233-E237 PolarHBondContact O-N 2.8Å; G233-E237 VanDerWaalsContact O-N 3.14Å; T235-E237 PolarHBondContact O-N 3.14Å; E237-S240 PolarHBondContact O-N 3.21Å; E237-S240 PolarHBondContact O-OG 2.98Å; E237-S241 PolarHBondContact O-OG 3.16Å; E237-S241 VanDerWaalsContact O-OG 3.1Å
238A51.5Low64.7Low64 Ų6479.4 Ų79.453%0.52953%0.529SS..Hα-helixtrans-70.6-31.6176.300000113.8T235 S240T235-A238 PolarHBondContact O-N 2.92Å; A238-S240 VanDerWaalsContact C-N 3.3Å
239D43.9Very low62.7Low141 Ų14182.2 Ų82.275%0.75455%0.554SS**Hα-helixtrans-79-14176.1-71.9-19000112.8T235T235-D239 PolarHBondContact O-N 2.88Å; T235-D239 VanDerWaalsContact O-N 3.16Å
240S44.8Very low60.7Low94 Ų9486.7 Ų86.766%0.65758%0.581SS**THydrogen-bonded Turntrans-96.7-1.2178.267.10000114.9A236 E237 A238A236-S240 PolarHBondContact O-N 3.04Å; A236-S240 PolarHBondContact O-OG 3.01Å; E237-S240 PolarHBondContact O-N 3.21Å; E237-S240 PolarHBondContact O-OG 2.98Å; A238-S240 VanDerWaalsContact C-N 3.3Å
241S39.4Very low58.5Low155 Ų15588.1 Ų88.1100%1.08458%0.581SS**  trans-109.20-179.9-58.30000111.5E237E237-S241 PolarHBondContact O-OG 3.16Å; E237-S241 VanDerWaalsContact O-OG 3.1Å

Retrieved 241 of 241 residues in 146.1 ms (Link to these results)

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