A0A075X6V8_HUMAN Loading...

Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A075X6V8, Species HUMAN (Homo sapiens, Human), Gene CYTB, Length 295 aa.

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

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
1L98.1Very high98.7Very high93 Ų9358.1 Ų58.149%0.48731%0.313SS..  0-74.50-172.369.2000111.2I3 T4 T5 L197L1-I3 PolarHBondContact O-N 3.41Å; L1-T4 PolarHBondContact O-N 3.01Å; L1-T4 VanDerWaalsContact O-N 3.11Å; L1-T5 HydrophobicContact CD1-CG2 4.16Å; L1-T5 PolarHBondContact O-N 3.36Å; L1-T5 PolarHBondContact O-OG1 3.48Å; L1-L197 HydrophobicContact CD1-CD2 4.48Å; L1-L197 HydrophobicContact CD2-CD2 3.39Å
2Q98.8Very high98.7Very high35 Ų3560.1 Ų60.116%0.16432%0.319CS..Hα-helixtrans-56.1-45.8-172.4-63.6-51.795.700114.7T4 T5 G6 H41 F48Q2-T4 VanDerWaalsContact C-N 3.34Å; Q2-T4 PolarHBondContact O-N 3.42Å; Q2-T5 PolarHBondContact O-OG1 3Å; Q2-G6 WeakPolarHBondContact O-CA 3.32Å; Q2-G6 PolarHBondContact O-N 3.47Å; Q2-H41 PolarHBondContact NE2-O 3.01Å; Q2-H41 PolarHBondContact O-CE1 2.86Å; Q2-H41 VanDerWaalsContact O-CE1 3.27Å; Q2-H41 PolarHBondContact O-ND1 2.85Å; Q2-F48 HydrophobicContact CG-CD2 4.12Å
3I98.8Very high98.7Very high59 Ų5957.2 Ų57.230%0.30330%0.301SS..Hα-helixtrans-59.2-47.4177.5-65.8173.2000110.4L1 L7 P144 F145L1-I3 PolarHBondContact O-N 3.41Å; I3-L7 HydrophobicContact CG2-CD1 3.87Å; I3-L7 HydrophobicContact CG2-CG 4.42Å; I3-L7 WeakPolarHBondContact O-CB 3.36Å; I3-L7 WeakPolarHBondContact O-CG 3.46Å; I3-L7 PolarHBondContact O-N 2.89Å; I3-P144 HydrophobicContact CD1-CB 4.36Å; I3-P144 HydrophobicContact CG1-CB 3.82Å; I3-F145 HydrophobicContact CG2-CE1 3.83Å; I3-F145 HydrophobicContact CG2-CZ 3.95Å
4T98.8Very high98.7Very high80 Ų8056.3 Ų56.349%0.49130%0.302SS..Hα-helixtrans-63.9-55.2-178.7-46.90000111.4L1 Q2 G6 L7 F8L1-T4 PolarHBondContact O-N 3.01Å; L1-T4 VanDerWaalsContact O-N 3.11Å; Q2-T4 VanDerWaalsContact C-N 3.34Å; Q2-T4 PolarHBondContact O-N 3.42Å; T4-G6 VanDerWaalsContact C-N 3.29Å; T4-G6 PolarHBondContact O-N 3.31Å; T4-L7 PolarHBondContact O-N 2.81Å; T4-F8 HydrophobicContact CG2-CD2 4.27Å; T4-F8 HydrophobicContact CG2-CE2 4.15Å; T4-F8 WeakPolarHBondContact O-CD2 3.4Å; T4-F8 PolarHBondContact O-N 2.73Å
5T98.9Very high98.6Very high12 Ų1254.8 Ų54.87%0.07430%0.296CS..Hα-helixtrans-62.6-39.5-179.753.10000111.3L1 Q2 L7 F8 L9 I37 L40 H41L1-T5 HydrophobicContact CD1-CG2 4.16Å; L1-T5 PolarHBondContact O-N 3.36Å; L1-T5 PolarHBondContact O-OG1 3.48Å; Q2-T5 PolarHBondContact O-OG1 3Å; T5-L7 PolarHBondContact O-N 3.02Å; T5-F8 PolarHBondContact O-N 2.96Å; T5-L9 VanDerWaalsContact O-CG 3.26Å; T5-L9 WeakPolarHBondContact O-CG 3.32Å; T5-L9 PolarHBondContact O-N 3.02Å; T5-I37 HydrophobicContact CG2-CG2 4.31Å; T5-L40 HydrophobicContact CG2-CB 4.14Å; T5-H41 PolarHBondContact OG1-ND1 3.47Å
6G98.8Very high98.5Very high19 Ų1954.9 Ų54.920%0.19630%0.297CS..Hα-helixtrans-62.3-41.1176.500000113.2Q2 T4 L9 A10 H41Q2-G6 WeakPolarHBondContact O-CA 3.32Å; Q2-G6 PolarHBondContact O-N 3.47Å; T4-G6 VanDerWaalsContact C-N 3.29Å; T4-G6 PolarHBondContact O-N 3.31Å; G6-L9 PolarHBondContact O-N 3.29Å; G6-A10 VanDerWaalsContact O-CB 3.3Å; G6-A10 WeakPolarHBondContact O-CB 3.45Å; G6-A10 PolarHBondContact O-N 3.03Å; G6-H41 VanDerWaalsContact CA-CE1 3.47Å; G6-H41 WeakPolarHBondContact CA-CE1 3.28Å; G6-H41 PolarHBondContact N-ND1 3.35Å
7L98.8Very high98.3Very high62 Ų6252.8 Ų52.833%0.32529%0.288SS..Hα-helixtrans-61.9-45.2174.8-77.3168.8000111.9I3 T4 T5 L9 A10 M11 F141 F145I3-L7 HydrophobicContact CG2-CD1 3.87Å; I3-L7 HydrophobicContact CG2-CG 4.42Å; I3-L7 WeakPolarHBondContact O-CB 3.36Å; I3-L7 WeakPolarHBondContact O-CG 3.46Å; I3-L7 PolarHBondContact O-N 2.89Å; T4-L7 PolarHBondContact O-N 2.81Å; T5-L7 PolarHBondContact O-N 3.02Å; L7-L9 VanDerWaalsContact C-N 3.35Å; L7-L9 PolarHBondContact O-N 3.41Å; L7-A10 PolarHBondContact O-N 2.89Å; L7-M11 WeakPolarHBondContact O-CG 3.36Å; L7-M11 PolarHBondContact O-N 2.76Å; L7-F141 HydrophobicContact CD2-CE2 3.67Å; L7-F141 HydrophobicContact CD2-CZ 3.58Å; L7-F145 HydrophobicContact CD2-CZ 4.48Å
8F98.8Very high98.3Very high103 Ų10355.2 Ų55.245%0.45231%0.31SS..Hα-helixtrans-64.9-37.6176.5-82.7-84.3000112.3T4 T5 M11 H12 I37T4-F8 HydrophobicContact CG2-CD2 4.27Å; T4-F8 HydrophobicContact CG2-CE2 4.15Å; T4-F8 WeakPolarHBondContact O-CD2 3.4Å; T4-F8 PolarHBondContact O-N 2.73Å; T5-F8 PolarHBondContact O-N 2.96Å; F8-M11 HydrophobicContact CD1-SD 4.36Å; F8-M11 PolarHBondContact O-N 3.43Å; F8-H12 PolarHBondContact O-CD2 2.88Å; F8-I37 HydrophobicContact CB-CD1 4.32Å; F8-I37 HydrophobicContact CB-CG2 4.14Å
9L98.9Very high98.3Very high22 Ų2254.8 Ų54.812%0.11531%0.309CS..Hα-helixtrans-65.2-42.5173.8-67.3169.7000111.7T5 G6 L7 M11 H12 Y13 I27 I37 R38 H41T5-L9 VanDerWaalsContact O-CG 3.26Å; T5-L9 WeakPolarHBondContact O-CG 3.32Å; T5-L9 PolarHBondContact O-N 3.02Å; G6-L9 PolarHBondContact O-N 3.29Å; L7-L9 VanDerWaalsContact C-N 3.35Å; L7-L9 PolarHBondContact O-N 3.41Å; L9-M11 PolarHBondContact O-N 3.34Å; L9-H12 PolarHBondContact O-N 2.82Å; L9-Y13 WeakPolarHBondContact O-CB 3.5Å; L9-Y13 PolarHBondContact O-N 3.46Å; L9-Y13 VanDerWaalsContact O-N 3.11Å; L9-I27 HydrophobicContact CD2-CD1 4.32Å; L9-I27 HydrophobicContact CD2-CG2 3.55Å; L9-I37 HydrophobicContact CD2-CG2 4.01Å; L9-I37 HydrophobicContact CG-CG2 3.92Å; L9-R38 HydrophobicContact CD2-CB 4.05Å; L9-H41 HydrophobicContact CD1-CB 3.52Å
10A98.7Very high98.3Very high24 Ų2452.1 Ų52.120%0.19829%0.293CS..Hα-helixtrans-61.8-27.8-179.900000113.2G6 L7 H12 F137 F141G6-A10 VanDerWaalsContact O-CB 3.3Å; G6-A10 WeakPolarHBondContact O-CB 3.45Å; G6-A10 PolarHBondContact O-N 3.03Å; L7-A10 PolarHBondContact O-N 2.89Å; A10-H12 PolarHBondContact O-N 2.8Å; A10-F137 HydrophobicContact CB-CE2 4.17Å; A10-F137 HydrophobicContact CB-CZ 4.09Å; A10-F141 HydrophobicContact CB-CD2 4.37Å; A10-F141 HydrophobicContact CB-CE2 4.21Å
11M98.7Very high98.3Very high130 Ų13052.2 Ų52.264%0.6429%0.291SS*.THydrogen-bonded Turntrans-64.6-17.4174.8-67.2173.6-170.900113.6L7 F8 L9L7-M11 WeakPolarHBondContact O-CG 3.36Å; L7-M11 PolarHBondContact O-N 2.76Å; F8-M11 HydrophobicContact CD1-SD 4.36Å; F8-M11 PolarHBondContact O-N 3.43Å; L9-M11 PolarHBondContact O-N 3.34Å
12H98.6Very high98.3Very high82 Ų8250.8 Ų50.838%0.3829%0.289SS..THydrogen-bonded Turntrans-123.8-3.4-175-61.8-68.4000113.6F8 L9 A10 I27 V31F8-H12 PolarHBondContact O-CD2 2.88Å; L9-H12 PolarHBondContact O-N 2.82Å; A10-H12 PolarHBondContact O-N 2.8Å; H12-I27 HydrophobicContact CB-CD1 3.83Å; H12-I27 HydrophobicContact CB-CG1 3.48Å; H12-I27 VanDerWaalsContact CB-CG1 3.48Å; H12-V31 HydrophobicContact CB-CG2 4.46Å
13Y98.8Very high98.3Very high22 Ų2249.7 Ų49.79%0.08629%0.285CS..  trans-92.4143.1-176.3175.1-107.3000111.8L9 P15 A20 S23 I24 L91 L133 F137L9-Y13 WeakPolarHBondContact O-CB 3.5Å; L9-Y13 PolarHBondContact O-N 3.46Å; L9-Y13 VanDerWaalsContact O-N 3.11Å; Y13-P15 HydrophobicContact CD1-CB 4.42Å; Y13-P15 HydrophobicContact CE1-CB 3.7Å; Y13-A20 HydrophobicContact CE2-CB 3.96Å; Y13-S23 VanDerWaalsContact CD2-OG 3.25Å; Y13-S23 WeakPolarHBondContact CD2-OG 3.41Å; Y13-I24 HydrophobicContact CD2-CD1 3.72Å; Y13-I24 HydrophobicContact CD2-CG1 4.1Å; Y13-I24 HydrophobicContact CE2-CD1 4.17Å; Y13-I24 HydrophobicContact CE2-CG1 4.19Å; Y13-L91 HydrophobicContact CE1-CB 4.43Å; Y13-L91 HydrophobicContact CE2-CB 4.4Å; Y13-L91 WeakPolarHBondContact CE2-O 3.32Å; Y13-L91 PolarHBondContact OH-O 3.34Å; Y13-L133 WeakPolarHBondContact OH-CD1 3.34Å; Y13-F137 AromaticContact CD1-CD2 3.64Å; Y13-F137 HydrophobicContact CD1-CD2 3.64Å; Y13-F137 AromaticContact CD1-CE2 3.65Å; Y13-F137 HydrophobicContact CD1-CE2 3.65Å; Y13-F137 HydrophobicContact CD1-CG 4.31Å; Y13-F137 HydrophobicContact CD1-CZ 4.34Å; Y13-F137 HydrophobicContact CE1-CB 4.31Å; Y13-F137 AromaticContact CE1-CD2 3.6Å; Y13-F137 HydrophobicContact CE1-CD2 3.6Å; Y13-F137 HydrophobicContact CE1-CE2 4.13Å; Y13-F137 HydrophobicContact CE1-CG 4.01Å
14S98.2Very high98.3Very high45 Ų4547.9 Ų47.932%0.31528%0.276SS..  trans-118.1113176.8-178.10000110.9D16 T19 A20 S23S14-D16 PolarHBondContact O-N 3.35Å; S14-T19 WeakPolarHBondContact CB-OG1 3.4Å; S14-T19 PolarHBondContact OG-OG1 3.38Å; S14-A20 VanDerWaalsContact O-CA 3.25Å; S14-A20 WeakPolarHBondContact O-CA 3.47Å; S14-S23 PolarHBondContact N-OG 3.4Å
15P96.9Very high98.3Very high34 Ų3445.4 Ų45.422%0.22126%0.263CS..  trans-84.353.9-173.536.4-38.4000113.3Y13 T134 F137Y13-P15 HydrophobicContact CD1-CB 4.42Å; Y13-P15 HydrophobicContact CE1-CB 3.7Å; P15-T134 PolarHBondContact O-OG1 3.5Å; P15-F137 HydrophobicContact CB-CB 3.79Å; P15-F137 HydrophobicContact CB-CD1 3.95Å; P15-F137 HydrophobicContact CB-CG 3.91Å; P15-F137 HydrophobicContact CG-CD1 3.92Å; P15-F137 HydrophobicContact CG-CE1 4.42Å; P15-F137 HydrophobicContact CG-CG 4.38Å
16D96.9Very high98.3Very high56 Ų5648.7 Ų48.730%0.29928%0.278SS..SBendtrans-128.9139.4174.1175-96.6000110.8S14 S18 T19 A20 S130S14-D16 PolarHBondContact O-N 3.35Å; D16-S18 PolarHBondContact O-N 3.06Å; D16-S18 VanDerWaalsContact O-N 3.07Å; D16-S18 VanDerWaalsContact OD1-CB 3.29Å; D16-S18 WeakPolarHBondContact OD1-CB 3.36Å; D16-S18 PolarHBondContact OD1-N 3.21Å; D16-S18 PolarHBondContact OD1-OG 3.32Å; D16-T19 CarbonylContact O-C 3.6Å; D16-T19 PolarHBondContact O-N 3.44Å; D16-A20 VanDerWaalsContact O-CB 3.28Å; D16-A20 WeakPolarHBondContact O-CB 3.3Å; D16-A20 PolarHBondContact O-N 2.82Å; D16-S130 PolarHBondContact OD2-OG 2.86Å
17A96.1Very high98.3Very high19 Ų1947.9 Ų47.916%0.15727%0.269CS..THydrogen-bonded Turntrans-57.3-28.4-17400000113.7W93 S130A17-W93 HydrophobicContact CB-CZ2 3.79Å; A17-S130 VanDerWaalsContact CB-OG 3.24Å; A17-S130 WeakPolarHBondContact CB-OG 3.5Å; A17-S130 PolarHBondContact N-OG 3.24Å
18S97.5Very high98.3Very high97 Ų9746.2 Ų46.268%0.67826%0.261SS*.THydrogen-bonded Turntrans-79.2-20.7178.273.80000113.8D16D16-S18 PolarHBondContact O-N 3.06Å; D16-S18 VanDerWaalsContact O-N 3.07Å; D16-S18 VanDerWaalsContact OD1-CB 3.29Å; D16-S18 WeakPolarHBondContact OD1-CB 3.36Å; D16-S18 PolarHBondContact OD1-N 3.21Å; D16-S18 PolarHBondContact OD1-OG 3.32Å
19T98.2Very high98.3Very high47 Ų4751.1 Ų51.129%0.28828%0.277SS..THydrogen-bonded Turntrans-124.7-13.1-172.556.20000114.9S14 D16 S22 S23S14-T19 WeakPolarHBondContact CB-OG1 3.4Å; S14-T19 PolarHBondContact OG-OG1 3.38Å; D16-T19 CarbonylContact O-C 3.6Å; D16-T19 PolarHBondContact O-N 3.44Å; T19-S22 WeakPolarHBondContact CA-OG 3.45Å; T19-S22 PolarHBondContact O-N 2.92Å; T19-S22 PolarHBondContact O-OG 2.94Å; T19-S23 VanDerWaalsContact O-CB 3.27Å; T19-S23 WeakPolarHBondContact O-CB 3.37Å; T19-S23 PolarHBondContact O-N 3.49Å; T19-S23 PolarHBondContact O-OG 3.46Å
20A98.6Very high98.2Very high0 Ų055.3 Ų55.30%030%0.299CS..Hα-helixtrans-60.3-53.4-175.300000112.4Y13 S14 D16 S22 S23 I24 W93 L133Y13-A20 HydrophobicContact CE2-CB 3.96Å; S14-A20 VanDerWaalsContact O-CA 3.25Å; S14-A20 WeakPolarHBondContact O-CA 3.47Å; D16-A20 VanDerWaalsContact O-CB 3.28Å; D16-A20 WeakPolarHBondContact O-CB 3.3Å; D16-A20 PolarHBondContact O-N 2.82Å; A20-S22 PolarHBondContact O-N 3.26Å; A20-S23 PolarHBondContact O-N 3.34Å; A20-S23 PolarHBondContact O-OG 3.13Å; A20-I24 PolarHBondContact O-N 3.35Å; A20-I24 VanDerWaalsContact O-N 3.11Å; A20-W93 HydrophobicContact CB-CB 3.85Å; A20-W93 HydrophobicContact CB-CG 4.43Å; A20-L133 HydrophobicContact CB-CD2 3.54Å
21F98.6Very high98.3Very high56 Ų5655.4 Ų55.425%0.24630%0.297CS..Hα-helixtrans-60.2-44.4179.2-171.8-88.1000112.3I24 A25 P92 W93 Y214 L216F21-I24 PolarHBondContact O-N 2.69Å; F21-A25 PolarHBondContact O-N 2.9Å; F21-A25 VanDerWaalsContact O-N 3.07Å; F21-P92 WeakPolarHBondContact CA-O 3.49Å; F21-P92 VanDerWaalsContact CD2-O 3.31Å; F21-P92 WeakPolarHBondContact CD2-O 3.3Å; F21-W93 HydrophobicContact CB-CB 4.49Å; F21-Y214 WeakPolarHBondContact CZ-O 3.46Å; F21-L216 HydrophobicContact CB-CD1 3.46Å; F21-L216 VanDerWaalsContact CB-CD1 3.46Å; F21-L216 HydrophobicContact CD1-CB 4.35Å; F21-L216 HydrophobicContact CD1-CD1 4.24Å; F21-L216 HydrophobicContact CD2-CB 4.44Å; F21-L216 HydrophobicContact CD2-CD1 4.17Å; F21-L216 HydrophobicContact CE1-CB 4.5Å; F21-L216 HydrophobicContact CG-CB 4.33Å; F21-L216 HydrophobicContact CG-CD1 3.71Å
22S98.6Very high98.2Very high63 Ų6356.1 Ų56.144%0.44130%0.304SS..Hα-helixtrans-70-32.4178.957.60000112.5T19 A20 A25 H26T19-S22 WeakPolarHBondContact CA-OG 3.45Å; T19-S22 PolarHBondContact O-N 2.92Å; T19-S22 PolarHBondContact O-OG 2.94Å; A20-S22 PolarHBondContact O-N 3.26Å; S22-A25 WeakPolarHBondContact O-CB 3.47Å; S22-A25 PolarHBondContact O-N 3.32Å; S22-H26 WeakPolarHBondContact O-CB 3.33Å; S22-H26 PolarHBondContact O-N 3.36Å
23S98.7Very high98.2Very high11 Ų1160.5 Ų60.58%0.07732%0.318CS..Hα-helixtrans-66.1-37.4174.475.60000112.2Y13 S14 T19 A20 H26 I27Y13-S23 VanDerWaalsContact CD2-OG 3.25Å; Y13-S23 WeakPolarHBondContact CD2-OG 3.41Å; S14-S23 PolarHBondContact N-OG 3.4Å; T19-S23 VanDerWaalsContact O-CB 3.27Å; T19-S23 WeakPolarHBondContact O-CB 3.37Å; T19-S23 PolarHBondContact O-N 3.49Å; T19-S23 PolarHBondContact O-OG 3.46Å; A20-S23 PolarHBondContact O-N 3.34Å; A20-S23 PolarHBondContact O-OG 3.13Å; S23-H26 PolarHBondContact O-N 3.16Å; S23-I27 VanDerWaalsContact O-CG1 3.32Å; S23-I27 WeakPolarHBondContact O-CG1 3.36Å; S23-I27 PolarHBondContact O-N 2.74Å
24I98.6Very high98.2Very high21 Ų2159.6 Ų59.611%0.10832%0.315CS..Hα-helixtrans-66.3-40171.7-66.6-58.5000111.4Y13 A20 F21 I27 T28 P92Y13-I24 HydrophobicContact CD2-CD1 3.72Å; Y13-I24 HydrophobicContact CD2-CG1 4.1Å; Y13-I24 HydrophobicContact CE2-CD1 4.17Å; Y13-I24 HydrophobicContact CE2-CG1 4.19Å; A20-I24 PolarHBondContact O-N 3.35Å; A20-I24 VanDerWaalsContact O-N 3.11Å; F21-I24 PolarHBondContact O-N 2.69Å; I24-I27 HydrophobicContact CD1-CD1 4.15Å; I24-I27 PolarHBondContact O-N 3.35Å; I24-T28 PolarHBondContact O-N 3.46Å; I24-T28 PolarHBondContact O-OG1 3.44Å; I24-P92 HydrophobicContact CG1-CB 4.45Å
25A98.4Very high98.3Very high28 Ų2862.5 Ų62.523%0.23132%0.319CS..Hα-helixtrans-62.3-44.3174.100000111.5F21 S22 T28 R29F21-A25 PolarHBondContact O-N 2.9Å; F21-A25 VanDerWaalsContact O-N 3.07Å; S22-A25 WeakPolarHBondContact O-CB 3.47Å; S22-A25 PolarHBondContact O-N 3.32Å; A25-T28 PolarHBondContact O-N 2.99Å; A25-T28 VanDerWaalsContact O-N 3.13Å; A25-R29 WeakPolarHBondContact O-CB 3.32Å; A25-R29 WeakPolarHBondContact O-CG 3.4Å; A25-R29 PolarHBondContact O-N 3.15Å
26H98.8Very high98.4Very high82 Ų8262.4 Ų62.438%0.3832%0.317SS..Hα-helixtrans-60.1-46.5174.8167.5-91.8000112S22 S23 T28 R29 D30 V31S22-H26 WeakPolarHBondContact O-CB 3.33Å; S22-H26 PolarHBondContact O-N 3.36Å; S23-H26 PolarHBondContact O-N 3.16Å; H26-T28 PolarHBondContact O-N 3.03Å; H26-R29 PolarHBondContact O-N 3.37Å; H26-D30 IonicContact CD2-OD2 3.31Å; H26-D30 PolarHBondContact CD2-OD2 3.05Å; H26-D30 VanDerWaalsContact CD2-OD2 3.31Å; H26-D30 IonicContact CG-OD2 3.9Å; H26-D30 PolarHBondContact O-N 3.41Å; H26-V31 PolarHBondContact O-N 2.95Å
27I98.8Very high98.4Very high2 Ų261.6 Ų61.61%0.0131%0.312CS..Hα-helixtrans-53.6-43.4172.8-75164.7000110.8L9 H12 S23 I24 G34 R38L9-I27 HydrophobicContact CD2-CD1 4.32Å; L9-I27 HydrophobicContact CD2-CG2 3.55Å; H12-I27 HydrophobicContact CB-CD1 3.83Å; H12-I27 HydrophobicContact CB-CG1 3.48Å; H12-I27 VanDerWaalsContact CB-CG1 3.48Å; S23-I27 VanDerWaalsContact O-CG1 3.32Å; S23-I27 WeakPolarHBondContact O-CG1 3.36Å; S23-I27 PolarHBondContact O-N 2.74Å; I24-I27 HydrophobicContact CD1-CD1 4.15Å; I24-I27 PolarHBondContact O-N 3.35Å; I27-G34 CarbonylContact O-C 3.59Å; I27-G34 WeakPolarHBondContact O-CA 3.39Å; I27-R38 HydrophobicContact CG2-CB 4.42Å
28T98.4Very high98.6Very high27 Ų2762.9 Ų62.917%0.16631%0.313CS..Hα-helixtrans-74.1-33.5-175.1-48.90000112.1I24 A25 H26 W35 R38I24-T28 PolarHBondContact O-N 3.46Å; I24-T28 PolarHBondContact O-OG1 3.44Å; A25-T28 PolarHBondContact O-N 2.99Å; A25-T28 VanDerWaalsContact O-N 3.13Å; H26-T28 PolarHBondContact O-N 3.03Å; T28-W35 HydrophobicContact CG2-CB 3.9Å; T28-W35 WeakPolarHBondContact O-CB 3.41Å; T28-R38 WeakPolarHBondContact OG1-CD 3.48Å; T28-R38 PolarHBondContact OG1-NH1 3.11Å
29R98.6Very high98.6Very high206 Ų20659.8 Ų59.878%0.77729%0.286SS*.Hα-helixtrans-102.3-37.1-168.6-66.4176.7179.1-169.1-0114A25 H26A25-R29 WeakPolarHBondContact O-CB 3.32Å; A25-R29 WeakPolarHBondContact O-CG 3.4Å; A25-R29 PolarHBondContact O-N 3.15Å; H26-R29 PolarHBondContact O-N 3.37Å
30D98.6Very high98.7Very high110 Ų11058.9 Ų58.959%0.58828%0.28SS*.THydrogen-bonded Turntrans-115.3-24.8-164.8-52.3-46.9000112.8H26H26-D30 IonicContact CD2-OD2 3.31Å; H26-D30 PolarHBondContact CD2-OD2 3.05Å; H26-D30 VanDerWaalsContact CD2-OD2 3.31Å; H26-D30 IonicContact CG-OD2 3.9Å; H26-D30 PolarHBondContact O-N 3.41Å
31V98.8Very high98.7Very high26 Ų2660.5 Ų60.516%0.15829%0.287CS..SBendtrans-80.6129.6176.6179.10000110.2H12 H26 Y33 G34H12-V31 HydrophobicContact CB-CG2 4.46Å; H26-V31 PolarHBondContact O-N 2.95Å; V31-Y33 PolarHBondContact O-N 2.7Å; V31-Y33 VanDerWaalsContact O-N 3.15Å; V31-G34 PolarHBondContact O-N 3.26Å
32N98.6Very high98.7Very high145 Ų14560.3 Ų60.378%0.77530%0.296SS*.THydrogen-bonded Turntrans-54.2120.5175.8-68.6-37.9000111G34N32-G34 PolarHBondContact O-N 2.9Å; N32-G34 VanDerWaalsContact O-N 3.1Å
33Y98.6Very high98.7Very high174 Ų17457.5 Ų57.568%0.68228%0.276SS*.THydrogen-bonded Turntrans57.614.4-174.4-56-78.9000114.9V31 W35 I36 I37V31-Y33 PolarHBondContact O-N 2.7Å; V31-Y33 VanDerWaalsContact O-N 3.15Å; Y33-W35 VanDerWaalsContact C-N 3.32Å; Y33-W35 PolarHBondContact O-N 2.91Å; Y33-I36 HydrophobicContact CD1-CG2 4.29Å; Y33-I36 WeakPolarHBondContact O-CG2 3.28Å; Y33-I36 PolarHBondContact O-N 3.48Å; Y33-I37 WeakPolarHBondContact O-CG1 3.5Å; Y33-I37 PolarHBondContact O-N 3.47Å; Y33-I37 VanDerWaalsContact O-N 3.13Å
34G98.8Very high98.7Very high2 Ų257.1 Ų57.12%0.02127%0.273CS..Hα-helixtrans-65.9-33.7-178.100000112.8I27 V31 N32 I36 I37 R38I27-G34 CarbonylContact O-C 3.59Å; I27-G34 WeakPolarHBondContact O-CA 3.39Å; V31-G34 PolarHBondContact O-N 3.26Å; N32-G34 PolarHBondContact O-N 2.9Å; N32-G34 VanDerWaalsContact O-N 3.1Å; G34-I36 PolarHBondContact O-N 3Å; G34-I37 PolarHBondContact O-N 2.97Å; G34-R38 WeakPolarHBondContact O-CB 3.5Å; G34-R38 PolarHBondContact O-N 2.9Å
35W98.6Very high98.7Very high107 Ų10757 Ų5741%0.40528%0.276SS..Hα-helixtrans-57.7-47.9172.968.5-90.8000112.4T28 Y33 R38 Y39 L202T28-W35 HydrophobicContact CG2-CB 3.9Å; T28-W35 WeakPolarHBondContact O-CB 3.41Å; Y33-W35 VanDerWaalsContact C-N 3.32Å; Y33-W35 PolarHBondContact O-N 2.91Å; W35-R38 PolarHBondContact O-N 2.96Å; W35-Y39 HydrophobicContact CE3-CD2 4.24Å; W35-Y39 WeakPolarHBondContact O-CD2 3.49Å; W35-Y39 PolarHBondContact O-N 3.37Å; W35-L202 HydrophobicContact CH2-CD2 4.01Å; W35-L202 HydrophobicContact CZ3-CD2 4.31Å
36I98.7Very high98.7Very high32 Ų3256 Ų5616%0.16427%0.267CS..Hα-helixtrans-71.4-37-177.2-171.3168.1000110.7Y33 G34 R38 Y39 L40 M198 T201 L202Y33-I36 HydrophobicContact CD1-CG2 4.29Å; Y33-I36 WeakPolarHBondContact O-CG2 3.28Å; Y33-I36 PolarHBondContact O-N 3.48Å; G34-I36 PolarHBondContact O-N 3Å; I36-R38 VanDerWaalsContact C-N 3.34Å; I36-R38 PolarHBondContact O-N 3.27Å; I36-Y39 PolarHBondContact O-N 3.04Å; I36-L40 HydrophobicContact CG1-CD1 4.08Å; I36-L40 HydrophobicContact CG1-CG 4.2Å; I36-L40 VanDerWaalsContact O-CB 3.23Å; I36-L40 WeakPolarHBondContact O-CB 3.4Å; I36-L40 WeakPolarHBondContact O-CG 3.47Å; I36-L40 PolarHBondContact O-N 3.25Å; I36-M198 HydrophobicContact CD1-CE 4.25Å; I36-T201 HydrophobicContact CG1-CG2 4.32Å; I36-L202 HydrophobicContact CD1-CD2 3.94Å
37I98.8Very high98.7Very high39 Ų3953 Ų5320%0.225%0.254CS..Hα-helixtrans-61.9-44.2174-63.5170.2000110.3T5 F8 L9 Y33 G34 H41T5-I37 HydrophobicContact CG2-CG2 4.31Å; F8-I37 HydrophobicContact CB-CD1 4.32Å; F8-I37 HydrophobicContact CB-CG2 4.14Å; L9-I37 HydrophobicContact CD2-CG2 4.01Å; L9-I37 HydrophobicContact CG-CG2 3.92Å; Y33-I37 WeakPolarHBondContact O-CG1 3.5Å; Y33-I37 PolarHBondContact O-N 3.47Å; Y33-I37 VanDerWaalsContact O-N 3.13Å; G34-I37 PolarHBondContact O-N 2.97Å; I37-H41 WeakPolarHBondContact O-CB 3.32Å; I37-H41 PolarHBondContact O-N 3.44Å
38R98.8Very high98.7Very high46 Ų4656.6 Ų56.617%0.17427%0.269CS..Hα-helixtrans-59.9-51.9176.6-179.3-171.5172.2-169.2-2.9111.3L9 I27 T28 G34 W35 I36 H41 A42L9-R38 HydrophobicContact CD2-CB 4.05Å; I27-R38 HydrophobicContact CG2-CB 4.42Å; T28-R38 WeakPolarHBondContact OG1-CD 3.48Å; T28-R38 PolarHBondContact OG1-NH1 3.11Å; G34-R38 WeakPolarHBondContact O-CB 3.5Å; G34-R38 PolarHBondContact O-N 2.9Å; W35-R38 PolarHBondContact O-N 2.96Å; I36-R38 VanDerWaalsContact C-N 3.34Å; I36-R38 PolarHBondContact O-N 3.27Å; R38-H41 WeakPolarHBondContact O-CB 3.48Å; R38-H41 PolarHBondContact O-N 3.18Å; R38-H41 VanDerWaalsContact O-N 3.16Å; R38-A42 PolarHBondContact O-N 2.82Å
39Y98.8Very high98.7Very high32 Ų3255.4 Ų55.413%0.12526%0.262CS..Hα-helixtrans-71.3-31.2-177.6-72-63.9000112.9W35 I36 H41 A42 N43 P205 D206 Y214W35-Y39 HydrophobicContact CE3-CD2 4.24Å; W35-Y39 WeakPolarHBondContact O-CD2 3.49Å; W35-Y39 PolarHBondContact O-N 3.37Å; I36-Y39 PolarHBondContact O-N 3.04Å; Y39-H41 VanDerWaalsContact C-N 3.3Å; Y39-H41 PolarHBondContact O-N 3.36Å; Y39-A42 PolarHBondContact O-N 3.42Å; Y39-N43 VanDerWaalsContact O-CB 3.27Å; Y39-N43 WeakPolarHBondContact O-CB 3.24Å; Y39-N43 PolarHBondContact O-N 3.46Å; Y39-N43 PolarHBondContact O-ND2 2.96Å; Y39-P205 HydrophobicContact CD1-CB 3.56Å; Y39-P205 HydrophobicContact CD2-CB 4.14Å; Y39-P205 HydrophobicContact CE1-CB 3.8Å; Y39-P205 HydrophobicContact CE2-CB 4.37Å; Y39-P205 HydrophobicContact CG-CB 3.74Å; Y39-D206 WeakPolarHBondContact CE1-OD1 3.24Å; Y39-Y214 PolarHBondContact OH-OH 3.44Å
40L98.9Very high98.8Very high28 Ų2848.5 Ų48.515%0.14724%0.24CC..Hα-helixtrans-61.8-39.7168.7-78.8172.5000111.6T5 I36 G44 L197 M198 T201T5-L40 HydrophobicContact CG2-CB 4.14Å; I36-L40 HydrophobicContact CG1-CD1 4.08Å; I36-L40 HydrophobicContact CG1-CG 4.2Å; I36-L40 VanDerWaalsContact O-CB 3.23Å; I36-L40 WeakPolarHBondContact O-CB 3.4Å; I36-L40 WeakPolarHBondContact O-CG 3.47Å; I36-L40 PolarHBondContact O-N 3.25Å; L40-G44 WeakPolarHBondContact O-CA 3.18Å; L40-G44 PolarHBondContact O-N 3.34Å; L40-L197 HydrophobicContact CD2-CD2 3.97Å; L40-L197 HydrophobicContact CD2-CG 4.09Å; L40-M198 HydrophobicContact CD2-SD 3.77Å; L40-T201 HydrophobicContact CD2-CG2 4.17Å; L40-T201 HydrophobicContact CG-CG2 4.15Å
41H98.9Very high98.8Very high33 Ų3346 Ų4615%0.15323%0.23CC..Hα-helixtrans-69.3-44.1177.3-164.681.7000111.9Q2 T5 G6 L9 I37 R38 Y39 A45 H140Q2-H41 PolarHBondContact NE2-O 3.01Å; Q2-H41 PolarHBondContact O-CE1 2.86Å; Q2-H41 VanDerWaalsContact O-CE1 3.27Å; Q2-H41 PolarHBondContact O-ND1 2.85Å; T5-H41 PolarHBondContact OG1-ND1 3.47Å; G6-H41 VanDerWaalsContact CA-CE1 3.47Å; G6-H41 WeakPolarHBondContact CA-CE1 3.28Å; G6-H41 PolarHBondContact N-ND1 3.35Å; L9-H41 HydrophobicContact CD1-CB 3.52Å; I37-H41 WeakPolarHBondContact O-CB 3.32Å; I37-H41 PolarHBondContact O-N 3.44Å; R38-H41 WeakPolarHBondContact O-CB 3.48Å; R38-H41 PolarHBondContact O-N 3.18Å; R38-H41 VanDerWaalsContact O-N 3.16Å; Y39-H41 VanDerWaalsContact C-N 3.3Å; Y39-H41 PolarHBondContact O-N 3.36Å; H41-A45 PolarHBondContact O-N 3.02Å; H41-A45 VanDerWaalsContact O-N 3.16Å; H41-H140 AromaticContact NE2-NE2 3.87Å
42A98.8Very high98.8Very high52 Ų5246 Ų4643%0.4323%0.229SC..Hα-helixtrans-67-53.9179.300000112.2R38 Y39 G44 A45R38-A42 PolarHBondContact O-N 2.82Å; Y39-A42 PolarHBondContact O-N 3.42Å; A42-G44 VanDerWaalsContact C-N 3.3Å; A42-G44 PolarHBondContact O-N 3.3Å; A42-A45 WeakPolarHBondContact O-CB 3.44Å; A42-A45 PolarHBondContact O-N 3.02Å
43N98.9Very high98.8Very high5 Ų542.3 Ų42.33%0.02721%0.207CC..Hα-helixtrans-69.5-30.1178-71.6-49.5000112Y39 A45 S46 M47 L197 L200 P205Y39-N43 VanDerWaalsContact O-CB 3.27Å; Y39-N43 WeakPolarHBondContact O-CB 3.24Å; Y39-N43 PolarHBondContact O-N 3.46Å; Y39-N43 PolarHBondContact O-ND2 2.96Å; N43-A45 VanDerWaalsContact C-N 3.26Å; N43-A45 PolarHBondContact O-N 2.99Å; N43-S46 WeakPolarHBondContact O-CB 3.44Å; N43-S46 PolarHBondContact O-N 3.47Å; N43-M47 WeakPolarHBondContact O-CG 3.19Å; N43-M47 PolarHBondContact O-N 2.75Å; N43-L197 HydrophobicContact CB-CD1 3.88Å; N43-L200 HydrophobicContact CB-CD2 3.78Å; N43-L200 HydrophobicContact CB-CG 4.17Å; N43-L200 WeakPolarHBondContact OD1-CD2 3.5Å; N43-P205 PolarHBondContact ND2-O 2.83Å; N43-P205 PolarHBondContact OD1-O 3.32Å
44G98.9Very high98.8Very high2 Ų239.8 Ų39.82%0.02120%0.204CC..Hα-helixtrans-60.8-33171.800000113.2L40 A42 M47 F48L40-G44 WeakPolarHBondContact O-CA 3.18Å; L40-G44 PolarHBondContact O-N 3.34Å; A42-G44 VanDerWaalsContact C-N 3.3Å; A42-G44 PolarHBondContact O-N 3.3Å; G44-M47 PolarHBondContact O-N 3.08Å; G44-F48 WeakPolarHBondContact O-CB 3.24Å; G44-F48 PolarHBondContact O-N 3.1Å
45A98.8Very high98.8Very high20 Ų2044 Ų4417%0.16522%0.223CC..Hα-helixtrans-65.2-45.3172.800000111.6H41 A42 N43 M47 F48 F49H41-A45 PolarHBondContact O-N 3.02Å; H41-A45 VanDerWaalsContact O-N 3.16Å; A42-A45 WeakPolarHBondContact O-CB 3.44Å; A42-A45 PolarHBondContact O-N 3.02Å; N43-A45 VanDerWaalsContact C-N 3.26Å; N43-A45 PolarHBondContact O-N 2.99Å; A45-M47 PolarHBondContact O-N 3.45Å; A45-F48 VanDerWaalsContact O-CB 3.25Å; A45-F48 WeakPolarHBondContact O-CB 3.31Å; A45-F48 PolarHBondContact O-N 2.98Å; A45-F49 WeakPolarHBondContact O-CD2 3.41Å; A45-F49 PolarHBondContact O-N 3.41Å; A45-F49 VanDerWaalsContact O-N 3.14Å
46S98.8Very high98.8Very high7 Ų740.2 Ų40.25%0.04921%0.211CC..Hα-helixtrans-60.6-46.3174.4-70.90000112N43 F48 F49 I50 W230N43-S46 WeakPolarHBondContact O-CB 3.44Å; N43-S46 PolarHBondContact O-N 3.47Å; S46-F48 PolarHBondContact O-N 2.83Å; S46-F49 PolarHBondContact O-N 3.45Å; S46-F49 VanDerWaalsContact O-N 3.13Å; S46-I50 WeakPolarHBondContact O-CG1 3.37Å; S46-I50 PolarHBondContact O-N 2.89Å; S46-W230 PolarHBondContact OG-NE1 3.17Å
47M98.7Very high98.8Very high19 Ų1939.2 Ų39.29%0.09421%0.208CC..Hα-helixtrans-61.8-33.4176.6-67.6-57.8-65.100112.2N43 G44 A45 I50 C51 F193 S196 L197N43-M47 WeakPolarHBondContact O-CG 3.19Å; N43-M47 PolarHBondContact O-N 2.75Å; G44-M47 PolarHBondContact O-N 3.08Å; A45-M47 PolarHBondContact O-N 3.45Å; M47-I50 PolarHBondContact O-N 3.25Å; M47-I50 HydrophobicContact SD-CD1 3.95Å; M47-C51 PolarHBondContact O-N 3.06Å; M47-C51 PolarHBondContact O-SG 3.44Å; M47-C51 VanDerWaalsContact O-SG 3.34Å; M47-F193 HydrophobicContact CB-CE2 3.68Å; M47-F193 HydrophobicContact CB-CZ 3.9Å; M47-F193 HydrophobicContact CE-CD2 3.98Å; M47-F193 HydrophobicContact CE-CE2 4.02Å; M47-F193 HydrophobicContact CG-CE2 4.48Å; M47-S196 WeakPolarHBondContact CE-OG 3.47Å; M47-L197 HydrophobicContact CG-CB 4.28Å; M47-L197 HydrophobicContact CG-CD1 3.87Å
48F98.7Very high98.8Very high77 Ų7743.1 Ų43.134%0.33822%0.22SC..Hα-helixtrans-59.6-50.7172.4-154.8-47.2000110.6Q2 G44 A45 S46 I50 C51 L52 T81Q2-F48 HydrophobicContact CG-CD2 4.12Å; G44-F48 WeakPolarHBondContact O-CB 3.24Å; G44-F48 PolarHBondContact O-N 3.1Å; A45-F48 VanDerWaalsContact O-CB 3.25Å; A45-F48 WeakPolarHBondContact O-CB 3.31Å; A45-F48 PolarHBondContact O-N 2.98Å; S46-F48 PolarHBondContact O-N 2.83Å; F48-I50 PolarHBondContact O-N 2.86Å; F48-C51 WeakPolarHBondContact O-CB 3.44Å; F48-C51 PolarHBondContact O-N 3.45Å; F48-C51 VanDerWaalsContact O-N 3.17Å; F48-L52 HydrophobicContact CD1-CD1 3.58Å; F48-L52 HydrophobicContact CD1-CG 3.72Å; F48-L52 HydrophobicContact CE1-CD1 3.7Å; F48-L52 HydrophobicContact CE1-CD2 4.14Å; F48-L52 HydrophobicContact CE1-CG 3.78Å; F48-L52 PolarHBondContact O-N 3.32Å; F48-T81 HydrophobicContact CD1-CG2 4.05Å; F48-T81 HydrophobicContact CE1-CG2 3.93Å; F48-T81 HydrophobicContact CG-CG2 4.47Å; F48-T81 HydrophobicContact CZ-CG2 4.2Å
49F98.8Very high98.8Very high2 Ų241.1 Ų41.11%0.00921%0.214CC..Hα-helixtrans-65.4-36.9179.8-81.8-79.9000113.4A45 S46 C51 L52 F53 T81 M82 A85 W230 Y231 F232A45-F49 WeakPolarHBondContact O-CD2 3.41Å; A45-F49 PolarHBondContact O-N 3.41Å; A45-F49 VanDerWaalsContact O-N 3.14Å; S46-F49 PolarHBondContact O-N 3.45Å; S46-F49 VanDerWaalsContact O-N 3.13Å; F49-C51 VanDerWaalsContact C-N 3.33Å; F49-C51 PolarHBondContact O-N 3.49Å; F49-L52 HydrophobicContact CD1-CD1 4.28Å; F49-L52 HydrophobicContact CE1-CD1 4.41Å; F49-L52 PolarHBondContact O-N 2.94Å; F49-F53 HydrophobicContact CB-CD2 4.48Å; F49-F53 HydrophobicContact CB-CE2 4.02Å; F49-F53 HydrophobicContact CB-CZ 4.37Å; F49-F53 HydrophobicContact CD1-CE1 4.23Å; F49-F53 HydrophobicContact CD1-CE2 4.31Å; F49-F53 AromaticContact CD1-CZ 3.8Å; F49-F53 HydrophobicContact CD1-CZ 3.8Å; F49-F53 WeakPolarHBondContact O-CD2 3.41Å; F49-F53 VanDerWaalsContact O-CG 3.26Å; F49-F53 WeakPolarHBondContact O-CG 3.4Å; F49-F53 PolarHBondContact O-N 3.38Å; F49-T81 HydrophobicContact CZ-CG2 4.26Å; F49-M82 HydrophobicContact CE1-CG 3.91Å; F49-M82 HydrophobicContact CZ-CG 4.27Å; F49-A85 HydrophobicContact CE2-CB 3.5Å; F49-A85 HydrophobicContact CZ-CB 3.84Å; F49-W230 HydrophobicContact CB-CH2 4.2Å; F49-W230 HydrophobicContact CB-CZ2 4.27Å; F49-Y231 HydrophobicContact CB-CD1 4.11Å; F49-Y231 HydrophobicContact CB-CG 3.99Å; F49-Y231 HydrophobicContact CD1-CD2 4.29Å; F49-Y231 HydrophobicContact CD1-CG 4.11Å; F49-Y231 AromaticContact CD2-CD1 3.54Å; F49-Y231 HydrophobicContact CD2-CD1 3.54Å; F49-Y231 AromaticContact CD2-CD2 3.71Å; F49-Y231 HydrophobicContact CD2-CD2 3.71Å; F49-Y231 AromaticContact CD2-CE1 3.9Å; F49-Y231 HydrophobicContact CD2-CE1 3.9Å; F49-Y231 HydrophobicContact CD2-CE2 4.05Å; F49-Y231 AromaticContact CD2-CG 3.45Å; F49-Y231 HydrophobicContact CD2-CG 3.45Å; F49-Y231 VanDerWaalsContact CD2-CG 3.45Å; F49-Y231 HydrophobicContact CE1-CD2 4.23Å; F49-Y231 HydrophobicContact CE2-CD1 4.2Å; F49-Y231 AromaticContact CE2-CD2 3.64Å; F49-Y231 HydrophobicContact CE2-CD2 3.64Å; F49-Y231 HydrophobicContact CE2-CE1 4.25Å; F49-Y231 AromaticContact CE2-CE2 3.71Å; F49-Y231 HydrophobicContact CE2-CE2 3.71Å; F49-Y231 AromaticContact CE2-CG 3.91Å; F49-Y231 HydrophobicContact CE2-CG 3.91Å; F49-Y231 AromaticContact CG-CD1 3.95Å; F49-Y231 HydrophobicContact CG-CD1 3.95Å; F49-Y231 HydrophobicContact CG-CD2 4.05Å; F49-Y231 AromaticContact CG-CG 3.57Å; F49-Y231 HydrophobicContact CG-CG 3.57Å; F49-Y231 AromaticContact CZ-CD2 3.91Å; F49-Y231 HydrophobicContact CZ-CD2 3.91Å; F49-Y231 HydrophobicContact CZ-CE2 4.2Å; F49-Y231 HydrophobicContact CZ-CG 4.41Å; F49-F232 HydrophobicContact CZ-CE1 4.46Å; F49-F232 HydrophobicContact CZ-CZ 4.33Å
50I98.8Very high98.8Very high61 Ų6141 Ų4131%0.31322%0.215SC..Hα-helixtrans-56.9-49.8171.1-66.2170.6000109.9S46 M47 F48 L52 F53 L54 W230S46-I50 WeakPolarHBondContact O-CG1 3.37Å; S46-I50 PolarHBondContact O-N 2.89Å; M47-I50 PolarHBondContact O-N 3.25Å; M47-I50 HydrophobicContact SD-CD1 3.95Å; F48-I50 PolarHBondContact O-N 2.86Å; I50-L52 PolarHBondContact O-N 3.4Å; I50-F53 PolarHBondContact O-N 3.19Å; I50-L54 HydrophobicContact CG2-CD1 3.98Å; I50-L54 WeakPolarHBondContact O-CB 3.33Å; I50-L54 VanDerWaalsContact O-CG 3.29Å; I50-L54 WeakPolarHBondContact O-CG 3.47Å; I50-L54 PolarHBondContact O-N 3.48Å; I50-W230 HydrophobicContact CD1-CH2 4.43Å; I50-W230 HydrophobicContact CD1-CZ2 4.3Å; I50-W230 HydrophobicContact CG1-CH2 3.54Å; I50-W230 HydrophobicContact CG1-CZ2 3.77Å
51C98.9Very high98.8Very high58 Ų5841.2 Ų41.239%0.39221%0.214SC..Hα-helixtrans-61.7-40.9177.2-70.20000112.6M47 F48 F49 H55M47-C51 PolarHBondContact O-N 3.06Å; M47-C51 PolarHBondContact O-SG 3.44Å; M47-C51 VanDerWaalsContact O-SG 3.34Å; F48-C51 WeakPolarHBondContact O-CB 3.44Å; F48-C51 PolarHBondContact O-N 3.45Å; F48-C51 VanDerWaalsContact O-N 3.17Å; F49-C51 VanDerWaalsContact C-N 3.33Å; F49-C51 PolarHBondContact O-N 3.49Å; C51-H55 WeakPolarHBondContact O-CB 3.4Å; C51-H55 PolarHBondContact O-N 3.32Å
52L98.8Very high98.8Very high26 Ų2643 Ų4314%0.13622%0.22CC..Hα-helixtrans-63-49.1177.6-81.3172000112F48 F49 I50 L54 H55 I56 L78 T81F48-L52 HydrophobicContact CD1-CD1 3.58Å; F48-L52 HydrophobicContact CD1-CG 3.72Å; F48-L52 HydrophobicContact CE1-CD1 3.7Å; F48-L52 HydrophobicContact CE1-CD2 4.14Å; F48-L52 HydrophobicContact CE1-CG 3.78Å; F48-L52 PolarHBondContact O-N 3.32Å; F49-L52 HydrophobicContact CD1-CD1 4.28Å; F49-L52 HydrophobicContact CE1-CD1 4.41Å; F49-L52 PolarHBondContact O-N 2.94Å; I50-L52 PolarHBondContact O-N 3.4Å; L52-L54 VanDerWaalsContact C-N 3.35Å; L52-L54 PolarHBondContact O-N 2.87Å; L52-H55 WeakPolarHBondContact O-CB 3.27Å; L52-H55 PolarHBondContact O-N 3.18Å; L52-H55 VanDerWaalsContact O-N 3.16Å; L52-I56 VanDerWaalsContact O-CG1 3.28Å; L52-I56 WeakPolarHBondContact O-CG1 3.29Å; L52-I56 PolarHBondContact O-N 3.1Å; L52-L78 HydrophobicContact CD1-CD1 4.39Å; L52-T81 HydrophobicContact CD1-CG2 3.74Å
53F98.8Very high98.8Very high67 Ų6740.6 Ų40.629%0.29420%0.2SC..Hα-helixtrans-64.3-40.6-179.6-61.9-34.6000111.8F49 I50 H55 I56 G57 W230 Y231 F234F49-F53 HydrophobicContact CB-CD2 4.48Å; F49-F53 HydrophobicContact CB-CE2 4.02Å; F49-F53 HydrophobicContact CB-CZ 4.37Å; F49-F53 HydrophobicContact CD1-CE1 4.23Å; F49-F53 HydrophobicContact CD1-CE2 4.31Å; F49-F53 AromaticContact CD1-CZ 3.8Å; F49-F53 HydrophobicContact CD1-CZ 3.8Å; F49-F53 WeakPolarHBondContact O-CD2 3.41Å; F49-F53 VanDerWaalsContact O-CG 3.26Å; F49-F53 WeakPolarHBondContact O-CG 3.4Å; F49-F53 PolarHBondContact O-N 3.38Å; I50-F53 PolarHBondContact O-N 3.19Å; F53-H55 VanDerWaalsContact C-N 3.35Å; F53-I56 PolarHBondContact O-N 2.94Å; F53-G57 PolarHBondContact O-N 3.48Å; F53-W230 HydrophobicContact CD2-CH2 4.35Å; F53-W230 HydrophobicContact CD2-CZ3 4.28Å; F53-W230 HydrophobicContact CE2-CH2 4.17Å; F53-W230 AromaticContact CE2-CZ3 3.96Å; F53-W230 HydrophobicContact CE2-CZ3 3.96Å; F53-Y231 WeakPolarHBondContact CZ-O 3.43Å; F53-F234 HydrophobicContact CE1-CE1 4.42Å; F53-F234 HydrophobicContact CZ-CE1 4.19Å
54L98.8Very high98.8Very high120 Ų12041.4 Ų41.463%0.62821%0.206SC*.Hα-helixtrans-63.2-40.8172.5-69.4174000112I50 L52 G57 R58I50-L54 HydrophobicContact CG2-CD1 3.98Å; I50-L54 WeakPolarHBondContact O-CB 3.33Å; I50-L54 VanDerWaalsContact O-CG 3.29Å; I50-L54 WeakPolarHBondContact O-CG 3.47Å; I50-L54 PolarHBondContact O-N 3.48Å; L52-L54 VanDerWaalsContact C-N 3.35Å; L52-L54 PolarHBondContact O-N 2.87Å; L54-G57 PolarHBondContact O-N 3.15Å; L54-R58 WeakPolarHBondContact O-CB 3.47Å; L54-R58 PolarHBondContact O-N 3.42Å
55H98.9Very high98.8Very high90 Ų9041.8 Ų41.842%0.41721%0.207SC..Hα-helixtrans-65-43.3178.7-171.693.4000112.1C51 L52 F53 R58 G59C51-H55 WeakPolarHBondContact O-CB 3.4Å; C51-H55 PolarHBondContact O-N 3.32Å; L52-H55 WeakPolarHBondContact O-CB 3.27Å; L52-H55 PolarHBondContact O-N 3.18Å; L52-H55 VanDerWaalsContact O-N 3.16Å; F53-H55 VanDerWaalsContact C-N 3.35Å; H55-R58 PolarHBondContact CE1-NH2 3.49Å; H55-R58 VanDerWaalsContact CE1-NH2 3.3Å; H55-G59 PolarHBondContact O-N 3.25Å
56I98.9Very high98.8Very high29 Ų2943.9 Ų43.915%0.14922%0.215CC..Hα-helixtrans-65-48174.8-66.7162.8000110L52 F53 R58 G59 L60 W71 L78 L259L52-I56 VanDerWaalsContact O-CG1 3.28Å; L52-I56 WeakPolarHBondContact O-CG1 3.29Å; L52-I56 PolarHBondContact O-N 3.1Å; F53-I56 PolarHBondContact O-N 2.94Å; I56-R58 VanDerWaalsContact C-N 3.32Å; I56-R58 PolarHBondContact O-N 3.29Å; I56-G59 CarbonylContact O-C 3.48Å; I56-G59 WeakPolarHBondContact O-CA 3.27Å; I56-G59 PolarHBondContact O-N 3.48Å; I56-L60 HydrophobicContact CG2-CD1 4.15Å; I56-L60 HydrophobicContact CG2-CG 4.4Å; I56-L60 WeakPolarHBondContact O-CG 3.47Å; I56-L60 PolarHBondContact O-N 3.19Å; I56-W71 HydrophobicContact CG2-CH2 4.18Å; I56-L78 HydrophobicContact CD1-CD1 4.06Å; I56-L78 HydrophobicContact CD1-CD2 3.82Å; I56-L78 HydrophobicContact CD1-CG 4.41Å; I56-L259 HydrophobicContact CG2-CD1 4.48Å; I56-L259 HydrophobicContact CG2-CD2 4.14Å
57G98.8Very high98.7Very high10 Ų1045.9 Ų45.910%0.10322%0.222CC..Hα-helixtrans-57-44177.600000112.4F53 L54 G59 L60 Y61 Y283F53-G57 PolarHBondContact O-N 3.48Å; L54-G57 PolarHBondContact O-N 3.15Å; G57-G59 VanDerWaalsContact C-N 3.31Å; G57-G59 PolarHBondContact O-N 3.18Å; G57-L60 PolarHBondContact O-N 2.85Å; G57-Y61 WeakPolarHBondContact O-CB 3.42Å; G57-Y61 PolarHBondContact O-N 3.31Å; G57-Y283 WeakPolarHBondContact CA-OH 3.36Å; G57-Y283 PolarHBondContact O-OH 3.08Å
58R98.9Very high98.7Very high122 Ų12247.3 Ų47.346%0.4623%0.234SC..Hα-helixtrans-56.6-46170.7-175.3-79.3-69.5-101.7-1.7111.1L54 H55 I56 L60 Y61 Y62L54-R58 WeakPolarHBondContact O-CB 3.47Å; L54-R58 PolarHBondContact O-N 3.42Å; H55-R58 PolarHBondContact CE1-NH2 3.49Å; H55-R58 VanDerWaalsContact CE1-NH2 3.3Å; I56-R58 VanDerWaalsContact C-N 3.32Å; I56-R58 PolarHBondContact O-N 3.29Å; R58-L60 VanDerWaalsContact C-N 3.34Å; R58-L60 PolarHBondContact O-N 2.91Å; R58-Y61 PolarHBondContact O-N 3.49Å; R58-Y62 HydrophobicContact CG-CD2 3.75Å; R58-Y62 HydrophobicContact CG-CE2 4.03Å; R58-Y62 WeakPolarHBondContact O-CD2 3.43Å; R58-Y62 PolarHBondContact O-N 3.36Å
59G98.8Very high98.6Very high4 Ų448.7 Ų48.74%0.04124%0.241CC..Hα-helixtrans-59.4-43.2178.200000112.9H55 I56 G57 G63 S64 F65H55-G59 PolarHBondContact O-N 3.25Å; I56-G59 CarbonylContact O-C 3.48Å; I56-G59 WeakPolarHBondContact O-CA 3.27Å; I56-G59 PolarHBondContact O-N 3.48Å; G57-G59 VanDerWaalsContact C-N 3.31Å; G57-G59 PolarHBondContact O-N 3.18Å; G59-G63 CarbonylContact O-C 2.89Å; G59-G63 PolarHBondContact O-N 2.93Å; G59-S64 PolarHBondContact O-N 2.88Å; G59-F65 WeakPolarHBondContact O-CD1 3.4Å
60L98.8Very high98.6Very high28 Ų2849.2 Ų49.215%0.14724%0.244CC..Hα-helixtrans-66.2-49.7175.6-66.1174.1000112.1I56 G57 R58 Y62 G63 F65 W71 L259 I262 Y283I56-L60 HydrophobicContact CG2-CD1 4.15Å; I56-L60 HydrophobicContact CG2-CG 4.4Å; I56-L60 WeakPolarHBondContact O-CG 3.47Å; I56-L60 PolarHBondContact O-N 3.19Å; G57-L60 PolarHBondContact O-N 2.85Å; R58-L60 VanDerWaalsContact C-N 3.34Å; R58-L60 PolarHBondContact O-N 2.91Å; L60-Y62 PolarHBondContact O-N 2.93Å; L60-G63 PolarHBondContact O-N 3.41Å; L60-F65 HydrophobicContact CD2-CD1 4.21Å; L60-W71 HydrophobicContact CD2-CH2 3.86Å; L60-W71 HydrophobicContact CD2-CZ2 4.03Å; L60-W71 HydrophobicContact CG-CH2 4.12Å; L60-L259 HydrophobicContact CD2-CD2 4.46Å; L60-I262 HydrophobicContact CD2-CD1 4.47Å; L60-I262 HydrophobicContact CD2-CG1 4.12Å; L60-I262 HydrophobicContact CD2-CG2 3.88Å; L60-Y283 HydrophobicContact CB-CE2 4.14Å
61Y98.8Very high98.6Very high34 Ų3447.4 Ų47.413%0.13323%0.234CC..Hα-helixtrans-65-42.7-174.9-169.3-92.2000112.8G57 R58 M273 Q280 Y283G57-Y61 WeakPolarHBondContact O-CB 3.42Å; G57-Y61 PolarHBondContact O-N 3.31Å; R58-Y61 PolarHBondContact O-N 3.49Å; Y61-M273 HydrophobicContact CD2-CB 4.38Å; Y61-M273 HydrophobicContact CD2-SD 4.32Å; Y61-M273 HydrophobicContact CE1-CB 4.5Å; Y61-M273 HydrophobicContact CE2-CB 4.29Å; Y61-M273 VanDerWaalsContact O-CB 3.27Å; Y61-M273 WeakPolarHBondContact O-CB 3.36Å; Y61-M273 VanDerWaalsContact O-CG 3.27Å; Y61-M273 WeakPolarHBondContact O-CG 3.44Å; Y61-M273 PolarHBondContact O-N 3.07Å; Y61-Q280 HydrophobicContact CE2-CB 4.49Å; Y61-Q280 HydrophobicContact CE2-CG 4.1Å; Y61-Q280 VanDerWaalsContact OH-CD 3.31Å; Y61-Q280 WeakPolarHBondContact OH-CG 3.35Å; Y61-Y283 AromaticContact CD2-CD1 3.46Å; Y61-Y283 HydrophobicContact CD2-CD1 3.46Å; Y61-Y283 VanDerWaalsContact CD2-CD1 3.46Å; Y61-Y283 HydrophobicContact CD2-CD2 4.05Å; Y61-Y283 AromaticContact CD2-CE1 3.64Å; Y61-Y283 HydrophobicContact CD2-CE1 3.64Å; Y61-Y283 HydrophobicContact CD2-CE2 4.2Å; Y61-Y283 AromaticContact CD2-CG 3.68Å; Y61-Y283 HydrophobicContact CD2-CG 3.68Å; Y61-Y283 AromaticContact CE2-CD1 3.95Å; Y61-Y283 HydrophobicContact CE2-CD1 3.95Å; Y61-Y283 HydrophobicContact CE2-CE1 4.34Å; Y61-Y283 HydrophobicContact CE2-CG 4.35Å; Y61-Y283 HydrophobicContact CG-CE1 4.45Å
62Y98.8Very high98.6Very high71 Ų7148 Ų4828%0.27823%0.233SC..THydrogen-bonded Turntrans-93.34.2-178-63.2-66.5000113.8R58 L60 S64 N164 P166 S272R58-Y62 HydrophobicContact CG-CD2 3.75Å; R58-Y62 HydrophobicContact CG-CE2 4.03Å; R58-Y62 WeakPolarHBondContact O-CD2 3.43Å; R58-Y62 PolarHBondContact O-N 3.36Å; L60-Y62 PolarHBondContact O-N 2.93Å; Y62-S64 VanDerWaalsContact C-N 3.32Å; Y62-S64 PolarHBondContact O-N 3.24Å; Y62-N164 PolarHBondContact O-ND2 3.43Å; Y62-P166 HydrophobicContact CD1-CB 4.23Å; Y62-P166 HydrophobicContact CE1-CB 3.69Å; Y62-P166 HydrophobicContact CE1-CG 4.37Å; Y62-S272 WeakPolarHBondContact CD1-OG 3.38Å
63G98.6Very high98.6Very high1 Ų147.5 Ų47.51%0.0123%0.231CC..THydrogen-bonded Turntrans66.332-179.700000113.5G59 L60 F65 L66 Q271G59-G63 CarbonylContact O-C 2.89Å; G59-G63 PolarHBondContact O-N 2.93Å; L60-G63 PolarHBondContact O-N 3.41Å; G63-F65 PolarHBondContact O-N 3.47Å; G63-L66 PolarHBondContact O-N 3.47Å; G63-Q271 WeakPolarHBondContact O-CG 3.14Å; G63-Q271 PolarHBondContact O-NE2 3.04Å
64S98.7Very high98.6Very high21 Ų2145.4 Ų45.415%0.14723%0.228CC..G310 helixtrans-75.4-14.1179.3-46.80000112.4G59 Y62 L66 Y67 N164G59-S64 PolarHBondContact O-N 2.88Å; Y62-S64 VanDerWaalsContact C-N 3.32Å; Y62-S64 PolarHBondContact O-N 3.24Å; S64-L66 PolarHBondContact O-N 3.49Å; S64-Y67 PolarHBondContact O-N 3.44Å; S64-Y67 VanDerWaalsContact O-N 3.16Å; S64-N164 PolarHBondContact OG-ND2 2.83Å; S64-N164 VanDerWaalsContact OG-ND2 3.17Å
65F98.6Very high98.6Very high10 Ų1040.3 Ų40.34%0.04420%0.201CC..G310 helixtrans-62.5-14.517256.6-106.6000113.7G59 L60 G63 Y67 W71 I262 P263 H266G59-F65 WeakPolarHBondContact O-CD1 3.4Å; L60-F65 HydrophobicContact CD2-CD1 4.21Å; G63-F65 PolarHBondContact O-N 3.47Å; F65-Y67 PolarHBondContact O-N 2.82Å; F65-W71 HydrophobicContact CB-CB 4.42Å; F65-W71 HydrophobicContact CB-CD2 3.32Å; F65-W71 VanDerWaalsContact CB-CE2 3.47Å; F65-W71 HydrophobicContact CB-CE3 3.63Å; F65-W71 HydrophobicContact CB-CG 3.69Å; F65-W71 HydrophobicContact CB-CH2 4.17Å; F65-W71 HydrophobicContact CB-CZ2 3.9Å; F65-W71 HydrophobicContact CB-CZ3 4.05Å; F65-I262 HydrophobicContact CB-CG2 4.37Å; F65-I262 HydrophobicContact CD1-CG2 3.51Å; F65-I262 HydrophobicContact CD2-CG2 3.8Å; F65-I262 HydrophobicContact CE1-CG2 3.57Å; F65-I262 HydrophobicContact CE2-CG2 3.89Å; F65-I262 HydrophobicContact CG-CG2 3.63Å; F65-I262 HydrophobicContact CZ-CG2 3.76Å; F65-P263 HydrophobicContact CB-CG 4.34Å; F65-P263 HydrophobicContact CD2-CB 4.32Å; F65-P263 HydrophobicContact CD2-CG 4.2Å; F65-P263 WeakPolarHBondContact O-CG 3.41Å; F65-H266 HydrophobicContact CE2-CB 3.96Å; F65-H266 AromaticContact CE2-ND1 3.75Å; F65-H266 HydrophobicContact CZ-CB 4.48Å; F65-H266 AromaticContact CZ-ND1 3.61Å
66L98.3Very high98.6Very high64 Ų6440.1 Ų40.134%0.33520%0.202SC..G310 helixtrans-67.1-16.6173.6-65.3-178000112.9G63 S64 S68 H266 Q271G63-L66 PolarHBondContact O-N 3.47Å; S64-L66 PolarHBondContact O-N 3.49Å; L66-S68 PolarHBondContact O-N 3.48Å; L66-H266 HydrophobicContact CD2-CB 4.22Å; L66-Q271 HydrophobicContact CD1-CB 4.15Å; L66-Q271 HydrophobicContact CD1-CG 3.74Å
67Y98.2Very high98.6Very high50 Ų5039.8 Ų39.820%0.19620%0.2CC..SBendtrans-80.776.6165.5-56.1-39000109.3S64 F65 E69 T70 W71 T161 N164S64-Y67 PolarHBondContact O-N 3.44Å; S64-Y67 VanDerWaalsContact O-N 3.16Å; F65-Y67 PolarHBondContact O-N 2.82Å; Y67-E69 VanDerWaalsContact C-N 3.35Å; Y67-E69 PolarHBondContact O-N 3.47Å; Y67-T70 WeakPolarHBondContact O-CB 3.44Å; Y67-T70 PolarHBondContact O-N 3.29Å; Y67-T70 VanDerWaalsContact O-N 3.14Å; Y67-W71 WeakPolarHBondContact O-CB 3.23Å; Y67-W71 PolarHBondContact O-N 3.43Å; Y67-T161 HydrophobicContact CD1-CG2 4.14Å; Y67-T161 HydrophobicContact CE1-CG2 4.38Å; Y67-N164 HydrophobicContact CE2-CB 3.74Å
68S97.3Very high98.6Very high48 Ų4839.6 Ų39.634%0.33620%0.197SC..Hα-helixtrans-51.9-45.1-166.1-60.70000114.3L66 W71 N72L66-S68 PolarHBondContact O-N 3.48Å; S68-W71 PolarHBondContact O-N 2.85Å; S68-N72 VanDerWaalsContact O-CB 3.28Å; S68-N72 WeakPolarHBondContact O-CB 3.48Å; S68-N72 PolarHBondContact O-N 2.91Å; S68-N72 PolarHBondContact O-ND2 3.49Å
69E98.3Very high98.6Very high106 Ų10637.2 Ų37.250%0.49519%0.193SC..Hα-helixtrans-65.4-49.4-179.6-61.477.2-173.500110.7Y67 W71 N72 I73 F157Y67-E69 VanDerWaalsContact C-N 3.35Å; Y67-E69 PolarHBondContact O-N 3.47Å; E69-W71 VanDerWaalsContact C-N 3.33Å; E69-W71 PolarHBondContact O-N 3.07Å; E69-N72 PolarHBondContact O-N 2.91Å; E69-I73 WeakPolarHBondContact O-CD1 3.39Å; E69-I73 WeakPolarHBondContact O-CG1 3.2Å; E69-I73 PolarHBondContact O-N 3.04Å; E69-F157 HydrophobicContact CB-CB 4.09Å; E69-F157 HydrophobicContact CB-CD1 3.46Å; E69-F157 VanDerWaalsContact CB-CD1 3.46Å; E69-F157 HydrophobicContact CB-CD2 4.21Å; E69-F157 HydrophobicContact CB-CE1 3.84Å; E69-F157 HydrophobicContact CB-CG 3.66Å; E69-F157 HydrophobicContact CB-CZ 4.33Å; E69-F157 HydrophobicContact CG-CD1 3.85Å; E69-F157 HydrophobicContact CG-CE1 3.82Å; E69-F157 HydrophobicContact CG-CZ 4.46Å
70T98.8Very high98.6Very high13 Ų1337.8 Ų37.88%0.0820%0.197CC..Hα-helixtrans-58.8-46.9176.7-59.60000110.1Y67 I73 G74 H154 F157 L158Y67-T70 WeakPolarHBondContact O-CB 3.44Å; Y67-T70 PolarHBondContact O-N 3.29Å; Y67-T70 VanDerWaalsContact O-N 3.14Å; T70-I73 PolarHBondContact O-N 2.85Å; T70-G74 PolarHBondContact O-N 3.38Å; T70-H154 WeakPolarHBondContact CG2-CE1 3.5Å; T70-H154 PolarHBondContact O-CE1 3.36Å; T70-H154 PolarHBondContact O-ND1 3.08Å; T70-F157 WeakPolarHBondContact OG1-CB 3.18Å; T70-L158 HydrophobicContact CG2-CB 4.2Å; T70-L158 HydrophobicContact CG2-CD1 4.49Å; T70-L158 PolarHBondContact OG1-N 3.31Å
71W98.8Very high98.6Very high24 Ų2436.9 Ų36.99%0.09119%0.193CC..Hα-helixtrans-62.7-48.4180-177-107.7000112.8I56 L60 F65 Y67 S68 E69 I73 G74 I75 L259I56-W71 HydrophobicContact CG2-CH2 4.18Å; L60-W71 HydrophobicContact CD2-CH2 3.86Å; L60-W71 HydrophobicContact CD2-CZ2 4.03Å; L60-W71 HydrophobicContact CG-CH2 4.12Å; F65-W71 HydrophobicContact CB-CB 4.42Å; F65-W71 HydrophobicContact CB-CD2 3.32Å; F65-W71 VanDerWaalsContact CB-CE2 3.47Å; F65-W71 HydrophobicContact CB-CE3 3.63Å; F65-W71 HydrophobicContact CB-CG 3.69Å; F65-W71 HydrophobicContact CB-CH2 4.17Å; F65-W71 HydrophobicContact CB-CZ2 3.9Å; F65-W71 HydrophobicContact CB-CZ3 4.05Å; Y67-W71 WeakPolarHBondContact O-CB 3.23Å; Y67-W71 PolarHBondContact O-N 3.43Å; S68-W71 PolarHBondContact O-N 2.85Å; E69-W71 VanDerWaalsContact C-N 3.33Å; E69-W71 PolarHBondContact O-N 3.07Å; W71-I73 PolarHBondContact O-N 3.45Å; W71-G74 CarbonylContact O-C 3.44Å; W71-G74 VanDerWaalsContact O-CA 3.27Å; W71-G74 WeakPolarHBondContact O-CA 3.43Å; W71-G74 PolarHBondContact O-N 3.19Å; W71-I75 PolarHBondContact O-N 3.49Å; W71-L259 HydrophobicContact CH2-CD2 4.42Å; W71-L259 HydrophobicContact CZ2-CB 4.2Å; W71-L259 HydrophobicContact CZ2-CD2 3.98Å; W71-L259 PolarHBondContact NE1-O 3.03Å
72N98.7Very high98.6Very high71 Ų7136.7 Ų36.738%0.3819%0.194SC..Hα-helixtrans-65.4-38.3-179.2-72.7-32.7000111.9S68 E69 G74 I75 I76S68-N72 VanDerWaalsContact O-CB 3.28Å; S68-N72 WeakPolarHBondContact O-CB 3.48Å; S68-N72 PolarHBondContact O-N 2.91Å; S68-N72 PolarHBondContact O-ND2 3.49Å; E69-N72 PolarHBondContact O-N 2.91Å; N72-G74 VanDerWaalsContact C-N 3.27Å; N72-G74 PolarHBondContact O-N 2.92Å; N72-I75 WeakPolarHBondContact O-CB 3.29Å; N72-I75 PolarHBondContact O-N 2.95Å; N72-I76 WeakPolarHBondContact O-CG1 3.27Å; N72-I76 PolarHBondContact O-N 3.17Å; N72-I76 VanDerWaalsContact O-N 3.1Å
73I98.8Very high98.6Very high15 Ų1535.1 Ų35.18%0.07720%0.196CC..Hα-helixtrans-65-35.8170.6-65.7162.1000110.8E69 T70 W71 I75 I76 L77 L153 H154 F157E69-I73 WeakPolarHBondContact O-CD1 3.39Å; E69-I73 WeakPolarHBondContact O-CG1 3.2Å; E69-I73 PolarHBondContact O-N 3.04Å; T70-I73 PolarHBondContact O-N 2.85Å; W71-I73 PolarHBondContact O-N 3.45Å; I73-I75 VanDerWaalsContact C-N 3.3Å; I73-I75 PolarHBondContact O-N 3.31Å; I73-I76 PolarHBondContact O-N 3.49Å; I73-L77 HydrophobicContact CG2-CD1 4.2Å; I73-L77 HydrophobicContact CG2-CG 4.43Å; I73-L77 WeakPolarHBondContact O-CB 3.46Å; I73-L77 WeakPolarHBondContact O-CG 3.2Å; I73-L77 PolarHBondContact O-N 3Å; I73-L153 HydrophobicContact CD1-CD2 3.92Å; I73-L153 HydrophobicContact CD1-CG 3.8Å; I73-L153 HydrophobicContact CG1-CD2 4.5Å; I73-H154 HydrophobicContact CB-CB 4.46Å; I73-H154 HydrophobicContact CG2-CB 3.69Å; I73-F157 HydrophobicContact CD1-CD2 3.16Å; I73-F157 HydrophobicContact CD1-CE2 3.44Å; I73-F157 VanDerWaalsContact CD1-CE2 3.44Å; I73-F157 HydrophobicContact CD1-CG 4.22Å
74G98.8Very high98.6Very high23 Ų2335.7 Ų35.724%0.23720%0.199CC..Hα-helixtrans-57.6-39.8171.800000113.1T70 W71 N72 L77 L78T70-G74 PolarHBondContact O-N 3.38Å; W71-G74 CarbonylContact O-C 3.44Å; W71-G74 VanDerWaalsContact O-CA 3.27Å; W71-G74 WeakPolarHBondContact O-CA 3.43Å; W71-G74 PolarHBondContact O-N 3.19Å; N72-G74 VanDerWaalsContact C-N 3.27Å; N72-G74 PolarHBondContact O-N 2.92Å; G74-L77 WeakPolarHBondContact O-CB 3.45Å; G74-L77 PolarHBondContact O-N 2.49Å; G74-L78 PolarHBondContact O-N 3.4Å
75I98.8Very high98.6Very high13 Ų1335.4 Ų35.47%0.06720%0.198CC..Hα-helixtrans-66.2-42.2174.4-61.4168.6000110.8W71 N72 I73 L77 L78 L79 L259 A260W71-I75 PolarHBondContact O-N 3.49Å; N72-I75 WeakPolarHBondContact O-CB 3.29Å; N72-I75 PolarHBondContact O-N 2.95Å; I73-I75 VanDerWaalsContact C-N 3.3Å; I73-I75 PolarHBondContact O-N 3.31Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-L77 PolarHBondContact O-N 3.13Å; I75-L78 WeakPolarHBondContact O-CB 3.26Å; I75-L78 PolarHBondContact O-N 3.46Å; I75-L79 HydrophobicContact CG2-CD1 4.24Å; I75-L79 WeakPolarHBondContact O-CG 3.5Å; I75-L79 PolarHBondContact O-N 3.03Å; I75-L259 HydrophobicContact CD1-CB 3.79Å; I75-L259 HydrophobicContact CG1-CB 3.95Å; I75-A260 HydrophobicContact CD1-CB 3.87Å
76I98.8Very high98.6Very high86 Ų8636.4 Ų36.444%0.44120%0.202SC..Hα-helixtrans-62.6-42.6175.7-62.1169.5000110.6N72 I73 L78 L79 A80 L150N72-I76 WeakPolarHBondContact O-CG1 3.27Å; N72-I76 PolarHBondContact O-N 3.17Å; N72-I76 VanDerWaalsContact O-N 3.1Å; I73-I76 PolarHBondContact O-N 3.49Å; I76-L78 VanDerWaalsContact C-N 3.35Å; I76-L78 PolarHBondContact O-N 3.17Å; I76-L79 PolarHBondContact O-N 3.05Å; I76-A80 WeakPolarHBondContact O-CB 3.19Å; I76-A80 PolarHBondContact O-N 3.45Å; I76-L150 HydrophobicContact CG2-CD1 3.88Å; I76-L150 HydrophobicContact CG2-CD2 4.31Å
77L98.9Very high98.6Very high21 Ų2134.2 Ų34.211%0.1119%0.191CC..Hα-helixtrans-60.2-42.5174.6-80.7167.2000112.1I73 G74 I75 T81 I147 L150 A151 H154I73-L77 HydrophobicContact CG2-CD1 4.2Å; I73-L77 HydrophobicContact CG2-CG 4.43Å; I73-L77 WeakPolarHBondContact O-CB 3.46Å; I73-L77 WeakPolarHBondContact O-CG 3.2Å; I73-L77 PolarHBondContact O-N 3Å; G74-L77 WeakPolarHBondContact O-CB 3.45Å; G74-L77 PolarHBondContact O-N 2.49Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-L77 PolarHBondContact O-N 3.13Å; L77-T81 WeakPolarHBondContact O-CB 3.28Å; L77-T81 PolarHBondContact O-N 3.46Å; L77-T81 PolarHBondContact O-OG1 3.14Å; L77-I147 HydrophobicContact CD2-CG2 3.88Å; L77-I147 WeakPolarHBondContact CD2-O 3.4Å; L77-L150 HydrophobicContact CD2-CB 3.54Å; L77-L150 HydrophobicContact CG-CB 4.04Å; L77-A151 HydrophobicContact CD2-CB 4.34Å; L77-H154 HydrophobicContact CD1-CB 3.79Å
78L98.8Very high98.7Very high7 Ų732.7 Ų32.74%0.03719%0.19CC..Hα-helixtrans-59.1-53.7174.7174.263.6000110.5L52 I56 G74 I75 I76 A80 T81 M82 I256 L259L52-L78 HydrophobicContact CD1-CD1 4.39Å; I56-L78 HydrophobicContact CD1-CD1 4.06Å; I56-L78 HydrophobicContact CD1-CD2 3.82Å; I56-L78 HydrophobicContact CD1-CG 4.41Å; G74-L78 PolarHBondContact O-N 3.4Å; I75-L78 WeakPolarHBondContact O-CB 3.26Å; I75-L78 PolarHBondContact O-N 3.46Å; I76-L78 VanDerWaalsContact C-N 3.35Å; I76-L78 PolarHBondContact O-N 3.17Å; L78-A80 PolarHBondContact O-N 3.45Å; L78-T81 PolarHBondContact O-N 3.48Å; L78-T81 VanDerWaalsContact O-N 3.16Å; L78-M82 HydrophobicContact CD1-CG 4.14Å; L78-M82 HydrophobicContact CD1-SD 4.05Å; L78-M82 HydrophobicContact CG-CG 4.45Å; L78-M82 HydrophobicContact CG-SD 3.93Å; L78-M82 VanDerWaalsContact O-CG 3.26Å; L78-M82 WeakPolarHBondContact O-CG 3.48Å; L78-M82 PolarHBondContact O-N 2.85Å; L78-I256 HydrophobicContact CD2-CG2 3.8Å; L78-L259 HydrophobicContact CD2-CD1 3.75Å
79L98.8Very high98.7Very high71 Ų7132.3 Ų32.337%0.37218%0.181SC..Hα-helixtrans-60.5-42.8-179.5-69.9170.6000112.3I75 I76 T81 M82 A83 I256 L257I75-L79 HydrophobicContact CG2-CD1 4.24Å; I75-L79 WeakPolarHBondContact O-CG 3.5Å; I75-L79 PolarHBondContact O-N 3.03Å; I76-L79 PolarHBondContact O-N 3.05Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 2.88Å; L79-M82 PolarHBondContact O-N 3.16Å; L79-A83 WeakPolarHBondContact O-CB 3.33Å; L79-A83 PolarHBondContact O-N 3.46Å; L79-I256 HydrophobicContact CD2-CG2 3.8Å; L79-I256 HydrophobicContact CG-CG2 4.45Å; L79-L257 HydrophobicContact CD1-CD2 4.21Å
80A98.8Very high98.8Very high16 Ų1627.3 Ų27.313%0.13216%0.158CC..Hα-helixtrans-63.8-39.7176.500000111.9I76 L78 A83 T84 I147I76-A80 WeakPolarHBondContact O-CB 3.19Å; I76-A80 PolarHBondContact O-N 3.45Å; L78-A80 PolarHBondContact O-N 3.45Å; A80-A83 PolarHBondContact O-N 2.86Å; A80-T84 WeakPolarHBondContact O-CB 3.42Å; A80-T84 PolarHBondContact O-N 3.47Å; A80-T84 PolarHBondContact O-OG1 3.04Å; A80-I147 HydrophobicContact CB-CD1 4.17Å; A80-I147 HydrophobicContact CB-CG1 3.75Å
81T98.8Very high98.8Very high10 Ų1027.5 Ų27.56%0.06116%0.158CC..Hα-helixtrans-68.9-41.1177.2-53.40000111.5F48 F49 L52 L77 L78 L79 T84 A85F48-T81 HydrophobicContact CD1-CG2 4.05Å; F48-T81 HydrophobicContact CE1-CG2 3.93Å; F48-T81 HydrophobicContact CG-CG2 4.47Å; F48-T81 HydrophobicContact CZ-CG2 4.2Å; F49-T81 HydrophobicContact CZ-CG2 4.26Å; L52-T81 HydrophobicContact CD1-CG2 3.74Å; L77-T81 WeakPolarHBondContact O-CB 3.28Å; L77-T81 PolarHBondContact O-N 3.46Å; L77-T81 PolarHBondContact O-OG1 3.14Å; L78-T81 PolarHBondContact O-N 3.48Å; L78-T81 VanDerWaalsContact O-N 3.16Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 2.88Å; T81-T84 PolarHBondContact O-N 3.24Å; T81-A85 WeakPolarHBondContact O-CB 3.49Å; T81-A85 PolarHBondContact O-N 3.17Å
82M98.8Very high98.7Very high30 Ų3027.6 Ų27.615%0.14816%0.162CC..Hα-helixtrans-58-49.3172.7-68.5176.177.700111.5F49 L78 L79 T84 A85 F86 F232 I256F49-M82 HydrophobicContact CE1-CG 3.91Å; F49-M82 HydrophobicContact CZ-CG 4.27Å; L78-M82 HydrophobicContact CD1-CG 4.14Å; L78-M82 HydrophobicContact CD1-SD 4.05Å; L78-M82 HydrophobicContact CG-CG 4.45Å; L78-M82 HydrophobicContact CG-SD 3.93Å; L78-M82 VanDerWaalsContact O-CG 3.26Å; L78-M82 WeakPolarHBondContact O-CG 3.48Å; L78-M82 PolarHBondContact O-N 2.85Å; L79-M82 PolarHBondContact O-N 3.16Å; M82-T84 PolarHBondContact O-N 2.88Å; M82-A85 PolarHBondContact O-N 3.16Å; M82-F86 WeakPolarHBondContact O-CB 3.46Å; M82-F86 PolarHBondContact O-N 2.85Å; M82-F232 HydrophobicContact CB-CE1 3.82Å; M82-F232 HydrophobicContact CB-CZ 4.13Å; M82-F232 HydrophobicContact CE-CD1 3.79Å; M82-F232 HydrophobicContact CE-CE1 3.53Å; M82-F232 HydrophobicContact CG-CE1 3.81Å; M82-F232 HydrophobicContact CG-CZ 4.5Å; M82-I256 HydrophobicContact CE-CD1 3.9Å; M82-I256 HydrophobicContact CE-CG1 4.09Å; M82-I256 HydrophobicContact SD-CD1 4.25Å; M82-I256 HydrophobicContact SD-CG1 4.38Å; M82-I256 HydrophobicContact SD-CG2 4.38Å
83A98.7Very high98.7Very high38 Ų3824.7 Ų24.731%0.31415%0.146SC..Hα-helixtrans-60-46.1176.600000111.7L79 A80 A85 F86 M87L79-A83 WeakPolarHBondContact O-CB 3.33Å; L79-A83 PolarHBondContact O-N 3.46Å; A80-A83 PolarHBondContact O-N 2.86Å; A83-A85 PolarHBondContact O-N 3.3Å; A83-F86 PolarHBondContact O-N 2.88Å; A83-M87 VanDerWaalsContact C-CE 3.46Å; A83-M87 HydrophobicContact CB-CE 3.93Å; A83-M87 WeakPolarHBondContact O-CE 3.47Å; A83-M87 PolarHBondContact O-N 3.43Å
84T98.9Very high98.7Very high13 Ų1324 Ų248%0.0814%0.142CC..Hα-helixtrans-59.4-47.8179-57.90000111.5A80 T81 M82 M87 G88 H140 L143 P144 I147A80-T84 WeakPolarHBondContact O-CB 3.42Å; A80-T84 PolarHBondContact O-N 3.47Å; A80-T84 PolarHBondContact O-OG1 3.04Å; T81-T84 PolarHBondContact O-N 3.24Å; M82-T84 PolarHBondContact O-N 2.88Å; T84-M87 PolarHBondContact O-N 2.82Å; T84-G88 PolarHBondContact O-N 3.44Å; T84-H140 PolarHBondContact O-CE1 3.32Å; T84-H140 PolarHBondContact O-ND1 3.18Å; T84-L143 VanDerWaalsContact OG1-CB 3.26Å; T84-L143 WeakPolarHBondContact OG1-CB 3.46Å; T84-P144 HydrophobicContact CG2-CG 3.84Å; T84-I147 WeakPolarHBondContact OG1-CD1 3.41Å
85A98.8Very high98.7Very high15 Ų1523.6 Ų23.612%0.12413%0.134CC..Hα-helixtrans-65.4-45.3-179.500000112.1F49 T81 M82 A83 M87 G88 Y89 Y231F49-A85 HydrophobicContact CE2-CB 3.5Å; F49-A85 HydrophobicContact CZ-CB 3.84Å; T81-A85 WeakPolarHBondContact O-CB 3.49Å; T81-A85 PolarHBondContact O-N 3.17Å; M82-A85 PolarHBondContact O-N 3.16Å; A83-A85 PolarHBondContact O-N 3.3Å; A85-M87 PolarHBondContact O-N 3.02Å; A85-G88 PolarHBondContact O-N 3.11Å; A85-G88 VanDerWaalsContact O-N 3.16Å; A85-Y89 PolarHBondContact O-N 3.35Å; A85-Y231 HydrophobicContact CB-CE2 4.32Å
86F98.7Very high98.6Very high30 Ų3023 Ų2313%0.13213%0.131CC..Hα-helixtrans-54.6-52.2175.1164.4-110.1000111.4M82 A83 G88 Y89 V90 I104 T105 F136 F232M82-F86 WeakPolarHBondContact O-CB 3.46Å; M82-F86 PolarHBondContact O-N 2.85Å; A83-F86 PolarHBondContact O-N 2.88Å; F86-G88 VanDerWaalsContact C-N 3.3Å; F86-G88 PolarHBondContact O-N 2.74Å; F86-Y89 PolarHBondContact O-N 3.44Å; F86-V90 HydrophobicContact CE2-CG2 4.31Å; F86-V90 HydrophobicContact CZ-CG2 4.42Å; F86-V90 WeakPolarHBondContact O-CG2 3.46Å; F86-V90 PolarHBondContact O-N 3.25Å; F86-I104 HydrophobicContact CD2-CD1 3.69Å; F86-I104 HydrophobicContact CD2-CG2 4.29Å; F86-I104 HydrophobicContact CE1-CG2 4.34Å; F86-I104 HydrophobicContact CE2-CB 3.76Å; F86-I104 HydrophobicContact CE2-CD1 3.52Å; F86-I104 HydrophobicContact CE2-CG1 4.2Å; F86-I104 HydrophobicContact CE2-CG2 3.81Å; F86-I104 HydrophobicContact CZ-CB 3.97Å; F86-I104 HydrophobicContact CZ-CG2 3.82Å; F86-T105 HydrophobicContact CE1-CG2 4.33Å; F86-T105 HydrophobicContact CZ-CG2 4.12Å; F86-F136 AromaticContact CE1-CE2 3.8Å; F86-F136 HydrophobicContact CE1-CE2 3.8Å; F86-F136 HydrophobicContact CE1-CZ 4.05Å; F86-F136 HydrophobicContact CZ-CE2 4.06Å; F86-F232 HydrophobicContact CB-CE2 4.29Å; F86-F232 HydrophobicContact CB-CZ 4.42Å
87M98.6Very high98.6Very high19 Ų1918.9 Ų18.99%0.09411%0.11CC..Hα-helixtrans-64.4-36179.1-73.7176.8-82.200112.5A83 T84 A85 Y89 V90 L91 F136 F139 H140 L143A83-M87 VanDerWaalsContact C-CE 3.46Å; A83-M87 HydrophobicContact CB-CE 3.93Å; A83-M87 WeakPolarHBondContact O-CE 3.47Å; A83-M87 PolarHBondContact O-N 3.43Å; T84-M87 PolarHBondContact O-N 2.82Å; A85-M87 PolarHBondContact O-N 3.02Å; M87-Y89 VanDerWaalsContact C-N 3.32Å; M87-Y89 PolarHBondContact O-N 3.39Å; M87-V90 PolarHBondContact O-N 3.1Å; M87-L91 WeakPolarHBondContact O-CG 3.48Å; M87-F136 HydrophobicContact CB-CB 4.32Å; M87-F136 HydrophobicContact CB-CD2 4.37Å; M87-F136 HydrophobicContact CB-CG 4.37Å; M87-F136 HydrophobicContact CG-CB 4.3Å; M87-F136 HydrophobicContact CG-CD1 4.16Å; M87-F136 HydrophobicContact CG-CD2 3.93Å; M87-F136 HydrophobicContact CG-CE2 4.27Å; M87-F136 HydrophobicContact CG-CG 3.89Å; M87-F136 HydrophobicContact SD-CD1 4.26Å; M87-F136 HydrophobicContact SD-CG 4.45Å; M87-F139 HydrophobicContact CE-CB 4.16Å; M87-F139 HydrophobicContact SD-CB 3.43Å; M87-F139 WeakPolarHBondContact SD-CB 3.47Å; M87-F139 HydrophobicContact SD-CD2 4.4Å; M87-F139 HydrophobicContact SD-CG 4.25Å; M87-H140 HydrophobicContact CB-CB 4.1Å; M87-L143 HydrophobicContact CE-CD1 3.24Å
88G98.6Very high98.6Very high17 Ų1718.5 Ų18.518%0.17511%0.107CC..Hα-helixtrans-61.8-39.3175.100000112.7T84 A85 F86 V90 L91 P92 H140T84-G88 PolarHBondContact O-N 3.44Å; A85-G88 PolarHBondContact O-N 3.11Å; A85-G88 VanDerWaalsContact O-N 3.16Å; F86-G88 VanDerWaalsContact C-N 3.3Å; F86-G88 PolarHBondContact O-N 2.74Å; G88-V90 PolarHBondContact O-N 3.26Å; G88-L91 WeakPolarHBondContact O-CB 3.09Å; G88-L91 PolarHBondContact O-N 3.09Å; G88-P92 WeakPolarHBondContact O-CD 3.18Å; G88-H140 WeakPolarHBondContact CA-CE1 3.5Å; G88-H140 VanDerWaalsContact CA-ND1 3.25Å; G88-H140 WeakPolarHBondContact CA-ND1 3.48Å; G88-H140 PolarHBondContact N-ND1 3.48Å
89Y98.6Very high98.5Very high41 Ų4119.7 Ų19.716%0.16111%0.111CC..Hα-helixtrans-69.8-18.5177.7-169.5-110.6000113.5A85 F86 M87 P92 M96 S97 E229A85-Y89 PolarHBondContact O-N 3.35Å; F86-Y89 PolarHBondContact O-N 3.44Å; M87-Y89 VanDerWaalsContact C-N 3.32Å; M87-Y89 PolarHBondContact O-N 3.39Å; Y89-P92 WeakPolarHBondContact O-CD 3.11Å; Y89-M96 HydrophobicContact CE1-CB 3.99Å; Y89-M96 WeakPolarHBondContact OH-CB 3.38Å; Y89-S97 VanDerWaalsContact O-CB 3.28Å; Y89-S97 WeakPolarHBondContact O-CB 3.45Å; Y89-S97 PolarHBondContact O-OG 3.16Å; Y89-E229 WeakPolarHBondContact CB-OE1 3.38Å; Y89-E229 HydrophobicContact CD1-CG 4.07Å; Y89-E229 WeakPolarHBondContact CD1-OE2 3.3Å; Y89-E229 HydrophobicContact CD2-CG 3.68Å; Y89-E229 HydrophobicContact CE1-CG 4.01Å; Y89-E229 WeakPolarHBondContact CE1-OE2 3.34Å; Y89-E229 HydrophobicContact CE2-CG 3.62Å; Y89-E229 HydrophobicContact CG-CG 3.91Å
90V98.7Very high98.4Very high1 Ų116.8 Ų16.81%0.00610%0.098CC..Hα-helixtrans-77-28173.9-178.60000112F86 M87 G88 W93 A101 L133 F136F86-V90 HydrophobicContact CE2-CG2 4.31Å; F86-V90 HydrophobicContact CZ-CG2 4.42Å; F86-V90 WeakPolarHBondContact O-CG2 3.46Å; F86-V90 PolarHBondContact O-N 3.25Å; M87-V90 PolarHBondContact O-N 3.1Å; G88-V90 PolarHBondContact O-N 3.26Å; V90-W93 HydrophobicContact CG1-CE3 4.2Å; V90-W93 HydrophobicContact CG1-CZ3 3.98Å; V90-W93 PolarHBondContact O-N 3.35Å; V90-A101 HydrophobicContact CG1-CB 4Å; V90-A101 HydrophobicContact CG2-CB 3.74Å; V90-L133 HydrophobicContact CG1-CD1 4.36Å; V90-F136 HydrophobicContact CB-CD2 3.89Å; V90-F136 HydrophobicContact CB-CE2 4.5Å; V90-F136 HydrophobicContact CG1-CD2 3.91Å; V90-F136 HydrophobicContact CG1-CE2 4.46Å; V90-F136 HydrophobicContact CG2-CD2 3.86Å; V90-F136 HydrophobicContact CG2-CE2 4Å
91L98.8Very high98.4Very high16 Ų1616 Ų168%0.0849%0.092CC..THydrogen-bonded Turntrans-60.8-35.5-171.4-54.5-174.9000115.2Y13 M87 G88 W93 L133 F136 F137 H140Y13-L91 HydrophobicContact CE1-CB 4.43Å; Y13-L91 HydrophobicContact CE2-CB 4.4Å; Y13-L91 WeakPolarHBondContact CE2-O 3.32Å; Y13-L91 PolarHBondContact OH-O 3.34Å; M87-L91 WeakPolarHBondContact O-CG 3.48Å; G88-L91 WeakPolarHBondContact O-CB 3.09Å; G88-L91 PolarHBondContact O-N 3.09Å; L91-W93 PolarHBondContact O-N 2.82Å; L91-W93 VanDerWaalsContact O-N 3.12Å; L91-L133 HydrophobicContact CD2-CD1 4.01Å; L91-F136 HydrophobicContact CD2-CB 4.46Å; L91-F137 HydrophobicContact CD1-CD2 4.07Å; L91-F137 HydrophobicContact CD2-CB 3.92Å; L91-H140 HydrophobicContact CD1-CB 4.27Å
92P98.4Very high98.3Very high26 Ų2617 Ų1717%0.16910%0.098CC..THydrogen-bonded Turntrans-63.4-16.5175.9-24.535.7000115.1F21 I24 G88 Y89 G94F21-P92 WeakPolarHBondContact CA-O 3.49Å; F21-P92 VanDerWaalsContact CD2-O 3.31Å; F21-P92 WeakPolarHBondContact CD2-O 3.3Å; I24-P92 HydrophobicContact CG1-CB 4.45Å; G88-P92 WeakPolarHBondContact O-CD 3.18Å; Y89-P92 WeakPolarHBondContact O-CD 3.11Å; P92-G94 PolarHBondContact O-N 3.11Å
93W98.6Very high98.2Very high11 Ų1118.7 Ų18.74%0.04211%0.11CC..  trans55.835.6177.7-150.9-111.6000114.3A17 A20 F21 V90 L91 F98 V128 L133 A217A17-W93 HydrophobicContact CB-CZ2 3.79Å; A20-W93 HydrophobicContact CB-CB 3.85Å; A20-W93 HydrophobicContact CB-CG 4.43Å; F21-W93 HydrophobicContact CB-CB 4.49Å; V90-W93 HydrophobicContact CG1-CE3 4.2Å; V90-W93 HydrophobicContact CG1-CZ3 3.98Å; V90-W93 PolarHBondContact O-N 3.35Å; L91-W93 PolarHBondContact O-N 2.82Å; L91-W93 VanDerWaalsContact O-N 3.12Å; W93-F98 HydrophobicContact CH2-CD2 4.05Å; W93-F98 HydrophobicContact CH2-CE2 4.49Å; W93-F98 AromaticContact CZ2-CD2 3.85Å; W93-F98 HydrophobicContact CZ2-CD2 3.85Å; W93-F98 HydrophobicContact CZ2-CE2 4.24Å; W93-V128 HydrophobicContact CH2-CG1 3.64Å; W93-V128 HydrophobicContact CZ3-CG1 4.04Å; W93-L133 HydrophobicContact CD2-CD2 3.85Å; W93-L133 HydrophobicContact CE3-CB 4.28Å; W93-L133 HydrophobicContact CE3-CD1 3.65Å; W93-L133 HydrophobicContact CE3-CD2 3.68Å; W93-L133 HydrophobicContact CE3-CG 4.08Å; W93-L133 HydrophobicContact CG-CD2 4.25Å; W93-L133 HydrophobicContact CH2-CB 4.19Å; W93-L133 HydrophobicContact CZ3-CB 3.84Å; W93-L133 HydrophobicContact CZ3-CD1 3.86Å; W93-L133 HydrophobicContact CZ3-CD2 4.08Å; W93-L133 HydrophobicContact CZ3-CG 4.14Å; W93-A217 HydrophobicContact CG-CB 4.44Å; W93-A217 WeakPolarHBondContact O-CB 3.34Å; W93-A217 PolarHBondContact O-N 2.97Å; W93-A217 VanDerWaalsContact O-N 3.1Å
94G98.4Very high98.1Very high0 Ų019.6 Ų19.60%011%0.109CC..BIsolated β-bridgetrans-84.7-178.816900000112.6P92 M96 S97 F98 N213 T215P92-G94 PolarHBondContact O-N 3.11Å; G94-M96 PolarHBondContact O-N 3.1Å; G94-S97 WeakPolarHBondContact O-CB 3.33Å; G94-S97 PolarHBondContact O-N 3.15Å; G94-F98 PolarHBondContact O-N 3.26Å; G94-N213 VanDerWaalsContact C-OD1 3.25Å; G94-N213 VanDerWaalsContact CA-OD1 3.22Å; G94-N213 WeakPolarHBondContact CA-OD1 3.44Å; G94-T215 CarbonylContact C-O 3.6Å; G94-T215 WeakPolarHBondContact CA-O 3.47Å
95Q98.3Very high98Very high14 Ų1419.3 Ų19.37%0.06511%0.108CC..Hα-helixtrans-58-49.6-179.7-74-78.161.100112.4S97 F98 W99 D212 T215 N221 P223Q95-S97 VanDerWaalsContact C-N 3.35Å; Q95-S97 PolarHBondContact O-N 3.13Å; Q95-F98 PolarHBondContact O-N 3.37Å; Q95-W99 WeakPolarHBondContact O-CB 3.44Å; Q95-W99 PolarHBondContact O-N 2.96Å; Q95-D212 HydrophobicContact CB-CB 4.48Å; Q95-D212 WeakPolarHBondContact CB-O 3.36Å; Q95-T215 HydrophobicContact CG-CG2 4.07Å; Q95-T215 PolarHBondContact N-O 3.4Å; Q95-N221 PolarHBondContact NE2-O 2.81Å; Q95-P223 HydrophobicContact CB-CG 3.88Å
96M97.7Very high97.9Very high1 Ų121.5 Ų21.51%0.00512%0.117CC..Hα-helixtrans-68-35.5-180-68.4-61.2158.100112.2Y89 G94 G100 D210 D212 N213 P223Y89-M96 HydrophobicContact CE1-CB 3.99Å; Y89-M96 WeakPolarHBondContact OH-CB 3.38Å; G94-M96 PolarHBondContact O-N 3.1Å; M96-G100 WeakPolarHBondContact O-CA 3.45Å; M96-G100 PolarHBondContact O-N 2.86Å; M96-D210 HydrophobicContact CG-CB 4.17Å; M96-D212 HydrophobicContact CE-CB 3.44Å; M96-D212 VanDerWaalsContact CE-CB 3.44Å; M96-D212 WeakPolarHBondContact CE-OD2 3.41Å; M96-D212 HydrophobicContact CG-CB 3.84Å; M96-N213 HydrophobicContact CB-CB 4.12Å; M96-N213 PolarHBondContact N-OD1 2.75Å; M96-P223 HydrophobicContact CE-CB 3.46Å; M96-P223 VanDerWaalsContact CE-CB 3.46Å; M96-P223 HydrophobicContact CE-CG 3.77Å
97S97.9Very high97.8Very high0 Ų021.4 Ų21.40%012%0.118CC..Hα-helixtrans-56-54.1172.1-64.50000112Y89 G94 Q95 A101 N213Y89-S97 VanDerWaalsContact O-CB 3.28Å; Y89-S97 WeakPolarHBondContact O-CB 3.45Å; Y89-S97 PolarHBondContact O-OG 3.16Å; G94-S97 WeakPolarHBondContact O-CB 3.33Å; G94-S97 PolarHBondContact O-N 3.15Å; Q95-S97 VanDerWaalsContact C-N 3.35Å; Q95-S97 PolarHBondContact O-N 3.13Å; S97-A101 VanDerWaalsContact O-CB 3.3Å; S97-A101 WeakPolarHBondContact O-CB 3.39Å; S97-A101 PolarHBondContact O-N 2.89Å; S97-N213 PolarHBondContact N-OD1 3.36Å; S97-N213 PolarHBondContact OG-ND2 3.11Å; S97-N213 PolarHBondContact OG-OD1 3.23Å
98F98.3Very high97.7Very high12 Ų1223.5 Ų23.55%0.05313%0.129CC..Hα-helixtrans-68.4-48.4-175.6177.5-89.2000112.4W93 G94 Q95 A101 T102 V128 A217 P219W93-F98 HydrophobicContact CH2-CD2 4.05Å; W93-F98 HydrophobicContact CH2-CE2 4.49Å; W93-F98 AromaticContact CZ2-CD2 3.85Å; W93-F98 HydrophobicContact CZ2-CD2 3.85Å; W93-F98 HydrophobicContact CZ2-CE2 4.24Å; G94-F98 PolarHBondContact O-N 3.26Å; Q95-F98 PolarHBondContact O-N 3.37Å; F98-A101 PolarHBondContact O-N 3.4Å; F98-T102 WeakPolarHBondContact O-CB 3.39Å; F98-T102 PolarHBondContact O-N 3.25Å; F98-T102 PolarHBondContact O-OG1 3Å; F98-V128 HydrophobicContact CD2-CB 4.49Å; F98-V128 HydrophobicContact CD2-CG1 4Å; F98-V128 HydrophobicContact CE2-CB 4.06Å; F98-V128 HydrophobicContact CE2-CG1 4Å; F98-V128 VanDerWaalsContact CE2-O 3.29Å; F98-V128 WeakPolarHBondContact CE2-O 3.45Å; F98-V128 HydrophobicContact CZ-CB 4.48Å; F98-A217 HydrophobicContact CB-CB 3.51Å; F98-A217 HydrophobicContact CD2-CB 4.23Å; F98-A217 HydrophobicContact CG-CB 3.96Å; F98-P219 HydrophobicContact CE1-CB 4.16Å; F98-P219 HydrophobicContact CE1-CG 4.4Å; F98-P219 HydrophobicContact CE2-CG 4.21Å; F98-P219 HydrophobicContact CZ-CB 3.86Å; F98-P219 HydrophobicContact CZ-CG 3.89Å
99W98.4Very high97.6Very high32 Ų3224.3 Ų24.312%0.12113%0.132CC..Hα-helixtrans-73.2-35.3-177.7-72.1109.8000112.3Q95 T102 V103 N218 P219 N221 T222 I226Q95-W99 WeakPolarHBondContact O-CB 3.44Å; Q95-W99 PolarHBondContact O-N 2.96Å; W99-T102 PolarHBondContact O-N 3.45Å; W99-V103 WeakPolarHBondContact O-CB 3.12Å; W99-V103 WeakPolarHBondContact O-CG2 3.4Å; W99-V103 PolarHBondContact O-N 3.11Å; W99-N218 WeakPolarHBondContact CZ2-O 3.06Å; W99-N218 PolarHBondContact NE1-O 3.12Å; W99-P219 WeakPolarHBondContact CH2-O 3.16Å; W99-P219 WeakPolarHBondContact CZ2-O 3.46Å; W99-N221 PolarHBondContact NE1-O 2.71Å; W99-T222 HydrophobicContact CD2-CG2 4.17Å; W99-T222 HydrophobicContact CE3-CG2 4.18Å; W99-T222 WeakPolarHBondContact CH2-OG1 3.37Å; W99-T222 VanDerWaalsContact CZ2-OG1 3.28Å; W99-T222 WeakPolarHBondContact CZ2-OG1 3.25Å; W99-T222 HydrophobicContact CZ3-CG2 4.41Å; W99-I226 HydrophobicContact CB-CD1 3.57Å; W99-I226 HydrophobicContact CB-CG1 3.9Å; W99-I226 HydrophobicContact CB-CG2 4.22Å; W99-I226 HydrophobicContact CD2-CD1 4.21Å; W99-I226 HydrophobicContact CE3-CD1 4.35Å; W99-I226 HydrophobicContact CG-CD1 3.9Å; W99-I226 HydrophobicContact CG-CG1 4.43Å
100G96.5Very high97.5Very high10 Ų1023 Ų2310%0.10313%0.13CC..Hα-helixtrans-59.5-47.9169.800000111.6M96 T102 V103 I104M96-G100 WeakPolarHBondContact O-CA 3.45Å; M96-G100 PolarHBondContact O-N 2.86Å; G100-T102 VanDerWaalsContact C-N 3.34Å; G100-T102 PolarHBondContact O-N 2.94Å; G100-V103 PolarHBondContact O-N 3.23Å; G100-I104 VanDerWaalsContact O-CB 3.3Å; G100-I104 WeakPolarHBondContact O-CB 3.33Å; G100-I104 WeakPolarHBondContact O-CG1 3.48Å; G100-I104 PolarHBondContact O-N 3.32Å
101A97.2Very high97.5Very high0 Ų026 Ų260%015%0.145CC..Hα-helixtrans-56.7-48.6174.600000111.7V90 S97 F98 T105 V128V90-A101 HydrophobicContact CG1-CB 4Å; V90-A101 HydrophobicContact CG2-CB 3.74Å; S97-A101 VanDerWaalsContact O-CB 3.3Å; S97-A101 WeakPolarHBondContact O-CB 3.39Å; S97-A101 PolarHBondContact O-N 2.89Å; F98-A101 PolarHBondContact O-N 3.4Å; A101-T105 WeakPolarHBondContact O-CB 3.5Å; A101-T105 WeakPolarHBondContact O-CG2 3.46Å; A101-T105 PolarHBondContact O-N 2.94Å; A101-T105 VanDerWaalsContact O-N 3.07Å; A101-T105 PolarHBondContact O-OG1 2.88Å; A101-V128 HydrophobicContact CB-CG1 4.19Å; A101-V128 HydrophobicContact CB-CG2 4.27Å
102T97.7Very high97.4Very high30 Ų3028.7 Ų28.718%0.18416%0.164CC..Hα-helixtrans-59.8-49.8-179.1-60.40000111.7F98 W99 G100 N106F98-T102 WeakPolarHBondContact O-CB 3.39Å; F98-T102 PolarHBondContact O-N 3.25Å; F98-T102 PolarHBondContact O-OG1 3Å; W99-T102 PolarHBondContact O-N 3.45Å; G100-T102 VanDerWaalsContact C-N 3.34Å; G100-T102 PolarHBondContact O-N 2.94Å; T102-N106 WeakPolarHBondContact O-CB 3.38Å; T102-N106 PolarHBondContact O-N 3.3Å
103V96.9Very high97.3Very high67 Ų6738.6 Ų38.641%0.40620%0.199SC..Hα-helixtrans-68.6-49.8-177.3172.30000111.4W99 G100 N106 L107W99-V103 WeakPolarHBondContact O-CB 3.12Å; W99-V103 WeakPolarHBondContact O-CG2 3.4Å; W99-V103 PolarHBondContact O-N 3.11Å; G100-V103 PolarHBondContact O-N 3.23Å; V103-N106 PolarHBondContact O-N 3.01Å; V103-L107 PolarHBondContact O-N 3.4Å
104I96.1Very high97.3Very high56 Ų5642.5 Ų42.529%0.28722%0.22SC..Hα-helixtrans-66.4-46.1-173.3-69.2169.8000111.1F86 G100 N106 L107F86-I104 HydrophobicContact CD2-CD1 3.69Å; F86-I104 HydrophobicContact CD2-CG2 4.29Å; F86-I104 HydrophobicContact CE1-CG2 4.34Å; F86-I104 HydrophobicContact CE2-CB 3.76Å; F86-I104 HydrophobicContact CE2-CD1 3.52Å; F86-I104 HydrophobicContact CE2-CG1 4.2Å; F86-I104 HydrophobicContact CE2-CG2 3.81Å; F86-I104 HydrophobicContact CZ-CB 3.97Å; F86-I104 HydrophobicContact CZ-CG2 3.82Å; G100-I104 VanDerWaalsContact O-CB 3.3Å; G100-I104 WeakPolarHBondContact O-CB 3.33Å; G100-I104 WeakPolarHBondContact O-CG1 3.48Å; G100-I104 PolarHBondContact O-N 3.32Å; I104-N106 VanDerWaalsContact C-N 3.33Å; I104-N106 PolarHBondContact O-N 3.28Å; I104-L107 VanDerWaalsContact O-CB 3.22Å; I104-L107 WeakPolarHBondContact O-CB 3.27Å; I104-L107 WeakPolarHBondContact O-CG 3.4Å; I104-L107 PolarHBondContact O-N 3.18Å
105T97.3Very high97.3Very high8 Ų842.6 Ų42.65%0.04922%0.221CC..Hα-helixtrans-67.6-34.9179.155.10000112.1F86 A101 L107 L108 V119 I122 W123 F136F86-T105 HydrophobicContact CE1-CG2 4.33Å; F86-T105 HydrophobicContact CZ-CG2 4.12Å; A101-T105 WeakPolarHBondContact O-CB 3.5Å; A101-T105 WeakPolarHBondContact O-CG2 3.46Å; A101-T105 PolarHBondContact O-N 2.94Å; A101-T105 VanDerWaalsContact O-N 3.07Å; A101-T105 PolarHBondContact O-OG1 2.88Å; T105-L107 PolarHBondContact O-N 3.33Å; T105-L107 VanDerWaalsContact O-N 3.14Å; T105-L108 WeakPolarHBondContact O-CB 3.4Å; T105-L108 PolarHBondContact O-N 3.37Å; T105-L108 VanDerWaalsContact O-N 3.1Å; T105-V119 WeakPolarHBondContact O-CG2 3.5Å; T105-I122 HydrophobicContact CG2-CG2 4.24Å; T105-W123 PolarHBondContact OG1-NE1 2.82Å; T105-F136 HydrophobicContact CG2-CZ 3.9Å
106N97.2Very high97.2Very high61 Ų6145.9 Ų45.933%0.32624%0.242SC..G310 helixtrans-70.1-5.7177-166.743.1000113.9T102 V103 I104 L108 S109 W123 K245T102-N106 WeakPolarHBondContact O-CB 3.38Å; T102-N106 PolarHBondContact O-N 3.3Å; V103-N106 PolarHBondContact O-N 3.01Å; I104-N106 VanDerWaalsContact C-N 3.33Å; I104-N106 PolarHBondContact O-N 3.28Å; N106-L108 PolarHBondContact O-N 3.11Å; N106-S109 VanDerWaalsContact O-CB 3.32Å; N106-S109 WeakPolarHBondContact O-CB 3.46Å; N106-S109 PolarHBondContact O-N 3.09Å; N106-S109 PolarHBondContact O-OG 3.35Å; N106-S109 WeakPolarHBondContact OD1-CB 3.49Å; N106-W123 HydrophobicContact CB-CH2 4.43Å; N106-W123 HydrophobicContact CB-CZ2 4.22Å; N106-K245 PolarHBondContact O-NZ 2.91Å
107L95.7Very high97.2Very high28 Ų2851 Ų5115%0.14727%0.269CS..G310 helixtrans-62.9-31.2167.2-64.1-178.9000111.5V103 I104 T105 S109 A110 L239 V249 L252V103-L107 PolarHBondContact O-N 3.4Å; I104-L107 VanDerWaalsContact O-CB 3.22Å; I104-L107 WeakPolarHBondContact O-CB 3.27Å; I104-L107 WeakPolarHBondContact O-CG 3.4Å; I104-L107 PolarHBondContact O-N 3.18Å; T105-L107 PolarHBondContact O-N 3.33Å; T105-L107 VanDerWaalsContact O-N 3.14Å; L107-S109 PolarHBondContact O-N 3.25Å; L107-A110 WeakPolarHBondContact O-CB 3.46Å; L107-A110 PolarHBondContact O-N 3.37Å; L107-L239 HydrophobicContact CD1-CD2 3.98Å; L107-L239 HydrophobicContact CD2-CD1 4.32Å; L107-L239 HydrophobicContact CD2-CD2 4.13Å; L107-V249 HydrophobicContact CB-CG2 3.81Å; L107-V249 HydrophobicContact CD2-CG2 3.89Å; L107-V249 HydrophobicContact CG-CG2 4.31Å; L107-L252 HydrophobicContact CD1-CD2 3.74Å
108L95.9Very high97.3Very high63 Ų6353.6 Ų53.633%0.3328%0.283SS..G310 helixtrans-65-21.9176.8-63.9171.9000112.7T105 N106 A110 I111 G115 V119 I122T105-L108 WeakPolarHBondContact O-CB 3.4Å; T105-L108 PolarHBondContact O-N 3.37Å; T105-L108 VanDerWaalsContact O-N 3.1Å; N106-L108 PolarHBondContact O-N 3.11Å; L108-A110 PolarHBondContact O-N 2.94Å; L108-A110 VanDerWaalsContact O-N 3.08Å; L108-I111 HydrophobicContact CD2-CD1 4.12Å; L108-I111 WeakPolarHBondContact O-CB 3.34Å; L108-I111 WeakPolarHBondContact O-CG1 3.37Å; L108-I111 PolarHBondContact O-N 3.2Å; L108-G115 VanDerWaalsContact O-CA 3.26Å; L108-G115 WeakPolarHBondContact O-CA 3.44Å; L108-V119 HydrophobicContact CB-CG2 3.89Å; L108-I122 HydrophobicContact CD1-CD1 3.16Å
109S97.3Very high97.3Very high33 Ų3353.2 Ų53.223%0.23128%0.282CS..G310 helixtrans-63.7-13.3173.6118.30000112.9N106 L107 K245N106-S109 VanDerWaalsContact O-CB 3.32Å; N106-S109 WeakPolarHBondContact O-CB 3.46Å; N106-S109 PolarHBondContact O-N 3.09Å; N106-S109 PolarHBondContact O-OG 3.35Å; N106-S109 WeakPolarHBondContact OD1-CB 3.49Å; L107-S109 PolarHBondContact O-N 3.25Å; S109-K245 PolarHBondContact OG-NZ 3.34Å
110A96.9Very high97.2Very high15 Ų1555.2 Ų55.212%0.12429%0.292CS..G310 helixtrans-72.3-17.7174.200000113L107 L108 P112 K245 L246 V249L107-A110 WeakPolarHBondContact O-CB 3.46Å; L107-A110 PolarHBondContact O-N 3.37Å; L108-A110 PolarHBondContact O-N 2.94Å; L108-A110 VanDerWaalsContact O-N 3.08Å; A110-P112 WeakPolarHBondContact O-CD 3.46Å; A110-K245 HydrophobicContact CB-CD 4.34Å; A110-K245 HydrophobicContact CB-CG 4.06Å; A110-L246 HydrophobicContact CB-CB 4.44Å; A110-L246 HydrophobicContact CB-CD1 4.32Å; A110-V249 HydrophobicContact CB-CB 4.38Å; A110-V249 HydrophobicContact CB-CG2 4.02Å
111I97.4Very high97.3Very high62 Ų6263.8 Ų63.832%0.31832%0.322SS..SBendtrans-67.3122.3178.7-60.6171.1000108.9L108 I114 G115 L118L108-I111 HydrophobicContact CD2-CD1 4.12Å; L108-I111 WeakPolarHBondContact O-CB 3.34Å; L108-I111 WeakPolarHBondContact O-CG1 3.37Å; L108-I111 PolarHBondContact O-N 3.2Å; I111-I114 HydrophobicContact CG2-CD1 4.15Å; I111-I114 HydrophobicContact CG2-CG1 3.66Å; I111-G115 VanDerWaalsContact O-CA 3.31Å; I111-G115 WeakPolarHBondContact O-CA 2.92Å; I111-G115 PolarHBondContact O-N 3.3Å; I111-L118 HydrophobicContact CD1-CD1 3.96Å
112P97.1Very high97.3Very high74 Ų7465.6 Ų65.648%0.48133%0.331SS..THydrogen-bonded Turntrans-57.7144.6179.2-25.735.3000112.3A110 I114A110-P112 WeakPolarHBondContact O-CD 3.46Å; P112-I114 PolarHBondContact O-N 3.44Å
113Y96.9Very high97.4Very high233 Ų23365.2 Ų65.291%0.91433%0.326SS*.THydrogen-bonded Turntrans69.1-51.5176.6-43.9-69.2000115.6
114I98Very high97.4Very high93 Ų9363.8 Ų63.848%0.47733%0.325SS..THydrogen-bonded Turntrans-105.8-6.7-170.662.8172.9000114.2I111 P112 T116 D117 L118I111-I114 HydrophobicContact CG2-CD1 4.15Å; I111-I114 HydrophobicContact CG2-CG1 3.66Å; P112-I114 PolarHBondContact O-N 3.44Å; I114-T116 PolarHBondContact O-N 3.41Å; I114-D117 PolarHBondContact O-N 2.77Å; I114-L118 HydrophobicContact CD1-CD1 3.83Å; I114-L118 HydrophobicContact CG1-CD1 3.92Å; I114-L118 HydrophobicContact CG1-CG 4.49Å; I114-L118 WeakPolarHBondContact O-CG 3.37Å; I114-L118 PolarHBondContact O-N 3.16Å
115G97.7Very high97.4Very high2 Ų262.6 Ų62.62%0.02133%0.326CS..Hα-helixtrans-60.1-44.5-169.300000114.3L108 I111 L118 V119L108-G115 VanDerWaalsContact O-CA 3.26Å; L108-G115 WeakPolarHBondContact O-CA 3.44Å; I111-G115 VanDerWaalsContact O-CA 3.31Å; I111-G115 WeakPolarHBondContact O-CA 2.92Å; I111-G115 PolarHBondContact O-N 3.3Å; G115-L118 PolarHBondContact O-N 2.86Å; G115-V119 WeakPolarHBondContact O-CG2 3.4Å; G115-V119 PolarHBondContact O-N 3.19Å; G115-V119 VanDerWaalsContact O-N 3.1Å
116T97.4Very high97.4Very high83 Ų8371.6 Ų71.651%0.50936%0.361SS..Hα-helixtrans-64.7-43179.9-54.80000111.7I114 L118 V119 Q120I114-T116 PolarHBondContact O-N 3.41Å; T116-L118 VanDerWaalsContact C-N 3.34Å; T116-L118 PolarHBondContact O-N 3.02Å; T116-V119 PolarHBondContact O-N 2.83Å; T116-Q120 PolarHBondContact O-N 3.14Å
117D98.3Very high97.4Very high108 Ų10871.8 Ų71.858%0.57837%0.367SS*.Hα-helixtrans-64.8-40178.9-62-20.5000111I114 V119 Q120 W121I114-D117 PolarHBondContact O-N 2.77Å; D117-V119 PolarHBondContact O-N 2.92Å; D117-Q120 PolarHBondContact O-N 3.16Å; D117-W121 WeakPolarHBondContact O-CB 3.45Å; D117-W121 PolarHBondContact O-N 2.73Å
118L98.1Very high97.5Very high56 Ų5670.6 Ų70.629%0.29336%0.361SS..Hα-helixtrans-61.5-42.7174.9-74.9175.2000112.3I111 I114 G115 T116 W121 I122I111-L118 HydrophobicContact CD1-CD1 3.96Å; I114-L118 HydrophobicContact CD1-CD1 3.83Å; I114-L118 HydrophobicContact CG1-CD1 3.92Å; I114-L118 HydrophobicContact CG1-CG 4.49Å; I114-L118 WeakPolarHBondContact O-CG 3.37Å; I114-L118 PolarHBondContact O-N 3.16Å; G115-L118 PolarHBondContact O-N 2.86Å; T116-L118 VanDerWaalsContact C-N 3.34Å; T116-L118 PolarHBondContact O-N 3.02Å; L118-W121 PolarHBondContact O-N 3.39Å; L118-I122 WeakPolarHBondContact O-CB 3.43Å; L118-I122 VanDerWaalsContact O-CG1 3.32Å; L118-I122 WeakPolarHBondContact O-CG1 3.42Å; L118-I122 PolarHBondContact O-N 2.98Å
119V98.3Very high97.6Very high4 Ų471.5 Ų71.52%0.02437%0.366CS..Hα-helixtrans-63.3-50.2178171.90000110.7T105 L108 G115 T116 D117 W121 I122 W123T105-V119 WeakPolarHBondContact O-CG2 3.5Å; L108-V119 HydrophobicContact CB-CG2 3.89Å; G115-V119 WeakPolarHBondContact O-CG2 3.4Å; G115-V119 PolarHBondContact O-N 3.19Å; G115-V119 VanDerWaalsContact O-N 3.1Å; T116-V119 PolarHBondContact O-N 2.83Å; D117-V119 PolarHBondContact O-N 2.92Å; V119-W121 VanDerWaalsContact C-N 3.28Å; V119-W121 PolarHBondContact O-N 2.97Å; V119-I122 PolarHBondContact O-N 2.85Å; V119-W123 HydrophobicContact CG1-CD2 3.67Å; V119-W123 VanDerWaalsContact CG1-CE2 3.46Å; V119-W123 HydrophobicContact CG1-CE3 3.71Å; V119-W123 HydrophobicContact CG1-CH2 3.44Å; V119-W123 VanDerWaalsContact CG1-CH2 3.44Å; V119-W123 HydrophobicContact CG1-CZ2 3.37Å; V119-W123 HydrophobicContact CG1-CZ3 3.6Å; V119-W123 PolarHBondContact O-N 3.45Å
120Q98.2Very high97.6Very high73 Ų7371.1 Ų71.134%0.34136%0.363SS..Hα-helixtrans-64.3-34.7178.7-69.1-178-0.800112.1T116 D117 W123 G124 G125T116-Q120 PolarHBondContact O-N 3.14Å; D117-Q120 PolarHBondContact O-N 3.16Å; Q120-W123 PolarHBondContact O-N 2.96Å; Q120-G124 WeakPolarHBondContact O-CA 3.35Å; Q120-G124 PolarHBondContact O-N 3.49Å; Q120-G125 WeakPolarHBondContact CA-O 3.21Å; Q120-G125 PolarHBondContact O-N 3.23Å
121W98.3Very high97.6Very high190 Ų19073.3 Ų73.372%0.7238%0.376SS*.Hα-helixtrans-64.5-44.6173.5179.976.5000111.7D117 L118 V119 W123 G124 R135D117-W121 WeakPolarHBondContact O-CB 3.45Å; D117-W121 PolarHBondContact O-N 2.73Å; L118-W121 PolarHBondContact O-N 3.39Å; V119-W121 VanDerWaalsContact C-N 3.28Å; V119-W121 PolarHBondContact O-N 2.97Å; W121-W123 VanDerWaalsContact C-N 3.33Å; W121-W123 PolarHBondContact O-N 2.93Å; W121-G124 PolarHBondContact O-N 3.46Å; W121-R135 PolarHBondContact O-NH1 3.48Å
122I97.6Very high97.6Very high38 Ų3870.4 Ų70.420%0.19536%0.361CS..Hα-helixtrans-64.4-36.8175.3-73168.1000111.4T105 L108 L118 V119 R135 F136T105-I122 HydrophobicContact CG2-CG2 4.24Å; L108-I122 HydrophobicContact CD1-CD1 3.16Å; L118-I122 WeakPolarHBondContact O-CB 3.43Å; L118-I122 VanDerWaalsContact O-CG1 3.32Å; L118-I122 WeakPolarHBondContact O-CG1 3.42Å; L118-I122 PolarHBondContact O-N 2.98Å; V119-I122 PolarHBondContact O-N 2.85Å; I122-R135 WeakPolarHBondContact O-CD 3.21Å; I122-R135 PolarHBondContact O-NE 3.13Å; I122-R135 PolarHBondContact O-NH1 2.92Å; I122-F136 HydrophobicContact CG2-CE1 4.22Å; I122-F136 HydrophobicContact CG2-CZ 4.47Å
123W98.4Very high97.7Very high23 Ų2366.9 Ų66.99%0.08734%0.338CS..Hα-helixtrans-75-32175.5-65.1-15.4000112.5T105 N106 V119 Q120 W121 G125 Y126 S127 V128 T132T105-W123 PolarHBondContact OG1-NE1 2.82Å; N106-W123 HydrophobicContact CB-CH2 4.43Å; N106-W123 HydrophobicContact CB-CZ2 4.22Å; V119-W123 HydrophobicContact CG1-CD2 3.67Å; V119-W123 VanDerWaalsContact CG1-CE2 3.46Å; V119-W123 HydrophobicContact CG1-CE3 3.71Å; V119-W123 HydrophobicContact CG1-CH2 3.44Å; V119-W123 VanDerWaalsContact CG1-CH2 3.44Å; V119-W123 HydrophobicContact CG1-CZ2 3.37Å; V119-W123 HydrophobicContact CG1-CZ3 3.6Å; V119-W123 PolarHBondContact O-N 3.45Å; Q120-W123 PolarHBondContact O-N 2.96Å; W121-W123 VanDerWaalsContact C-N 3.33Å; W121-W123 PolarHBondContact O-N 2.93Å; W123-G125 VanDerWaalsContact C-N 3.28Å; W123-Y126 WeakPolarHBondContact CZ3-O 3.47Å; W123-S127 VanDerWaalsContact CE3-CA 3.46Å; W123-V128 HydrophobicContact CD2-CG2 4.31Å; W123-V128 HydrophobicContact CG-CG2 4.34Å; W123-V128 HydrophobicContact CZ2-CG2 4.24Å; W123-T132 WeakPolarHBondContact CA-OG1 3.38Å; W123-T132 PolarHBondContact O-N 2.83Å; W123-T132 PolarHBondContact O-OG1 3.45Å
124G97.6Very high97.8Very high37 Ų3758.7 Ų58.738%0.38131%0.313SS..THydrogen-bonded Turntrans69.330.3-167.800000112.8Q120 W121Q120-G124 WeakPolarHBondContact O-CA 3.35Å; Q120-G124 PolarHBondContact O-N 3.49Å; W121-G124 PolarHBondContact O-N 3.46Å
125G96.6Very high97.8Very high30 Ų3057.6 Ų57.631%0.30930%0.303SS..SBendtrans173.9-170.5-173.700000111Q120 W123Q120-G125 WeakPolarHBondContact CA-O 3.21Å; Q120-G125 PolarHBondContact O-N 3.23Å; W123-G125 VanDerWaalsContact C-N 3.28Å
126Y97.3Very high97.8Very high198 Ų19858 Ų5878%0.77630%0.304SS*.SBendtrans-86.7-11.5-177.4-59.2-69.2000114W123W123-Y126 WeakPolarHBondContact CZ3-O 3.47Å
127S96.8Very high97.9Very high64 Ų6456 Ų5645%0.44829%0.289SS..SBendtrans-150.2168.5178.756.40000110W123 D129W123-S127 VanDerWaalsContact CE3-CA 3.46Å; S127-D129 PolarHBondContact O-N 3.07Å
128V98Very high97.9Very high3 Ų354.8 Ų54.82%0.01829%0.285CS..SBendtrans-62.1124.5166.8174.60000109W93 F98 A101 W123 T132W93-V128 HydrophobicContact CH2-CG1 3.64Å; W93-V128 HydrophobicContact CZ3-CG1 4.04Å; F98-V128 HydrophobicContact CD2-CB 4.49Å; F98-V128 HydrophobicContact CD2-CG1 4Å; F98-V128 HydrophobicContact CE2-CB 4.06Å; F98-V128 HydrophobicContact CE2-CG1 4Å; F98-V128 VanDerWaalsContact CE2-O 3.29Å; F98-V128 WeakPolarHBondContact CE2-O 3.45Å; F98-V128 HydrophobicContact CZ-CB 4.48Å; A101-V128 HydrophobicContact CB-CG1 4.19Å; A101-V128 HydrophobicContact CB-CG2 4.27Å; W123-V128 HydrophobicContact CD2-CG2 4.31Å; W123-V128 HydrophobicContact CG-CG2 4.34Å; W123-V128 HydrophobicContact CZ2-CG2 4.24Å; V128-T132 HydrophobicContact CG1-CG2 4.23Å
129D97Very high97.9Very high82 Ų8257.1 Ų57.144%0.43929%0.293SS..SBendtrans-158.1-170.1-179.3-160.1-4.3000110.4S127 P131 T132 L133S127-D129 PolarHBondContact O-N 3.07Å; D129-P131 VanDerWaalsContact C-CD 3.43Å; D129-P131 VanDerWaalsContact C-N 3.33Å; D129-T132 PolarHBondContact N-OG1 3.01Å; D129-T132 WeakPolarHBondContact O-CA 3.49Å; D129-T132 VanDerWaalsContact O-CB 3.26Å; D129-T132 WeakPolarHBondContact O-CB 3.48Å; D129-T132 PolarHBondContact O-N 3.17Å; D129-L133 PolarHBondContact O-N 3.11Å; D129-L133 VanDerWaalsContact O-N 3.12Å
130S97Very high98Very high25 Ų2558.3 Ų58.318%0.17530%0.298CS..Hα-helixtrans-45.1-45.8179-81.40000114.1D16 A17 T132 L133 T134D16-S130 PolarHBondContact OD2-OG 2.86Å; A17-S130 VanDerWaalsContact CB-OG 3.24Å; A17-S130 WeakPolarHBondContact CB-OG 3.5Å; A17-S130 PolarHBondContact N-OG 3.24Å; S130-T132 VanDerWaalsContact C-N 3.25Å; S130-T132 PolarHBondContact O-N 3.4Å; S130-L133 PolarHBondContact O-N 3.33Å; S130-T134 PolarHBondContact O-N 3.13Å; S130-T134 PolarHBondContact O-OG1 2.88Å; S130-T134 VanDerWaalsContact O-OG1 3.11Å
131P98.1Very high98Very high61 Ų6158.9 Ų58.940%0.39630%0.299SS..Hα-helixtrans-57.7-35.8176.6-25.335.5000113.7D129 R135D129-P131 VanDerWaalsContact C-CD 3.43Å; D129-P131 VanDerWaalsContact C-N 3.33Å; P131-R135 WeakPolarHBondContact O-CG 3.36Å; P131-R135 PolarHBondContact O-N 3.11Å; P131-R135 PolarHBondContact O-NE 3.05Å
132T98.2Very high98Very high1 Ų153.6 Ų53.61%0.00628%0.284CS..Hα-helixtrans-69.2-40.5175.1-470000111.3W123 V128 D129 S130 R135 F136W123-T132 WeakPolarHBondContact CA-OG1 3.38Å; W123-T132 PolarHBondContact O-N 2.83Å; W123-T132 PolarHBondContact O-OG1 3.45Å; V128-T132 HydrophobicContact CG1-CG2 4.23Å; D129-T132 PolarHBondContact N-OG1 3.01Å; D129-T132 WeakPolarHBondContact O-CA 3.49Å; D129-T132 VanDerWaalsContact O-CB 3.26Å; D129-T132 WeakPolarHBondContact O-CB 3.48Å; D129-T132 PolarHBondContact O-N 3.17Å; S130-T132 VanDerWaalsContact C-N 3.25Å; S130-T132 PolarHBondContact O-N 3.4Å; T132-R135 WeakPolarHBondContact O-CG 3.41Å; T132-F136 HydrophobicContact CG2-CD1 4.32Å; T132-F136 HydrophobicContact CG2-CD2 4.46Å; T132-F136 HydrophobicContact CG2-CE1 4.07Å; T132-F136 HydrophobicContact CG2-CE2 4.24Å; T132-F136 HydrophobicContact CG2-CG 4.5Å; T132-F136 HydrophobicContact CG2-CZ 4.03Å; T132-F136 WeakPolarHBondContact O-CB 3.4Å; T132-F136 WeakPolarHBondContact O-CG 3.34Å; T132-F136 PolarHBondContact O-N 2.97Å
133L98.2Very high98.1Very high0 Ų053.2 Ų53.20%028%0.283CS..Hα-helixtrans-67.7-44.8-178.8-17355.3000112Y13 A20 V90 L91 W93 D129 S130 R135 F136 F137Y13-L133 WeakPolarHBondContact OH-CD1 3.34Å; A20-L133 HydrophobicContact CB-CD2 3.54Å; V90-L133 HydrophobicContact CG1-CD1 4.36Å; L91-L133 HydrophobicContact CD2-CD1 4.01Å; W93-L133 HydrophobicContact CD2-CD2 3.85Å; W93-L133 HydrophobicContact CE3-CB 4.28Å; W93-L133 HydrophobicContact CE3-CD1 3.65Å; W93-L133 HydrophobicContact CE3-CD2 3.68Å; W93-L133 HydrophobicContact CE3-CG 4.08Å; W93-L133 HydrophobicContact CG-CD2 4.25Å; W93-L133 HydrophobicContact CH2-CB 4.19Å; W93-L133 HydrophobicContact CZ3-CB 3.84Å; W93-L133 HydrophobicContact CZ3-CD1 3.86Å; W93-L133 HydrophobicContact CZ3-CD2 4.08Å; W93-L133 HydrophobicContact CZ3-CG 4.14Å; D129-L133 PolarHBondContact O-N 3.11Å; D129-L133 VanDerWaalsContact O-N 3.12Å; S130-L133 PolarHBondContact O-N 3.33Å; L133-R135 PolarHBondContact O-N 2.95Å; L133-F136 PolarHBondContact O-N 3.14Å; L133-F137 PolarHBondContact O-N 3.21Å
134T98.4Very high98.1Very high62 Ų6253.3 Ų53.338%0.3829%0.286SS..Hα-helixtrans-63-40.9179.9-500000112.6P15 S130 T138P15-T134 PolarHBondContact O-OG1 3.5Å; S130-T134 PolarHBondContact O-N 3.13Å; S130-T134 PolarHBondContact O-OG1 2.88Å; S130-T134 VanDerWaalsContact O-OG1 3.11Å; T134-T138 PolarHBondContact O-N 3.04Å; T134-T138 VanDerWaalsContact O-N 3.13Å; T134-T138 PolarHBondContact O-OG1 3.02Å
135R98.3Very high98.1Very high70 Ų7055.6 Ų55.626%0.26429%0.286SS..Hα-helixtrans-70.2-39.9175.266.5-174.668.3-153.3-10.1112W121 I122 P131 T132 L133 F137 T138 F139W121-R135 PolarHBondContact O-NH1 3.48Å; I122-R135 WeakPolarHBondContact O-CD 3.21Å; I122-R135 PolarHBondContact O-NE 3.13Å; I122-R135 PolarHBondContact O-NH1 2.92Å; P131-R135 WeakPolarHBondContact O-CG 3.36Å; P131-R135 PolarHBondContact O-N 3.11Å; P131-R135 PolarHBondContact O-NE 3.05Å; T132-R135 WeakPolarHBondContact O-CG 3.41Å; L133-R135 PolarHBondContact O-N 2.95Å; R135-F137 VanDerWaalsContact C-N 3.3Å; R135-F137 PolarHBondContact O-N 3.23Å; R135-T138 WeakPolarHBondContact O-CB 3.32Å; R135-T138 PolarHBondContact O-N 3.31Å; R135-T138 VanDerWaalsContact O-N 3.15Å; R135-F139 HydrophobicContact CB-CD2 4.34Å; R135-F139 HydrophobicContact CB-CE2 4.19Å; R135-F139 WeakPolarHBondContact O-CD2 3.42Å; R135-F139 PolarHBondContact O-N 2.73Å
136F98.6Very high98.3Very high10 Ų1057.9 Ų57.94%0.04429%0.29CS..Hα-helixtrans-65.4-37.3178.8-83.417.5000110.9F86 M87 V90 L91 T105 I122 T132 L133 F139 H140F86-F136 AromaticContact CE1-CE2 3.8Å; F86-F136 HydrophobicContact CE1-CE2 3.8Å; F86-F136 HydrophobicContact CE1-CZ 4.05Å; F86-F136 HydrophobicContact CZ-CE2 4.06Å; M87-F136 HydrophobicContact CB-CB 4.32Å; M87-F136 HydrophobicContact CB-CD2 4.37Å; M87-F136 HydrophobicContact CB-CG 4.37Å; M87-F136 HydrophobicContact CG-CB 4.3Å; M87-F136 HydrophobicContact CG-CD1 4.16Å; M87-F136 HydrophobicContact CG-CD2 3.93Å; M87-F136 HydrophobicContact CG-CE2 4.27Å; M87-F136 HydrophobicContact CG-CG 3.89Å; M87-F136 HydrophobicContact SD-CD1 4.26Å; M87-F136 HydrophobicContact SD-CG 4.45Å; V90-F136 HydrophobicContact CB-CD2 3.89Å; V90-F136 HydrophobicContact CB-CE2 4.5Å; V90-F136 HydrophobicContact CG1-CD2 3.91Å; V90-F136 HydrophobicContact CG1-CE2 4.46Å; V90-F136 HydrophobicContact CG2-CD2 3.86Å; V90-F136 HydrophobicContact CG2-CE2 4Å; L91-F136 HydrophobicContact CD2-CB 4.46Å; T105-F136 HydrophobicContact CG2-CZ 3.9Å; I122-F136 HydrophobicContact CG2-CE1 4.22Å; I122-F136 HydrophobicContact CG2-CZ 4.47Å; T132-F136 HydrophobicContact CG2-CD1 4.32Å; T132-F136 HydrophobicContact CG2-CD2 4.46Å; T132-F136 HydrophobicContact CG2-CE1 4.07Å; T132-F136 HydrophobicContact CG2-CE2 4.24Å; T132-F136 HydrophobicContact CG2-CG 4.5Å; T132-F136 HydrophobicContact CG2-CZ 4.03Å; T132-F136 WeakPolarHBondContact O-CB 3.4Å; T132-F136 WeakPolarHBondContact O-CG 3.34Å; T132-F136 PolarHBondContact O-N 2.97Å; L133-F136 PolarHBondContact O-N 3.14Å; F136-F139 PolarHBondContact O-N 3.09Å; F136-H140 WeakPolarHBondContact O-CB 3.24Å; F136-H140 PolarHBondContact O-N 3.18Å
137F98.8Very high98.3Very high42 Ų4249.4 Ų49.418%0.18426%0.258CS..Hα-helixtrans-59-49.9169.5175-111.2000111.7A10 Y13 P15 L91 L133 R135 F139 H140 F141A10-F137 HydrophobicContact CB-CE2 4.17Å; A10-F137 HydrophobicContact CB-CZ 4.09Å; Y13-F137 AromaticContact CD1-CD2 3.64Å; Y13-F137 HydrophobicContact CD1-CD2 3.64Å; Y13-F137 AromaticContact CD1-CE2 3.65Å; Y13-F137 HydrophobicContact CD1-CE2 3.65Å; Y13-F137 HydrophobicContact CD1-CG 4.31Å; Y13-F137 HydrophobicContact CD1-CZ 4.34Å; Y13-F137 HydrophobicContact CE1-CB 4.31Å; Y13-F137 AromaticContact CE1-CD2 3.6Å; Y13-F137 HydrophobicContact CE1-CD2 3.6Å; Y13-F137 HydrophobicContact CE1-CE2 4.13Å; Y13-F137 HydrophobicContact CE1-CG 4.01Å; P15-F137 HydrophobicContact CB-CB 3.79Å; P15-F137 HydrophobicContact CB-CD1 3.95Å; P15-F137 HydrophobicContact CB-CG 3.91Å; P15-F137 HydrophobicContact CG-CD1 3.92Å; P15-F137 HydrophobicContact CG-CE1 4.42Å; P15-F137 HydrophobicContact CG-CG 4.38Å; L91-F137 HydrophobicContact CD1-CD2 4.07Å; L91-F137 HydrophobicContact CD2-CB 3.92Å; L133-F137 PolarHBondContact O-N 3.21Å; R135-F137 VanDerWaalsContact C-N 3.3Å; R135-F137 PolarHBondContact O-N 3.23Å; F137-F139 PolarHBondContact O-N 2.84Å; F137-H140 PolarHBondContact O-N 3.26Å; F137-F141 HydrophobicContact CZ-CD2 4.48Å; F137-F141 WeakPolarHBondContact O-CB 3.37Å; F137-F141 PolarHBondContact O-N 3.33Å
138T98.7Very high98.4Very high81 Ų8148.8 Ų48.850%0.49726%0.257SS..Hα-helixtrans-57.7-46.5178-56.50000112T134 R135 F141 I142T134-T138 PolarHBondContact O-N 3.04Å; T134-T138 VanDerWaalsContact O-N 3.13Å; T134-T138 PolarHBondContact O-OG1 3.02Å; R135-T138 WeakPolarHBondContact O-CB 3.32Å; R135-T138 PolarHBondContact O-N 3.31Å; R135-T138 VanDerWaalsContact O-N 3.15Å; T138-F141 PolarHBondContact O-N 3.47Å; T138-I142 WeakPolarHBondContact O-CG2 3.26Å; T138-I142 PolarHBondContact O-N 3.33Å; T138-I142 VanDerWaalsContact O-N 3.1Å
139F98.7Very high98.5Very high106 Ų10651.7 Ų51.747%0.46528%0.281SS..Hα-helixtrans-67.9-43.8178.6-73.2-55.9000112.6M87 R135 F136 F137 F141 I142 L143M87-F139 HydrophobicContact CE-CB 4.16Å; M87-F139 HydrophobicContact SD-CB 3.43Å; M87-F139 WeakPolarHBondContact SD-CB 3.47Å; M87-F139 HydrophobicContact SD-CD2 4.4Å; M87-F139 HydrophobicContact SD-CG 4.25Å; R135-F139 HydrophobicContact CB-CD2 4.34Å; R135-F139 HydrophobicContact CB-CE2 4.19Å; R135-F139 WeakPolarHBondContact O-CD2 3.42Å; R135-F139 PolarHBondContact O-N 2.73Å; F136-F139 PolarHBondContact O-N 3.09Å; F137-F139 PolarHBondContact O-N 2.84Å; F139-F141 PolarHBondContact O-N 3.5Å; F139-I142 PolarHBondContact O-N 2.97Å; F139-L143 HydrophobicContact CB-CD1 4.48Å; F139-L143 WeakPolarHBondContact O-CB 3.34Å; F139-L143 VanDerWaalsContact O-CG 3.31Å; F139-L143 WeakPolarHBondContact O-CG 3.47Å; F139-L143 PolarHBondContact O-N 3.32Å
140H98.8Very high98.5Very high29 Ų2949.5 Ų49.513%0.13427%0.269CS..Hα-helixtrans-61.1-31.8175.1-178.671.7000112H41 T84 M87 G88 L91 F136 F137 P144H41-H140 AromaticContact NE2-NE2 3.87Å; T84-H140 PolarHBondContact O-CE1 3.32Å; T84-H140 PolarHBondContact O-ND1 3.18Å; M87-H140 HydrophobicContact CB-CB 4.1Å; G88-H140 WeakPolarHBondContact CA-CE1 3.5Å; G88-H140 VanDerWaalsContact CA-ND1 3.25Å; G88-H140 WeakPolarHBondContact CA-ND1 3.48Å; G88-H140 PolarHBondContact N-ND1 3.48Å; L91-H140 HydrophobicContact CD1-CB 4.27Å; F136-H140 WeakPolarHBondContact O-CB 3.24Å; F136-H140 PolarHBondContact O-N 3.18Å; F137-H140 PolarHBondContact O-N 3.26Å; H140-P144 WeakPolarHBondContact O-CD 3.48Å; H140-P144 VanDerWaalsContact O-CG 3.24Å; H140-P144 WeakPolarHBondContact O-CG 3.45Å
141F98.8Very high98.6Very high84 Ų8450 Ų5037%0.36828%0.275SS..Hα-helixtrans-72.3-46.1176.1-170.8-83.7000112.5L7 A10 F137 T138 F139 P144 F145L7-F141 HydrophobicContact CD2-CE2 3.67Å; L7-F141 HydrophobicContact CD2-CZ 3.58Å; A10-F141 HydrophobicContact CB-CD2 4.37Å; A10-F141 HydrophobicContact CB-CE2 4.21Å; F137-F141 HydrophobicContact CZ-CD2 4.48Å; F137-F141 WeakPolarHBondContact O-CB 3.37Å; F137-F141 PolarHBondContact O-N 3.33Å; T138-F141 PolarHBondContact O-N 3.47Å; F139-F141 PolarHBondContact O-N 3.5Å; F141-P144 WeakPolarHBondContact O-CD 3.4Å; F141-F145 HydrophobicContact CD1-CE2 4.16Å; F141-F145 AromaticContact CE1-CE2 3.88Å; F141-F145 HydrophobicContact CE1-CE2 3.88Å; F141-F145 HydrophobicContact CZ-CE2 4.42Å; F141-F145 VanDerWaalsContact O-CD2 3.24Å; F141-F145 WeakPolarHBondContact O-CD2 3.35Å; F141-F145 VanDerWaalsContact O-CE2 3.26Å; F141-F145 WeakPolarHBondContact O-CE2 3.38Å
142I98.8Very high98.7Very high79 Ų7950.1 Ų50.141%0.40528%0.281SS..Hα-helixtrans-79.3-35.6-174.1-168.559.6000113.5T138 F139 F145 I146T138-I142 WeakPolarHBondContact O-CG2 3.26Å; T138-I142 PolarHBondContact O-N 3.33Å; T138-I142 VanDerWaalsContact O-N 3.1Å; F139-I142 PolarHBondContact O-N 2.97Å; I142-F145 PolarHBondContact O-N 3.27Å; I142-F145 VanDerWaalsContact O-N 3.1Å; I142-I146 HydrophobicContact CG1-CD1 4.26Å; I142-I146 PolarHBondContact O-N 3.2Å
143L98.7Very high98.7Very high31 Ų3153.6 Ų53.616%0.16230%0.299CS..Hα-helixtrans-60-39-174.7-79.9167.7000114.9T84 M87 F139 F145 I146 I147T84-L143 VanDerWaalsContact OG1-CB 3.26Å; T84-L143 WeakPolarHBondContact OG1-CB 3.46Å; M87-L143 HydrophobicContact CE-CD1 3.24Å; F139-L143 HydrophobicContact CB-CD1 4.48Å; F139-L143 WeakPolarHBondContact O-CB 3.34Å; F139-L143 VanDerWaalsContact O-CG 3.31Å; F139-L143 WeakPolarHBondContact O-CG 3.47Å; F139-L143 PolarHBondContact O-N 3.32Å; L143-F145 PolarHBondContact O-N 3.5Å; L143-I146 HydrophobicContact CD2-CD1 4.21Å; L143-I146 CarbonylContact O-C 3.57Å; L143-I146 WeakPolarHBondContact O-CA 3.39Å; L143-I146 WeakPolarHBondContact O-CB 3.36Å; L143-I146 PolarHBondContact O-N 3.3Å; L143-I147 WeakPolarHBondContact O-CG1 3.48Å; L143-I147 PolarHBondContact O-N 2.91Å
144P98.8Very high98.7Very high25 Ų2554.8 Ų54.816%0.16231%0.305CS..Hα-helixtrans-54.1-34.1173.5-28.934.3000114.1I3 T84 H140 F141 A148I3-P144 HydrophobicContact CD1-CB 4.36Å; I3-P144 HydrophobicContact CG1-CB 3.82Å; T84-P144 HydrophobicContact CG2-CG 3.84Å; H140-P144 WeakPolarHBondContact O-CD 3.48Å; H140-P144 VanDerWaalsContact O-CG 3.24Å; H140-P144 WeakPolarHBondContact O-CG 3.45Å; F141-P144 WeakPolarHBondContact O-CD 3.4Å; P144-A148 PolarHBondContact O-N 3.24Å
145F98.7Very high98.7Very high84 Ų8455.9 Ų55.937%0.36831%0.308SS..Hα-helixtrans-75.8-35.7176.8-59.5-78.6000111.9I3 L7 F141 I142 L143 I147 A148 A149I3-F145 HydrophobicContact CG2-CE1 3.83Å; I3-F145 HydrophobicContact CG2-CZ 3.95Å; L7-F145 HydrophobicContact CD2-CZ 4.48Å; F141-F145 HydrophobicContact CD1-CE2 4.16Å; F141-F145 AromaticContact CE1-CE2 3.88Å; F141-F145 HydrophobicContact CE1-CE2 3.88Å; F141-F145 HydrophobicContact CZ-CE2 4.42Å; F141-F145 VanDerWaalsContact O-CD2 3.24Å; F141-F145 WeakPolarHBondContact O-CD2 3.35Å; F141-F145 VanDerWaalsContact O-CE2 3.26Å; F141-F145 WeakPolarHBondContact O-CE2 3.38Å; I142-F145 PolarHBondContact O-N 3.27Å; I142-F145 VanDerWaalsContact O-N 3.1Å; L143-F145 PolarHBondContact O-N 3.5Å; F145-I147 VanDerWaalsContact C-N 3.35Å; F145-A148 WeakPolarHBondContact O-CB 3.35Å; F145-A148 PolarHBondContact O-N 2.82Å; F145-A149 PolarHBondContact O-N 2.89Å; F145-A149 VanDerWaalsContact O-N 3.1Å
146I98.8Very high98.7Very high79 Ų7956.9 Ų56.941%0.40532%0.318SS..Hα-helixtrans-63.9-42.5171.3-62.9171.4000110.1I142 L143 A148 A149 L150I142-I146 HydrophobicContact CG1-CD1 4.26Å; I142-I146 PolarHBondContact O-N 3.2Å; L143-I146 HydrophobicContact CD2-CD1 4.21Å; L143-I146 CarbonylContact O-C 3.57Å; L143-I146 WeakPolarHBondContact O-CA 3.39Å; L143-I146 WeakPolarHBondContact O-CB 3.36Å; L143-I146 PolarHBondContact O-N 3.3Å; I146-A148 VanDerWaalsContact C-N 3.3Å; I146-A148 PolarHBondContact O-N 3.13Å; I146-A149 PolarHBondContact O-N 3.44Å; I146-L150 HydrophobicContact CG2-CD1 4.07Å; I146-L150 HydrophobicContact CG2-CG 4.41Å; I146-L150 WeakPolarHBondContact O-CG 3.08Å; I146-L150 PolarHBondContact O-N 2.83Å
147I98.9Very high98.8Very high20 Ų2059.7 Ų59.710%0.10333%0.33CS..Hα-helixtrans-59.1-41.9174.3-70.4167.3000110.7L77 A80 T84 L143 F145 A149 L150 A151L77-I147 HydrophobicContact CD2-CG2 3.88Å; L77-I147 WeakPolarHBondContact CD2-O 3.4Å; A80-I147 HydrophobicContact CB-CD1 4.17Å; A80-I147 HydrophobicContact CB-CG1 3.75Å; T84-I147 WeakPolarHBondContact OG1-CD1 3.41Å; L143-I147 WeakPolarHBondContact O-CG1 3.48Å; L143-I147 PolarHBondContact O-N 2.91Å; F145-I147 VanDerWaalsContact C-N 3.35Å; I147-A149 PolarHBondContact O-N 3.38Å; I147-L150 PolarHBondContact O-N 3.38Å; I147-A151 WeakPolarHBondContact O-CB 3.44Å; I147-A151 PolarHBondContact O-N 3.31Å
148A98.8Very high98.7Very high50 Ų5059.4 Ų59.441%0.41333%0.331SS..Hα-helixtrans-61.5-41.917600000112.3P144 F145 I146 A151 A152P144-A148 PolarHBondContact O-N 3.24Å; F145-A148 WeakPolarHBondContact O-CB 3.35Å; F145-A148 PolarHBondContact O-N 2.82Å; I146-A148 VanDerWaalsContact C-N 3.3Å; I146-A148 PolarHBondContact O-N 3.13Å; A148-A151 PolarHBondContact O-N 3.24Å; A148-A152 PolarHBondContact O-N 3.06Å; A148-A152 VanDerWaalsContact O-N 3.08Å
149A98.8Very high98.7Very high65 Ų6562.7 Ų62.754%0.53734%0.34SS..Hα-helixtrans-65.2-43.4174.900000112.2F145 I146 I147 A151 A152 L153F145-A149 PolarHBondContact O-N 2.89Å; F145-A149 VanDerWaalsContact O-N 3.1Å; I146-A149 PolarHBondContact O-N 3.44Å; I147-A149 PolarHBondContact O-N 3.38Å; A149-A151 VanDerWaalsContact C-N 3.3Å; A149-A151 PolarHBondContact O-N 2.86Å; A149-A152 PolarHBondContact O-N 3.47Å; A149-L153 PolarHBondContact O-N 3.18Å
150L98.8Very high98.7Very high35 Ų3564.7 Ų64.718%0.18335%0.351CS..Hα-helixtrans-63.2-35.4174.8-72.3170.4000112.2I76 L77 I146 I147 L153 H154I76-L150 HydrophobicContact CG2-CD1 3.88Å; I76-L150 HydrophobicContact CG2-CD2 4.31Å; L77-L150 HydrophobicContact CD2-CB 3.54Å; L77-L150 HydrophobicContact CG-CB 4.04Å; I146-L150 HydrophobicContact CG2-CD1 4.07Å; I146-L150 HydrophobicContact CG2-CG 4.41Å; I146-L150 WeakPolarHBondContact O-CG 3.08Å; I146-L150 PolarHBondContact O-N 2.83Å; I147-L150 PolarHBondContact O-N 3.38Å; L150-L153 PolarHBondContact O-N 3.1Å; L150-H154 WeakPolarHBondContact O-CB 3.26Å; L150-H154 PolarHBondContact O-N 3.27Å
151A98.8Very high98.6Very high37 Ų3766.4 Ų66.431%0.30636%0.363SS..Hα-helixtrans-68.1-38176.300000111.8L77 I147 A148 A149 L153 H154 L155L77-A151 HydrophobicContact CD2-CB 4.34Å; I147-A151 WeakPolarHBondContact O-CB 3.44Å; I147-A151 PolarHBondContact O-N 3.31Å; A148-A151 PolarHBondContact O-N 3.24Å; A149-A151 VanDerWaalsContact C-N 3.3Å; A149-A151 PolarHBondContact O-N 2.86Å; A151-L153 VanDerWaalsContact C-N 3.34Å; A151-H154 WeakPolarHBondContact O-CB 3.44Å; A151-H154 PolarHBondContact O-N 2.83Å; A151-L155 WeakPolarHBondContact O-CG 3.28Å; A151-L155 PolarHBondContact O-N 3.04Å
152A98.8Very high98.5Very high62 Ų6263.4 Ų63.451%0.51236%0.356SS..Hα-helixtrans-62.6-42.3171.500000111.5A148 A149 L155 L156A148-A152 PolarHBondContact O-N 3.06Å; A148-A152 VanDerWaalsContact O-N 3.08Å; A149-A152 PolarHBondContact O-N 3.47Å; A152-L155 PolarHBondContact O-N 3.41Å; A152-L156 PolarHBondContact O-N 2.82Å
153L98.7Very high98.5Very high74 Ų7463.7 Ų63.739%0.38737%0.365SS..Hα-helixtrans-64.8-41.1175.3-17365.3000112.3I73 A149 L150 A151 L155 L156 F157I73-L153 HydrophobicContact CD1-CD2 3.92Å; I73-L153 HydrophobicContact CD1-CG 3.8Å; I73-L153 HydrophobicContact CG1-CD2 4.5Å; A149-L153 PolarHBondContact O-N 3.18Å; L150-L153 PolarHBondContact O-N 3.1Å; A151-L153 VanDerWaalsContact C-N 3.34Å; L153-L155 VanDerWaalsContact C-N 3.32Å; L153-L155 PolarHBondContact O-N 3.28Å; L153-L156 WeakPolarHBondContact O-CB 3.49Å; L153-L156 PolarHBondContact O-N 3.31Å; L153-F157 HydrophobicContact CD1-CD2 4.19Å; L153-F157 HydrophobicContact CD1-CE2 3.79Å; L153-F157 HydrophobicContact CD2-CE2 4.45Å; L153-F157 HydrophobicContact CG-CD2 4.14Å; L153-F157 HydrophobicContact CG-CE2 3.95Å; L153-F157 WeakPolarHBondContact O-CD2 3.45Å; L153-F157 PolarHBondContact O-N 2.81Å; L153-F157 VanDerWaalsContact O-N 3.11Å
154H98.8Very high98.4Very high25 Ų2563.4 Ų63.412%0.11636%0.364CS..Hα-helixtrans-57.6-44.8174.7-17680.7000111.7T70 I73 L77 L150 A151 L158T70-H154 WeakPolarHBondContact CG2-CE1 3.5Å; T70-H154 PolarHBondContact O-CE1 3.36Å; T70-H154 PolarHBondContact O-ND1 3.08Å; I73-H154 HydrophobicContact CB-CB 4.46Å; I73-H154 HydrophobicContact CG2-CB 3.69Å; L77-H154 HydrophobicContact CD1-CB 3.79Å; L150-H154 WeakPolarHBondContact O-CB 3.26Å; L150-H154 PolarHBondContact O-N 3.27Å; A151-H154 WeakPolarHBondContact O-CB 3.44Å; A151-H154 PolarHBondContact O-N 2.83Å; H154-L158 PolarHBondContact O-N 3.06Å; H154-L158 VanDerWaalsContact O-N 3.09Å
155L98.8Very high98.4Very high86 Ų8663.8 Ų63.845%0.4536%0.364SS..Hα-helixtrans-69.2-33.8176.6-70.7174.2000112.8A151 A152 L153 L158 H159A151-L155 WeakPolarHBondContact O-CG 3.28Å; A151-L155 PolarHBondContact O-N 3.04Å; A152-L155 PolarHBondContact O-N 3.41Å; L153-L155 VanDerWaalsContact C-N 3.32Å; L153-L155 PolarHBondContact O-N 3.28Å; L155-L158 HydrophobicContact CD2-CD2 4.12Å; L155-L158 WeakPolarHBondContact O-CB 3.48Å; L155-L158 PolarHBondContact O-N 3.28Å; L155-H159 PolarHBondContact O-CD2 3.07Å; L155-H159 VanDerWaalsContact O-CG 3.32Å; L155-H159 PolarHBondContact O-N 2.81Å
156L98.7Very high98.4Very high91 Ų9163.1 Ų63.148%0.47637%0.368SS..Hα-helixtrans-60.1-50.8175.1-177.2146.2000110.8A152 L153 L158 H159 E160A152-L156 PolarHBondContact O-N 2.82Å; L153-L156 WeakPolarHBondContact O-CB 3.49Å; L153-L156 PolarHBondContact O-N 3.31Å; L156-L158 VanDerWaalsContact C-N 3.29Å; L156-L158 PolarHBondContact O-N 3.44Å; L156-H159 PolarHBondContact O-N 2.88Å; L156-E160 PolarHBondContact O-N 3.41Å
157F98.7Very high98.4Very high69 Ų6962.9 Ų62.930%0.30337%0.368SS..Hα-helixtrans-64.8-32.5176-78-70.7000113.1E69 T70 I73 L153 H159 E160E69-F157 HydrophobicContact CB-CB 4.09Å; E69-F157 HydrophobicContact CB-CD1 3.46Å; E69-F157 VanDerWaalsContact CB-CD1 3.46Å; E69-F157 HydrophobicContact CB-CD2 4.21Å; E69-F157 HydrophobicContact CB-CE1 3.84Å; E69-F157 HydrophobicContact CB-CG 3.66Å; E69-F157 HydrophobicContact CB-CZ 4.33Å; E69-F157 HydrophobicContact CG-CD1 3.85Å; E69-F157 HydrophobicContact CG-CE1 3.82Å; E69-F157 HydrophobicContact CG-CZ 4.46Å; T70-F157 WeakPolarHBondContact OG1-CB 3.18Å; I73-F157 HydrophobicContact CD1-CD2 3.16Å; I73-F157 HydrophobicContact CD1-CE2 3.44Å; I73-F157 VanDerWaalsContact CD1-CE2 3.44Å; I73-F157 HydrophobicContact CD1-CG 4.22Å; L153-F157 HydrophobicContact CD1-CD2 4.19Å; L153-F157 HydrophobicContact CD1-CE2 3.79Å; L153-F157 HydrophobicContact CD2-CE2 4.45Å; L153-F157 HydrophobicContact CG-CD2 4.14Å; L153-F157 HydrophobicContact CG-CE2 3.95Å; L153-F157 WeakPolarHBondContact O-CD2 3.45Å; L153-F157 PolarHBondContact O-N 2.81Å; L153-F157 VanDerWaalsContact O-N 3.11Å; F157-H159 VanDerWaalsContact C-N 3.29Å; F157-H159 PolarHBondContact O-N 3.23Å; F157-E160 PolarHBondContact O-N 2.73Å
158L98.6Very high98.3Very high36 Ų3662.5 Ų62.519%0.18837%0.369CS..Hα-helixtrans-65-34.3172.8179.964.3000111.9T70 H154 L155 L156 E160 G162T70-L158 HydrophobicContact CG2-CB 4.2Å; T70-L158 HydrophobicContact CG2-CD1 4.49Å; T70-L158 PolarHBondContact OG1-N 3.31Å; H154-L158 PolarHBondContact O-N 3.06Å; H154-L158 VanDerWaalsContact O-N 3.09Å; L155-L158 HydrophobicContact CD2-CD2 4.12Å; L155-L158 WeakPolarHBondContact O-CB 3.48Å; L155-L158 PolarHBondContact O-N 3.28Å; L156-L158 VanDerWaalsContact C-N 3.29Å; L156-L158 PolarHBondContact O-N 3.44Å; L158-E160 VanDerWaalsContact C-N 3.33Å; L158-G162 VanDerWaalsContact O-CA 3.29Å; L158-G162 WeakPolarHBondContact O-CA 3.22Å; L158-G162 PolarHBondContact O-N 3.43Å
159H98.4Very high98.2Very high150 Ų15065.2 Ų65.269%0.69438%0.375SS*.Hα-helixtrans-73.4-23.9179.8-75.5-177.7000113.3L155 L156 F157 T161L155-H159 PolarHBondContact O-CD2 3.07Å; L155-H159 VanDerWaalsContact O-CG 3.32Å; L155-H159 PolarHBondContact O-N 2.81Å; L156-H159 PolarHBondContact O-N 2.88Å; F157-H159 VanDerWaalsContact C-N 3.29Å; F157-H159 PolarHBondContact O-N 3.23Å; H159-T161 VanDerWaalsContact C-N 3.33Å; H159-T161 PolarHBondContact O-N 3.01Å
160E98.1Very high98Very high147 Ų14766.8 Ų66.869%0.68738%0.378SS*.Hα-helixtrans-63.1-38.1174-65.6-59.6133.800112.2L156 F157 L158L156-E160 PolarHBondContact O-N 3.41Å; F157-E160 PolarHBondContact O-N 2.73Å; L158-E160 VanDerWaalsContact C-N 3.33Å
161T96.4Very high97.9Very high66 Ų6667.1 Ų67.141%0.40538%0.383SS..Hα-helixtrans-101.2-27.8-17959.30000113.3Y67 H159Y67-T161 HydrophobicContact CD1-CG2 4.14Å; Y67-T161 HydrophobicContact CE1-CG2 4.38Å; H159-T161 VanDerWaalsContact C-N 3.33Å; H159-T161 PolarHBondContact O-N 3.01Å
162G96.9Very high97.8Very high20 Ų2071.8 Ų71.821%0.20640%0.398CS..  trans80.1171.8-165.300000112.8L158L158-G162 VanDerWaalsContact O-CA 3.29Å; L158-G162 WeakPolarHBondContact O-CA 3.22Å; L158-G162 PolarHBondContact O-N 3.43Å
163S97.8Very high97.6Very high85 Ų8574.5 Ų74.559%0.59441%0.414SS*.  trans-71143.5-179.4-67.60000113
164N98Very high97.6Very high26 Ų2677.3 Ų77.314%0.13943%0.429CS..  trans-68.2168.4162.4-17118.8000110.8Y62 S64 Y67 Q271Y62-N164 PolarHBondContact O-ND2 3.43Å; S64-N164 PolarHBondContact OG-ND2 2.83Å; S64-N164 VanDerWaalsContact OG-ND2 3.17Å; Y67-N164 HydrophobicContact CE2-CB 3.74Å; N164-Q271 PolarHBondContact ND2-NE2 3.22Å
165N98.4Very high97.5Very high33 Ų3382 Ų8218%0.17645%0.449CS..  trans-137.4165.217767.980.9000111.6L167 G168 I169N165-L167 VanDerWaalsContact C-N 3.25Å; N165-L167 PolarHBondContact O-N 3.21Å; N165-L167 VanDerWaalsContact O-N 3.15Å; N165-L167 WeakPolarHBondContact OD1-CB 3.4Å; N165-L167 PolarHBondContact OD1-N 2.91Å; N165-L167 VanDerWaalsContact OD1-N 3.11Å; N165-G168 PolarHBondContact O-N 3.45Å; N165-G168 PolarHBondContact OD1-N 2.98Å; N165-I169 PolarHBondContact ND2-O 3.47Å
166P98.6Very high97.5Very high69 Ų6981.8 Ų81.845%0.44845%0.448SS..THydrogen-bonded Turntrans-57.1-32.6-174-29.437.6000115.6Y62 G168 S272 M274Y62-P166 HydrophobicContact CD1-CB 4.23Å; Y62-P166 HydrophobicContact CE1-CB 3.69Å; Y62-P166 HydrophobicContact CE1-CG 4.37Å; P166-G168 VanDerWaalsContact C-N 3.27Å; P166-G168 PolarHBondContact O-N 3.16Å; P166-S272 VanDerWaalsContact O-CB 3.32Å; P166-S272 WeakPolarHBondContact O-CB 3.29Å; P166-S272 PolarHBondContact O-OG 3.43Å; P166-M274 HydrophobicContact CB-SD 4.2Å; P166-M274 WeakPolarHBondContact O-CB 3.21Å
167L98.2Very high97.5Very high75 Ų7581.9 Ų81.939%0.39345%0.452SS..THydrogen-bonded Turntrans-73.6-20.4-178.8-59.6171.4000112.2N165 I169 M274 F275N165-L167 VanDerWaalsContact C-N 3.25Å; N165-L167 PolarHBondContact O-N 3.21Å; N165-L167 VanDerWaalsContact O-N 3.15Å; N165-L167 WeakPolarHBondContact OD1-CB 3.4Å; N165-L167 PolarHBondContact OD1-N 2.91Å; N165-L167 VanDerWaalsContact OD1-N 3.11Å; L167-I169 HydrophobicContact CB-CD1 4.26Å; L167-I169 HydrophobicContact CB-CG1 3.85Å; L167-I169 HydrophobicContact CD1-CD1 4.18Å; L167-I169 HydrophobicContact CD1-CG1 4.44Å; L167-I169 PolarHBondContact O-N 3.44Å; L167-M274 HydrophobicContact CD2-CE 3.81Å; L167-M274 HydrophobicContact CD2-SD 3.68Å; L167-M274 HydrophobicContact CG-SD 4.47Å; L167-F275 HydrophobicContact CB-CE2 4.48Å; L167-F275 HydrophobicContact CD2-CE2 4.02Å; L167-F275 HydrophobicContact CD2-CZ 3.61Å
168G97.1Very high97.5Very high12 Ų1284.3 Ų84.312%0.12446%0.463CS..  trans64.925.2-177.600000113.8N165 P166N165-G168 PolarHBondContact O-N 3.45Å; N165-G168 PolarHBondContact OD1-N 2.98Å; P166-G168 VanDerWaalsContact C-N 3.27Å; P166-G168 PolarHBondContact O-N 3.16Å
169I96.6Very high97.4Very high107 Ų10788.9 Ų88.955%0.54948%0.483SS..SBendtrans-116165.2173.364.1177.1000109.5N165 L167 S171N165-I169 PolarHBondContact ND2-O 3.47Å; L167-I169 HydrophobicContact CB-CD1 4.26Å; L167-I169 HydrophobicContact CB-CG1 3.85Å; L167-I169 HydrophobicContact CD1-CD1 4.18Å; L167-I169 HydrophobicContact CD1-CG1 4.44Å; L167-I169 PolarHBondContact O-N 3.44Å; I169-S171 PolarHBondContact O-N 3.48Å
170T95.9Very high97.4Very high98 Ų9884.9 Ų84.960%0.60147%0.47SS*.  trans-57.9131.3176175.20000112H172T170-H172 PolarHBondContact OG1-CD2 2.89Å; T170-H172 PolarHBondContact OG1-N 3.4Å
171S96.6Very high97.5Very high41 Ų4184.3 Ų84.329%0.28746%0.463SS..  trans-100.29.3176.256.60000113.1I169 S173 D174 K175I169-S171 PolarHBondContact O-N 3.48Å; S171-S173 PolarHBondContact O-N 3.46Å; S171-S173 VanDerWaalsContact O-N 3.13Å; S171-D174 CarbonylContact O-C 3.32Å; S171-D174 PolarHBondContact O-N 3.39Å; S171-K175 WeakPolarHBondContact O-CG 3.46Å; S171-K175 PolarHBondContact O-N 3.32Å
172H95.1Very high97.6Very high135 Ų13585.6 Ų85.663%0.62546%0.461SS*.G310 helixtrans-57-31.2-175.4-74.8-62.8000114T170 D174 K175T170-H172 PolarHBondContact OG1-CD2 2.89Å; T170-H172 PolarHBondContact OG1-N 3.4Å; H172-D174 VanDerWaalsContact C-N 3.3Å; H172-D174 PolarHBondContact O-N 2.86Å; H172-K175 WeakPolarHBondContact ND1-CE 3.21Å; H172-K175 PolarHBondContact ND1-NZ 3.49Å
173S96.3Very high97.6Very high120 Ų12087.1 Ų87.184%0.83947%0.466SS*.G310 helixtrans-75.3-14.6179.755.20000114.4S171S171-S173 PolarHBondContact O-N 3.46Å; S171-S173 VanDerWaalsContact O-N 3.13Å
174D97.3Very high97.7Very high132 Ų13288.6 Ų88.671%0.70647%0.466SS*.G310 helixtrans-140.647.8-173-168.229.4000111.3S171 H172S171-D174 CarbonylContact O-C 3.32Å; S171-D174 PolarHBondContact O-N 3.39Å; H172-D174 VanDerWaalsContact C-N 3.3Å; H172-D174 PolarHBondContact O-N 2.86Å
175K97.8Very high97.7Very high124 Ų12493 Ų9354%0.53948%0.484SS..  trans-81.9137.8173.3-70.1-168.5175.7-1730110.2S171 H172S171-K175 WeakPolarHBondContact O-CG 3.46Å; S171-K175 PolarHBondContact O-N 3.32Å; H172-K175 WeakPolarHBondContact ND1-CE 3.21Å; H172-K175 PolarHBondContact ND1-NZ 3.49Å
176I98.3Very high97.7Very high82 Ų8295.6 Ų95.642%0.42150%0.498SS..  trans-112.9157.3168.865.1-178.2000109.9Y181 Y182I176-Y181 HydrophobicContact CB-CD2 4.08Å; I176-Y181 HydrophobicContact CB-CE2 4.23Å; I176-Y181 HydrophobicContact CD1-CD1 4.22Å; I176-Y181 HydrophobicContact CD1-CD2 3.91Å; I176-Y181 HydrophobicContact CD1-CG 3.69Å; I176-Y181 HydrophobicContact CG1-CD2 4.19Å; I176-Y181 HydrophobicContact CG1-CG 4.45Å; I176-Y182 HydrophobicContact CD1-CD2 4.47Å; I176-Y182 HydrophobicContact CD1-CE2 3.78Å; I176-Y182 HydrophobicContact CG1-CD2 4.47Å; I176-Y182 HydrophobicContact CG1-CE2 3.73Å
177T98Very high97.7Very high93 Ų9394.8 Ų94.857%0.57150%0.497SS*.  trans-63.7149.6172.952.20000110.8H179 Y181T177-H179 WeakPolarHBondContact CB-O 2.96Å; T177-H179 PolarHBondContact OG1-O 3.16Å; T177-Y181 WeakPolarHBondContact O-CD2 3.44Å
178F98.4Very high97.8Very high120 Ų12096 Ų9653%0.52650%0.503SS..SBendtrans-64.2-46.4178.3-172.7-91.9000111.7Y181 Y182 T183 D186F178-Y181 PolarHBondContact O-N 3.34Å; F178-Y182 HydrophobicContact CD2-CD2 4.14Å; F178-Y182 HydrophobicContact CD2-CG 4.05Å; F178-Y182 HydrophobicContact CE2-CG 4.11Å; F178-Y182 WeakPolarHBondContact O-CA 3.33Å; F178-Y182 PolarHBondContact O-N 3.49Å; F178-T183 HydrophobicContact CD1-CG2 3.67Å; F178-T183 HydrophobicContact CE1-CG2 3.56Å; F178-T183 PolarHBondContact O-N 3.49Å; F178-D186 WeakPolarHBondContact CZ-OD2 3.39Å
179H98.3Very high97.8Very high132 Ų13297.2 Ų97.261%0.61152%0.516SS*.THydrogen-bonded Turntrans-93135.6171-176.872.7000110.2T177 T183T177-H179 WeakPolarHBondContact CB-O 2.96Å; T177-H179 PolarHBondContact OG1-O 3.16Å; H179-T183 HydrophobicContact CB-CG2 4Å; H179-T183 PolarHBondContact ND1-OG1 2.83Å
180P98.1Very high97.9Very high66 Ų6697 Ų9743%0.42952%0.515SS..THydrogen-bonded Turncis-87.5-14.12.134.5-35.4000114.9Y182 T183 I184P180-Y182 PolarHBondContact O-N 2.92Å; P180-T183 VanDerWaalsContact C-OG1 3.25Å; P180-T183 WeakPolarHBondContact CA-OG1 3.5Å; P180-T183 PolarHBondContact O-N 3.41Å; P180-T183 PolarHBondContact O-OG1 3.17Å; P180-I184 WeakPolarHBondContact O-CG2 3.4Å; P180-I184 PolarHBondContact O-N 2.88Å
181Y98.6Very high98Very high134 Ų13497.6 Ų97.653%0.52551%0.514SS..Hα-helixtrans-59.1-53.9-163.6-59.9-79.3000114.6I176 T177 F178 I184 K185I176-Y181 HydrophobicContact CB-CD2 4.08Å; I176-Y181 HydrophobicContact CB-CE2 4.23Å; I176-Y181 HydrophobicContact CD1-CD1 4.22Å; I176-Y181 HydrophobicContact CD1-CD2 3.91Å; I176-Y181 HydrophobicContact CD1-CG 3.69Å; I176-Y181 HydrophobicContact CG1-CD2 4.19Å; I176-Y181 HydrophobicContact CG1-CG 4.45Å; T177-Y181 WeakPolarHBondContact O-CD2 3.44Å; F178-Y181 PolarHBondContact O-N 3.34Å; Y181-I184 WeakPolarHBondContact O-CG2 3.25Å; Y181-K185 PolarHBondContact O-N 2.98Å
182Y98.4Very high98.1Very high94 Ų94100.5 Ų100.537%0.36953%0.526SS..Hα-helixtrans-81.9-29.4179.7-67-80.1000111.7I176 F178 P180 I184 K185 D186I176-Y182 HydrophobicContact CD1-CD2 4.47Å; I176-Y182 HydrophobicContact CD1-CE2 3.78Å; I176-Y182 HydrophobicContact CG1-CD2 4.47Å; I176-Y182 HydrophobicContact CG1-CE2 3.73Å; F178-Y182 HydrophobicContact CD2-CD2 4.14Å; F178-Y182 HydrophobicContact CD2-CG 4.05Å; F178-Y182 HydrophobicContact CE2-CG 4.11Å; F178-Y182 WeakPolarHBondContact O-CA 3.33Å; F178-Y182 PolarHBondContact O-N 3.49Å; P180-Y182 PolarHBondContact O-N 2.92Å; Y182-I184 PolarHBondContact O-N 3.1Å; Y182-K185 VanDerWaalsContact CE1-NZ 3.33Å; Y182-K185 PolarHBondContact O-N 2.87Å; Y182-D186 VanDerWaalsContact O-CB 3.3Å; Y182-D186 WeakPolarHBondContact O-CB 3.46Å; Y182-D186 VanDerWaalsContact O-CG 3.22Å; Y182-D186 PolarHBondContact O-N 3.26Å
183T98.7Very high98.3Very high51 Ų5196.7 Ų96.731%0.31351%0.508SS..Hα-helixtrans-59.9-43.3174500000112.9F178 H179 P180 A187F178-T183 HydrophobicContact CD1-CG2 3.67Å; F178-T183 HydrophobicContact CE1-CG2 3.56Å; F178-T183 PolarHBondContact O-N 3.49Å; H179-T183 HydrophobicContact CB-CG2 4Å; H179-T183 PolarHBondContact ND1-OG1 2.83Å; P180-T183 VanDerWaalsContact C-OG1 3.25Å; P180-T183 WeakPolarHBondContact CA-OG1 3.5Å; P180-T183 PolarHBondContact O-N 3.41Å; P180-T183 PolarHBondContact O-OG1 3.17Å; T183-A187 WeakPolarHBondContact O-CB 3.23Å; T183-A187 PolarHBondContact O-N 3.07Å
184I98.8Very high98.4Very high117 Ų11794.7 Ų94.760%0.649%0.487SS*.Hα-helixtrans-72.9-35.5178.8-169.359.8000111.7P180 Y181 Y182 A187 L188P180-I184 WeakPolarHBondContact O-CG2 3.4Å; P180-I184 PolarHBondContact O-N 2.88Å; Y181-I184 WeakPolarHBondContact O-CG2 3.25Å; Y182-I184 PolarHBondContact O-N 3.1Å; I184-A187 PolarHBondContact O-N 3.42Å; I184-L188 PolarHBondContact O-N 3.2Å
185K98.7Very high98.5Very high118 Ų11893.4 Ų93.451%0.51348%0.48SS..Hα-helixtrans-65.4-42.5176.3-165.5-176.473.81800111.6Y181 Y182 L188 G189Y181-K185 PolarHBondContact O-N 2.98Å; Y182-K185 VanDerWaalsContact CE1-NZ 3.33Å; Y182-K185 PolarHBondContact O-N 2.87Å; K185-L188 PolarHBondContact O-N 3.02Å; K185-G189 PolarHBondContact O-N 3.23Å
186D98.6Very high98.5Very high87 Ų8789.9 Ų89.947%0.46547%0.471SS..Hα-helixtrans-69.6-36.3177.9-712.9000111F178 Y182 L188 G189 L190F178-D186 WeakPolarHBondContact CZ-OD2 3.39Å; Y182-D186 VanDerWaalsContact O-CB 3.3Å; Y182-D186 WeakPolarHBondContact O-CB 3.46Å; Y182-D186 VanDerWaalsContact O-CG 3.22Å; Y182-D186 PolarHBondContact O-N 3.26Å; D186-L188 PolarHBondContact O-N 2.92Å; D186-G189 PolarHBondContact O-N 3Å; D186-L190 WeakPolarHBondContact O-CB 3.49Å; D186-L190 PolarHBondContact O-N 3.18Å
187A98.7Very high98.5Very high52 Ų5286.2 Ų86.243%0.4345%0.452SS..Hα-helixtrans-61.6-41.7172.100000112.2T183 I184 L190 L191T183-A187 WeakPolarHBondContact O-CB 3.23Å; T183-A187 PolarHBondContact O-N 3.07Å; I184-A187 PolarHBondContact O-N 3.42Å; A187-L190 PolarHBondContact O-N 3.03Å; A187-L191 PolarHBondContact O-N 3.23Å
188L98.7Very high98.6Very high101 Ų10184.4 Ų84.453%0.52944%0.437SS..Hα-helixtrans-63.3-45.4172.9176.762.5000111.5I184 K185 D186 L190 L191 L192I184-L188 PolarHBondContact O-N 3.2Å; K185-L188 PolarHBondContact O-N 3.02Å; D186-L188 PolarHBondContact O-N 2.92Å; L188-L190 VanDerWaalsContact C-N 3.32Å; L188-L190 PolarHBondContact O-N 3.34Å; L188-L191 WeakPolarHBondContact O-CB 3.4Å; L188-L191 PolarHBondContact O-N 2.62Å; L188-L192 WeakPolarHBondContact O-CG 3.3Å; L188-L192 PolarHBondContact O-N 3.25Å
189G98.6Very high98.6Very high38 Ų3881.8 Ų81.839%0.39243%0.432SS..Hα-helixtrans-59-42.817600000112.5K185 D186 L192 F193K185-G189 PolarHBondContact O-N 3.23Å; D186-G189 PolarHBondContact O-N 3Å; G189-L192 PolarHBondContact O-N 3.2Å; G189-F193 WeakPolarHBondContact O-CB 3.3Å; G189-F193 PolarHBondContact O-N 2.97Å
190L98.5Very high98.6Very high102 Ų10276.4 Ų76.453%0.53441%0.407SS..Hα-helixtrans-63.4-40.7175.3-179.962.2000111.9D186 A187 L188 L192 F193 I194D186-L190 WeakPolarHBondContact O-CB 3.49Å; D186-L190 PolarHBondContact O-N 3.18Å; A187-L190 PolarHBondContact O-N 3.03Å; L188-L190 VanDerWaalsContact C-N 3.32Å; L188-L190 PolarHBondContact O-N 3.34Å; L190-L192 PolarHBondContact O-N 2.88Å; L190-F193 HydrophobicContact CD1-CD1 4.42Å; L190-F193 WeakPolarHBondContact O-CB 3.26Å; L190-F193 PolarHBondContact O-N 3.25Å; L190-I194 HydrophobicContact CD1-CD1 4.01Å; L190-I194 HydrophobicContact CD1-CG1 4.18Å; L190-I194 HydrophobicContact CG-CD1 3.89Å; L190-I194 HydrophobicContact CG-CG1 4.44Å; L190-I194 VanDerWaalsContact O-CG1 3.3Å; L190-I194 WeakPolarHBondContact O-CG1 3.24Å; L190-I194 PolarHBondContact O-N 3.14Å
191L98.7Very high98.6Very high111 Ų11173.3 Ų73.358%0.58139%0.387SS*.Hα-helixtrans-60.6-45.2175.8178.864.4000111.4A187 L188 I194 L195A187-L191 PolarHBondContact O-N 3.23Å; L188-L191 WeakPolarHBondContact O-CB 3.4Å; L188-L191 PolarHBondContact O-N 2.62Å; L191-I194 PolarHBondContact O-N 3.46Å; L191-L195 WeakPolarHBondContact O-CB 3.27Å; L191-L195 PolarHBondContact O-N 3.23Å
192L98.6Very high98.6Very high102 Ų10270.9 Ų70.953%0.53438%0.382SS..Hα-helixtrans-65.2-40.3176.8-65.3175.1000112L188 G189 L190 L195 S196L188-L192 WeakPolarHBondContact O-CG 3.3Å; L188-L192 PolarHBondContact O-N 3.25Å; G189-L192 PolarHBondContact O-N 3.2Å; L190-L192 PolarHBondContact O-N 2.88Å; L192-L195 PolarHBondContact O-N 3.27Å; L192-S196 PolarHBondContact O-N 3.12Å; L192-S196 PolarHBondContact O-OG 2.98Å
193F98.5Very high98.6Very high55 Ų5574.4 Ų74.424%0.24140%0.4CS..Hα-helixtrans-59.3-49.7173.4174-89.3000111.3M47 G189 L190 L195 S196 L197M47-F193 HydrophobicContact CB-CE2 3.68Å; M47-F193 HydrophobicContact CB-CZ 3.9Å; M47-F193 HydrophobicContact CE-CD2 3.98Å; M47-F193 HydrophobicContact CE-CE2 4.02Å; M47-F193 HydrophobicContact CG-CE2 4.48Å; G189-F193 WeakPolarHBondContact O-CB 3.3Å; G189-F193 PolarHBondContact O-N 2.97Å; L190-F193 HydrophobicContact CD1-CD1 4.42Å; L190-F193 WeakPolarHBondContact O-CB 3.26Å; L190-F193 PolarHBondContact O-N 3.25Å; F193-L195 VanDerWaalsContact C-N 3.35Å; F193-L195 PolarHBondContact O-N 3Å; F193-S196 PolarHBondContact O-N 3.39Å; F193-S196 PolarHBondContact O-OG 2.96Å; F193-L197 HydrophobicContact CE1-CD2 4.09Å; F193-L197 WeakPolarHBondContact O-CB 3.48Å; F193-L197 PolarHBondContact O-N 3.38Å
194I98.6Very high98.6Very high78 Ų7874 Ų7440%0.440%0.399SS..Hα-helixtrans-62.9-43.5178.8-68.3168.7000110.2L190 L191 S196 L197 M198L190-I194 HydrophobicContact CD1-CD1 4.01Å; L190-I194 HydrophobicContact CD1-CG1 4.18Å; L190-I194 HydrophobicContact CG-CD1 3.89Å; L190-I194 HydrophobicContact CG-CG1 4.44Å; L190-I194 VanDerWaalsContact O-CG1 3.3Å; L190-I194 WeakPolarHBondContact O-CG1 3.24Å; L190-I194 PolarHBondContact O-N 3.14Å; L191-I194 PolarHBondContact O-N 3.46Å; I194-S196 PolarHBondContact O-N 3.38Å; I194-L197 PolarHBondContact O-N 2.99Å; I194-M198 HydrophobicContact CG2-CG 3.86Å; I194-M198 VanDerWaalsContact O-CB 3.28Å; I194-M198 WeakPolarHBondContact O-CB 3.33Å; I194-M198 WeakPolarHBondContact O-CG 2.92Å; I194-M198 PolarHBondContact O-N 3.33Å
195L98.6Very high98.6Very high105 Ų10570 Ų7055%0.5538%0.381SS..Hα-helixtrans-58-47.7178.3179.963.1000111.6L191 L192 F193 T199L191-L195 WeakPolarHBondContact O-CB 3.27Å; L191-L195 PolarHBondContact O-N 3.23Å; L192-L195 PolarHBondContact O-N 3.27Å; F193-L195 VanDerWaalsContact C-N 3.35Å; F193-L195 PolarHBondContact O-N 3Å; L195-T199 WeakPolarHBondContact O-CB 3.36Å; L195-T199 PolarHBondContact O-N 3.43Å; L195-T199 PolarHBondContact O-OG1 3.26Å
196S98.5Very high98.5Very high50 Ų5067.9 Ų67.935%0.3538%0.375SS..Hα-helixtrans-64.5-46.4178.159.50000112.5M47 L192 F193 I194 M198 T199 L200M47-S196 WeakPolarHBondContact CE-OG 3.47Å; L192-S196 PolarHBondContact O-N 3.12Å; L192-S196 PolarHBondContact O-OG 2.98Å; F193-S196 PolarHBondContact O-N 3.39Å; F193-S196 PolarHBondContact O-OG 2.96Å; I194-S196 PolarHBondContact O-N 3.38Å; S196-M198 PolarHBondContact O-N 2.89Å; S196-T199 PolarHBondContact O-N 2.97Å; S196-L200 PolarHBondContact O-N 2.97Å
197L98.8Very high98.5Very high4 Ų469.7 Ų69.72%0.02138%0.384CS..Hα-helixtrans-60.2-45.4176.7173.864000112.1L1 L40 N43 M47 F193 I194 L200 T201L1-L197 HydrophobicContact CD1-CD2 4.48Å; L1-L197 HydrophobicContact CD2-CD2 3.39Å; L40-L197 HydrophobicContact CD2-CD2 3.97Å; L40-L197 HydrophobicContact CD2-CG 4.09Å; N43-L197 HydrophobicContact CB-CD1 3.88Å; M47-L197 HydrophobicContact CG-CB 4.28Å; M47-L197 HydrophobicContact CG-CD1 3.87Å; F193-L197 HydrophobicContact CE1-CD2 4.09Å; F193-L197 WeakPolarHBondContact O-CB 3.48Å; F193-L197 PolarHBondContact O-N 3.38Å; I194-L197 PolarHBondContact O-N 2.99Å; L197-L200 PolarHBondContact O-N 3.34Å; L197-T201 VanDerWaalsContact O-CB 3.24Å; L197-T201 WeakPolarHBondContact O-CB 3.41Å; L197-T201 PolarHBondContact O-N 3.06Å; L197-T201 PolarHBondContact O-OG1 3.36Å
198M98.6Very high98.5Very high55 Ų5570.2 Ų70.227%0.27138%0.379SS..Hα-helixtrans-68.7-37.4179.6-68.5-56.9-59.800111.3I36 L40 I194 S196 T201 L202I36-M198 HydrophobicContact CD1-CE 4.25Å; L40-M198 HydrophobicContact CD2-SD 3.77Å; I194-M198 HydrophobicContact CG2-CG 3.86Å; I194-M198 VanDerWaalsContact O-CB 3.28Å; I194-M198 WeakPolarHBondContact O-CB 3.33Å; I194-M198 WeakPolarHBondContact O-CG 2.92Å; I194-M198 PolarHBondContact O-N 3.33Å; S196-M198 PolarHBondContact O-N 2.89Å; M198-T201 PolarHBondContact O-N 3.31Å; M198-L202 HydrophobicContact CB-CD1 4.48Å; M198-L202 HydrophobicContact CE-CD1 3.71Å; M198-L202 HydrophobicContact CE-CD2 4.24Å; M198-L202 HydrophobicContact CE-CG 3.96Å; M198-L202 VanDerWaalsContact O-CB 3.24Å; M198-L202 WeakPolarHBondContact O-CB 3.37Å; M198-L202 VanDerWaalsContact O-CG 3.24Å; M198-L202 WeakPolarHBondContact O-CG 3.44Å; M198-L202 PolarHBondContact O-N 3.21Å
199T98.7Very high98.4Very high66 Ų6667.8 Ų67.841%0.40538%0.379SS..Hα-helixtrans-60.9-48.8175.2-57.80000110.4L195 S196 F203L195-T199 WeakPolarHBondContact O-CB 3.36Å; L195-T199 PolarHBondContact O-N 3.43Å; L195-T199 PolarHBondContact O-OG1 3.26Å; S196-T199 PolarHBondContact O-N 2.97Å; T199-F203 HydrophobicContact CG2-CD2 4.01Å; T199-F203 WeakPolarHBondContact O-CB 3.45Å; T199-F203 WeakPolarHBondContact O-CD2 3.25Å; T199-F203 PolarHBondContact O-N 3.25Å
200L98.5Very high98.4Very high19 Ų1967.1 Ų67.110%0.09937%0.366CS..Hα-helixtrans-59.5-48.8175.5178.762.2000111.3N43 S196 L197 L202 S204 P205 L207 L208N43-L200 HydrophobicContact CB-CD2 3.78Å; N43-L200 HydrophobicContact CB-CG 4.17Å; N43-L200 WeakPolarHBondContact OD1-CD2 3.5Å; S196-L200 PolarHBondContact O-N 2.97Å; L197-L200 PolarHBondContact O-N 3.34Å; L200-L202 PolarHBondContact O-N 3.03Å; L200-S204 WeakPolarHBondContact CD1-O 3.31Å; L200-S204 CarbonylContact O-C 3.53Å; L200-S204 WeakPolarHBondContact O-CA 3.1Å; L200-S204 PolarHBondContact O-N 3.11Å; L200-S204 VanDerWaalsContact O-O 3.13Å; L200-P205 WeakPolarHBondContact O-CA 3.46Å; L200-L207 HydrophobicContact CD1-CB 4Å; L200-L207 HydrophobicContact CD1-CD2 4.12Å; L200-L208 HydrophobicContact CD1-CG 4.38Å; L200-L208 HydrophobicContact CD2-CD1 3.68Å; L200-L208 HydrophobicContact CD2-CG 4.36Å
201T98.3Very high98.3Very high0 Ų066.8 Ų66.80%037%0.37CS..Hα-helixtrans-67.5-36.2-175.5-60.20000113.4I36 L40 L197 M198 P205I36-T201 HydrophobicContact CG1-CG2 4.32Å; L40-T201 HydrophobicContact CD2-CG2 4.17Å; L40-T201 HydrophobicContact CG-CG2 4.15Å; L197-T201 VanDerWaalsContact O-CB 3.24Å; L197-T201 WeakPolarHBondContact O-CB 3.41Å; L197-T201 PolarHBondContact O-N 3.06Å; L197-T201 PolarHBondContact O-OG1 3.36Å; M198-T201 PolarHBondContact O-N 3.31Å; T201-P205 WeakPolarHBondContact O-CB 3.25Å
202L98.6Very high98.3Very high83 Ų8364.5 Ų64.544%0.43536%0.359SS..Hα-helixtrans-91.5-33.7-174.2-64.7176.6000113.3W35 I36 M198 L200W35-L202 HydrophobicContact CH2-CD2 4.01Å; W35-L202 HydrophobicContact CZ3-CD2 4.31Å; I36-L202 HydrophobicContact CD1-CD2 3.94Å; M198-L202 HydrophobicContact CB-CD1 4.48Å; M198-L202 HydrophobicContact CE-CD1 3.71Å; M198-L202 HydrophobicContact CE-CD2 4.24Å; M198-L202 HydrophobicContact CE-CG 3.96Å; M198-L202 VanDerWaalsContact O-CB 3.24Å; M198-L202 WeakPolarHBondContact O-CB 3.37Å; M198-L202 VanDerWaalsContact O-CG 3.24Å; M198-L202 WeakPolarHBondContact O-CG 3.44Å; M198-L202 PolarHBondContact O-N 3.21Å; L200-L202 PolarHBondContact O-N 3.03Å
203F98.6Very high98.2Very high168 Ų16860.6 Ų60.674%0.73734%0.338SS*.Hα-helixtrans-105.6-27.1-174.6-63.5-71.7000113.6T199T199-F203 HydrophobicContact CG2-CD2 4.01Å; T199-F203 WeakPolarHBondContact O-CB 3.45Å; T199-F203 WeakPolarHBondContact O-CD2 3.25Å; T199-F203 PolarHBondContact O-N 3.25Å
204S98.4Very high98.2Very high42 Ų4262.8 Ų62.829%0.29435%0.346SS..  trans-146.655.1-176.162.10000112.3L200 D206 L207L200-S204 WeakPolarHBondContact CD1-O 3.31Å; L200-S204 CarbonylContact O-C 3.53Å; L200-S204 WeakPolarHBondContact O-CA 3.1Å; L200-S204 PolarHBondContact O-N 3.11Å; L200-S204 VanDerWaalsContact O-O 3.13Å; S204-D206 PolarHBondContact O-N 3.35Å; S204-D206 VanDerWaalsContact O-N 3.08Å; S204-L207 VanDerWaalsContact O-CB 3.31Å; S204-L207 WeakPolarHBondContact O-CB 3.33Å; S204-L207 PolarHBondContact O-N 2.87Å; S204-L207 VanDerWaalsContact O-N 3.1Å
205P98.1Very high98.2Very high34 Ų3462.9 Ų62.922%0.22135%0.35CS..THydrogen-bonded Turntrans-60.3-25.6-16819.9-32.1000114.6Y39 N43 L200 T201Y39-P205 HydrophobicContact CD1-CB 3.56Å; Y39-P205 HydrophobicContact CD2-CB 4.14Å; Y39-P205 HydrophobicContact CE1-CB 3.8Å; Y39-P205 HydrophobicContact CE2-CB 4.37Å; Y39-P205 HydrophobicContact CG-CB 3.74Å; N43-P205 PolarHBondContact ND2-O 2.83Å; N43-P205 PolarHBondContact OD1-O 3.32Å; L200-P205 WeakPolarHBondContact O-CA 3.46Å; T201-P205 WeakPolarHBondContact O-CB 3.25Å
206D98.3Very high98.1Very high73 Ų7362.1 Ų62.139%0.3935%0.346SS..THydrogen-bonded Turntrans-100.60.3-176.4-66.3-48.9000113.9Y39 S204 L208 G209 Y214Y39-D206 WeakPolarHBondContact CE1-OD1 3.24Å; S204-D206 PolarHBondContact O-N 3.35Å; S204-D206 VanDerWaalsContact O-N 3.08Å; D206-L208 PolarHBondContact O-N 3.1Å; D206-L208 VanDerWaalsContact O-N 3.11Å; D206-G209 PolarHBondContact O-N 3.05Å; D206-Y214 PolarHBondContact OD1-OH 3.19Å
207L98.6Very high98.1Very high125 Ų12560.4 Ų60.465%0.65434%0.335SS*.THydrogen-bonded Turntrans-56-34.1-173.1179.463.6000113.6L200 S204L200-L207 HydrophobicContact CD1-CB 4Å; L200-L207 HydrophobicContact CD1-CD2 4.12Å; S204-L207 VanDerWaalsContact O-CB 3.31Å; S204-L207 WeakPolarHBondContact O-CB 3.33Å; S204-L207 PolarHBondContact O-N 2.87Å; S204-L207 VanDerWaalsContact O-N 3.1Å
208L98.1Very high98Very high63 Ų6363.4 Ų63.433%0.3335%0.351SS..THydrogen-bonded Turntrans-101.82-178-56.7-177.7000113.3L200 D206L200-L208 HydrophobicContact CD1-CG 4.38Å; L200-L208 HydrophobicContact CD2-CD1 3.68Å; L200-L208 HydrophobicContact CD2-CG 4.36Å; D206-L208 PolarHBondContact O-N 3.1Å; D206-L208 VanDerWaalsContact O-N 3.11Å
209G96.5Very high97.9Very high50 Ų5064.5 Ų64.552%0.51536%0.362SS..SBendtrans-95.1172.7179.200000112.9D206D206-G209 PolarHBondContact O-N 3.05Å
210D97.7Very high97.8Very high24 Ų2469.2 Ų69.213%0.12838%0.384CS..  trans-108.4126.6173.6-163.1-65000110.6M96 D212 N213 K227M96-D210 HydrophobicContact CG-CB 4.17Å; D210-D212 PolarHBondContact O-N 2.99Å; D210-D212 WeakPolarHBondContact OD1-CB 3.33Å; D210-D212 PolarHBondContact OD1-N 3.33Å; D210-N213 WeakPolarHBondContact O-CB 3.26Å; D210-N213 PolarHBondContact O-N 3.32Å; D210-N213 VanDerWaalsContact O-N 3.11Å; D210-K227 WeakPolarHBondContact OD2-CE 3.36Å; D210-K227 IonicContact OD2-NZ 3.57Å
211P97.4Very high97.7Very high96 Ų9672.7 Ų72.762%0.62340%0.403SS*.G310 helixtrans-61.5-27.5-178.225.5-35.2000113.4N213 Y214P211-N213 PolarHBondContact O-N 3.1Å; P211-N213 VanDerWaalsContact O-N 3.17Å; P211-Y214 WeakPolarHBondContact O-CB 3.31Å; P211-Y214 PolarHBondContact O-N 3.38Å
212D97.4Very high97.6Very high63 Ų6376 Ų7634%0.33742%0.423SS..G310 helixtrans-63.7-24.2179-76.6-12.8000111.4Q95 M96 D210 Y214 T215Q95-D212 HydrophobicContact CB-CB 4.48Å; Q95-D212 WeakPolarHBondContact CB-O 3.36Å; M96-D212 HydrophobicContact CE-CB 3.44Å; M96-D212 VanDerWaalsContact CE-CB 3.44Å; M96-D212 WeakPolarHBondContact CE-OD2 3.41Å; M96-D212 HydrophobicContact CG-CB 3.84Å; D210-D212 PolarHBondContact O-N 2.99Å; D210-D212 WeakPolarHBondContact OD1-CB 3.33Å; D210-D212 PolarHBondContact OD1-N 3.33Å; D212-Y214 PolarHBondContact O-N 2.81Å; D212-T215 WeakPolarHBondContact O-CB 3.28Å; D212-T215 PolarHBondContact O-N 3.41Å
213N97.8Very high97.4Very high19 Ų1972.8 Ų72.810%0.10241%0.407CS..G310 helixtrans-74.5-4.5176.9-139.832.6000114G94 M96 S97 D210 P211 T215G94-N213 VanDerWaalsContact C-OD1 3.25Å; G94-N213 VanDerWaalsContact CA-OD1 3.22Å; G94-N213 WeakPolarHBondContact CA-OD1 3.44Å; M96-N213 HydrophobicContact CB-CB 4.12Å; M96-N213 PolarHBondContact N-OD1 2.75Å; S97-N213 PolarHBondContact N-OD1 3.36Å; S97-N213 PolarHBondContact OG-ND2 3.11Å; S97-N213 PolarHBondContact OG-OD1 3.23Å; D210-N213 WeakPolarHBondContact O-CB 3.26Å; D210-N213 PolarHBondContact O-N 3.32Å; D210-N213 VanDerWaalsContact O-N 3.11Å; P211-N213 PolarHBondContact O-N 3.1Å; P211-N213 VanDerWaalsContact O-N 3.17Å; N213-T215 VanDerWaalsContact C-N 3.3Å
214Y97.8Very high97.1Very high101 Ų10172.7 Ų72.740%0.39641%0.413SS..G310 helixtrans-86.51.3166.5-74-73000113.6F21 Y39 D206 P211 D212F21-Y214 WeakPolarHBondContact CZ-O 3.46Å; Y39-Y214 PolarHBondContact OH-OH 3.44Å; D206-Y214 PolarHBondContact OD1-OH 3.19Å; P211-Y214 WeakPolarHBondContact O-CB 3.31Å; P211-Y214 PolarHBondContact O-N 3.38Å; D212-Y214 PolarHBondContact O-N 2.81Å
215T98.1Very high96.8Very high80 Ų8078 Ų7849%0.49143%0.433SS..SBendtrans-104.1133.1170-56.20000109.2G94 Q95 D212 N213G94-T215 CarbonylContact C-O 3.6Å; G94-T215 WeakPolarHBondContact CA-O 3.47Å; Q95-T215 HydrophobicContact CG-CG2 4.07Å; Q95-T215 PolarHBondContact N-O 3.4Å; D212-T215 WeakPolarHBondContact O-CB 3.28Å; D212-T215 PolarHBondContact O-N 3.41Å; N213-T215 VanDerWaalsContact C-N 3.3Å
216L97.9Very high96.5Very high90 Ų9078 Ų7847%0.47143%0.431SS..BIsolated β-bridgetrans-54.4139.1175.6176.465.7000110.6F21 N218F21-L216 HydrophobicContact CB-CD1 3.46Å; F21-L216 VanDerWaalsContact CB-CD1 3.46Å; F21-L216 HydrophobicContact CD1-CB 4.35Å; F21-L216 HydrophobicContact CD1-CD1 4.24Å; F21-L216 HydrophobicContact CD2-CB 4.44Å; F21-L216 HydrophobicContact CD2-CD1 4.17Å; F21-L216 HydrophobicContact CE1-CB 4.5Å; F21-L216 HydrophobicContact CG-CB 4.33Å; F21-L216 HydrophobicContact CG-CD1 3.71Å; L216-N218 PolarHBondContact O-N 2.9Å
217A97.6Very high96.4Very high14 Ų1479 Ų7912%0.11643%0.432CS..  trans-52.8130176.200000112.4W93 F98W93-A217 HydrophobicContact CG-CB 4.44Å; W93-A217 WeakPolarHBondContact O-CB 3.34Å; W93-A217 PolarHBondContact O-N 2.97Å; W93-A217 VanDerWaalsContact O-N 3.1Å; F98-A217 HydrophobicContact CB-CB 3.51Å; F98-A217 HydrophobicContact CD2-CB 4.23Å; F98-A217 HydrophobicContact CG-CB 3.96Å
218N97.5Very high96.3Very high66 Ų6673.9 Ų73.935%0.35341%0.406SS..  trans-123.4106.9172.8-177-12.6000109.3W99 L216 L220 N221W99-N218 WeakPolarHBondContact CZ2-O 3.06Å; W99-N218 PolarHBondContact NE1-O 3.12Å; L216-N218 PolarHBondContact O-N 2.9Å; N218-L220 PolarHBondContact O-N 2.78Å; N218-L220 WeakPolarHBondContact OD1-CB 3.47Å; N218-L220 PolarHBondContact OD1-N 3.35Å; N218-N221 HydrophobicContact CB-CB 4.22Å; N218-N221 PolarHBondContact O-N 3.26Å; N218-N221 VanDerWaalsContact O-N 3.09Å
219P96.3Very high96.3Very high78 Ų7871.7 Ų71.751%0.50639%0.394SS..THydrogen-bonded Turntrans-60.1-16.8179.5-24.534.3000114.8F98 W99F98-P219 HydrophobicContact CE1-CB 4.16Å; F98-P219 HydrophobicContact CE1-CG 4.4Å; F98-P219 HydrophobicContact CE2-CG 4.21Å; F98-P219 HydrophobicContact CZ-CB 3.86Å; F98-P219 HydrophobicContact CZ-CG 3.89Å; W99-P219 WeakPolarHBondContact CH2-O 3.16Å; W99-P219 WeakPolarHBondContact CZ2-O 3.46Å
220L96.9Very high96.4Very high166 Ų16672.4 Ų72.487%0.86938%0.381SS*.THydrogen-bonded Turntrans-99.5-5.8-178.6-55.7179.7000113.4N218N218-L220 PolarHBondContact O-N 2.78Å; N218-L220 WeakPolarHBondContact OD1-CB 3.47Å; N218-L220 PolarHBondContact OD1-N 3.35Å
221N96.6Very high96.4Very high91 Ų9171.8 Ų71.849%0.48738%0.377SS..  trans-132.6100.1-178.8-173.1-6.8000111.1Q95 W99 N218Q95-N221 PolarHBondContact NE2-O 2.81Å; W99-N221 PolarHBondContact NE1-O 2.71Å; N218-N221 HydrophobicContact CB-CB 4.22Å; N218-N221 PolarHBondContact O-N 3.26Å; N218-N221 VanDerWaalsContact O-N 3.09Å
222T95.4Very high96.5Very high71 Ų7168.3 Ų68.344%0.43635%0.352SS..  trans-76.1123.9174.6-49.70000110.6W99 I226W99-T222 HydrophobicContact CD2-CG2 4.17Å; W99-T222 HydrophobicContact CE3-CG2 4.18Å; W99-T222 WeakPolarHBondContact CH2-OG1 3.37Å; W99-T222 VanDerWaalsContact CZ2-OG1 3.28Å; W99-T222 WeakPolarHBondContact CZ2-OG1 3.25Å; W99-T222 HydrophobicContact CZ3-CG2 4.41Å; T222-I226 HydrophobicContact CG2-CD1 3.2Å; T222-I226 HydrophobicContact CG2-CG1 4.22Å
223P94.8Very high96.5Very high15 Ų1566.8 Ų66.810%0.09734%0.344CS..  trans-54.1146.7171.2-26.634000112.1Q95 M96 H225 I226Q95-P223 HydrophobicContact CB-CG 3.88Å; M96-P223 HydrophobicContact CE-CB 3.46Å; M96-P223 VanDerWaalsContact CE-CB 3.46Å; M96-P223 HydrophobicContact CE-CG 3.77Å; P223-H225 PolarHBondContact O-N 3.1Å; P223-I226 HydrophobicContact CB-CG1 4.14Å; P223-I226 HydrophobicContact CG-CG1 4.29Å
224L92Very high96.6Very high165 Ų16567 Ų6786%0.86434%0.344SS*.THydrogen-bonded Turntrans-58.6-35.9-177.8-68.2174.1000112.7
225H92.1Very high96.6Very high154 Ų15462.3 Ų62.371%0.71333%0.327SS*.THydrogen-bonded Turntrans-132.175.1-176.6-61-49.8000111.6P223 K227P223-H225 PolarHBondContact O-N 3.1Å; H225-K227 PolarHBondContact O-N 3.06Å
226I92.8Very high96.6Very high34 Ų3461 Ų6117%0.17431%0.313CS..  trans-67124.4171.4-60.6160.7000109.8W99 T222 P223 Y236W99-I226 HydrophobicContact CB-CD1 3.57Å; W99-I226 HydrophobicContact CB-CG1 3.9Å; W99-I226 HydrophobicContact CB-CG2 4.22Å; W99-I226 HydrophobicContact CD2-CD1 4.21Å; W99-I226 HydrophobicContact CE3-CD1 4.35Å; W99-I226 HydrophobicContact CG-CD1 3.9Å; W99-I226 HydrophobicContact CG-CG1 4.43Å; T222-I226 HydrophobicContact CG2-CD1 3.2Å; T222-I226 HydrophobicContact CG2-CG1 4.22Å; P223-I226 HydrophobicContact CB-CG1 4.14Å; P223-I226 HydrophobicContact CG-CG1 4.29Å; I226-Y236 PolarHBondContact O-OH 3Å
227K94.4Very high96.6Very high95 Ų9558.7 Ų58.741%0.41330%0.303SS..  trans-142.3153.417562.1-177.5177.6-178.20109.7D210 H225 L233D210-K227 WeakPolarHBondContact OD2-CE 3.36Å; D210-K227 IonicContact OD2-NZ 3.57Å; H225-K227 PolarHBondContact O-N 3.06Å; K227-L233 HydrophobicContact CB-CD2 4.19Å
228P96.6Very high96.7Very high16 Ų1659.9 Ų59.910%0.10431%0.307CS..  trans-76.5174.9169.437-37.6000110.5F232 L233 Y236P228-F232 HydrophobicContact CB-CB 3.79Å; P228-F232 HydrophobicContact CB-CD2 4.2Å; P228-F232 HydrophobicContact CB-CG 4.48Å; P228-F232 HydrophobicContact CG-CB 3.79Å; P228-L233 HydrophobicContact CG-CD2 4.22Å; P228-Y236 HydrophobicContact CG-CD2 4.33Å; P228-Y236 HydrophobicContact CG-CG 4.06Å
229E97.9Very high96.7Very high18 Ų1858.1 Ų58.18%0.08430%0.297CS..  trans-61.8157.7173.3-52.793.69500111.7Y89 Y231 F232Y89-E229 WeakPolarHBondContact CB-OE1 3.38Å; Y89-E229 HydrophobicContact CD1-CG 4.07Å; Y89-E229 WeakPolarHBondContact CD1-OE2 3.3Å; Y89-E229 HydrophobicContact CD2-CG 3.68Å; Y89-E229 HydrophobicContact CE1-CG 4.01Å; Y89-E229 WeakPolarHBondContact CE1-OE2 3.34Å; Y89-E229 HydrophobicContact CE2-CG 3.62Å; Y89-E229 HydrophobicContact CG-CG 3.91Å; E229-Y231 HydrophobicContact CB-CD1 4.4Å; E229-Y231 HydrophobicContact CB-CD2 4.35Å; E229-Y231 HydrophobicContact CB-CE1 3.84Å; E229-Y231 HydrophobicContact CB-CE2 3.77Å; E229-Y231 VanDerWaalsContact CB-CZ 3.47Å; E229-Y231 HydrophobicContact CG-CE2 4.43Å; E229-Y231 PolarHBondContact O-N 3.25Å; E229-Y231 PolarHBondContact OE1-OH 3.21Å; E229-F232 PolarHBondContact O-N 3.33Å
230W98.6Very high96.7Very high64 Ų6462.5 Ų62.524%0.24230%0.303CS..G310 helixtrans-54.2-36.4-167.571.7-93.1000113.9S46 F49 I50 F53 F232 L233S46-W230 PolarHBondContact OG-NE1 3.17Å; F49-W230 HydrophobicContact CB-CH2 4.2Å; F49-W230 HydrophobicContact CB-CZ2 4.27Å; I50-W230 HydrophobicContact CD1-CH2 4.43Å; I50-W230 HydrophobicContact CD1-CZ2 4.3Å; I50-W230 HydrophobicContact CG1-CH2 3.54Å; I50-W230 HydrophobicContact CG1-CZ2 3.77Å; F53-W230 HydrophobicContact CD2-CH2 4.35Å; F53-W230 HydrophobicContact CD2-CZ3 4.28Å; F53-W230 HydrophobicContact CE2-CH2 4.17Å; F53-W230 AromaticContact CE2-CZ3 3.96Å; F53-W230 HydrophobicContact CE2-CZ3 3.96Å; W230-F232 PolarHBondContact O-N 3.2Å; W230-F232 VanDerWaalsContact O-N 3.13Å; W230-L233 HydrophobicContact CB-CD1 4.26Å; W230-L233 PolarHBondContact O-N 2.96Å; W230-L233 VanDerWaalsContact O-N 3.14Å
231Y98.5Very high96.8Very high12 Ų1258.6 Ų58.65%0.04729%0.29CS..G310 helixtrans-70.1-5.4-179.945.1-107.5000114F49 F53 A85 E229 F234F49-Y231 HydrophobicContact CB-CD1 4.11Å; F49-Y231 HydrophobicContact CB-CG 3.99Å; F49-Y231 HydrophobicContact CD1-CD2 4.29Å; F49-Y231 HydrophobicContact CD1-CG 4.11Å; F49-Y231 AromaticContact CD2-CD1 3.54Å; F49-Y231 HydrophobicContact CD2-CD1 3.54Å; F49-Y231 AromaticContact CD2-CD2 3.71Å; F49-Y231 HydrophobicContact CD2-CD2 3.71Å; F49-Y231 AromaticContact CD2-CE1 3.9Å; F49-Y231 HydrophobicContact CD2-CE1 3.9Å; F49-Y231 HydrophobicContact CD2-CE2 4.05Å; F49-Y231 AromaticContact CD2-CG 3.45Å; F49-Y231 HydrophobicContact CD2-CG 3.45Å; F49-Y231 VanDerWaalsContact CD2-CG 3.45Å; F49-Y231 HydrophobicContact CE1-CD2 4.23Å; F49-Y231 HydrophobicContact CE2-CD1 4.2Å; F49-Y231 AromaticContact CE2-CD2 3.64Å; F49-Y231 HydrophobicContact CE2-CD2 3.64Å; F49-Y231 HydrophobicContact CE2-CE1 4.25Å; F49-Y231 AromaticContact CE2-CE2 3.71Å; F49-Y231 HydrophobicContact CE2-CE2 3.71Å; F49-Y231 AromaticContact CE2-CG 3.91Å; F49-Y231 HydrophobicContact CE2-CG 3.91Å; F49-Y231 AromaticContact CG-CD1 3.95Å; F49-Y231 HydrophobicContact CG-CD1 3.95Å; F49-Y231 HydrophobicContact CG-CD2 4.05Å; F49-Y231 AromaticContact CG-CG 3.57Å; F49-Y231 HydrophobicContact CG-CG 3.57Å; F49-Y231 AromaticContact CZ-CD2 3.91Å; F49-Y231 HydrophobicContact CZ-CD2 3.91Å; F49-Y231 HydrophobicContact CZ-CE2 4.2Å; F49-Y231 HydrophobicContact CZ-CG 4.41Å; F53-Y231 WeakPolarHBondContact CZ-O 3.43Å; A85-Y231 HydrophobicContact CB-CE2 4.32Å; E229-Y231 HydrophobicContact CB-CD1 4.4Å; E229-Y231 HydrophobicContact CB-CD2 4.35Å; E229-Y231 HydrophobicContact CB-CE1 3.84Å; E229-Y231 HydrophobicContact CB-CE2 3.77Å; E229-Y231 VanDerWaalsContact CB-CZ 3.47Å; E229-Y231 HydrophobicContact CG-CE2 4.43Å; E229-Y231 PolarHBondContact O-N 3.25Å; E229-Y231 PolarHBondContact OE1-OH 3.21Å; Y231-F234 WeakPolarHBondContact O-CE1 3.34Å
232F98.6Very high96.9Very high22 Ų2256.8 Ų56.810%0.09628%0.282CS..G310 helixtrans-110.6-6.4172.6-66.8-48.4000113.9F49 M82 F86 P228 E229 W230 F234 A235 Y236F49-F232 HydrophobicContact CZ-CE1 4.46Å; F49-F232 HydrophobicContact CZ-CZ 4.33Å; M82-F232 HydrophobicContact CB-CE1 3.82Å; M82-F232 HydrophobicContact CB-CZ 4.13Å; M82-F232 HydrophobicContact CE-CD1 3.79Å; M82-F232 HydrophobicContact CE-CE1 3.53Å; M82-F232 HydrophobicContact CG-CE1 3.81Å; M82-F232 HydrophobicContact CG-CZ 4.5Å; F86-F232 HydrophobicContact CB-CE2 4.29Å; F86-F232 HydrophobicContact CB-CZ 4.42Å; P228-F232 HydrophobicContact CB-CB 3.79Å; P228-F232 HydrophobicContact CB-CD2 4.2Å; P228-F232 HydrophobicContact CB-CG 4.48Å; P228-F232 HydrophobicContact CG-CB 3.79Å; E229-F232 PolarHBondContact O-N 3.33Å; W230-F232 PolarHBondContact O-N 3.2Å; W230-F232 VanDerWaalsContact O-N 3.13Å; F232-F234 PolarHBondContact O-N 3.36Å; F232-A235 PolarHBondContact O-N 2.58Å; F232-Y236 WeakPolarHBondContact O-CB 3.3Å; F232-Y236 PolarHBondContact O-N 3.39Å
233L98.6Very high97Very high32 Ų3260 Ų6017%0.16830%0.304CS..Hα-helixtrans-60.9-41.1-172.6-70.1175.1000112.7K227 P228 W230 A235 Y236 T237 T294K227-L233 HydrophobicContact CB-CD2 4.19Å; P228-L233 HydrophobicContact CG-CD2 4.22Å; W230-L233 HydrophobicContact CB-CD1 4.26Å; W230-L233 PolarHBondContact O-N 2.96Å; W230-L233 VanDerWaalsContact O-N 3.14Å; L233-A235 VanDerWaalsContact C-N 3.27Å; L233-A235 PolarHBondContact O-N 3.48Å; L233-Y236 HydrophobicContact CD2-CD1 4.48Å; L233-Y236 WeakPolarHBondContact O-CB 3.35Å; L233-Y236 PolarHBondContact O-N 3.04Å; L233-T237 PolarHBondContact O-N 2.92Å; L233-T237 PolarHBondContact O-OG1 3.32Å; L233-T237 VanDerWaalsContact O-OG1 3.09Å; L233-T294 HydrophobicContact CB-CG2 4.12Å; L233-T294 HydrophobicContact CD1-CG2 4.34Å; L233-T294 WeakPolarHBondContact CD1-O 3.49Å
234F98.8Very high97.1Very high23 Ų2363.8 Ų63.810%0.10132%0.323CS..Hα-helixtrans-55.8-43.3177.979.2-83.4000112.5F53 Y231 F232 T237 I238 I256 L290 L293F53-F234 HydrophobicContact CE1-CE1 4.42Å; F53-F234 HydrophobicContact CZ-CE1 4.19Å; Y231-F234 WeakPolarHBondContact O-CE1 3.34Å; F232-F234 PolarHBondContact O-N 3.36Å; F234-T237 PolarHBondContact O-N 3.49Å; F234-I238 HydrophobicContact CD2-CD1 4.43Å; F234-I238 WeakPolarHBondContact O-CG1 3.38Å; F234-I238 PolarHBondContact O-N 2.94Å; F234-I256 HydrophobicContact CE2-CD1 3.94Å; F234-I256 HydrophobicContact CZ-CD1 3.59Å; F234-L290 HydrophobicContact CB-CD2 4.48Å; F234-L290 HydrophobicContact CD2-CD2 3.88Å; F234-L290 HydrophobicContact CG-CD2 4.36Å; F234-L293 WeakPolarHBondContact CA-O 3.45Å; F234-L293 HydrophobicContact CB-CB 3.94Å
235A98.3Very high97.3Very high3 Ų360.5 Ų60.53%0.02530%0.302CS..Hα-helixtrans-75.3-36.5-177.900000110.9F232 L233 I238 L239 L252F232-A235 PolarHBondContact O-N 2.58Å; L233-A235 VanDerWaalsContact C-N 3.27Å; L233-A235 PolarHBondContact O-N 3.48Å; A235-I238 PolarHBondContact O-N 3.48Å; A235-L239 PolarHBondContact O-N 3.47Å; A235-L252 HydrophobicContact CB-CD1 3.51Å; A235-L252 VanDerWaalsContact O-CD1 3.25Å; A235-L252 WeakPolarHBondContact O-CD1 3.28Å
236Y98.2Very high97.5Very high53 Ų5356.3 Ų56.321%0.20829%0.285CS..Hα-helixtrans-62.7-39.2172.4170.4-100.8000112.6I226 P228 F232 L233 L239 R240I226-Y236 PolarHBondContact O-OH 3Å; P228-Y236 HydrophobicContact CG-CD2 4.33Å; P228-Y236 HydrophobicContact CG-CG 4.06Å; F232-Y236 WeakPolarHBondContact O-CB 3.3Å; F232-Y236 PolarHBondContact O-N 3.39Å; L233-Y236 HydrophobicContact CD2-CD1 4.48Å; L233-Y236 WeakPolarHBondContact O-CB 3.35Å; L233-Y236 PolarHBondContact O-N 3.04Å; Y236-L239 WeakPolarHBondContact O-CB 3.38Å; Y236-L239 PolarHBondContact O-N 3.35Å; Y236-R240 VanDerWaalsContact CE1-CD 3.48Å; Y236-R240 HydrophobicContact CE2-CG 4.32Å; Y236-R240 WeakPolarHBondContact O-CG 3.43Å; Y236-R240 PolarHBondContact O-N 2.91Å; Y236-R240 VanDerWaalsContact O-N 3.12Å; Y236-R240 WeakPolarHBondContact OH-CD 3.31Å; Y236-R240 PolarHBondContact OH-NH1 3.4Å
237T98.4Very high97.8Very high41 Ų4155.7 Ų55.725%0.25229%0.287SS..Hα-helixtrans-64.1-46.4174.6-61.20000110.6L233 F234 L239 R240 S241 L293L233-T237 PolarHBondContact O-N 2.92Å; L233-T237 PolarHBondContact O-OG1 3.32Å; L233-T237 VanDerWaalsContact O-OG1 3.09Å; F234-T237 PolarHBondContact O-N 3.49Å; T237-L239 VanDerWaalsContact C-N 3.34Å; T237-L239 PolarHBondContact O-N 3.01Å; T237-R240 PolarHBondContact O-N 3.39Å; T237-S241 PolarHBondContact O-N 2.94Å; T237-S241 PolarHBondContact O-OG 3.01Å; T237-L293 WeakPolarHBondContact CB-O 3.19Å; T237-L293 HydrophobicContact CG2-CD2 3.78Å; T237-L293 PolarHBondContact OG1-O 3.1Å
238I98.6Very high98Very high39 Ų3951.2 Ų51.220%0.227%0.268CS..Hα-helixtrans-56.7-45.2174.8-67.5167.5000111.7F234 A235 R240 S241 A251 L293F234-I238 HydrophobicContact CD2-CD1 4.43Å; F234-I238 WeakPolarHBondContact O-CG1 3.38Å; F234-I238 PolarHBondContact O-N 2.94Å; A235-I238 PolarHBondContact O-N 3.48Å; I238-R240 VanDerWaalsContact C-N 3.27Å; I238-R240 PolarHBondContact O-N 2.85Å; I238-S241 PolarHBondContact O-N 3.04Å; I238-A251 HydrophobicContact CG2-CB 3.91Å; I238-L293 HydrophobicContact CD1-CD1 4.07Å; I238-L293 HydrophobicContact CG1-CD1 4.09Å; I238-L293 HydrophobicContact CG1-CD2 4.25Å
239L98.1Very high98Very high28 Ų2851.1 Ų51.115%0.14727%0.267CS..Hα-helixtrans-53.9-45.1175.2168.866.3000111.4L107 A235 Y236 T237 G248 V249 L252L107-L239 HydrophobicContact CD1-CD2 3.98Å; L107-L239 HydrophobicContact CD2-CD1 4.32Å; L107-L239 HydrophobicContact CD2-CD2 4.13Å; A235-L239 PolarHBondContact O-N 3.47Å; Y236-L239 WeakPolarHBondContact O-CB 3.38Å; Y236-L239 PolarHBondContact O-N 3.35Å; T237-L239 VanDerWaalsContact C-N 3.34Å; T237-L239 PolarHBondContact O-N 3.01Å; L239-G248 VanDerWaalsContact CD1-O 3.31Å; L239-G248 WeakPolarHBondContact CD1-O 3.23Å; L239-V249 HydrophobicContact CD1-CG2 4.33Å; L239-L252 HydrophobicContact CB-CB 4.21Å; L239-L252 HydrophobicContact CB-CD1 4.4Å; L239-L252 HydrophobicContact CD1-CB 4.39Å; L239-L252 HydrophobicContact CD2-CD2 4.48Å
240R97.4Very high98Very high171 Ų17154.5 Ų54.565%0.64529%0.285SS*.Hα-helixtrans-77.9-20.6-176.6-72.8-175.160.2-173.3-5.7114.1Y236 T237 I238 V242Y236-R240 VanDerWaalsContact CE1-CD 3.48Å; Y236-R240 HydrophobicContact CE2-CG 4.32Å; Y236-R240 WeakPolarHBondContact O-CG 3.43Å; Y236-R240 PolarHBondContact O-N 2.91Å; Y236-R240 VanDerWaalsContact O-N 3.12Å; Y236-R240 WeakPolarHBondContact OH-CD 3.31Å; Y236-R240 PolarHBondContact OH-NH1 3.4Å; T237-R240 PolarHBondContact O-N 3.39Å; I238-R240 VanDerWaalsContact C-N 3.27Å; I238-R240 PolarHBondContact O-N 2.85Å; R240-V242 PolarHBondContact O-N 3.43Å
241S98Very high98Very high84 Ų8452.6 Ų52.659%0.58728%0.283SS*.Hα-helixtrans-67.7-18.1177.4-57.40000113.3T237 I238T237-S241 PolarHBondContact O-N 2.94Å; T237-S241 PolarHBondContact O-OG 3.01Å; I238-S241 PolarHBondContact O-N 3.04Å
242V98.4Very high98Very high52 Ų5253.9 Ų53.932%0.31529%0.29SS..SBendtrans-102.1115.3-179.3-175.40000110.1R240 N244 A251R240-V242 PolarHBondContact O-N 3.43Å; V242-N244 HydrophobicContact CG1-CB 4.32Å; V242-N244 PolarHBondContact O-N 3.43Å; V242-A251 HydrophobicContact CG2-CB 3.91Å
243P97.4Very high97.9Very high138 Ų13857.2 Ų57.290%0.89631%0.309SS*.SBendtrans-7944.3-177.834.4-37.3000112.7
244N97.8Very high97.9Very high95 Ų9560.8 Ų60.851%0.50833%0.328SS..SBendtrans-149.5129.5176.2-179.9-81.8000109V242 L246 G247 G248V242-N244 HydrophobicContact CG1-CB 4.32Å; V242-N244 PolarHBondContact O-N 3.43Å; N244-L246 PolarHBondContact O-N 3.39Å; N244-L246 PolarHBondContact OD1-N 3.09Å; N244-L246 VanDerWaalsContact OD1-N 3.07Å; N244-G247 PolarHBondContact O-N 2.95Å; N244-G247 PolarHBondContact OD1-N 3.2Å; N244-G248 PolarHBondContact O-N 2.87Å
245K95.4Very high97.8Very high97 Ų9761 Ų6142%0.42233%0.331SS..Hα-helixtrans-57.2-51.7-176.2-172.7178.4179.91740112.3N106 S109 A110 V249N106-K245 PolarHBondContact O-NZ 2.91Å; S109-K245 PolarHBondContact OG-NZ 3.34Å; A110-K245 HydrophobicContact CB-CD 4.34Å; A110-K245 HydrophobicContact CB-CG 4.06Å; K245-V249 VanDerWaalsContact O-CG2 3.29Å; K245-V249 WeakPolarHBondContact O-CG2 3.38Å; K245-V249 PolarHBondContact O-N 3.05Å; K245-V249 VanDerWaalsContact O-N 3.09Å
246L97.3Very high97.8Very high65 Ų6561.4 Ų61.434%0.3433%0.333SS..Hα-helixtrans-66.3-45.4179.617660.3000111.5A110 N244 G248 V249 L250A110-L246 HydrophobicContact CB-CB 4.44Å; A110-L246 HydrophobicContact CB-CD1 4.32Å; N244-L246 PolarHBondContact O-N 3.39Å; N244-L246 PolarHBondContact OD1-N 3.09Å; N244-L246 VanDerWaalsContact OD1-N 3.07Å; L246-G248 VanDerWaalsContact C-N 3.33Å; L246-G248 PolarHBondContact O-N 3.27Å; L246-V249 PolarHBondContact O-N 3.48Å; L246-L250 HydrophobicContact CD1-CD1 4.16Å; L246-L250 HydrophobicContact CD1-CG 4.11Å; L246-L250 HydrophobicContact CG-CD1 4.08Å; L246-L250 HydrophobicContact CG-CG 4.44Å; L246-L250 WeakPolarHBondContact O-CG 3.46Å; L246-L250 PolarHBondContact O-N 3.47Å
247G98.3Very high97.8Very high22 Ų2262.6 Ų62.623%0.22734%0.343CS..Hα-helixtrans-58.7-43178.300000112.7N244 L250 A251N244-G247 PolarHBondContact O-N 2.95Å; N244-G247 PolarHBondContact OD1-N 3.2Å; G247-L250 PolarHBondContact O-N 2.88Å; G247-A251 WeakPolarHBondContact O-CB 3.46Å; G247-A251 PolarHBondContact O-N 2.9Å
248G98.2Very high97.8Very high1 Ų164.6 Ų64.61%0.0135%0.351CS..Hα-helixtrans-64.6-43175.200000112.5L239 N244 L246 L250 A251 L252L239-G248 VanDerWaalsContact CD1-O 3.31Å; L239-G248 WeakPolarHBondContact CD1-O 3.23Å; N244-G248 PolarHBondContact O-N 2.87Å; L246-G248 VanDerWaalsContact C-N 3.33Å; L246-G248 PolarHBondContact O-N 3.27Å; G248-L250 VanDerWaalsContact C-N 3.33Å; G248-L250 PolarHBondContact O-N 3.47Å; G248-A251 PolarHBondContact O-N 2.87Å; G248-L252 WeakPolarHBondContact O-CB 3.5Å; G248-L252 PolarHBondContact O-N 3.32Å
249V97.9Very high97.8Very high14 Ų1463.9 Ų63.99%0.08535%0.347CS..Hα-helixtrans-62.7-41176.1171.90000111.4L107 A110 L239 K245 L246 L252 L253L107-V249 HydrophobicContact CB-CG2 3.81Å; L107-V249 HydrophobicContact CD2-CG2 3.89Å; L107-V249 HydrophobicContact CG-CG2 4.31Å; A110-V249 HydrophobicContact CB-CB 4.38Å; A110-V249 HydrophobicContact CB-CG2 4.02Å; L239-V249 HydrophobicContact CD1-CG2 4.33Å; K245-V249 VanDerWaalsContact O-CG2 3.29Å; K245-V249 WeakPolarHBondContact O-CG2 3.38Å; K245-V249 PolarHBondContact O-N 3.05Å; K245-V249 VanDerWaalsContact O-N 3.09Å; L246-V249 PolarHBondContact O-N 3.48Å; V249-L252 PolarHBondContact O-N 3.41Å; V249-L253 HydrophobicContact CG1-CD1 4.28Å; V249-L253 WeakPolarHBondContact O-CG 3.14Å; V249-L253 PolarHBondContact O-N 3.25Å
250L98.1Very high97.8Very high88 Ų8864.4 Ų64.446%0.46136%0.356SS..Hα-helixtrans-65.3-43.1174.7-68.5174.7000111.6L246 G247 G248 L252 L253 L254L246-L250 HydrophobicContact CD1-CD1 4.16Å; L246-L250 HydrophobicContact CD1-CG 4.11Å; L246-L250 HydrophobicContact CG-CD1 4.08Å; L246-L250 HydrophobicContact CG-CG 4.44Å; L246-L250 WeakPolarHBondContact O-CG 3.46Å; L246-L250 PolarHBondContact O-N 3.47Å; G247-L250 PolarHBondContact O-N 2.88Å; G248-L250 VanDerWaalsContact C-N 3.33Å; G248-L250 PolarHBondContact O-N 3.47Å; L250-L252 VanDerWaalsContact C-N 3.35Å; L250-L252 PolarHBondContact O-N 2.81Å; L250-L253 PolarHBondContact O-N 3.02Å; L250-L254 VanDerWaalsContact O-CB 3.3Å; L250-L254 WeakPolarHBondContact O-CB 3.43Å; L250-L254 VanDerWaalsContact O-CG 3.23Å; L250-L254 WeakPolarHBondContact O-CG 3.39Å; L250-L254 PolarHBondContact O-N 2.95Å
251A98.4Very high97.9Very high24 Ų2460.5 Ų60.520%0.19835%0.346CS..Hα-helixtrans-62-41.8176.700000112I238 V242 G247 G248 L254 S255I238-A251 HydrophobicContact CG2-CB 3.91Å; V242-A251 HydrophobicContact CG2-CB 3.91Å; G247-A251 WeakPolarHBondContact O-CB 3.46Å; G247-A251 PolarHBondContact O-N 2.9Å; G248-A251 PolarHBondContact O-N 2.87Å; A251-L254 PolarHBondContact O-N 3.4Å; A251-S255 WeakPolarHBondContact O-CB 3.34Å; A251-S255 PolarHBondContact O-N 3.07Å
252L97.7Very high97.9Very high39 Ų3958.4 Ų58.420%0.20433%0.328CS..Hα-helixtrans-57.1-53.3173.2176.170.5000111.2L107 A235 L239 G248 V249 L250 L254 S255L107-L252 HydrophobicContact CD1-CD2 3.74Å; A235-L252 HydrophobicContact CB-CD1 3.51Å; A235-L252 VanDerWaalsContact O-CD1 3.25Å; A235-L252 WeakPolarHBondContact O-CD1 3.28Å; L239-L252 HydrophobicContact CB-CB 4.21Å; L239-L252 HydrophobicContact CB-CD1 4.4Å; L239-L252 HydrophobicContact CD1-CB 4.39Å; L239-L252 HydrophobicContact CD2-CD2 4.48Å; G248-L252 WeakPolarHBondContact O-CB 3.5Å; G248-L252 PolarHBondContact O-N 3.32Å; V249-L252 PolarHBondContact O-N 3.41Å; L250-L252 VanDerWaalsContact C-N 3.35Å; L250-L252 PolarHBondContact O-N 2.81Å; L252-L254 PolarHBondContact O-N 2.83Å; L252-S255 WeakPolarHBondContact O-CB 3.25Å; L252-S255 PolarHBondContact O-N 2.81Å; L252-S255 PolarHBondContact O-OG 2.97Å
253L96.9Very high97.8Very high93 Ų9357.2 Ų57.249%0.48732%0.321SS..Hα-helixtrans-61.8-44.5-179.6-71.1172.1000111.4V249 L250 S255 I256 L257V249-L253 HydrophobicContact CG1-CD1 4.28Å; V249-L253 WeakPolarHBondContact O-CG 3.14Å; V249-L253 PolarHBondContact O-N 3.25Å; L250-L253 PolarHBondContact O-N 3.02Å; L253-S255 VanDerWaalsContact C-N 3.28Å; L253-S255 PolarHBondContact O-N 2.77Å; L253-I256 PolarHBondContact O-N 2.91Å; L253-L257 WeakPolarHBondContact O-CG 3.5Å; L253-L257 PolarHBondContact O-N 3.45Å
254L98Very high97.8Very high107 Ų10756.5 Ų56.556%0.5631%0.309SS*.Hα-helixtrans-66.6-28.5179.3-70.9172.7000112.7L250 A251 L252 I256 L257 I258L250-L254 VanDerWaalsContact O-CB 3.3Å; L250-L254 WeakPolarHBondContact O-CB 3.43Å; L250-L254 VanDerWaalsContact O-CG 3.23Å; L250-L254 WeakPolarHBondContact O-CG 3.39Å; L250-L254 PolarHBondContact O-N 2.95Å; A251-L254 PolarHBondContact O-N 3.4Å; L252-L254 PolarHBondContact O-N 2.83Å; L254-I256 PolarHBondContact O-N 3.45Å; L254-I256 VanDerWaalsContact O-N 3.14Å; L254-L257 PolarHBondContact O-N 3.28Å; L254-I258 VanDerWaalsContact O-CB 3.23Å; L254-I258 WeakPolarHBondContact O-CB 3.29Å; L254-I258 WeakPolarHBondContact O-CG2 3.45Å; L254-I258 PolarHBondContact O-N 3.46Å
255S98.1Very high97.8Very high26 Ų2657 Ų5718%0.18231%0.311CS..Hα-helixtrans-58.7-26.6175.877.20000113.4A251 L252 L253 I258A251-S255 WeakPolarHBondContact O-CB 3.34Å; A251-S255 PolarHBondContact O-N 3.07Å; L252-S255 WeakPolarHBondContact O-CB 3.25Å; L252-S255 PolarHBondContact O-N 2.81Å; L252-S255 PolarHBondContact O-OG 2.97Å; L253-S255 VanDerWaalsContact C-N 3.28Å; L253-S255 PolarHBondContact O-N 2.77Å; S255-I258 WeakPolarHBondContact O-CG2 3.4Å
256I98.2Very high97.9Very high13 Ų1354.5 Ų54.57%0.06730%0.301CS..Hα-helixtrans-97.9-46.6175.2-48.7-58.5000110.7L78 L79 M82 F234 L253 L254 I258 L259L78-I256 HydrophobicContact CD2-CG2 3.8Å; L79-I256 HydrophobicContact CD2-CG2 3.8Å; L79-I256 HydrophobicContact CG-CG2 4.45Å; M82-I256 HydrophobicContact CE-CD1 3.9Å; M82-I256 HydrophobicContact CE-CG1 4.09Å; M82-I256 HydrophobicContact SD-CD1 4.25Å; M82-I256 HydrophobicContact SD-CG1 4.38Å; M82-I256 HydrophobicContact SD-CG2 4.38Å; F234-I256 HydrophobicContact CE2-CD1 3.94Å; F234-I256 HydrophobicContact CZ-CD1 3.59Å; L253-I256 PolarHBondContact O-N 2.91Å; L254-I256 PolarHBondContact O-N 3.45Å; L254-I256 VanDerWaalsContact O-N 3.14Å; I256-I258 PolarHBondContact O-N 2.85Å; I256-L259 WeakPolarHBondContact O-CB 3.45Å; I256-L259 WeakPolarHBondContact O-CG 3.09Å; I256-L259 PolarHBondContact O-N 3.01Å; I256-L259 VanDerWaalsContact O-N 3.13Å
257L97.9Very high98Very high77 Ų7759.8 Ų59.840%0.40333%0.326SS..Hα-helixtrans-67.8-17.7-175.9-66.1179.4000113.5L79 L253 L254 L259 A260L79-L257 HydrophobicContact CD1-CD2 4.21Å; L253-L257 WeakPolarHBondContact O-CG 3.5Å; L253-L257 PolarHBondContact O-N 3.45Å; L254-L257 PolarHBondContact O-N 3.28Å; L257-L259 PolarHBondContact O-N 2.93Å; L257-L259 VanDerWaalsContact O-N 3.11Å; L257-A260 WeakPolarHBondContact O-CB 3.47Å; L257-A260 PolarHBondContact O-N 3.41Å
258I98.4Very high98Very high83 Ų8360.5 Ų60.543%0.42633%0.327SS..G310 helixtrans-56.7-25.3171.8-166.164.2000112.3L254 S255 I256 A260 M261 I262L254-I258 VanDerWaalsContact O-CB 3.23Å; L254-I258 WeakPolarHBondContact O-CB 3.29Å; L254-I258 WeakPolarHBondContact O-CG2 3.45Å; L254-I258 PolarHBondContact O-N 3.46Å; S255-I258 WeakPolarHBondContact O-CG2 3.4Å; I256-I258 PolarHBondContact O-N 2.85Å; I258-A260 PolarHBondContact O-N 3.15Å; I258-M261 HydrophobicContact CD1-CB 4.14Å; I258-M261 HydrophobicContact CD1-CG 4.22Å; I258-M261 WeakPolarHBondContact O-CB 3.38Å; I258-M261 PolarHBondContact O-N 3.13Å; I258-I262 PolarHBondContact O-N 2.88Å
259L98.6Very high97.9Very high24 Ų2470.8 Ų70.813%0.12637%0.372CS..G310 helixtrans-56.6-32.8173.9-67.6174.8000112.5I56 L60 W71 I75 L78 I256 L257 M261 I262I56-L259 HydrophobicContact CG2-CD1 4.48Å; I56-L259 HydrophobicContact CG2-CD2 4.14Å; L60-L259 HydrophobicContact CD2-CD2 4.46Å; W71-L259 HydrophobicContact CH2-CD2 4.42Å; W71-L259 HydrophobicContact CZ2-CB 4.2Å; W71-L259 HydrophobicContact CZ2-CD2 3.98Å; W71-L259 PolarHBondContact NE1-O 3.03Å; I75-L259 HydrophobicContact CD1-CB 3.79Å; I75-L259 HydrophobicContact CG1-CB 3.95Å; L78-L259 HydrophobicContact CD2-CD1 3.75Å; I256-L259 WeakPolarHBondContact O-CB 3.45Å; I256-L259 WeakPolarHBondContact O-CG 3.09Å; I256-L259 PolarHBondContact O-N 3.01Å; I256-L259 VanDerWaalsContact O-N 3.13Å; L257-L259 PolarHBondContact O-N 2.93Å; L257-L259 VanDerWaalsContact O-N 3.11Å; L259-M261 VanDerWaalsContact C-N 3.25Å; L259-M261 PolarHBondContact O-N 3.09Å; L259-I262 WeakPolarHBondContact O-CB 3.28Å; L259-I262 WeakPolarHBondContact O-CG1 3.45Å; L259-I262 PolarHBondContact O-N 3.47Å
260A98.1Very high98Very high40 Ų4074.5 Ų74.533%0.33139%0.388SS..G310 helixtrans-70.9-22.5178.100000112.6I75 L257 I258 P263I75-A260 HydrophobicContact CD1-CB 3.87Å; L257-A260 WeakPolarHBondContact O-CB 3.47Å; L257-A260 PolarHBondContact O-N 3.41Å; I258-A260 PolarHBondContact O-N 3.15Å; A260-P263 WeakPolarHBondContact O-CD 3.32Å
261M97.9Very high97.9Very high88 Ų8872.4 Ų72.443%0.43338%0.376SS..G310 helixtrans-82.6-18.9177.4-60.3-57.9-65.300112.5I258 L259 I264 L265I258-M261 HydrophobicContact CD1-CB 4.14Å; I258-M261 HydrophobicContact CD1-CG 4.22Å; I258-M261 WeakPolarHBondContact O-CB 3.38Å; I258-M261 PolarHBondContact O-N 3.13Å; L259-M261 VanDerWaalsContact C-N 3.25Å; L259-M261 PolarHBondContact O-N 3.09Å; M261-I264 HydrophobicContact CE-CD1 4.24Å; M261-I264 WeakPolarHBondContact O-CB 3.38Å; M261-I264 PolarHBondContact O-N 3.24Å; M261-I264 HydrophobicContact SD-CD1 4.38Å; M261-L265 HydrophobicContact CB-CD1 4.08Å; M261-L265 HydrophobicContact CB-CG 4.45Å; M261-L265 WeakPolarHBondContact O-CG 3.5Å; M261-L265 PolarHBondContact O-N 2.59Å
262I98Very high97.9Very high40 Ų4071.4 Ų71.421%0.20537%0.367CS..THydrogen-bonded Turntrans-55.4-44.1-173.9-59.5-64000113.6L60 F65 I258 L259 I264 L265 H266L60-I262 HydrophobicContact CD2-CD1 4.47Å; L60-I262 HydrophobicContact CD2-CG1 4.12Å; L60-I262 HydrophobicContact CD2-CG2 3.88Å; F65-I262 HydrophobicContact CB-CG2 4.37Å; F65-I262 HydrophobicContact CD1-CG2 3.51Å; F65-I262 HydrophobicContact CD2-CG2 3.8Å; F65-I262 HydrophobicContact CE1-CG2 3.57Å; F65-I262 HydrophobicContact CE2-CG2 3.89Å; F65-I262 HydrophobicContact CG-CG2 3.63Å; F65-I262 HydrophobicContact CZ-CG2 3.76Å; I258-I262 PolarHBondContact O-N 2.88Å; L259-I262 WeakPolarHBondContact O-CB 3.28Å; L259-I262 WeakPolarHBondContact O-CG1 3.45Å; L259-I262 PolarHBondContact O-N 3.47Å; I262-I264 VanDerWaalsContact C-N 3.26Å; I262-I264 PolarHBondContact O-N 2.95Å; I262-L265 PolarHBondContact O-N 3.07Å; I262-H266 PolarHBondContact O-N 3.45Å
263P97.5Very high98Very high27 Ų2771 Ų7118%0.17537%0.365CS..THydrogen-bonded Turntrans-60.1-35.8177-23.434.7000113.1F65 A260 H266F65-P263 HydrophobicContact CB-CG 4.34Å; F65-P263 HydrophobicContact CD2-CB 4.32Å; F65-P263 HydrophobicContact CD2-CG 4.2Å; F65-P263 WeakPolarHBondContact O-CG 3.41Å; A260-P263 WeakPolarHBondContact O-CD 3.32Å; P263-H266 WeakPolarHBondContact O-CB 3.22Å; P263-H266 PolarHBondContact O-N 3.38Å
264I97.3Very high98Very high123 Ų12370.3 Ų70.363%0.63136%0.36SS*.THydrogen-bonded Turntrans-75.1-31.9-179-54170.3000110.9M261 I262 H266M261-I264 HydrophobicContact CE-CD1 4.24Å; M261-I264 WeakPolarHBondContact O-CB 3.38Å; M261-I264 PolarHBondContact O-N 3.24Å; M261-I264 HydrophobicContact SD-CD1 4.38Å; I262-I264 VanDerWaalsContact C-N 3.26Å; I262-I264 PolarHBondContact O-N 2.95Å; I264-H266 PolarHBondContact O-N 3.14Å
265L97.8Very high98Very high107 Ų10770.6 Ų70.656%0.5636%0.357SS*.THydrogen-bonded Turntrans-78.4-1.3178.1-63.5172.6000113.2M261 I262 M267M261-L265 HydrophobicContact CB-CD1 4.08Å; M261-L265 HydrophobicContact CB-CG 4.45Å; M261-L265 WeakPolarHBondContact O-CG 3.5Å; M261-L265 PolarHBondContact O-N 2.59Å; I262-L265 PolarHBondContact O-N 3.07Å; L265-M267 PolarHBondContact O-N 3.1Å; L265-M267 VanDerWaalsContact O-N 3.16Å
266H98.2Very high98.1Very high44 Ų4471.3 Ų71.320%0.20436%0.356CS..  trans-77.4101.1-178.7-17184.8000112.3F65 L66 I262 P263 I264 S268F65-H266 HydrophobicContact CE2-CB 3.96Å; F65-H266 AromaticContact CE2-ND1 3.75Å; F65-H266 HydrophobicContact CZ-CB 4.48Å; F65-H266 AromaticContact CZ-ND1 3.61Å; L66-H266 HydrophobicContact CD2-CB 4.22Å; I262-H266 PolarHBondContact O-N 3.45Å; P263-H266 WeakPolarHBondContact O-CB 3.22Å; P263-H266 PolarHBondContact O-N 3.38Å; I264-H266 PolarHBondContact O-N 3.14Å; H266-S268 PolarHBondContact NE2-O 3.21Å
267M97.8Very high98.1Very high175 Ų17575.2 Ų75.286%0.86238%0.382SS*.  trans-100-8.3-179.6-59.1-59.1-69.600114.4L265L265-M267 PolarHBondContact O-N 3.1Å; L265-M267 VanDerWaalsContact O-N 3.16Å
268S97.9Very high98.1Very high37 Ų3778.2 Ų78.226%0.25940%0.397SS..  trans-74.6150.7-176.8-168.70000111.4H266 Q270 R276H266-S268 PolarHBondContact NE2-O 3.21Å; S268-Q270 VanDerWaalsContact C-N 3.25Å; S268-Q270 PolarHBondContact OG-N 3.36Å; S268-Q270 PolarHBondContact OG-O 3.45Å; S268-R276 WeakPolarHBondContact OG-CD 3.26Å; S268-R276 PolarHBondContact OG-NE 2.92Å; S268-R276 PolarHBondContact OG-NH1 2.91Å
269K98Very high98.1Very high218 Ų21875.5 Ų75.595%0.94839%0.386SS*.SBendtrans-81-7.5168.4-61.3-174.8179.5-177.50112.8
270Q98.1Very high98.1Very high91 Ų9176.7 Ų76.743%0.42539%0.391SS..SBendtrans-116.7127179.9-65.6170.6-3900109.7S268 R276S268-Q270 VanDerWaalsContact C-N 3.25Å; S268-Q270 PolarHBondContact OG-N 3.36Å; S268-Q270 PolarHBondContact OG-O 3.45Å; Q270-R276 PolarHBondContact O-NH1 3.42Å; Q270-R276 VanDerWaalsContact O-NH1 3.1Å; Q270-R276 VanDerWaalsContact OE1-CG 3.24Å
271Q97.8Very high98.1Very high44 Ų4478.1 Ų78.121%0.20640%0.398CS..SBendtrans-62.9-56.7-177.4175.4167.52.400112.3G63 L66 N164G63-Q271 WeakPolarHBondContact O-CG 3.14Å; G63-Q271 PolarHBondContact O-NE2 3.04Å; L66-Q271 HydrophobicContact CD1-CB 4.15Å; L66-Q271 HydrophobicContact CD1-CG 3.74Å; N164-Q271 PolarHBondContact ND2-NE2 3.22Å
272S98.3Very high98.1Very high3 Ų379.2 Ų79.22%0.02141%0.405CS..SBendtrans-81.1147.8-178.2173.90000112.7Y62 P166 M274 R276Y62-S272 WeakPolarHBondContact CD1-OG 3.38Å; P166-S272 VanDerWaalsContact O-CB 3.32Å; P166-S272 WeakPolarHBondContact O-CB 3.29Å; P166-S272 PolarHBondContact O-OG 3.43Å; S272-M274 PolarHBondContact O-N 2.84Å; S272-M274 WeakPolarHBondContact OG-CB 3.35Å; S272-M274 PolarHBondContact OG-N 2.98Å; S272-R276 WeakPolarHBondContact O-CD 3.42Å
273M98.6Very high98.2Very high31 Ų3179.1 Ų79.115%0.15340%0.403CS..G310 helixtrans-75.3-6170.1-64-173.1-170.700113.7Y61 F275 R276 Q280 Y283Y61-M273 HydrophobicContact CD2-CB 4.38Å; Y61-M273 HydrophobicContact CD2-SD 4.32Å; Y61-M273 HydrophobicContact CE1-CB 4.5Å; Y61-M273 HydrophobicContact CE2-CB 4.29Å; Y61-M273 VanDerWaalsContact O-CB 3.27Å; Y61-M273 WeakPolarHBondContact O-CB 3.36Å; Y61-M273 VanDerWaalsContact O-CG 3.27Å; Y61-M273 WeakPolarHBondContact O-CG 3.44Å; Y61-M273 PolarHBondContact O-N 3.07Å; M273-F275 PolarHBondContact O-N 2.53Å; M273-R276 PolarHBondContact O-N 3.34Å; M273-Q280 HydrophobicContact CB-CG 4.21Å; M273-Q280 VanDerWaalsContact O-CG 3.28Å; M273-Q280 WeakPolarHBondContact O-CG 3.49Å; M273-Q280 PolarHBondContact O-NE2 3.35Å; M273-Y283 HydrophobicContact SD-CD2 4.47Å; M273-Y283 HydrophobicContact SD-CG 4.38Å
274M98.1Very high98.2Very high79 Ų7985.2 Ų85.239%0.38942%0.422SS..G310 helixtrans-51.1-33.2-176.6-178.6167.5179.700114.1P166 L167 S272 Q280P166-M274 HydrophobicContact CB-SD 4.2Å; P166-M274 WeakPolarHBondContact O-CB 3.21Å; L167-M274 HydrophobicContact CD2-CE 3.81Å; L167-M274 HydrophobicContact CD2-SD 3.68Å; L167-M274 HydrophobicContact CG-SD 4.47Å; S272-M274 PolarHBondContact O-N 2.84Å; S272-M274 WeakPolarHBondContact OG-CB 3.35Å; S272-M274 PolarHBondContact OG-N 2.98Å; M274-Q280 VanDerWaalsContact C-NE2 3.31Å; M274-Q280 PolarHBondContact O-NE2 2.72Å
275F98.2Very high98.3Very high112 Ų11284.9 Ų84.949%0.49142%0.421SS..G310 helixtrans-110.620.2179.4-54.1-63.6000113.7L167 M273 P277L167-F275 HydrophobicContact CB-CE2 4.48Å; L167-F275 HydrophobicContact CD2-CE2 4.02Å; L167-F275 HydrophobicContact CD2-CZ 3.61Å; M273-F275 PolarHBondContact O-N 2.53Å; F275-P277 WeakPolarHBondContact O-CD 3.29Å
276R98.4Very high98.4Very high42 Ų4283.8 Ų83.816%0.15842%0.415CS..  trans-125.177.7-174.8-65.516749.6-171.3-5111.2S268 Q270 S272 M273 L278 S279 Q280S268-R276 WeakPolarHBondContact OG-CD 3.26Å; S268-R276 PolarHBondContact OG-NE 2.92Å; S268-R276 PolarHBondContact OG-NH1 2.91Å; Q270-R276 PolarHBondContact O-NH1 3.42Å; Q270-R276 VanDerWaalsContact O-NH1 3.1Å; Q270-R276 VanDerWaalsContact OE1-CG 3.24Å; S272-R276 WeakPolarHBondContact O-CD 3.42Å; M273-R276 PolarHBondContact O-N 3.34Å; R276-L278 VanDerWaalsContact C-N 3.31Å; R276-L278 PolarHBondContact O-N 2.98Å; R276-S279 PolarHBondContact NE-OG 2.74Å; R276-S279 VanDerWaalsContact NE-OG 3.15Å; R276-S279 PolarHBondContact NH2-OG 3.11Å; R276-S279 WeakPolarHBondContact O-CA 3.34Å; R276-S279 WeakPolarHBondContact O-CB 3.24Å; R276-S279 PolarHBondContact O-N 3.12Å; R276-Q280 PolarHBondContact O-N 3.06Å
277P98.4Very high98.4Very high94 Ų9483.1 Ų83.161%0.6142%0.417SS*.Hα-helixtrans-54.1-41.6-172.3-27.735000114.4F275 S279 Q280 S281F275-P277 WeakPolarHBondContact O-CD 3.29Å; P277-S279 VanDerWaalsContact C-N 3.33Å; P277-S279 PolarHBondContact O-N 2.88Å; P277-Q280 WeakPolarHBondContact O-CB 2.97Å; P277-Q280 PolarHBondContact O-N 3.24Å; P277-S281 PolarHBondContact O-N 3.4Å
278L98.5Very high98.4Very high140 Ų14076.8 Ų76.873%0.73339%0.393SS*.Hα-helixtrans-65.1-35176.6-63.6177.3000112.7R276 S281 L282R276-L278 VanDerWaalsContact C-N 3.31Å; R276-L278 PolarHBondContact O-N 2.98Å; L278-S281 PolarHBondContact O-OG 2.96Å; L278-L282 VanDerWaalsContact O-CG 3.32Å; L278-L282 WeakPolarHBondContact O-CG 3.06Å; L278-L282 PolarHBondContact O-N 2.89Å
279S98.4Very high98.5Very high26 Ų2678.7 Ų78.718%0.18240%0.401CS..Hα-helixtrans-73.9-33.4175.4-56.90000111.7R276 P277 L282 Y283R276-S279 PolarHBondContact NE-OG 2.74Å; R276-S279 VanDerWaalsContact NE-OG 3.15Å; R276-S279 PolarHBondContact NH2-OG 3.11Å; R276-S279 WeakPolarHBondContact O-CA 3.34Å; R276-S279 WeakPolarHBondContact O-CB 3.24Å; R276-S279 PolarHBondContact O-N 3.12Å; P277-S279 VanDerWaalsContact C-N 3.33Å; P277-S279 PolarHBondContact O-N 2.88Å; S279-L282 PolarHBondContact O-N 3.39Å; S279-Y283 WeakPolarHBondContact O-CB 3.36Å; S279-Y283 PolarHBondContact O-N 3.39Å
280Q98.7Very high98.5Very high50 Ų5071.7 Ų71.723%0.23437%0.373CS..Hα-helixtrans-63.4-45.7174.3-63.9178.319.400111.6Y61 M273 M274 R276 P277 L282 Y283 W284Y61-Q280 HydrophobicContact CE2-CB 4.49Å; Y61-Q280 HydrophobicContact CE2-CG 4.1Å; Y61-Q280 VanDerWaalsContact OH-CD 3.31Å; Y61-Q280 WeakPolarHBondContact OH-CG 3.35Å; M273-Q280 HydrophobicContact CB-CG 4.21Å; M273-Q280 VanDerWaalsContact O-CG 3.28Å; M273-Q280 WeakPolarHBondContact O-CG 3.49Å; M273-Q280 PolarHBondContact O-NE2 3.35Å; M274-Q280 VanDerWaalsContact C-NE2 3.31Å; M274-Q280 PolarHBondContact O-NE2 2.72Å; R276-Q280 PolarHBondContact O-N 3.06Å; P277-Q280 WeakPolarHBondContact O-CB 2.97Å; P277-Q280 PolarHBondContact O-N 3.24Å; Q280-L282 PolarHBondContact O-N 3.19Å; Q280-Y283 PolarHBondContact O-N 3.39Å; Q280-W284 PolarHBondContact O-N 2.82Å
281S98.6Very high98.5Very high69 Ų6973.3 Ų73.348%0.48338%0.384SS..Hα-helixtrans-62.8-42.517861.60000111.8P277 L278 W284 L285P277-S281 PolarHBondContact O-N 3.4Å; L278-S281 PolarHBondContact O-OG 2.96Å; S281-W284 PolarHBondContact O-N 3.34Å; S281-L285 WeakPolarHBondContact O-CB 3.32Å; S281-L285 PolarHBondContact O-N 2.76Å
282L98.6Very high98.6Very high112 Ų11276.1 Ų76.159%0.58640%0.399SS*.Hα-helixtrans-65.5-36.8175.3-69.3174.5000112.9L278 S279 Q280 L285 L286L278-L282 VanDerWaalsContact O-CG 3.32Å; L278-L282 WeakPolarHBondContact O-CG 3.06Å; L278-L282 PolarHBondContact O-N 2.89Å; S279-L282 PolarHBondContact O-N 3.39Å; Q280-L282 PolarHBondContact O-N 3.19Å; L282-L285 HydrophobicContact CD2-CD2 4.43Å; L282-L285 PolarHBondContact O-N 3.05Å; L282-L286 PolarHBondContact O-N 2.72Å
283Y98.8Very high98.6Very high38 Ų3877.4 Ų77.415%0.14941%0.406CS..Hα-helixtrans-62.5-46.2174170.4-89.6000111.6G57 L60 Y61 M273 S279 Q280 L285 L286 A287G57-Y283 WeakPolarHBondContact CA-OH 3.36Å; G57-Y283 PolarHBondContact O-OH 3.08Å; L60-Y283 HydrophobicContact CB-CE2 4.14Å; Y61-Y283 AromaticContact CD2-CD1 3.46Å; Y61-Y283 HydrophobicContact CD2-CD1 3.46Å; Y61-Y283 VanDerWaalsContact CD2-CD1 3.46Å; Y61-Y283 HydrophobicContact CD2-CD2 4.05Å; Y61-Y283 AromaticContact CD2-CE1 3.64Å; Y61-Y283 HydrophobicContact CD2-CE1 3.64Å; Y61-Y283 HydrophobicContact CD2-CE2 4.2Å; Y61-Y283 AromaticContact CD2-CG 3.68Å; Y61-Y283 HydrophobicContact CD2-CG 3.68Å; Y61-Y283 AromaticContact CE2-CD1 3.95Å; Y61-Y283 HydrophobicContact CE2-CD1 3.95Å; Y61-Y283 HydrophobicContact CE2-CE1 4.34Å; Y61-Y283 HydrophobicContact CE2-CG 4.35Å; Y61-Y283 HydrophobicContact CG-CE1 4.45Å; M273-Y283 HydrophobicContact SD-CD2 4.47Å; M273-Y283 HydrophobicContact SD-CG 4.38Å; S279-Y283 WeakPolarHBondContact O-CB 3.36Å; S279-Y283 PolarHBondContact O-N 3.39Å; Q280-Y283 PolarHBondContact O-N 3.39Å; Y283-L285 VanDerWaalsContact C-N 3.32Å; Y283-L286 WeakPolarHBondContact O-CB 3.32Å; Y283-L286 PolarHBondContact O-N 3.05Å; Y283-A287 PolarHBondContact O-N 3.5Å
284W98.7Very high98.6Very high155 Ų15577.9 Ų77.959%0.58741%0.41SS*.Hα-helixtrans-70.2-31.1178.4-70.6118.2000112.5Q280 S281 A287 A288Q280-W284 PolarHBondContact O-N 2.82Å; S281-W284 PolarHBondContact O-N 3.34Å; W284-A287 HydrophobicContact CE3-CB 4.14Å; W284-A287 PolarHBondContact O-N 3.25Å; W284-A288 WeakPolarHBondContact O-CB 3.41Å; W284-A288 PolarHBondContact O-N 3.48Å
285L98.8Very high98.5Very high115 Ų11586.7 Ų86.760%0.60244%0.439SS*.Hα-helixtrans-62-45169.4-178.263.4000111.2S281 L282 Y283 A287 A288 D289S281-L285 WeakPolarHBondContact O-CB 3.32Å; S281-L285 PolarHBondContact O-N 2.76Å; L282-L285 HydrophobicContact CD2-CD2 4.43Å; L282-L285 PolarHBondContact O-N 3.05Å; Y283-L285 VanDerWaalsContact C-N 3.32Å; L285-A287 VanDerWaalsContact C-N 3.35Å; L285-A287 PolarHBondContact O-N 2.93Å; L285-A288 PolarHBondContact O-N 3.27Å; L285-D289 WeakPolarHBondContact O-CB 3.26Å; L285-D289 PolarHBondContact O-N 2.84Å
286L98.7Very high98.5Very high84 Ų8485.4 Ų85.444%0.4444%0.437SS..Hα-helixtrans-60.8-42.7174.1174.465.5000111.8L282 Y283 A288 D289 L290L282-L286 PolarHBondContact O-N 2.72Å; Y283-L286 WeakPolarHBondContact O-CB 3.32Å; Y283-L286 PolarHBondContact O-N 3.05Å; L286-A288 VanDerWaalsContact C-N 3.34Å; L286-A288 PolarHBondContact O-N 2.77Å; L286-D289 PolarHBondContact O-N 3.49Å; L286-L290 HydrophobicContact CG-CD1 4.48Å; L286-L290 WeakPolarHBondContact O-CG 3.32Å; L286-L290 PolarHBondContact O-N 3.46Å
287A98.6Very high98.5Very high30 Ų3087.7 Ų87.725%0.24845%0.451CS..Hα-helixtrans-62.7-41.6176.700000111.8Y283 W284 L285 L290 L291Y283-A287 PolarHBondContact O-N 3.5Å; W284-A287 HydrophobicContact CE3-CB 4.14Å; W284-A287 PolarHBondContact O-N 3.25Å; L285-A287 VanDerWaalsContact C-N 3.35Å; L285-A287 PolarHBondContact O-N 2.93Å; A287-L290 PolarHBondContact O-N 2.7Å; A287-L291 WeakPolarHBondContact O-CG 3.43Å; A287-L291 PolarHBondContact O-N 3.27Å
288A98.8Very high98.5Very high43 Ų4387.3 Ų87.336%0.35544%0.443SS..Hα-helixtrans-65.8-39.9174.900000112.1W284 L285 L286 L291 I292W284-A288 WeakPolarHBondContact O-CB 3.41Å; W284-A288 PolarHBondContact O-N 3.48Å; L285-A288 PolarHBondContact O-N 3.27Å; L286-A288 VanDerWaalsContact C-N 3.34Å; L286-A288 PolarHBondContact O-N 2.77Å; A288-L291 WeakPolarHBondContact O-CB 3.4Å; A288-L291 PolarHBondContact O-N 2.91Å; A288-I292 WeakPolarHBondContact O-CG1 3.35Å; A288-I292 PolarHBondContact O-N 3.42Å
289D98.8Very high98.5Very high77 Ų7784.2 Ų84.241%0.41243%0.426SS..Hα-helixtrans-61.8-43.3175.9-173.362.7000111.8L285 L286 L291 I292 L293L285-D289 WeakPolarHBondContact O-CB 3.26Å; L285-D289 PolarHBondContact O-N 2.84Å; L286-D289 PolarHBondContact O-N 3.49Å; D289-L291 VanDerWaalsContact C-N 3.29Å; D289-L291 PolarHBondContact O-N 3.05Å; D289-I292 CarbonylContact O-C 3.55Å; D289-I292 PolarHBondContact O-N 3.27Å; D289-I292 VanDerWaalsContact O-N 3.11Å; D289-L293 WeakPolarHBondContact O-CG 3.44Å; D289-L293 PolarHBondContact O-N 3.48Å
290L98.7Very high98.5Very high70 Ų7087.9 Ų87.937%0.36644%0.441SS..Hα-helixtrans-62.1-35173.9-72171.3000112.9F234 L286 A287 L293 T294F234-L290 HydrophobicContact CB-CD2 4.48Å; F234-L290 HydrophobicContact CD2-CD2 3.88Å; F234-L290 HydrophobicContact CG-CD2 4.36Å; L286-L290 HydrophobicContact CG-CD1 4.48Å; L286-L290 WeakPolarHBondContact O-CG 3.32Å; L286-L290 PolarHBondContact O-N 3.46Å; A287-L290 PolarHBondContact O-N 2.7Å; L290-L293 HydrophobicContact CD2-CD1 4.42Å; L290-T294 WeakPolarHBondContact O-CB 3.39Å; L290-T294 PolarHBondContact O-N 3.41Å; L290-T294 VanDerWaalsContact O-N 3.09Å; L290-T294 PolarHBondContact O-OG1 3.39Å
291L98.4Very high98.5Very high125 Ų12590.4 Ų90.465%0.65446%0.455SS*.Hα-helixtrans-67.8-39.7173-69.1172.5000111.6A287 A288 D289 T294 W295A287-L291 WeakPolarHBondContact O-CG 3.43Å; A287-L291 PolarHBondContact O-N 3.27Å; A288-L291 WeakPolarHBondContact O-CB 3.4Å; A288-L291 PolarHBondContact O-N 2.91Å; D289-L291 VanDerWaalsContact C-N 3.29Å; D289-L291 PolarHBondContact O-N 3.05Å; L291-T294 WeakPolarHBondContact O-CB 3.31Å; L291-T294 PolarHBondContact O-N 3.01Å; L291-W295 PolarHBondContact O-N 3.05Å; L291-W295 VanDerWaalsContact O-N 3.1Å
292I98.6Very high98.5Very high104 Ų10491.9 Ų91.953%0.53345%0.453SS..Hα-helixtrans-65.7-41.4175-68166.8000110.9A288 D289 T294 W295A288-I292 WeakPolarHBondContact O-CG1 3.35Å; A288-I292 PolarHBondContact O-N 3.42Å; D289-I292 CarbonylContact O-C 3.55Å; D289-I292 PolarHBondContact O-N 3.27Å; D289-I292 VanDerWaalsContact O-N 3.11Å; I292-T294 PolarHBondContact O-N 3.32Å; I292-W295 PolarHBondContact O-N 2.85Å
293L98.5Very high98.5Very high29 Ų2990.4 Ų90.415%0.15244%0.442CS..Hα-helixtrans-65.2-26.9175.7-71.7170.5000112.5F234 T237 I238 D289 L290F234-L293 WeakPolarHBondContact CA-O 3.45Å; F234-L293 HydrophobicContact CB-CB 3.94Å; T237-L293 WeakPolarHBondContact CB-O 3.19Å; T237-L293 HydrophobicContact CG2-CD2 3.78Å; T237-L293 PolarHBondContact OG1-O 3.1Å; I238-L293 HydrophobicContact CD1-CD1 4.07Å; I238-L293 HydrophobicContact CG1-CD1 4.09Å; I238-L293 HydrophobicContact CG1-CD2 4.25Å; D289-L293 WeakPolarHBondContact O-CG 3.44Å; D289-L293 PolarHBondContact O-N 3.48Å; L290-L293 HydrophobicContact CD2-CD1 4.42Å
294T98.5Very high98.5Very high41 Ų4194.8 Ų94.825%0.25247%0.467SS..Hα-helixtrans-78.7-30.3176.7-58.20000112.3L233 L290 L291 I292L233-T294 HydrophobicContact CB-CG2 4.12Å; L233-T294 HydrophobicContact CD1-CG2 4.34Å; L233-T294 WeakPolarHBondContact CD1-O 3.49Å; L290-T294 WeakPolarHBondContact O-CB 3.39Å; L290-T294 PolarHBondContact O-N 3.41Å; L290-T294 VanDerWaalsContact O-N 3.09Å; L290-T294 PolarHBondContact O-OG1 3.39Å; L291-T294 WeakPolarHBondContact O-CB 3.31Å; L291-T294 PolarHBondContact O-N 3.01Å; I292-T294 PolarHBondContact O-N 3.32Å
295W97.1Very high98.5Very high264 Ų26489.3 Ų89.3100%146%0.456SS*.  trans-740-178.8171.162000112.3L291 I292L291-W295 PolarHBondContact O-N 3.05Å; L291-W295 VanDerWaalsContact O-N 3.1Å; I292-W295 PolarHBondContact O-N 2.85Å

Retrieved 295 of 295 residues in 635.1 ms (Link to these results)