A0A060YN95_ONCMY Loading...

Rhodopsin

AlphaFold DB , UniProt , Accession A0A060YN95, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene RHO, Length 353 aa.

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

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M77Confident93Very high188 Ų18857.5 Ų57.593%0.92631%0.313SS*.  01430-62175-175.100108.9G3 S14M1-G3 VanDerWaalsContact CB-O 3.25Å; M1-G3 WeakPolarHBondContact CB-O 3.46Å; M1-S14 WeakPolarHBondContact O-CB 3.38Å; M1-S14 PolarHBondContact O-OG 3.47Å
2N90.8Very high93.2Very high78 Ų7853.2 Ų53.242%0.41729%0.289SS..  trans-76.6-35.1-179.5-67.5-42000112.2M13 S14 G280 N282N2-M13 CarbonylContact O-C 3.37Å; N2-M13 VanDerWaalsContact O-C 3.25Å; N2-S14 WeakPolarHBondContact O-CA 3.4Å; N2-S14 PolarHBondContact O-N 3.27Å; N2-G280 WeakPolarHBondContact CB-O 3.22Å; N2-G280 PolarHBondContact ND2-O 3.2Å; N2-N282 HydrophobicContact CB-CB 4.04Å
3G93.2Very high93.3Very high4 Ų453.6 Ų53.64%0.04129%0.289CS..SBendtrans-106.4-179.1164.100000112.7M1 Y10 V11 M13M1-G3 VanDerWaalsContact CB-O 3.25Å; M1-G3 WeakPolarHBondContact CB-O 3.46Å; G3-Y10 WeakPolarHBondContact CA-OH 3.36Å; G3-Y10 PolarHBondContact N-OH 3.46Å; G3-V11 CarbonylContact C-O 3.52Å; G3-V11 VanDerWaalsContact CA-O 3.31Å; G3-V11 WeakPolarHBondContact CA-O 3.44Å; G3-M13 CarbonylContact C-O 3.08Å
4T95.5Very high93.4Very high25 Ų2552.1 Ų52.115%0.15329%0.285CS..EExtended strand (participates in β ladder)trans-124.2110.2178.7-54.90000108.8V11 M13 N15 V20T4-V11 PolarHBondContact N-O 3.41Å; T4-V11 PolarHBondContact O-N 3.09Å; T4-M13 PolarHBondContact N-O 3.36Å; T4-M13 PolarHBondContact OG1-O 3.26Å; T4-N15 HydrophobicContact CG2-CB 3.98Å; T4-N15 WeakPolarHBondContact OG1-CB 3.47Å; T4-N15 PolarHBondContact OG1-N 2.89Å; T4-N15 VanDerWaalsContact OG1-N 3.16Å; T4-V20 HydrophobicContact CG2-CB 4.46Å; T4-V20 HydrophobicContact CG2-CG1 3.89Å
5E95.4Very high93.6Very high101 Ų10153.2 Ų53.247%0.47229%0.29SS..EExtended strand (participates in β ladder)trans-89.8136.6178-173.3172.6178.400110.3Y10 T193E5-Y10 HydrophobicContact CB-CD2 4.09Å; E5-T193 HydrophobicContact CG-CG2 3.97Å; E5-T193 WeakPolarHBondContact OE1-CG2 3.24Å
6G93.9Very high93.7Very high15 Ų1561.8 Ų61.816%0.15532%0.324CS..EExtended strand (participates in β ladder)trans-126.3178.2169.900000110.8N8 F9G6-N8 PolarHBondContact O-N 3.28Å; G6-N8 VanDerWaalsContact O-N 3.11Å; G6-F9 PolarHBondContact N-O 2.92Å
7P91.8Very high93.7Very high110 Ų11064.1 Ų64.171%0.71434%0.341SS*.THydrogen-bonded Turntrans-57.5-33-173.8-26.634.6000114.4R177P7-R177 PolarHBondContact O-NH1 3.44Å
8N94.2Very high93.8Very high78 Ų7862.4 Ų62.442%0.41734%0.342SS..THydrogen-bonded Turntrans-129.514-174.7-64.6-45.3000113.4G6 F24 V107 I179G6-N8 PolarHBondContact O-N 3.28Å; G6-N8 VanDerWaalsContact O-N 3.11Å; N8-F24 HydrophobicContact CB-CE2 3.95Å; N8-F24 WeakPolarHBondContact O-CE2 3.29Å; N8-V107 HydrophobicContact CB-CG2 4.1Å; N8-I179 WeakPolarHBondContact O-CG2 3.34Å
9F96.8Very high94Very high23 Ų2362.3 Ų62.310%0.10134%0.344CS..EExtended strand (participates in β ladder)trans-157.1162.5-174.863.7-96.8000112.4G6 V11 P23 F24G6-F9 PolarHBondContact N-O 2.92Å; F9-V11 HydrophobicContact CD2-CG2 3.84Å; F9-V11 HydrophobicContact CE2-CG2 4Å; F9-P23 HydrophobicContact CB-CG 3.69Å; F9-P23 HydrophobicContact CD1-CG 4.26Å; F9-P23 HydrophobicContact CD2-CG 4.13Å; F9-P23 VanDerWaalsContact CG-CD 3.47Å; F9-P23 HydrophobicContact CG-CG 3.78Å; F9-F24 HydrophobicContact CB-CE2 4.05Å; F9-F24 HydrophobicContact CD1-CD2 4.13Å; F9-F24 HydrophobicContact CD1-CE2 4.16Å
10Y96.9Very high94.2Very high11 Ų1159.6 Ų59.64%0.04333%0.329CS..EExtended strand (participates in β ladder)trans-133.1115.8167.6-178.8-85.1000109.6G3 E5 P12 Y192 T193 F283G3-Y10 WeakPolarHBondContact CA-OH 3.36Å; G3-Y10 PolarHBondContact N-OH 3.46Å; E5-Y10 HydrophobicContact CB-CD2 4.09Å; Y10-P12 HydrophobicContact CE1-CB 4.43Å; Y10-Y192 AromaticContact CD1-CD1 3.56Å; Y10-Y192 HydrophobicContact CD1-CD1 3.56Å; Y10-Y192 HydrophobicContact CD1-CE1 4.27Å; Y10-Y192 AromaticContact CD1-CG 3.93Å; Y10-Y192 HydrophobicContact CD1-CG 3.93Å; Y10-Y192 AromaticContact CE1-CD1 3.97Å; Y10-Y192 HydrophobicContact CE1-CD1 3.97Å; Y10-Y192 HydrophobicContact CG-CD1 4.29Å; Y10-Y192 HydrophobicContact CG-CG 4.22Å; Y10-T193 HydrophobicContact CD2-CG2 4.02Å; Y10-T193 HydrophobicContact CG-CG2 4.42Å; Y10-F283 HydrophobicContact CD1-CE2 4.23Å; Y10-F283 HydrophobicContact CD1-CZ 4.31Å; Y10-F283 AromaticContact CE1-CE2 3.46Å; Y10-F283 HydrophobicContact CE1-CE2 3.46Å; Y10-F283 VanDerWaalsContact CE1-CE2 3.46Å; Y10-F283 AromaticContact CE1-CZ 3.37Å; Y10-F283 HydrophobicContact CE1-CZ 3.37Å; Y10-F283 AromaticContact CZ-CZ 3.75Å
11V97.3Very high94.3Very high0 Ų062.3 Ų62.30%033%0.334CS..EExtended strand (participates in β ladder)trans-90.9123.8174.7178.70000109.1G3 T4 F9 M13 V20 Y30 L31G3-V11 CarbonylContact C-O 3.52Å; G3-V11 VanDerWaalsContact CA-O 3.31Å; G3-V11 WeakPolarHBondContact CA-O 3.44Å; T4-V11 PolarHBondContact N-O 3.41Å; T4-V11 PolarHBondContact O-N 3.09Å; F9-V11 HydrophobicContact CD2-CG2 3.84Å; F9-V11 HydrophobicContact CE2-CG2 4Å; V11-M13 HydrophobicContact CG1-CB 4.14Å; V11-M13 PolarHBondContact O-N 3.06Å; V11-V20 HydrophobicContact CB-CG1 3.91Å; V11-V20 HydrophobicContact CG1-CG1 3.87Å; V11-V20 HydrophobicContact CG2-CG1 4.07Å; V11-Y30 HydrophobicContact CG1-CE2 4.22Å; V11-L31 HydrophobicContact CG1-CD1 4.15Å; V11-L31 HydrophobicContact CG1-CD2 3.8Å; V11-L31 HydrophobicContact CG1-CG 4.43Å
12P95.3Very high95.3Very high5 Ų554.2 Ų54.23%0.03230%0.296CS..SBendtrans-77.252.8-179.734.4-37.8000112.2Y10 F283 P285Y10-P12 HydrophobicContact CE1-CB 4.43Å; P12-F283 HydrophobicContact CB-CD2 3.72Å; P12-F283 HydrophobicContact CB-CE2 3.77Å; P12-F283 WeakPolarHBondContact CB-O 3.33Å; P12-P285 HydrophobicContact CG-CB 3.94Å
13M94.9Very high95.7Very high59 Ų5950.5 Ų50.529%0.29128%0.276SS..SBendtrans-154.2142.1176.7-176.2175.2-176.300110.2N2 G3 T4 V11 V19 V20 Y30 L31N2-M13 CarbonylContact O-C 3.37Å; N2-M13 VanDerWaalsContact O-C 3.25Å; G3-M13 CarbonylContact C-O 3.08Å; T4-M13 PolarHBondContact N-O 3.36Å; T4-M13 PolarHBondContact OG1-O 3.26Å; V11-M13 HydrophobicContact CG1-CB 4.14Å; V11-M13 PolarHBondContact O-N 3.06Å; M13-V19 HydrophobicContact CE-CG2 4.22Å; M13-V20 HydrophobicContact CB-CG2 4.38Å; M13-V20 HydrophobicContact CG-CG2 4.24Å; M13-V20 HydrophobicContact SD-CG2 4.44Å; M13-Y30 HydrophobicContact SD-CD2 3.56Å; M13-Y30 VanDerWaalsContact SD-CD2 3.56Å; M13-Y30 HydrophobicContact SD-CE2 4.13Å; M13-L31 HydrophobicContact CB-CD2 3.6Å; M13-L31 HydrophobicContact CG-CD2 4.36Å; M13-L31 HydrophobicContact SD-CD2 3.9Å
14S94.8Very high95.9Very high33 Ų3351.5 Ų51.523%0.23128%0.279CS..  trans-75.4131.3178-173.20000111.5M1 N2 K16M1-S14 WeakPolarHBondContact O-CB 3.38Å; M1-S14 PolarHBondContact O-OG 3.47Å; N2-S14 WeakPolarHBondContact O-CA 3.4Å; N2-S14 PolarHBondContact O-N 3.27Å; S14-K16 PolarHBondContact O-N 3.26Å
15N95.9Very high96Very high68 Ų6856.5 Ų56.536%0.36430%0.301SS..G310 helixtrans-81.623.7176.2-161.123.1000114.6T4 T17 G18 V19 V20T4-N15 HydrophobicContact CG2-CB 3.98Å; T4-N15 WeakPolarHBondContact OG1-CB 3.47Å; T4-N15 PolarHBondContact OG1-N 2.89Å; T4-N15 VanDerWaalsContact OG1-N 3.16Å; N15-T17 PolarHBondContact O-N 3.34Å; N15-G18 PolarHBondContact O-N 3.3Å; N15-G18 VanDerWaalsContact OD1-C 3.28Å; N15-G18 WeakPolarHBondContact OD1-CA 3.49Å; N15-V19 PolarHBondContact OD1-N 3.18Å; N15-V20 HydrophobicContact CB-CB 3.92Å; N15-V20 HydrophobicContact CB-CG2 3.97Å; N15-V20 WeakPolarHBondContact OD1-CB 3.44Å; N15-V20 PolarHBondContact OD1-N 3.45Å
16K95Very high96.1Very high190 Ų19055.9 Ų55.983%0.82630%0.298SS*.G310 helixtrans-58.1-32.2178.6-83.2177.7-179.2-176.80113.4S14 G18S14-K16 PolarHBondContact O-N 3.26Å; K16-G18 VanDerWaalsContact C-N 3.34Å
17T95Very high96.3Very high101 Ų10157.6 Ų57.662%0.6231%0.306SS*.G310 helixtrans-86.1-5.8179.1550000113.2N15 V19N15-T17 PolarHBondContact O-N 3.34Å; T17-V19 PolarHBondContact O-N 3.23Å; T17-V19 WeakPolarHBondContact OG1-CG2 3.33Å
18G95.6Very high96.6Very high35 Ų3552.3 Ų52.336%0.36127%0.272SS..SBendtrans7113.8-176.500000114.6N15 K16 R21N15-G18 PolarHBondContact O-N 3.3Å; N15-G18 VanDerWaalsContact OD1-C 3.28Å; N15-G18 WeakPolarHBondContact OD1-CA 3.49Å; K16-G18 VanDerWaalsContact C-N 3.34Å; G18-R21 PolarHBondContact O-NH1 3.18Å; G18-R21 PolarHBondContact O-NH2 3.42Å
19V96.6Very high96.8Very high60 Ų6053 Ų5336%0.36427%0.27SS..  trans-89.9-18.4-177.9-560000114M13 N15 T17 Y30M13-V19 HydrophobicContact CE-CG2 4.22Å; N15-V19 PolarHBondContact OD1-N 3.18Å; T17-V19 PolarHBondContact O-N 3.23Å; T17-V19 WeakPolarHBondContact OG1-CG2 3.33Å; V19-Y30 HydrophobicContact CG2-CG 4.38Å
20V97.4Very high96.8Very high8 Ų854.8 Ų54.85%0.04828%0.276CS..  trans-70.8135.6-175.2179.40000109.6T4 V11 M13 N15 Y30T4-V20 HydrophobicContact CG2-CB 4.46Å; T4-V20 HydrophobicContact CG2-CG1 3.89Å; V11-V20 HydrophobicContact CB-CG1 3.91Å; V11-V20 HydrophobicContact CG1-CG1 3.87Å; V11-V20 HydrophobicContact CG2-CG1 4.07Å; M13-V20 HydrophobicContact CB-CG2 4.38Å; M13-V20 HydrophobicContact CG-CG2 4.24Å; M13-V20 HydrophobicContact SD-CG2 4.44Å; N15-V20 HydrophobicContact CB-CB 3.92Å; N15-V20 HydrophobicContact CB-CG2 3.97Å; N15-V20 WeakPolarHBondContact OD1-CB 3.44Å; N15-V20 PolarHBondContact OD1-N 3.45Å; V20-Y30 HydrophobicContact CB-CE2 4.42Å; V20-Y30 HydrophobicContact CG1-CE2 4.36Å; V20-Y30 HydrophobicContact CG2-CE2 4.16Å
21R97.6Very high96.8Very high117 Ų11755.2 Ų55.244%0.44228%0.279SS..  trans-134.5157.4-177.9-65.1-67.1177.3-81.8-2.5110.2G18 H26 Q28 Y30G18-R21 PolarHBondContact O-NH1 3.18Å; G18-R21 PolarHBondContact O-NH2 3.42Å; R21-H26 HydrophobicContact CB-CB 3.72Å; R21-H26 HydrophobicContact CG-CB 4.25Å; R21-Q28 PolarHBondContact O-NE2 3.3Å; R21-Y30 HydrophobicContact CB-CE1 4.4Å; R21-Y30 PolarHBondContact N-OH 3.02Å; R21-Y30 PolarHBondContact O-OH 3.02Å
22S97.9Very high96.7Very high17 Ų1755.5 Ų55.512%0.11928%0.281CS..  trans-53.8129.1175.9174.50000110.9F24 E25 H26 Q28S22-F24 PolarHBondContact O-N 3.43Å; S22-F24 VanDerWaalsContact O-N 3.14Å; S22-F24 PolarHBondContact OG-N 3.05Å; S22-E25 PolarHBondContact O-N 3.34Å; S22-H26 PolarHBondContact O-N 3Å; S22-H26 VanDerWaalsContact O-N 3.1Å; S22-Q28 PolarHBondContact O-NE2 3.46Å
23P98.1Very high96.8Very high0 Ų058 Ų580%030%0.297CS..THydrogen-bonded Turntrans-67.6-7.6174.430.6-35.7000112.6F9 Q28 Y102 F103 P180 Q184F9-P23 HydrophobicContact CB-CG 3.69Å; F9-P23 HydrophobicContact CD1-CG 4.26Å; F9-P23 HydrophobicContact CD2-CG 4.13Å; F9-P23 VanDerWaalsContact CG-CD 3.47Å; F9-P23 HydrophobicContact CG-CG 3.78Å; P23-Q28 HydrophobicContact CB-CG 4.25Å; P23-Y102 WeakPolarHBondContact O-CB 2.98Å; P23-F103 WeakPolarHBondContact O-CA 3.36Å; P23-F103 WeakPolarHBondContact O-CB 3.39Å; P23-F103 PolarHBondContact O-N 2.88Å; P23-P180 HydrophobicContact CB-CB 4.4Å; P23-P180 HydrophobicContact CB-CG 4.32Å; P23-P180 HydrophobicContact CG-CB 4.34Å; P23-P180 HydrophobicContact CG-CG 3.99Å; P23-Q184 HydrophobicContact CB-CB 3.83Å; P23-Q184 HydrophobicContact CB-CG 4.21Å
24F98.3Very high96.9Very high26 Ų2658.5 Ų58.511%0.11431%0.305CS..THydrogen-bonded Turntrans-92.5-15.1175.6-60.1-60.8000113.9N8 F9 S22 F103 G106 V107 C110 P180N8-F24 HydrophobicContact CB-CE2 3.95Å; N8-F24 WeakPolarHBondContact O-CE2 3.29Å; F9-F24 HydrophobicContact CB-CE2 4.05Å; F9-F24 HydrophobicContact CD1-CD2 4.13Å; F9-F24 HydrophobicContact CD1-CE2 4.16Å; S22-F24 PolarHBondContact O-N 3.43Å; S22-F24 VanDerWaalsContact O-N 3.14Å; S22-F24 PolarHBondContact OG-N 3.05Å; F24-F103 WeakPolarHBondContact CA-O 3.25Å; F24-F103 HydrophobicContact CD1-CB 3.72Å; F24-F103 HydrophobicContact CE1-CB 4Å; F24-G106 VanDerWaalsContact CD1-C 3.41Å; F24-V107 HydrophobicContact CD2-CG2 4.27Å; F24-V107 HydrophobicContact CE1-CG2 4.35Å; F24-V107 HydrophobicContact CE2-CG2 3.97Å; F24-V107 HydrophobicContact CZ-CG2 4Å; F24-C110 HydrophobicContact CE1-CB 3.9Å; F24-C110 HydrophobicContact CZ-CB 4.39Å; F24-P180 HydrophobicContact CE1-CG 3.72Å; F24-P180 HydrophobicContact CE2-CG 4.35Å; F24-P180 HydrophobicContact CZ-CG 3.58Å
25E97.4Very high97Very high130 Ų13064.6 Ų64.661%0.60732%0.323SS*.THydrogen-bonded Turntrans-118.8-29.6-171.9-64173.7-172.500112.6S22S22-E25 PolarHBondContact O-N 3.34Å
26H97.8Very high97.1Very high87 Ų8764.5 Ų64.540%0.40332%0.32SS..SBendtrans-138.7146.7-170.8-64-67000113.7R21 S22 Q28 Y102R21-H26 HydrophobicContact CB-CB 3.72Å; R21-H26 HydrophobicContact CG-CB 4.25Å; S22-H26 PolarHBondContact O-N 3Å; S22-H26 VanDerWaalsContact O-N 3.1Å; H26-Q28 PolarHBondContact O-NE2 2.8Å; H26-Y102 VanDerWaalsContact C-CG 3.45Å; H26-Y102 WeakPolarHBondContact O-CB 3.42Å
27P98Very high97.2Very high51 Ų5155.5 Ų55.533%0.33128%0.28SS..  trans-53.5141.6172.1-26.334.5000113.7Y29 Y102P27-Y29 HydrophobicContact CB-CD2 3.57Å; P27-Y29 HydrophobicContact CB-CE2 3.49Å; P27-Y29 VanDerWaalsContact CB-CE2 3.49Å; P27-Y29 HydrophobicContact CB-CG 4.32Å; P27-Y29 HydrophobicContact CG-CE2 4.22Å; P27-Y102 HydrophobicContact CB-CD1 4.17Å; P27-Y102 HydrophobicContact CG-CD1 3.78Å; P27-Y102 HydrophobicContact CG-CE1 3.89Å
28Q98.2Very high97.4Very high0 Ų054.4 Ų54.40%028%0.277CS..  trans-99.824.8-173.5-58.8-68.6-60.800112.8R21 S22 P23 H26 Y30 L31 Y37 G101 Q184R21-Q28 PolarHBondContact O-NE2 3.3Å; S22-Q28 PolarHBondContact O-NE2 3.46Å; P23-Q28 HydrophobicContact CB-CG 4.25Å; H26-Q28 PolarHBondContact O-NE2 2.8Å; Q28-Y30 VanDerWaalsContact CD-OH 3.23Å; Q28-Y30 PolarHBondContact NE2-OH 2.98Å; Q28-Y30 PolarHBondContact O-N 3.05Å; Q28-Y30 VanDerWaalsContact OE1-CZ 3.25Å; Q28-Y30 PolarHBondContact OE1-OH 2.92Å; Q28-L31 HydrophobicContact CB-CD1 3.99Å; Q28-L31 HydrophobicContact CB-CG 4.39Å; Q28-L31 VanDerWaalsContact O-CB 3.3Å; Q28-L31 WeakPolarHBondContact O-CB 3.29Å; Q28-L31 PolarHBondContact O-N 3.4Å; Q28-Y37 WeakPolarHBondContact CB-OH 3.13Å; Q28-Y37 PolarHBondContact O-OH 2.99Å; Q28-G101 WeakPolarHBondContact CB-O 3.43Å; Q28-G101 PolarHBondContact N-O 3.38Å; Q28-Q184 HydrophobicContact CG-CB 3.97Å; Q28-Q184 HydrophobicContact CG-CG 4.2Å
29Y97.4Very high97.5Very high93 Ų9357.7 Ų57.737%0.36529%0.285SS..THydrogen-bonded Turntrans-62-9.7-175.9-59.7-47.1000115.4P27 L31 A32 P34 Y37 Q100P27-Y29 HydrophobicContact CB-CD2 3.57Å; P27-Y29 HydrophobicContact CB-CE2 3.49Å; P27-Y29 VanDerWaalsContact CB-CE2 3.49Å; P27-Y29 HydrophobicContact CB-CG 4.32Å; P27-Y29 HydrophobicContact CG-CE2 4.22Å; Y29-L31 VanDerWaalsContact C-N 3.32Å; Y29-A32 CarbonylContact C-O 3.45Å; Y29-A32 CarbonylContact O-C 3.58Å; Y29-P34 HydrophobicContact CD1-CB 4.06Å; Y29-P34 HydrophobicContact CD1-CG 3.9Å; Y29-P34 HydrophobicContact CE1-CB 4.11Å; Y29-P34 HydrophobicContact CE1-CG 4.38Å; Y29-P34 HydrophobicContact CG-CG 4.02Å; Y29-Y37 AromaticContact CD1-CD2 3.62Å; Y29-Y37 HydrophobicContact CD1-CD2 3.62Å; Y29-Y37 AromaticContact CD1-CE2 3.74Å; Y29-Y37 HydrophobicContact CD1-CE2 3.74Å; Y29-Y37 HydrophobicContact CD1-CG 4.3Å; Y29-Y37 AromaticContact CE1-CD2 3.79Å; Y29-Y37 HydrophobicContact CE1-CD2 3.79Å; Y29-Y37 HydrophobicContact CE1-CE2 4.28Å; Y29-Y37 HydrophobicContact CE1-CG 4.01Å; Y29-Q100 PolarHBondContact OH-O 3.27Å; Y29-Q100 VanDerWaalsContact OH-O 3.09Å
30Y96.3Very high97.6Very high59 Ų5955.9 Ų55.923%0.23127%0.273CS..THydrogen-bonded Turntrans-75.9-19.1169.557.4-102.3000113.1V11 M13 V19 V20 R21 Q28V11-Y30 HydrophobicContact CG1-CE2 4.22Å; M13-Y30 HydrophobicContact SD-CD2 3.56Å; M13-Y30 VanDerWaalsContact SD-CD2 3.56Å; M13-Y30 HydrophobicContact SD-CE2 4.13Å; V19-Y30 HydrophobicContact CG2-CG 4.38Å; V20-Y30 HydrophobicContact CB-CE2 4.42Å; V20-Y30 HydrophobicContact CG1-CE2 4.36Å; V20-Y30 HydrophobicContact CG2-CE2 4.16Å; R21-Y30 HydrophobicContact CB-CE1 4.4Å; R21-Y30 PolarHBondContact N-OH 3.02Å; R21-Y30 PolarHBondContact O-OH 3.02Å; Q28-Y30 VanDerWaalsContact CD-OH 3.23Å; Q28-Y30 PolarHBondContact NE2-OH 2.98Å; Q28-Y30 PolarHBondContact O-N 3.05Å; Q28-Y30 VanDerWaalsContact OE1-CZ 3.25Å; Q28-Y30 PolarHBondContact OE1-OH 2.92Å
31L96.8Very high97.6Very high21 Ų2155.6 Ų55.611%0.1127%0.272CS..THydrogen-bonded Turntrans-78.6-31.3175.4-67.1-178.3000112.4V11 M13 Q28 Y29 Q184 P285V11-L31 HydrophobicContact CG1-CD1 4.15Å; V11-L31 HydrophobicContact CG1-CD2 3.8Å; V11-L31 HydrophobicContact CG1-CG 4.43Å; M13-L31 HydrophobicContact CB-CD2 3.6Å; M13-L31 HydrophobicContact CG-CD2 4.36Å; M13-L31 HydrophobicContact SD-CD2 3.9Å; Q28-L31 HydrophobicContact CB-CD1 3.99Å; Q28-L31 HydrophobicContact CB-CG 4.39Å; Q28-L31 VanDerWaalsContact O-CB 3.3Å; Q28-L31 WeakPolarHBondContact O-CB 3.29Å; Q28-L31 PolarHBondContact O-N 3.4Å; Y29-L31 VanDerWaalsContact C-N 3.32Å; L31-Q184 HydrophobicContact CD1-CG 3.56Å; L31-P285 HydrophobicContact CB-CB 4.23Å; L31-P285 HydrophobicContact CB-CG 3.98Å; L31-P285 HydrophobicContact CD1-CB 4.36Å; L31-P285 HydrophobicContact CD2-CG 4.32Å; L31-P285 WeakPolarHBondContact O-CG 3.41Å
32A96.8Very high97.6Very high5 Ų552.6 Ų52.64%0.04127%0.272CS..SBendtrans-162147.9-174.100000110.7Y29 K36 Y37 M183Y29-A32 CarbonylContact C-O 3.45Å; Y29-A32 CarbonylContact O-C 3.58Å; A32-K36 HydrophobicContact CB-CB 4.39Å; A32-K36 HydrophobicContact CB-CD 3.98Å; A32-Y37 HydrophobicContact CB-CE2 3.88Å; A32-Y37 WeakPolarHBondContact O-CE2 3.5Å; A32-M183 HydrophobicContact CB-CE 3.56Å; A32-M183 HydrophobicContact CB-CG 4.24Å; A32-M183 HydrophobicContact CB-SD 3.91Å
33P96.9Very high97.7Very high58 Ų5854.8 Ų54.838%0.37728%0.278SS..  trans-55.3143.5174.6-27.135.1000112.7W35 K36P33-W35 VanDerWaalsContact CB-CD1 3.42Å; P33-W35 HydrophobicContact CB-CG 4.34Å; P33-W35 VanDerWaalsContact CB-NE1 3.33Å; P33-W35 PolarHBondContact O-N 2.98Å; P33-W35 VanDerWaalsContact O-N 3.09Å; P33-K36 WeakPolarHBondContact O-CB 3.5Å; P33-K36 PolarHBondContact O-N 3.32Å
34P97.2Very high97.7Very high70 Ų7054.8 Ų54.846%0.45528%0.278SS..Hα-helixtrans-52-35-178.1-30.335.3000115.2Y29 K36 Y37 S38Y29-P34 HydrophobicContact CD1-CB 4.06Å; Y29-P34 HydrophobicContact CD1-CG 3.9Å; Y29-P34 HydrophobicContact CE1-CB 4.11Å; Y29-P34 HydrophobicContact CE1-CG 4.38Å; Y29-P34 HydrophobicContact CG-CG 4.02Å; P34-K36 PolarHBondContact O-N 2.82Å; P34-K36 VanDerWaalsContact O-N 3.17Å; P34-Y37 WeakPolarHBondContact O-CB 3.49Å; P34-Y37 PolarHBondContact O-N 3.06Å; P34-S38 PolarHBondContact O-N 3.1Å; P34-S38 VanDerWaalsContact O-N 3.12Å; P34-S38 PolarHBondContact O-OG 2.96Å
35W97.3Very high97.7Very high161 Ų16157.1 Ų57.161%0.6129%0.291SS*.Hα-helixtrans-61-26.9178.469.7-100.7000113.3P33 S38 L39P33-W35 VanDerWaalsContact CB-CD1 3.42Å; P33-W35 HydrophobicContact CB-CG 4.34Å; P33-W35 VanDerWaalsContact CB-NE1 3.33Å; P33-W35 PolarHBondContact O-N 2.98Å; P33-W35 VanDerWaalsContact O-N 3.09Å; W35-S38 PolarHBondContact O-N 3.19Å; W35-L39 HydrophobicContact CZ3-CD2 4.23Å; W35-L39 WeakPolarHBondContact O-CB 3.26Å; W35-L39 PolarHBondContact O-N 2.92Å
36K97.5Very high97.7Very high66 Ų6655.7 Ų55.729%0.28728%0.283SS..Hα-helixtrans-68.7-36.6174.8-65.9-169.6-178.2178.20111.3A32 P33 P34 L39 L40 M183A32-K36 HydrophobicContact CB-CB 4.39Å; A32-K36 HydrophobicContact CB-CD 3.98Å; P33-K36 WeakPolarHBondContact O-CB 3.5Å; P33-K36 PolarHBondContact O-N 3.32Å; P34-K36 PolarHBondContact O-N 2.82Å; P34-K36 VanDerWaalsContact O-N 3.17Å; K36-L39 WeakPolarHBondContact O-CB 3.29Å; K36-L39 PolarHBondContact O-N 2.72Å; K36-L40 WeakPolarHBondContact O-CG 3.27Å; K36-L40 PolarHBondContact O-N 3.46Å; K36-M183 HydrophobicContact CB-CE 3.78Å; K36-M183 HydrophobicContact CB-SD 4.35Å
37Y98Very high97.7Very high1 Ų151.6 Ų51.60%0.00426%0.264CS..Hα-helixtrans-67-42.3173.5-68.2-90.2000111.2Q28 Y29 A32 P34 L39 L40 A41 M183 C185Q28-Y37 WeakPolarHBondContact CB-OH 3.13Å; Q28-Y37 PolarHBondContact O-OH 2.99Å; Y29-Y37 AromaticContact CD1-CD2 3.62Å; Y29-Y37 HydrophobicContact CD1-CD2 3.62Å; Y29-Y37 AromaticContact CD1-CE2 3.74Å; Y29-Y37 HydrophobicContact CD1-CE2 3.74Å; Y29-Y37 HydrophobicContact CD1-CG 4.3Å; Y29-Y37 AromaticContact CE1-CD2 3.79Å; Y29-Y37 HydrophobicContact CE1-CD2 3.79Å; Y29-Y37 HydrophobicContact CE1-CE2 4.28Å; Y29-Y37 HydrophobicContact CE1-CG 4.01Å; A32-Y37 HydrophobicContact CB-CE2 3.88Å; A32-Y37 WeakPolarHBondContact O-CE2 3.5Å; P34-Y37 WeakPolarHBondContact O-CB 3.49Å; P34-Y37 PolarHBondContact O-N 3.06Å; Y37-L39 VanDerWaalsContact C-N 3.27Å; Y37-L39 PolarHBondContact O-N 2.85Å; Y37-L40 PolarHBondContact O-N 3.36Å; Y37-A41 PolarHBondContact O-N 3.49Å; Y37-M183 HydrophobicContact CD1-CE 3.79Å; Y37-M183 HydrophobicContact CD2-CE 3.58Å; Y37-M183 HydrophobicContact CE1-CB 4.11Å; Y37-M183 HydrophobicContact CE1-CE 3.66Å; Y37-M183 WeakPolarHBondContact CE1-O 3.16Å; Y37-M183 HydrophobicContact CE2-CE 3.44Å; Y37-M183 VanDerWaalsContact CE2-CE 3.44Å; Y37-M183 HydrophobicContact CG-CE 3.76Å; Y37-M183 VanDerWaalsContact CZ-CE 3.47Å; Y37-M183 PolarHBondContact OH-O 3.02Å; Y37-M183 VanDerWaalsContact OH-O 3.08Å; Y37-C185 WeakPolarHBondContact CD1-SG 3.4Å; Y37-C185 WeakPolarHBondContact CE1-SG 3.12Å
38S97.9Very high97.7Very high77 Ų7750.8 Ų50.854%0.53826%0.257SS..Hα-helixtrans-59.9-37.4172.2-50.30000112.4P34 W35 A41 A42P34-S38 PolarHBondContact O-N 3.1Å; P34-S38 VanDerWaalsContact O-N 3.12Å; P34-S38 PolarHBondContact O-OG 2.96Å; W35-S38 PolarHBondContact O-N 3.19Å; S38-A41 PolarHBondContact O-N 3.1Å; S38-A42 WeakPolarHBondContact O-CB 3.38Å; S38-A42 PolarHBondContact O-N 2.98Å
39L98Very high97.6Very high105 Ų10556 Ų5655%0.5528%0.283SS..Hα-helixtrans-65.4-43.5174.8-178.663.4000111.9W35 K36 Y37 A41 A42 Y43W35-L39 HydrophobicContact CZ3-CD2 4.23Å; W35-L39 WeakPolarHBondContact O-CB 3.26Å; W35-L39 PolarHBondContact O-N 2.92Å; K36-L39 WeakPolarHBondContact O-CB 3.29Å; K36-L39 PolarHBondContact O-N 2.72Å; Y37-L39 VanDerWaalsContact C-N 3.27Å; Y37-L39 PolarHBondContact O-N 2.85Å; L39-A41 VanDerWaalsContact C-N 3.34Å; L39-A42 PolarHBondContact O-N 3.47Å; L39-Y43 WeakPolarHBondContact O-CB 3.43Å; L39-Y43 PolarHBondContact O-N 2.92Å
40L97.9Very high97.5Very high21 Ų2153.3 Ų53.311%0.1128%0.277CS..Hα-helixtrans-60.9-44.1173.9-66.8177.6000111.1K36 Y37 Y43 M44 A98 M183 T289 F293K36-L40 WeakPolarHBondContact O-CG 3.27Å; K36-L40 PolarHBondContact O-N 3.46Å; Y37-L40 PolarHBondContact O-N 3.36Å; L40-Y43 WeakPolarHBondContact O-CB 3.21Å; L40-Y43 PolarHBondContact O-N 3.2Å; L40-M44 WeakPolarHBondContact O-CG 3.35Å; L40-M44 PolarHBondContact O-N 3.05Å; L40-A98 HydrophobicContact CB-CB 4.21Å; L40-M183 HydrophobicContact CD1-CE 3.87Å; L40-M183 HydrophobicContact CD1-SD 4.04Å; L40-T289 HydrophobicContact CD1-CG2 3.9Å; L40-T289 HydrophobicContact CD2-CG2 3.86Å; L40-F293 HydrophobicContact CB-CE1 3.99Å; L40-F293 HydrophobicContact CB-CZ 4.24Å; L40-F293 HydrophobicContact CD1-CE1 4.42Å; L40-F293 HydrophobicContact CD1-CE2 4.08Å; L40-F293 HydrophobicContact CD1-CZ 3.91Å; L40-F293 HydrophobicContact CD2-CD1 3.8Å; L40-F293 HydrophobicContact CD2-CD2 4.04Å; L40-F293 HydrophobicContact CD2-CE1 3.89Å; L40-F293 HydrophobicContact CD2-CE2 4.14Å; L40-F293 HydrophobicContact CD2-CG 3.85Å; L40-F293 HydrophobicContact CD2-CZ 4.06Å; L40-F293 HydrophobicContact CG-CE1 4.31Å; L40-F293 HydrophobicContact CG-CZ 4.29Å
41A98.3Very high97.5Very high2 Ų250.5 Ų50.52%0.01727%0.266CS..Hα-helixtrans-61.3-46.3176.300000111.9Y37 S38 L39 Y43 M44 I45 L95 A98 L99Y37-A41 PolarHBondContact O-N 3.49Å; S38-A41 PolarHBondContact O-N 3.1Å; L39-A41 VanDerWaalsContact C-N 3.34Å; A41-Y43 VanDerWaalsContact C-N 3.3Å; A41-Y43 PolarHBondContact O-N 3.29Å; A41-M44 PolarHBondContact O-N 3.36Å; A41-I45 WeakPolarHBondContact O-CG1 3.37Å; A41-I45 PolarHBondContact O-N 3.43Å; A41-L95 HydrophobicContact CB-CD1 3.99Å; A41-L95 WeakPolarHBondContact O-CD1 3.31Å; A41-A98 HydrophobicContact CB-CB 4.04Å; A41-L99 HydrophobicContact CB-CD2 3.68Å; A41-L99 HydrophobicContact CB-CG 3.96Å
42A98.5Very high97.4Very high54 Ų5453.6 Ų53.645%0.44628%0.278SS..Hα-helixtrans-60.2-40.4176.200000112.2S38 L39 I45 F46S38-A42 WeakPolarHBondContact O-CB 3.38Å; S38-A42 PolarHBondContact O-N 2.98Å; L39-A42 PolarHBondContact O-N 3.47Å; A42-I45 PolarHBondContact O-N 2.95Å; A42-F46 PolarHBondContact O-N 3.39Å
43Y98.3Very high97.3Very high64 Ų6456.5 Ų56.525%0.25130%0.297SS..Hα-helixtrans-64.4-43.5174.7175.2-106.2000112.4L39 L40 A41 I45 F46 L47 F293 S297L39-Y43 WeakPolarHBondContact O-CB 3.43Å; L39-Y43 PolarHBondContact O-N 2.92Å; L40-Y43 WeakPolarHBondContact O-CB 3.21Å; L40-Y43 PolarHBondContact O-N 3.2Å; A41-Y43 VanDerWaalsContact C-N 3.3Å; A41-Y43 PolarHBondContact O-N 3.29Å; Y43-I45 VanDerWaalsContact C-N 3.34Å; Y43-I45 PolarHBondContact O-N 3.01Å; Y43-F46 HydrophobicContact CD2-CD1 4.49Å; Y43-F46 WeakPolarHBondContact O-CB 3.44Å; Y43-F46 PolarHBondContact O-N 2.89Å; Y43-L47 HydrophobicContact CD1-CD1 4.15Å; Y43-L47 HydrophobicContact CD1-CG 4.47Å; Y43-L47 HydrophobicContact CE1-CD1 3.43Å; Y43-L47 VanDerWaalsContact CE1-CD1 3.43Å; Y43-L47 HydrophobicContact CE1-CG 4.01Å; Y43-L47 HydrophobicContact CE2-CD1 4.42Å; Y43-L47 HydrophobicContact CE2-CD2 4.26Å; Y43-L47 HydrophobicContact CE2-CG 4.18Å; Y43-L47 PolarHBondContact O-N 2.93Å; Y43-F293 HydrophobicContact CD1-CB 4.39Å; Y43-F293 AromaticContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CE1-CB 4.03Å; Y43-F293 HydrophobicContact CE1-CD1 4.24Å; Y43-F293 WeakPolarHBondContact CE1-O 3.35Å; Y43-F293 PolarHBondContact OH-O 3.31Å; Y43-S297 WeakPolarHBondContact OH-CB 3.05Å
44M98.3Very high97.1Very high0 Ų055.4 Ų55.40%029%0.289CS..Hα-helixtrans-64.9-37.8175.9-66.9-50.8-56.500112.1L40 A41 L47 I48 F91 T94 L95 F293 K296L40-M44 WeakPolarHBondContact O-CG 3.35Å; L40-M44 PolarHBondContact O-N 3.05Å; A41-M44 PolarHBondContact O-N 3.36Å; M44-L47 HydrophobicContact CE-CD1 4.42Å; M44-L47 PolarHBondContact O-N 3.15Å; M44-L47 HydrophobicContact SD-CD1 4.21Å; M44-I48 WeakPolarHBondContact O-CB 3.39Å; M44-I48 WeakPolarHBondContact O-CD1 3.33Å; M44-I48 VanDerWaalsContact O-CG1 3.24Å; M44-I48 WeakPolarHBondContact O-CG1 3.34Å; M44-I48 PolarHBondContact O-N 3.25Å; M44-F91 HydrophobicContact CE-CB 3.42Å; M44-F91 VanDerWaalsContact CE-CB 3.42Å; M44-F91 HydrophobicContact CE-CD1 3.64Å; M44-F91 HydrophobicContact CE-CD2 4Å; M44-F91 HydrophobicContact CE-CE1 4.43Å; M44-F91 HydrophobicContact CE-CG 3.41Å; M44-F91 VanDerWaalsContact CE-CG 3.41Å; M44-T94 HydrophobicContact CE-CG2 3.96Å; M44-T94 HydrophobicContact CG-CG2 3.83Å; M44-T94 HydrophobicContact SD-CG2 3.81Å; M44-L95 HydrophobicContact CB-CB 4.05Å; M44-L95 HydrophobicContact CB-CD1 4.24Å; M44-F293 HydrophobicContact CG-CD1 4.27Å; M44-F293 HydrophobicContact CG-CE1 3.79Å; M44-F293 HydrophobicContact SD-CD1 3.65Å; M44-F293 HydrophobicContact SD-CE1 3.64Å; M44-K296 HydrophobicContact CE-CD 3.99Å; M44-K296 HydrophobicContact SD-CD 3.98Å
45I98.4Very high96.9Very high75 Ų7552.1 Ų52.139%0.38527%0.268SS..Hα-helixtrans-58.4-50.4171.3-69.7166.3000109.7A41 A42 Y43 L47 I48 I49 L95A41-I45 WeakPolarHBondContact O-CG1 3.37Å; A41-I45 PolarHBondContact O-N 3.43Å; A42-I45 PolarHBondContact O-N 2.95Å; Y43-I45 VanDerWaalsContact C-N 3.34Å; Y43-I45 PolarHBondContact O-N 3.01Å; I45-L47 VanDerWaalsContact C-N 3.32Å; I45-L47 PolarHBondContact O-N 2.85Å; I45-I48 PolarHBondContact O-N 3.34Å; I45-I49 HydrophobicContact CG2-CG2 4.23Å; I45-I49 WeakPolarHBondContact O-CG1 3.46Å; I45-I49 WeakPolarHBondContact O-CG2 3.33Å; I45-I49 PolarHBondContact O-N 3.42Å; I45-L95 HydrophobicContact CD1-CD1 4.13Å; I45-L95 HydrophobicContact CG1-CD1 3.64Å; I45-L95 HydrophobicContact CG1-CD2 3.85Å; I45-L95 HydrophobicContact CG1-CG 4.43Å
46F98Very high96.7Very high99 Ų9949.5 Ų49.543%0.43426%0.261SS..Hα-helixtrans-54.5-47.2176.9165.8-97.7000111.9A42 Y43 I49 T50 L300A42-F46 PolarHBondContact O-N 3.39Å; Y43-F46 HydrophobicContact CD2-CD1 4.49Å; Y43-F46 WeakPolarHBondContact O-CB 3.44Å; Y43-F46 PolarHBondContact O-N 2.89Å; F46-I49 WeakPolarHBondContact O-CG1 3.38Å; F46-T50 HydrophobicContact CD2-CG2 4.01Å; F46-T50 HydrophobicContact CE2-CG2 3.72Å; F46-T50 HydrophobicContact CZ-CG2 4.21Å; F46-T50 WeakPolarHBondContact O-CB 3.34Å; F46-T50 WeakPolarHBondContact O-CG2 3.4Å; F46-T50 PolarHBondContact O-N 3.13Å; F46-T50 VanDerWaalsContact O-N 3.15Å; F46-T50 PolarHBondContact O-OG1 3.01Å; F46-L300 HydrophobicContact CE1-CD2 3.82Å; F46-L300 HydrophobicContact CZ-CD2 3.89Å
47L97.5Very high96.4Very high1 Ų148.2 Ų48.21%0.00526%0.257CS..Hα-helixtrans-62.4-45.2177.4-71.3-174.7000111.9Y43 M44 I45 T50 A51 F91 K296 L300Y43-L47 HydrophobicContact CD1-CD1 4.15Å; Y43-L47 HydrophobicContact CD1-CG 4.47Å; Y43-L47 HydrophobicContact CE1-CD1 3.43Å; Y43-L47 VanDerWaalsContact CE1-CD1 3.43Å; Y43-L47 HydrophobicContact CE1-CG 4.01Å; Y43-L47 HydrophobicContact CE2-CD1 4.42Å; Y43-L47 HydrophobicContact CE2-CD2 4.26Å; Y43-L47 HydrophobicContact CE2-CG 4.18Å; Y43-L47 PolarHBondContact O-N 2.93Å; M44-L47 HydrophobicContact CE-CD1 4.42Å; M44-L47 PolarHBondContact O-N 3.15Å; M44-L47 HydrophobicContact SD-CD1 4.21Å; I45-L47 VanDerWaalsContact C-N 3.32Å; I45-L47 PolarHBondContact O-N 2.85Å; L47-T50 PolarHBondContact O-N 3.33Å; L47-T50 PolarHBondContact O-OG1 3.14Å; L47-A51 WeakPolarHBondContact O-CA 3.35Å; L47-A51 WeakPolarHBondContact O-CB 3.19Å; L47-A51 PolarHBondContact O-N 3.41Å; L47-F91 HydrophobicContact CB-CD2 4.19Å; L47-F91 HydrophobicContact CB-CE2 4.17Å; L47-F91 HydrophobicContact CD1-CE2 4.21Å; L47-K296 HydrophobicContact CD1-CB 3.91Å; L47-L300 HydrophobicContact CD2-CB 4.41Å; L47-L300 HydrophobicContact CD2-CD2 4.43Å
48I97.8Very high96Very high35 Ų3548.6 Ų48.618%0.17926%0.259CS..Hα-helixtrans-63.2-48.2-179-68.7162.5000110.9M44 I45 T50 F52 V87 F91 L95M44-I48 WeakPolarHBondContact O-CB 3.39Å; M44-I48 WeakPolarHBondContact O-CD1 3.33Å; M44-I48 VanDerWaalsContact O-CG1 3.24Å; M44-I48 WeakPolarHBondContact O-CG1 3.34Å; M44-I48 PolarHBondContact O-N 3.25Å; I45-I48 PolarHBondContact O-N 3.34Å; I48-T50 VanDerWaalsContact C-N 3.25Å; I48-T50 PolarHBondContact O-N 3.47Å; I48-F52 WeakPolarHBondContact O-CB 3.28Å; I48-F52 PolarHBondContact O-N 3.44Å; I48-F52 VanDerWaalsContact O-N 3.15Å; I48-V87 HydrophobicContact CB-CG1 4.47Å; I48-V87 HydrophobicContact CG1-CG1 4.27Å; I48-V87 HydrophobicContact CG2-CG1 4.26Å; I48-F91 HydrophobicContact CD1-CB 4.01Å; I48-F91 HydrophobicContact CG1-CB 3.72Å; I48-F91 HydrophobicContact CG1-CD2 4.33Å; I48-L95 HydrophobicContact CD1-CB 4.14Å; I48-L95 HydrophobicContact CD1-CD2 3.8Å
49I97.3Very high95.6Very high108 Ų10847.1 Ų47.155%0.55425%0.245SC*.Hα-helixtrans-70.7-20-176.470.1-178.6000113.2I45 F46 P53I45-I49 HydrophobicContact CG2-CG2 4.23Å; I45-I49 WeakPolarHBondContact O-CG1 3.46Å; I45-I49 WeakPolarHBondContact O-CG2 3.33Å; I45-I49 PolarHBondContact O-N 3.42Å; F46-I49 WeakPolarHBondContact O-CG1 3.38Å; I49-P53 WeakPolarHBondContact O-CD 3.22Å; I49-P53 VanDerWaalsContact O-CG 3.22Å; I49-P53 WeakPolarHBondContact O-CG 3.41Å
50T95.3Very high95.2Very high37 Ų3747 Ų4723%0.22724%0.238CC..Hα-helixtrans-101.4-44.7179.455.90000112.7F46 L47 I48 P53 V54 L300F46-T50 HydrophobicContact CD2-CG2 4.01Å; F46-T50 HydrophobicContact CE2-CG2 3.72Å; F46-T50 HydrophobicContact CZ-CG2 4.21Å; F46-T50 WeakPolarHBondContact O-CB 3.34Å; F46-T50 WeakPolarHBondContact O-CG2 3.4Å; F46-T50 PolarHBondContact O-N 3.13Å; F46-T50 VanDerWaalsContact O-N 3.15Å; F46-T50 PolarHBondContact O-OG1 3.01Å; L47-T50 PolarHBondContact O-N 3.33Å; L47-T50 PolarHBondContact O-OG1 3.14Å; I48-T50 VanDerWaalsContact C-N 3.25Å; I48-T50 PolarHBondContact O-N 3.47Å; T50-P53 WeakPolarHBondContact O-CD 3.41Å; T50-V54 VanDerWaalsContact O-CG2 3.27Å; T50-V54 WeakPolarHBondContact O-CG2 3.46Å; T50-V54 PolarHBondContact O-N 3.01Å; T50-L300 WeakPolarHBondContact OG1-CD2 3.47Å
51A95.5Very high94.7Very high0 Ų046 Ų460%023%0.233CC..Hα-helixtrans-71.6-39.5-178.400000111.8L47 N55 V87 A299 L300L47-A51 WeakPolarHBondContact O-CA 3.35Å; L47-A51 WeakPolarHBondContact O-CB 3.19Å; L47-A51 PolarHBondContact O-N 3.41Å; A51-N55 WeakPolarHBondContact O-CB 3.26Å; A51-N55 PolarHBondContact O-N 2.98Å; A51-N55 PolarHBondContact O-ND2 3.42Å; A51-V87 HydrophobicContact CB-CG2 3.84Å; A51-A299 HydrophobicContact CB-CB 4.23Å; A51-L300 HydrophobicContact CB-CB 4.27Å
52F95.8Very high94.1Very high86 Ų8646.3 Ų46.338%0.37724%0.235SC..Hα-helixtrans-60.3-53.5-179.9-177.2-87.7000112I48 V54 N55 F56 L84 V87 V88I48-F52 WeakPolarHBondContact O-CB 3.28Å; I48-F52 PolarHBondContact O-N 3.44Å; I48-F52 VanDerWaalsContact O-N 3.15Å; F52-V54 PolarHBondContact O-N 3.37Å; F52-N55 PolarHBondContact O-N 2.89Å; F52-F56 HydrophobicContact CE1-CB 4.46Å; F52-F56 VanDerWaalsContact O-CB 3.23Å; F52-F56 WeakPolarHBondContact O-CB 3.42Å; F52-F56 PolarHBondContact O-N 2.92Å; F52-L84 HydrophobicContact CD2-CD2 3.65Å; F52-L84 HydrophobicContact CE2-CD2 3.89Å; F52-L84 HydrophobicContact CG-CD2 4.25Å; F52-V87 HydrophobicContact CB-CG1 3.99Å; F52-V87 HydrophobicContact CD2-CG1 4.28Å; F52-V88 HydrophobicContact CD2-CG2 4.31Å; F52-V88 HydrophobicContact CE2-CG2 4.08Å
53P94.2Very high93.5Very high66 Ų6647.4 Ų47.443%0.42924%0.236SC..Hα-helixtrans-64.6-39.3-178.2-23.836.9000113I49 T50 L57I49-P53 WeakPolarHBondContact O-CD 3.22Å; I49-P53 VanDerWaalsContact O-CG 3.22Å; I49-P53 WeakPolarHBondContact O-CG 3.41Å; T50-P53 WeakPolarHBondContact O-CD 3.41Å; P53-L57 WeakPolarHBondContact O-CB 3.37Å; P53-L57 PolarHBondContact O-N 2.99Å
54V92.3Very high93Very high36 Ų3649.3 Ų49.322%0.21825%0.247CC..Hα-helixtrans-67.1-43.7-178.21740000111.1T50 F52 T58 P303 I307T50-V54 VanDerWaalsContact O-CG2 3.27Å; T50-V54 WeakPolarHBondContact O-CG2 3.46Å; T50-V54 PolarHBondContact O-N 3.01Å; F52-V54 PolarHBondContact O-N 3.37Å; V54-T58 WeakPolarHBondContact O-CB 3.4Å; V54-T58 PolarHBondContact O-N 3.45Å; V54-T58 PolarHBondContact O-OG1 3.46Å; V54-P303 HydrophobicContact CG1-CB 3.46Å; V54-P303 VanDerWaalsContact CG1-CB 3.46Å; V54-P303 HydrophobicContact CG1-CG 4.2Å; V54-I307 HydrophobicContact CG1-CD1 3.93Å
55N93.6Very high92.3Very high0 Ų051.8 Ų51.80%026%0.258CS..Hα-helixtrans-69.6-41.5176.9-75.9-70.5000112.3A51 F52 L57 T58 L59 A80 D83 L84 A299 P303A51-N55 WeakPolarHBondContact O-CB 3.26Å; A51-N55 PolarHBondContact O-N 2.98Å; A51-N55 PolarHBondContact O-ND2 3.42Å; F52-N55 PolarHBondContact O-N 2.89Å; N55-L57 PolarHBondContact O-N 2.91Å; N55-T58 WeakPolarHBondContact O-CB 3.48Å; N55-T58 PolarHBondContact O-N 3.32Å; N55-L59 PolarHBondContact O-N 3.45Å; N55-A80 HydrophobicContact CB-CB 4.47Å; N55-A80 WeakPolarHBondContact OD1-CA 3.48Å; N55-D83 HydrophobicContact CB-CB 4.48Å; N55-D83 VanDerWaalsContact CG-CB 3.49Å; N55-D83 VanDerWaalsContact OD1-CB 3.31Å; N55-D83 WeakPolarHBondContact OD1-CB 3.27Å; N55-D83 PolarHBondContact OD1-OD2 3.18Å; N55-L84 HydrophobicContact CB-CD1 4.45Å; N55-L84 HydrophobicContact CB-CD2 3.9Å; N55-L84 HydrophobicContact CB-CG 3.77Å; N55-A299 PolarHBondContact ND2-O 3.4Å; N55-P303 WeakPolarHBondContact OD1-CG 3.44Å
56F93.4Very high91.5Very high107 Ų10756.1 Ų56.147%0.46927%0.274SS..Hα-helixtrans-61.3-44.9175.3-178.9-97.4000111.7F52 T58 L59 Y60 L84F52-F56 HydrophobicContact CE1-CB 4.46Å; F52-F56 VanDerWaalsContact O-CB 3.23Å; F52-F56 WeakPolarHBondContact O-CB 3.42Å; F52-F56 PolarHBondContact O-N 2.92Å; F56-T58 VanDerWaalsContact C-N 3.27Å; F56-T58 PolarHBondContact O-N 2.88Å; F56-L59 WeakPolarHBondContact O-CB 3.25Å; F56-L59 PolarHBondContact O-N 3.47Å; F56-Y60 WeakPolarHBondContact O-CB 3.38Å; F56-Y60 PolarHBondContact O-N 2.9Å; F56-L84 HydrophobicContact CB-CD2 4.4Å
57L90.6Very high90.6Very high39 Ų3959.4 Ų59.420%0.20429%0.288CS..Hα-helixtrans-63.9-36.8176.2-176.156.5000111.1P53 N55 L59 Y60 V61 M317 I320 V321P53-L57 WeakPolarHBondContact O-CB 3.37Å; P53-L57 PolarHBondContact O-N 2.99Å; N55-L57 PolarHBondContact O-N 2.91Å; L57-L59 PolarHBondContact O-N 3.06Å; L57-Y60 PolarHBondContact O-N 3.41Å; L57-V61 HydrophobicContact CD1-CG2 3.77Å; L57-V61 HydrophobicContact CG-CG2 4.09Å; L57-V61 WeakPolarHBondContact O-CB 3.4Å; L57-V61 WeakPolarHBondContact O-CG2 3.46Å; L57-V61 PolarHBondContact O-N 3.21Å; L57-M317 HydrophobicContact CB-CE 4.25Å; L57-M317 HydrophobicContact CD2-CE 3.23Å; L57-M317 HydrophobicContact CD2-CG 4.1Å; L57-M317 HydrophobicContact CG-CE 3.67Å; L57-M317 HydrophobicContact CG-CG 4.27Å; L57-I320 HydrophobicContact CD1-CG2 4.21Å; L57-V321 HydrophobicContact CD2-CG2 3.7Å
58T89.1Confident89.7Confident8 Ų859.4 Ų59.45%0.04929%0.288CS..Hα-helixtrans-61.3-46176-64.10000111.5V54 N55 F56 T62 A80 F313V54-T58 WeakPolarHBondContact O-CB 3.4Å; V54-T58 PolarHBondContact O-N 3.45Å; V54-T58 PolarHBondContact O-OG1 3.46Å; N55-T58 WeakPolarHBondContact O-CB 3.48Å; N55-T58 PolarHBondContact O-N 3.32Å; F56-T58 VanDerWaalsContact C-N 3.27Å; F56-T58 PolarHBondContact O-N 2.88Å; T58-T62 PolarHBondContact O-N 2.88Å; T58-T62 PolarHBondContact O-OG1 2.98Å; T58-A80 HydrophobicContact CG2-CB 3.87Å; T58-F313 HydrophobicContact CG2-CE1 4.36Å; T58-F313 HydrophobicContact CG2-CE2 4.43Å; T58-F313 HydrophobicContact CG2-CZ 3.73Å
59L89.8Confident88.9Confident46 Ų4663.5 Ų63.524%0.24130%0.301CS..Hα-helixtrans-59.5-51.6174.1-169.983.7000111N55 F56 L57 T62 V63 L77 V81 L84N55-L59 PolarHBondContact O-N 3.45Å; F56-L59 WeakPolarHBondContact O-CB 3.25Å; F56-L59 PolarHBondContact O-N 3.47Å; L57-L59 PolarHBondContact O-N 3.06Å; L59-T62 PolarHBondContact O-N 3.02Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 2.96Å; L59-V63 VanDerWaalsContact O-N 3.11Å; L59-L77 HydrophobicContact CD1-CD1 3.45Å; L59-L77 VanDerWaalsContact CD1-CD1 3.45Å; L59-L77 HydrophobicContact CD1-CG 3.88Å; L59-L77 HydrophobicContact CG-CD1 4.18Å; L59-V81 HydrophobicContact CD1-CG2 3.56Å; L59-L84 HydrophobicContact CD2-CD1 4.45Å
60Y89.9Confident88Confident104 Ų10460.8 Ų60.841%0.40829%0.29SS..Hα-helixtrans-60.1-50.1-176.5-178.7-97.9000112.4F56 L57 T62 V63 Q64 I320F56-Y60 WeakPolarHBondContact O-CB 3.38Å; F56-Y60 PolarHBondContact O-N 2.9Å; L57-Y60 PolarHBondContact O-N 3.41Å; Y60-T62 VanDerWaalsContact C-N 3.31Å; Y60-T62 PolarHBondContact O-N 3.42Å; Y60-V63 PolarHBondContact O-N 3.5Å; Y60-Q64 HydrophobicContact CD1-CG 4.1Å; Y60-Q64 HydrophobicContact CD2-CG 4.37Å; Y60-Q64 HydrophobicContact CE1-CG 3.72Å; Y60-Q64 HydrophobicContact CE2-CG 4.03Å; Y60-Q64 HydrophobicContact CG-CG 4.41Å; Y60-Q64 VanDerWaalsContact O-CG 3.31Å; Y60-Q64 WeakPolarHBondContact O-CG 3.24Å; Y60-Q64 PolarHBondContact O-N 3.08Å; Y60-I320 HydrophobicContact CD1-CD1 4.3Å; Y60-I320 HydrophobicContact CD1-CG2 4.32Å; Y60-I320 HydrophobicContact CE1-CD1 4.22Å; Y60-I320 HydrophobicContact CE1-CG2 4.07Å
61V87.9Confident86.9Confident0 Ų060.6 Ų60.60%029%0.29CS..Hα-helixtrans-58.9-43.7-179.7171.80000111L57 V63 Q64 H65 L68 F313 C316 M317 I320L57-V61 HydrophobicContact CD1-CG2 3.77Å; L57-V61 HydrophobicContact CG-CG2 4.09Å; L57-V61 WeakPolarHBondContact O-CB 3.4Å; L57-V61 WeakPolarHBondContact O-CG2 3.46Å; L57-V61 PolarHBondContact O-N 3.21Å; V61-V63 PolarHBondContact O-N 3.44Å; V61-Q64 PolarHBondContact O-N 2.99Å; V61-H65 PolarHBondContact O-CD2 3.45Å; V61-H65 PolarHBondContact O-N 3.46Å; V61-L68 HydrophobicContact CG1-CD1 3.7Å; V61-F313 HydrophobicContact CB-CZ 4.21Å; V61-F313 HydrophobicContact CG1-CE2 4.2Å; V61-F313 HydrophobicContact CG1-CZ 4.15Å; V61-C316 HydrophobicContact CG1-CB 3.95Å; V61-M317 HydrophobicContact CG1-CB 4.43Å; V61-M317 HydrophobicContact CG2-CB 4.23Å; V61-M317 HydrophobicContact CG2-CG 4.18Å; V61-I320 HydrophobicContact CB-CD1 4.09Å; V61-I320 HydrophobicContact CG1-CD1 4.23Å; V61-I320 HydrophobicContact CG2-CD1 3.64Å
62T85.3Confident85.8Confident8 Ų861.8 Ų61.85%0.04930%0.296CS..Hα-helixtrans-64.4-40.5-179.8-51.80000112T58 L59 Y60 L68 L77 F313T58-T62 PolarHBondContact O-N 2.88Å; T58-T62 PolarHBondContact O-OG1 2.98Å; L59-T62 PolarHBondContact O-N 3.02Å; Y60-T62 VanDerWaalsContact C-N 3.31Å; Y60-T62 PolarHBondContact O-N 3.42Å; T62-L68 HydrophobicContact CG2-CB 4.47Å; T62-L77 HydrophobicContact CG2-CD1 3.86Å; T62-F313 WeakPolarHBondContact OG1-CE2 3.37Å
63V86.1Confident85.2Confident77 Ų7757.9 Ų57.947%0.46728%0.279SS..Hα-helixtrans-68.4-43.4178.8171.70000111.2L59 Y60 V61 R69L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 2.96Å; L59-V63 VanDerWaalsContact O-N 3.11Å; Y60-V63 PolarHBondContact O-N 3.5Å; V61-V63 PolarHBondContact O-N 3.44Å; V63-R69 PolarHBondContact O-NH2 2.98Å
64Q86.5Confident84.7Confident104 Ų10457.2 Ų57.249%0.48627%0.268SS..Hα-helixtrans-67-43.8-178.4-69.5-60.9-23.700112.7Y60 V61 K66 I320Y60-Q64 HydrophobicContact CD1-CG 4.1Å; Y60-Q64 HydrophobicContact CD2-CG 4.37Å; Y60-Q64 HydrophobicContact CE1-CG 3.72Å; Y60-Q64 HydrophobicContact CE2-CG 4.03Å; Y60-Q64 HydrophobicContact CG-CG 4.41Å; Y60-Q64 VanDerWaalsContact O-CG 3.31Å; Y60-Q64 WeakPolarHBondContact O-CG 3.24Å; Y60-Q64 PolarHBondContact O-N 3.08Å; V61-Q64 PolarHBondContact O-N 2.99Å; Q64-K66 PolarHBondContact O-N 3.03Å; Q64-I320 HydrophobicContact CB-CD1 4.4Å
65H83.6Confident84.2Confident52 Ų5256 Ų5624%0.24126%0.26CS..  trans-93.8101.4-175.5-69.2-82.6000112V61 K67 L68 I320V61-H65 PolarHBondContact O-CD2 3.45Å; V61-H65 PolarHBondContact O-N 3.46Å; H65-K67 PolarHBondContact O-N 3.44Å; H65-L68 HydrophobicContact CB-CB 4.44Å; H65-L68 HydrophobicContact CB-CD1 3.9Å; H65-L68 HydrophobicContact CB-CG 3.94Å; H65-L68 WeakPolarHBondContact O-CB 3.4Å; H65-L68 PolarHBondContact O-N 2.99Å; H65-I320 VanDerWaalsContact NE2-CD1 3.31Å; H65-I320 WeakPolarHBondContact NE2-CD1 3.12Å
66K81.7Confident83.5Confident165 Ų16556.5 Ų56.572%0.71726%0.263SS*.G310 helixtrans-51.9-32.3174.6-67.7-175.5-179.1-179.80113.7Q64 L68 R69Q64-K66 PolarHBondContact O-N 3.03Å; K66-L68 PolarHBondContact O-N 3.36Å; K66-R69 WeakPolarHBondContact O-CB 3.37Å; K66-R69 PolarHBondContact O-N 3.18Å
67K79.1Confident83.2Confident169 Ų16953.3 Ų53.374%0.73525%0.25SS*.G310 helixtrans-60.6-22.4176.1-64.4-174.6178.7-176.70113.3H65 Q312H65-K67 PolarHBondContact O-N 3.44Å; K67-Q312 PolarHBondContact O-NE2 2.94Å
68L78.2Confident83.2Confident0 Ų051.9 Ų51.90%024%0.243CC..G310 helixtrans-904.9176.8-60.9178.1000112.6V61 T62 H65 K66 T70 N73 Q312 F313 C316V61-L68 HydrophobicContact CG1-CD1 3.7Å; T62-L68 HydrophobicContact CG2-CB 4.47Å; H65-L68 HydrophobicContact CB-CB 4.44Å; H65-L68 HydrophobicContact CB-CD1 3.9Å; H65-L68 HydrophobicContact CB-CG 3.94Å; H65-L68 WeakPolarHBondContact O-CB 3.4Å; H65-L68 PolarHBondContact O-N 2.99Å; K66-L68 PolarHBondContact O-N 3.36Å; L68-T70 PolarHBondContact O-N 3.41Å; L68-N73 VanDerWaalsContact C-ND2 3.34Å; L68-N73 WeakPolarHBondContact CA-ND2 3.37Å; L68-N73 WeakPolarHBondContact O-CB 3.28Å; L68-N73 VanDerWaalsContact O-CG 3.24Å; L68-N73 PolarHBondContact O-ND2 3.5Å; L68-Q312 HydrophobicContact CD2-CG 3.86Å; L68-F313 HydrophobicContact CD1-CD2 3.87Å; L68-F313 HydrophobicContact CD1-CE2 4.09Å; L68-F313 HydrophobicContact CD2-CD2 4.38Å; L68-C316 HydrophobicContact CD1-CB 3.95Å
69R81.3Confident83.1Confident121 Ų12151.7 Ų51.746%0.45724%0.241SC..  trans-87.158.6178.4-59.9-179.2-170.5-176-0.5111.6V63 K66V63-R69 PolarHBondContact O-NH2 2.98Å; K66-R69 WeakPolarHBondContact O-CB 3.37Å; K66-R69 PolarHBondContact O-N 3.18Å
70T79.6Confident83.2Confident52 Ų5249.6 Ų49.632%0.31923%0.231SC..SBendtrans-99.7156.217567.60000109.9L68 L72 N73 Y74L68-T70 PolarHBondContact O-N 3.41Å; T70-L72 PolarHBondContact O-N 2.7Å; T70-L72 VanDerWaalsContact O-N 3.13Å; T70-N73 PolarHBondContact O-N 2.75Å; T70-N73 PolarHBondContact OG1-ND2 2.92Å; T70-N73 VanDerWaalsContact OG1-ND2 3.13Å; T70-Y74 WeakPolarHBondContact O-CD2 2.99Å; T70-Y74 PolarHBondContact O-N 3.37Å; T70-Y74 VanDerWaalsContact O-N 3.15Å
71P71.7Confident83.4Confident33 Ų3347 Ų4721%0.21423%0.226CC..Hα-helixtrans-48.1-39.8176.5-33.739.1000115.3Y74 F148 A153P71-Y74 PolarHBondContact O-N 3.49Å; P71-F148 HydrophobicContact CB-CD1 3.58Å; P71-F148 HydrophobicContact CB-CE1 3.64Å; P71-F148 HydrophobicContact CG-CD1 3.99Å; P71-F148 HydrophobicContact CG-CE1 4.41Å; P71-A153 HydrophobicContact CB-CB 4.01Å
72L72.9Confident83.6Confident25 Ų2547 Ų4713%0.13123%0.226CC..Hα-helixtrans-61.3-45.5175.8-174.8158.9000111.8T70 Y74 I75 L76 L131 R135T70-L72 PolarHBondContact O-N 2.7Å; T70-L72 VanDerWaalsContact O-N 3.13Å; L72-Y74 VanDerWaalsContact C-N 3.28Å; L72-Y74 PolarHBondContact O-N 3.36Å; L72-I75 PolarHBondContact O-N 3.1Å; L72-I75 VanDerWaalsContact O-N 3.16Å; L72-L76 HydrophobicContact CD2-CD1 3.65Å; L72-L76 HydrophobicContact CD2-CG 3.96Å; L72-L76 PolarHBondContact O-N 2.97Å; L72-L131 HydrophobicContact CG-CD1 4.22Å; L72-R135 VanDerWaalsContact CD1-CZ 3.42Å
73N81.7Confident84.1Confident3 Ų346.7 Ų46.72%0.01622%0.224CC..Hα-helixtrans-74-19.7-175.4-66-20.1000112.5L68 T70 I75 L76 L77 N310L68-N73 VanDerWaalsContact C-ND2 3.34Å; L68-N73 WeakPolarHBondContact CA-ND2 3.37Å; L68-N73 WeakPolarHBondContact O-CB 3.28Å; L68-N73 VanDerWaalsContact O-CG 3.24Å; L68-N73 PolarHBondContact O-ND2 3.5Å; T70-N73 PolarHBondContact O-N 2.75Å; T70-N73 PolarHBondContact OG1-ND2 2.92Å; T70-N73 VanDerWaalsContact OG1-ND2 3.13Å; N73-I75 VanDerWaalsContact C-N 3.3Å; N73-L76 PolarHBondContact O-N 2.98Å; N73-L77 WeakPolarHBondContact O-CB 3.48Å; N73-L77 PolarHBondContact O-N 3.47Å; N73-N310 PolarHBondContact OD1-ND2 2.91Å
74Y83.9Confident84.5Confident52 Ų5244.2 Ų44.220%0.20421%0.208CC..Hα-helixtrans-62.5-37.7168.2-84-74.7000112.1T70 P71 L72 L77 N78 E150 A153T70-Y74 WeakPolarHBondContact O-CD2 2.99Å; T70-Y74 PolarHBondContact O-N 3.37Å; T70-Y74 VanDerWaalsContact O-N 3.15Å; P71-Y74 PolarHBondContact O-N 3.49Å; L72-Y74 VanDerWaalsContact C-N 3.28Å; L72-Y74 PolarHBondContact O-N 3.36Å; Y74-L77 WeakPolarHBondContact O-CB 3.42Å; Y74-L77 PolarHBondContact O-N 3.36Å; Y74-N78 WeakPolarHBondContact O-CB 3.35Å; Y74-N78 PolarHBondContact O-N 3.03Å; Y74-E150 HydrophobicContact CE2-CG 3.82Å; Y74-E150 PolarHBondContact OH-OE1 3.08Å; Y74-A153 HydrophobicContact CD2-CB 4.14Å; Y74-A153 HydrophobicContact CG-CB 4.32Å
75I81.9Confident84.7Confident11 Ų1142.1 Ų42.16%0.05620%0.197CC..Hα-helixtrans-71.2-37.3176.1-59.1-59.2000111.2L72 N73 L77 N78 L79 V130 V157L72-I75 PolarHBondContact O-N 3.1Å; L72-I75 VanDerWaalsContact O-N 3.16Å; N73-I75 VanDerWaalsContact C-N 3.3Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-N78 WeakPolarHBondContact O-CB 3.3Å; I75-N78 PolarHBondContact O-N 3.43Å; I75-L79 PolarHBondContact O-N 2.99Å; I75-V130 HydrophobicContact CD1-CB 4.21Å; I75-V130 HydrophobicContact CD1-CG1 3.62Å; I75-V130 HydrophobicContact CG1-CG1 4.28Å; I75-V157 HydrophobicContact CD1-CG2 4.04Å
76L78.8Confident85.2Confident11 Ų1139.8 Ų39.86%0.05819%0.186CC..Hα-helixtrans-63.9-41.1173.2-59-174.9000112L72 N73 N78 L79 A80 Y306L72-L76 HydrophobicContact CD2-CD1 3.65Å; L72-L76 HydrophobicContact CD2-CG 3.96Å; L72-L76 PolarHBondContact O-N 2.97Å; N73-L76 PolarHBondContact O-N 2.98Å; L76-N78 VanDerWaalsContact C-N 3.33Å; L76-L79 PolarHBondContact O-N 3.3Å; L76-A80 PolarHBondContact O-N 3.2Å; L76-Y306 HydrophobicContact CD2-CD1 3.22Å; L76-Y306 HydrophobicContact CD2-CD2 3.89Å; L76-Y306 HydrophobicContact CD2-CE1 3.58Å; L76-Y306 HydrophobicContact CD2-CE2 4.3Å; L76-Y306 HydrophobicContact CD2-CG 3.37Å
77L86.7Confident85.9Confident39 Ų3932 Ų3220%0.20415%0.153CC..Hα-helixtrans-61.2-44.9173.9-167.681.8000110.8L59 T62 N73 Y74 I75 L79 A80 V81L59-L77 HydrophobicContact CD1-CD1 3.45Å; L59-L77 VanDerWaalsContact CD1-CD1 3.45Å; L59-L77 HydrophobicContact CD1-CG 3.88Å; L59-L77 HydrophobicContact CG-CD1 4.18Å; T62-L77 HydrophobicContact CG2-CD1 3.86Å; N73-L77 WeakPolarHBondContact O-CB 3.48Å; N73-L77 PolarHBondContact O-N 3.47Å; Y74-L77 WeakPolarHBondContact O-CB 3.42Å; Y74-L77 PolarHBondContact O-N 3.36Å; I75-L77 VanDerWaalsContact C-N 3.34Å; L77-L79 VanDerWaalsContact C-N 3.31Å; L77-L79 PolarHBondContact O-N 3.45Å; L77-A80 PolarHBondContact O-N 3.31Å; L77-V81 WeakPolarHBondContact O-CG2 3.04Å; L77-V81 PolarHBondContact O-N 2.89Å
78N91.1Very high86.6Confident9 Ų928 Ų285%0.04814%0.143CC..Hα-helixtrans-58.8-43.8178.2-169.344.4000111.9Y74 I75 L76 V81 A82 I123 S127 V157 T160 W161Y74-N78 WeakPolarHBondContact O-CB 3.35Å; Y74-N78 PolarHBondContact O-N 3.03Å; I75-N78 WeakPolarHBondContact O-CB 3.3Å; I75-N78 PolarHBondContact O-N 3.43Å; L76-N78 VanDerWaalsContact C-N 3.33Å; N78-V81 PolarHBondContact O-N 3.43Å; N78-A82 PolarHBondContact O-N 3.47Å; N78-I123 WeakPolarHBondContact ND2-CG2 3.22Å; N78-S127 PolarHBondContact ND2-OG 2.83Å; N78-V157 HydrophobicContact CB-CG1 4.39Å; N78-V157 HydrophobicContact CB-CG2 4.12Å; N78-T160 PolarHBondContact ND2-OG1 2.93Å; N78-W161 PolarHBondContact OD1-NE1 3.32Å
79L88.2Confident87.3Confident4 Ų428.4 Ų28.42%0.02115%0.147CC..Hα-helixtrans-65.5-42.8177.4-169.564.5000112.1I75 L76 L77 V81 A82 D83 A124 N302 Y306I75-L79 PolarHBondContact O-N 2.99Å; L76-L79 PolarHBondContact O-N 3.3Å; L77-L79 VanDerWaalsContact C-N 3.31Å; L77-L79 PolarHBondContact O-N 3.45Å; L79-V81 VanDerWaalsContact C-N 3.28Å; L79-V81 PolarHBondContact O-N 3.28Å; L79-A82 WeakPolarHBondContact O-CB 3.17Å; L79-A82 PolarHBondContact O-N 3.01Å; L79-A82 VanDerWaalsContact O-N 3.14Å; L79-D83 WeakPolarHBondContact O-CB 3.43Å; L79-D83 PolarHBondContact O-N 3.4Å; L79-A124 VanDerWaalsContact CD1-CA 3.48Å; L79-A124 HydrophobicContact CD1-CB 3.36Å; L79-N302 HydrophobicContact CD2-CB 3.88Å; L79-N302 HydrophobicContact CG-CB 4.46Å; L79-Y306 HydrophobicContact CD2-CD2 3.99Å; L79-Y306 HydrophobicContact CD2-CE2 3.16Å
80A91.8Very high88Confident2 Ų222.7 Ų22.72%0.01713%0.125CC..Hα-helixtrans-61.2-37.3175.500000112.3N55 T58 L76 L77 L84N55-A80 HydrophobicContact CB-CB 4.47Å; N55-A80 WeakPolarHBondContact OD1-CA 3.48Å; T58-A80 HydrophobicContact CG2-CB 3.87Å; L76-A80 PolarHBondContact O-N 3.2Å; L77-A80 PolarHBondContact O-N 3.31Å; A80-L84 WeakPolarHBondContact O-CB 3.21Å; A80-L84 VanDerWaalsContact O-CG 3.25Å; A80-L84 WeakPolarHBondContact O-CG 3.23Å; A80-L84 PolarHBondContact O-N 3.12Å
81V93.1Very high88.9Confident51 Ų5120.2 Ų20.231%0.30911%0.11SC..Hα-helixtrans-65.6-44.5173.3174.10000111.1L59 L77 N78 L79 L84 F85 W161L59-V81 HydrophobicContact CD1-CG2 3.56Å; L77-V81 WeakPolarHBondContact O-CG2 3.04Å; L77-V81 PolarHBondContact O-N 2.89Å; N78-V81 PolarHBondContact O-N 3.43Å; L79-V81 VanDerWaalsContact C-N 3.28Å; L79-V81 PolarHBondContact O-N 3.28Å; V81-L84 PolarHBondContact O-N 2.88Å; V81-F85 WeakPolarHBondContact O-CB 3.46Å; V81-F85 PolarHBondContact O-N 3.39Å; V81-W161 HydrophobicContact CG1-CH2 4.28Å; V81-W161 HydrophobicContact CG1-CZ2 3.89Å
82A93.2Very high90.1Very high0 Ų021.6 Ų21.60%012%0.118CC..Hα-helixtrans-61.7-44.3177.800000112.4N78 L79 F85 M86 I123N78-A82 PolarHBondContact O-N 3.47Å; L79-A82 WeakPolarHBondContact O-CB 3.17Å; L79-A82 PolarHBondContact O-N 3.01Å; L79-A82 VanDerWaalsContact O-N 3.14Å; A82-F85 VanDerWaalsContact O-CB 3.24Å; A82-F85 WeakPolarHBondContact O-CB 3.37Å; A82-F85 PolarHBondContact O-N 3.39Å; A82-F85 VanDerWaalsContact O-N 3.14Å; A82-M86 PolarHBondContact O-N 2.82Å; A82-I123 HydrophobicContact CB-CB 3.74Å; A82-I123 HydrophobicContact CB-CD1 4.09Å; A82-I123 HydrophobicContact CB-CG2 3.59Å
83D94Very high91.3Very high0 Ų021.2 Ų21.20%012%0.116CC..Hα-helixtrans-65.8-39.7178.2-70.6-23.9000110.9N55 L79 F85 M86 V87 A299N55-D83 HydrophobicContact CB-CB 4.48Å; N55-D83 VanDerWaalsContact CG-CB 3.49Å; N55-D83 VanDerWaalsContact OD1-CB 3.31Å; N55-D83 WeakPolarHBondContact OD1-CB 3.27Å; N55-D83 PolarHBondContact OD1-OD2 3.18Å; L79-D83 WeakPolarHBondContact O-CB 3.43Å; L79-D83 PolarHBondContact O-N 3.4Å; D83-F85 VanDerWaalsContact C-N 3.31Å; D83-F85 PolarHBondContact O-N 2.91Å; D83-M86 PolarHBondContact O-N 3.27Å; D83-V87 WeakPolarHBondContact O-CG2 3.05Å; D83-V87 PolarHBondContact O-N 3.32Å; D83-A299 HydrophobicContact CB-CB 4.09Å
84L94.6Very high92Very high25 Ų2521 Ų2113%0.13112%0.115CC..Hα-helixtrans-62.8-37.5171.7-73.8169.9000112.2F52 N55 F56 L59 A80 V81 V87 V88F52-L84 HydrophobicContact CD2-CD2 3.65Å; F52-L84 HydrophobicContact CE2-CD2 3.89Å; F52-L84 HydrophobicContact CG-CD2 4.25Å; N55-L84 HydrophobicContact CB-CD1 4.45Å; N55-L84 HydrophobicContact CB-CD2 3.9Å; N55-L84 HydrophobicContact CB-CG 3.77Å; F56-L84 HydrophobicContact CB-CD2 4.4Å; L59-L84 HydrophobicContact CD2-CD1 4.45Å; A80-L84 WeakPolarHBondContact O-CB 3.21Å; A80-L84 VanDerWaalsContact O-CG 3.25Å; A80-L84 WeakPolarHBondContact O-CG 3.23Å; A80-L84 PolarHBondContact O-N 3.12Å; V81-L84 PolarHBondContact O-N 2.88Å; L84-V87 PolarHBondContact O-N 3.01Å; L84-V88 WeakPolarHBondContact O-CB 3.32Å; L84-V88 WeakPolarHBondContact O-CG2 3.29Å; L84-V88 PolarHBondContact O-N 2.95Å
85F90.9Very high92.7Very high60 Ų6020 Ų2026%0.26311%0.113SC..Hα-helixtrans-60.4-48.2175.1-156.5-105.8000110.4V81 A82 D83 V87 G89 F115 F116 M119V81-F85 WeakPolarHBondContact O-CB 3.46Å; V81-F85 PolarHBondContact O-N 3.39Å; A82-F85 VanDerWaalsContact O-CB 3.24Å; A82-F85 WeakPolarHBondContact O-CB 3.37Å; A82-F85 PolarHBondContact O-N 3.39Å; A82-F85 VanDerWaalsContact O-N 3.14Å; D83-F85 VanDerWaalsContact C-N 3.31Å; D83-F85 PolarHBondContact O-N 2.91Å; F85-V87 PolarHBondContact O-N 2.67Å; F85-G89 PolarHBondContact O-N 3.48Å; F85-F115 HydrophobicContact CE1-CD1 4.42Å; F85-F115 AromaticContact CE1-CE1 3.86Å; F85-F115 HydrophobicContact CE1-CE1 3.86Å; F85-F115 HydrophobicContact CZ-CE1 4.08Å; F85-F116 HydrophobicContact CB-CD1 4.49Å; F85-F116 HydrophobicContact CD1-CB 4.47Å; F85-F116 AromaticContact CD1-CD1 3.08Å; F85-F116 HydrophobicContact CD1-CD1 3.08Å; F85-F116 AromaticContact CD1-CE1 3.5Å; F85-F116 HydrophobicContact CD1-CE1 3.5Å; F85-F116 HydrophobicContact CD1-CG 4.05Å; F85-F116 HydrophobicContact CD2-CD1 4.09Å; F85-F116 AromaticContact CD2-CE1 3.69Å; F85-F116 HydrophobicContact CD2-CE1 3.69Å; F85-F116 AromaticContact CE1-CD1 3.04Å; F85-F116 HydrophobicContact CE1-CD1 3.04Å; F85-F116 AromaticContact CE1-CE1 3.16Å; F85-F116 HydrophobicContact CE1-CE1 3.16Å; F85-F116 AromaticContact CE1-CG 3.84Å; F85-F116 HydrophobicContact CE1-CG 3.84Å; F85-F116 AromaticContact CE1-CZ 3.99Å; F85-F116 HydrophobicContact CE1-CZ 3.99Å; F85-F116 HydrophobicContact CE2-CD1 4.07Å; F85-F116 AromaticContact CE2-CE1 3.38Å; F85-F116 HydrophobicContact CE2-CE1 3.38Å; F85-F116 HydrophobicContact CE2-CZ 4.15Å; F85-F116 AromaticContact CG-CD1 3.62Å; F85-F116 HydrophobicContact CG-CD1 3.62Å; F85-F116 AromaticContact CG-CE1 3.74Å; F85-F116 HydrophobicContact CG-CE1 3.74Å; F85-F116 AromaticContact CZ-CD1 3.57Å; F85-F116 HydrophobicContact CZ-CD1 3.57Å; F85-F116 AromaticContact CZ-CE1 3.08Å; F85-F116 HydrophobicContact CZ-CE1 3.08Å; F85-F116 AromaticContact CZ-CZ 3.69Å; F85-F116 HydrophobicContact CZ-CZ 3.69Å; F85-F116 VanDerWaalsContact O-CD1 3.22Å; F85-F116 WeakPolarHBondContact O-CD1 3.44Å; F85-M119 HydrophobicContact CD1-CB 4.41Å; F85-M119 HydrophobicContact CD1-CG 4.19Å; F85-M119 HydrophobicContact CE1-CB 4.28Å; F85-M119 HydrophobicContact CE1-CG 3.99Å
86M94.3Very high93.5Very high3 Ų320.9 Ų20.92%0.01512%0.122CC..Iπ-helixtrans-60-44.9175-67.4179.471.500112.4A82 D83 G90 F91 F116A82-M86 PolarHBondContact O-N 2.82Å; D83-M86 PolarHBondContact O-N 3.27Å; M86-G90 CarbonylContact O-C 3.4Å; M86-G90 VanDerWaalsContact O-CA 3.25Å; M86-G90 WeakPolarHBondContact O-CA 3.22Å; M86-G90 PolarHBondContact O-N 3.43Å; M86-F91 HydrophobicContact CB-CE1 4.13Å; M86-F91 HydrophobicContact CB-CZ 4.3Å; M86-F91 HydrophobicContact CE-CE1 4.04Å; M86-F91 HydrophobicContact CE-CZ 4.27Å; M86-F91 PolarHBondContact O-N 3.39Å; M86-F116 WeakPolarHBondContact CG-O 3.23Å
87V96.3Very high94.4Very high3 Ų320.3 Ų20.32%0.01812%0.119CC..Iπ-helixtrans-65.4-47.1-177.1174.10000111I48 A51 F52 D83 L84 F85 F91 T92 A299I48-V87 HydrophobicContact CB-CG1 4.47Å; I48-V87 HydrophobicContact CG1-CG1 4.27Å; I48-V87 HydrophobicContact CG2-CG1 4.26Å; A51-V87 HydrophobicContact CB-CG2 3.84Å; F52-V87 HydrophobicContact CB-CG1 3.99Å; F52-V87 HydrophobicContact CD2-CG1 4.28Å; D83-V87 WeakPolarHBondContact O-CG2 3.05Å; D83-V87 PolarHBondContact O-N 3.32Å; L84-V87 PolarHBondContact O-N 3.01Å; F85-V87 PolarHBondContact O-N 2.67Å; V87-F91 HydrophobicContact CB-CD2 4.2Å; V87-F91 HydrophobicContact CG1-CD2 4.46Å; V87-F91 HydrophobicContact CG2-CD2 3.7Å; V87-F91 HydrophobicContact CG2-CE2 3.75Å; V87-F91 WeakPolarHBondContact O-CB 3.39Å; V87-T92 PolarHBondContact O-N 3.34Å; V87-A299 HydrophobicContact CG2-CB 4.28Å
88V94.8Very high94.9Very high85 Ų8518.5 Ų18.552%0.51511%0.11SC..Iπ-helixtrans-74.6-43.5-175.8175.30000111.9F52 L84 T92F52-V88 HydrophobicContact CD2-CG2 4.31Å; F52-V88 HydrophobicContact CE2-CG2 4.08Å; L84-V88 WeakPolarHBondContact O-CB 3.32Å; L84-V88 WeakPolarHBondContact O-CG2 3.29Å; L84-V88 PolarHBondContact O-N 2.95Å; V88-T92 WeakPolarHBondContact O-CG2 3.37Å; V88-T92 PolarHBondContact O-OG1 2.89Å
89G92.5Very high95.3Very high8 Ų823 Ų238%0.08213%0.133CC..Iπ-helixtrans-95.1-34-17400000115.2F85 V93F85-G89 PolarHBondContact O-N 3.48Å; G89-V93 WeakPolarHBondContact O-CG2 3.49Å
90G95.8Very high95.7Very high0 Ų027.3 Ų27.30%015%0.153CC..Iπ-helixtrans-95.9-53.6-178.100000113.2M86 T92 V93 T94M86-G90 CarbonylContact O-C 3.4Å; M86-G90 VanDerWaalsContact O-CA 3.25Å; M86-G90 WeakPolarHBondContact O-CA 3.22Å; M86-G90 PolarHBondContact O-N 3.43Å; G90-T92 VanDerWaalsContact C-N 3.34Å; G90-T92 PolarHBondContact O-N 2.89Å; G90-V93 PolarHBondContact O-N 3.3Å; G90-T94 PolarHBondContact O-N 3.41Å; G90-T94 PolarHBondContact O-OG1 2.62Å
91F97.7Very high95.9Very high0 Ų027.2 Ų27.20%015%0.152CC..Iπ-helixtrans-69-34.2-170.7-65.91.8000112.5M44 L47 I48 M86 V87 V93 T94 L95 K296 A299M44-F91 HydrophobicContact CE-CB 3.42Å; M44-F91 VanDerWaalsContact CE-CB 3.42Å; M44-F91 HydrophobicContact CE-CD1 3.64Å; M44-F91 HydrophobicContact CE-CD2 4Å; M44-F91 HydrophobicContact CE-CE1 4.43Å; M44-F91 HydrophobicContact CE-CG 3.41Å; M44-F91 VanDerWaalsContact CE-CG 3.41Å; L47-F91 HydrophobicContact CB-CD2 4.19Å; L47-F91 HydrophobicContact CB-CE2 4.17Å; L47-F91 HydrophobicContact CD1-CE2 4.21Å; I48-F91 HydrophobicContact CD1-CB 4.01Å; I48-F91 HydrophobicContact CG1-CB 3.72Å; I48-F91 HydrophobicContact CG1-CD2 4.33Å; M86-F91 HydrophobicContact CB-CE1 4.13Å; M86-F91 HydrophobicContact CB-CZ 4.3Å; M86-F91 HydrophobicContact CE-CE1 4.04Å; M86-F91 HydrophobicContact CE-CZ 4.27Å; M86-F91 PolarHBondContact O-N 3.39Å; V87-F91 HydrophobicContact CB-CD2 4.2Å; V87-F91 HydrophobicContact CG1-CD2 4.46Å; V87-F91 HydrophobicContact CG2-CD2 3.7Å; V87-F91 HydrophobicContact CG2-CE2 3.75Å; V87-F91 WeakPolarHBondContact O-CB 3.39Å; F91-V93 VanDerWaalsContact C-N 3.34Å; F91-T94 PolarHBondContact O-N 3.42Å; F91-L95 VanDerWaalsContact O-CB 3.29Å; F91-L95 WeakPolarHBondContact O-CB 3.29Å; F91-L95 PolarHBondContact O-N 3.1Å; F91-K296 HydrophobicContact CD1-CB 4.5Å; F91-K296 HydrophobicContact CD1-CD 4.2Å; F91-K296 HydrophobicContact CD1-CG 4.43Å; F91-K296 HydrophobicContact CE1-CB 3.63Å; F91-K296 HydrophobicContact CE1-CD 4Å; F91-K296 HydrophobicContact CE1-CG 3.74Å; F91-K296 HydrophobicContact CZ-CB 3.73Å; F91-K296 HydrophobicContact CZ-CG 4.34Å; F91-K296 WeakPolarHBondContact CZ-O 3.39Å; F91-A299 HydrophobicContact CE2-CB 3.77Å; F91-A299 HydrophobicContact CZ-CB 3.76Å
92T97.4Very high96.2Very high63 Ų6327 Ų2739%0.38715%0.146SC..Hα-helixtrans-60.2-43173.8540000111.7V87 V88 G90 L95 A96V87-T92 PolarHBondContact O-N 3.34Å; V88-T92 WeakPolarHBondContact O-CG2 3.37Å; V88-T92 PolarHBondContact O-OG1 2.89Å; G90-T92 VanDerWaalsContact C-N 3.34Å; G90-T92 PolarHBondContact O-N 2.89Å; T92-L95 PolarHBondContact O-N 3.2Å; T92-A96 WeakPolarHBondContact O-CB 3.37Å; T92-A96 PolarHBondContact O-N 2.83Å
93V97.9Very high96.4Very high16 Ų1627 Ų2710%0.09715%0.146CC..Hα-helixtrans-68.6-44.9176.4177.90000111G89 G90 F91 L95 A96 T97 F103 L105 I112 E113G89-V93 WeakPolarHBondContact O-CG2 3.49Å; G90-V93 PolarHBondContact O-N 3.3Å; F91-V93 VanDerWaalsContact C-N 3.34Å; V93-L95 VanDerWaalsContact C-N 3.29Å; V93-L95 PolarHBondContact O-N 3.06Å; V93-A96 PolarHBondContact O-N 3Å; V93-T97 HydrophobicContact CG1-CG2 4.37Å; V93-T97 VanDerWaalsContact O-CG2 3.31Å; V93-T97 WeakPolarHBondContact O-CG2 3.3Å; V93-T97 PolarHBondContact O-N 2.93Å; V93-T97 PolarHBondContact O-OG1 3.05Å; V93-F103 HydrophobicContact CG1-CE1 4.33Å; V93-L105 HydrophobicContact CG1-CD1 3.91Å; V93-I112 HydrophobicContact CG2-CG2 4.11Å; V93-E113 HydrophobicContact CB-CB 4.05Å; V93-E113 HydrophobicContact CB-CG 4.08Å; V93-E113 HydrophobicContact CG1-CB 3.74Å; V93-E113 HydrophobicContact CG1-CG 4.05Å
94T98.1Very high96.5Very high0 Ų031.2 Ų31.20%017%0.165CC..Hα-helixtrans-59-41.7175.6-54.50000111.1M44 G90 F91 T97 A98 E113 C185 F293 K296M44-T94 HydrophobicContact CE-CG2 3.96Å; M44-T94 HydrophobicContact CG-CG2 3.83Å; M44-T94 HydrophobicContact SD-CG2 3.81Å; G90-T94 PolarHBondContact O-N 3.41Å; G90-T94 PolarHBondContact O-OG1 2.62Å; F91-T94 PolarHBondContact O-N 3.42Å; T94-T97 PolarHBondContact O-OG1 3.02Å; T94-T97 VanDerWaalsContact O-OG1 3.05Å; T94-A98 WeakPolarHBondContact O-CB 3.26Å; T94-A98 PolarHBondContact O-N 2.73Å; T94-E113 WeakPolarHBondContact OG1-CG 3.4Å; T94-E113 PolarHBondContact OG1-OE1 3.12Å; T94-C185 WeakPolarHBondContact CG2-O 3.29Å; T94-F293 HydrophobicContact CG2-CE1 3.6Å; T94-F293 HydrophobicContact CG2-CZ 3.67Å; T94-K296 HydrophobicContact CG2-CD 4.46Å
95L98.4Very high96.6Very high31 Ų3133.6 Ų33.616%0.16218%0.177CC..Hα-helixtrans-62.8-50175.9172.158.3000111.1A41 M44 I45 I48 F91 T92 V93 T97 A98 L99A41-L95 HydrophobicContact CB-CD1 3.99Å; A41-L95 WeakPolarHBondContact O-CD1 3.31Å; M44-L95 HydrophobicContact CB-CB 4.05Å; M44-L95 HydrophobicContact CB-CD1 4.24Å; I45-L95 HydrophobicContact CD1-CD1 4.13Å; I45-L95 HydrophobicContact CG1-CD1 3.64Å; I45-L95 HydrophobicContact CG1-CD2 3.85Å; I45-L95 HydrophobicContact CG1-CG 4.43Å; I48-L95 HydrophobicContact CD1-CB 4.14Å; I48-L95 HydrophobicContact CD1-CD2 3.8Å; F91-L95 VanDerWaalsContact O-CB 3.29Å; F91-L95 WeakPolarHBondContact O-CB 3.29Å; F91-L95 PolarHBondContact O-N 3.1Å; T92-L95 PolarHBondContact O-N 3.2Å; V93-L95 VanDerWaalsContact C-N 3.29Å; V93-L95 PolarHBondContact O-N 3.06Å; L95-T97 VanDerWaalsContact C-N 3.27Å; L95-T97 PolarHBondContact O-N 3.38Å; L95-A98 PolarHBondContact O-N 3Å; L95-L99 HydrophobicContact CD1-CD1 3.97Å; L95-L99 HydrophobicContact CD1-CG 4.02Å; L95-L99 HydrophobicContact CG-CD1 4.13Å; L95-L99 WeakPolarHBondContact O-CG 3.33Å; L95-L99 PolarHBondContact O-N 2.79Å
96A98Very high96.9Very high28 Ų2831.7 Ų31.723%0.23117%0.174CC..Hα-helixtrans-58.6-41.6-179.100000111.8T92 V93 Q100 F104T92-A96 WeakPolarHBondContact O-CB 3.37Å; T92-A96 PolarHBondContact O-N 2.83Å; V93-A96 PolarHBondContact O-N 3Å; A96-Q100 WeakPolarHBondContact O-CG 3.33Å; A96-Q100 PolarHBondContact O-N 3.48Å; A96-F104 HydrophobicContact CB-CE1 4.03Å; A96-F104 HydrophobicContact CB-CZ 4.32Å
97T98Very high97Very high0 Ų034 Ų340%019%0.188CC..Hα-helixtrans-76.3-34.7-179.956.90000112.7V93 T94 L95 L99 Q100 G101 Y102 F103 F104 C185V93-T97 HydrophobicContact CG1-CG2 4.37Å; V93-T97 VanDerWaalsContact O-CG2 3.31Å; V93-T97 WeakPolarHBondContact O-CG2 3.3Å; V93-T97 PolarHBondContact O-N 2.93Å; V93-T97 PolarHBondContact O-OG1 3.05Å; T94-T97 PolarHBondContact O-OG1 3.02Å; T94-T97 VanDerWaalsContact O-OG1 3.05Å; L95-T97 VanDerWaalsContact C-N 3.27Å; L95-T97 PolarHBondContact O-N 3.38Å; T97-L99 VanDerWaalsContact C-N 3.35Å; T97-Q100 PolarHBondContact O-N 2.7Å; T97-G101 PolarHBondContact O-N 2.96Å; T97-Y102 WeakPolarHBondContact CA-O 3.26Å; T97-Y102 WeakPolarHBondContact CB-O 3.35Å; T97-Y102 PolarHBondContact O-N 2.82Å; T97-F103 HydrophobicContact CG2-CB 4.47Å; T97-F103 HydrophobicContact CG2-CD1 3.59Å; T97-F103 HydrophobicContact CG2-CE1 3.84Å; T97-F103 HydrophobicContact CG2-CG 3.98Å; T97-F103 HydrophobicContact CG2-CZ 4.45Å; T97-F104 HydrophobicContact CG2-CD1 4.5Å; T97-C185 PolarHBondContact OG1-O 3.3Å; T97-C185 VanDerWaalsContact OG1-O 3.06Å
98A97.7Very high97.1Very high1 Ų138.6 Ų38.61%0.00822%0.217CC..Hα-helixtrans-64.7-36.317200000112.6L40 A41 T94 L95 Q100 C185L40-A98 HydrophobicContact CB-CB 4.21Å; A41-A98 HydrophobicContact CB-CB 4.04Å; T94-A98 WeakPolarHBondContact O-CB 3.26Å; T94-A98 PolarHBondContact O-N 2.73Å; L95-A98 PolarHBondContact O-N 3Å; A98-Q100 VanDerWaalsContact C-N 3.29Å; A98-Q100 PolarHBondContact O-N 2.84Å; A98-C185 HydrophobicContact CB-CB 4.3Å
99L97.8Very high97.2Very high103 Ų10334.8 Ų34.854%0.53919%0.194SC..Hα-helixtrans-65.4-31.6174.7-74170.1000112.8A41 L95 T97A41-L99 HydrophobicContact CB-CD2 3.68Å; A41-L99 HydrophobicContact CB-CG 3.96Å; L95-L99 HydrophobicContact CD1-CD1 3.97Å; L95-L99 HydrophobicContact CD1-CG 4.02Å; L95-L99 HydrophobicContact CG-CD1 4.13Å; L95-L99 WeakPolarHBondContact O-CG 3.33Å; L95-L99 PolarHBondContact O-N 2.79Å; T97-L99 VanDerWaalsContact C-N 3.35Å
100Q97.4Very high97.5Very high94 Ų9434.4 Ų34.444%0.43919%0.191SC..Hα-helixtrans-92.3-21.5179.8-63.7-59.5-21.700113.5Y29 A96 T97 A98 Y102 F104Y29-Q100 PolarHBondContact OH-O 3.27Å; Y29-Q100 VanDerWaalsContact OH-O 3.09Å; A96-Q100 WeakPolarHBondContact O-CG 3.33Å; A96-Q100 PolarHBondContact O-N 3.48Å; T97-Q100 PolarHBondContact O-N 2.7Å; A98-Q100 VanDerWaalsContact C-N 3.29Å; A98-Q100 PolarHBondContact O-N 2.84Å; Q100-Y102 HydrophobicContact CB-CD1 4.01Å; Q100-Y102 HydrophobicContact CB-CE1 3.93Å; Q100-Y102 WeakPolarHBondContact O-CD1 3.5Å; Q100-F104 HydrophobicContact CB-CD1 4.07Å; Q100-F104 HydrophobicContact CG-CD1 3.69Å; Q100-F104 HydrophobicContact CG-CE1 3.86Å; Q100-F104 HydrophobicContact CG-CG 4.45Å
101G97Very high97.6Very high0 Ų036.5 Ų36.50%020%0.202CC..THydrogen-bonded Turntrans80.512.3-176.300000114.7Q28 T97Q28-G101 WeakPolarHBondContact CB-O 3.43Å; Q28-G101 PolarHBondContact N-O 3.38Å; T97-G101 PolarHBondContact O-N 2.96Å
102Y97.6Very high97.6Very high47 Ų4739.8 Ų39.818%0.18422%0.219CC..SBendtrans-164.9168.3176.172.2-69.5000111.9P23 H26 P27 T97 Q100 F104P23-Y102 WeakPolarHBondContact O-CB 2.98Å; H26-Y102 VanDerWaalsContact C-CG 3.45Å; H26-Y102 WeakPolarHBondContact O-CB 3.42Å; P27-Y102 HydrophobicContact CB-CD1 4.17Å; P27-Y102 HydrophobicContact CG-CD1 3.78Å; P27-Y102 HydrophobicContact CG-CE1 3.89Å; T97-Y102 WeakPolarHBondContact CA-O 3.26Å; T97-Y102 WeakPolarHBondContact CB-O 3.35Å; T97-Y102 PolarHBondContact O-N 2.82Å; Q100-Y102 HydrophobicContact CB-CD1 4.01Å; Q100-Y102 HydrophobicContact CB-CE1 3.93Å; Q100-Y102 WeakPolarHBondContact O-CD1 3.5Å; Y102-F104 VanDerWaalsContact C-N 3.33Å; Y102-F104 HydrophobicContact CD2-CB 4.14Å; Y102-F104 HydrophobicContact CE1-CB 4.2Å; Y102-F104 VanDerWaalsContact CE2-CA 3.5Å; Y102-F104 HydrophobicContact CE2-CB 3.46Å; Y102-F104 VanDerWaalsContact CE2-CB 3.46Å; Y102-F104 VanDerWaalsContact CZ-CB 3.48Å; Y102-F104 PolarHBondContact O-N 3.3Å; Y102-F104 VanDerWaalsContact O-N 3.08Å
103F97.3Very high97.7Very high0 Ų036.8 Ų36.80%020%0.2CC..  trans-8267.8177.4-88.7-88.3000112.7P23 F24 V93 T97 L105 G106 C110 E113 P180 Q184 C185 S186 C187P23-F103 WeakPolarHBondContact O-CA 3.36Å; P23-F103 WeakPolarHBondContact O-CB 3.39Å; P23-F103 PolarHBondContact O-N 2.88Å; F24-F103 WeakPolarHBondContact CA-O 3.25Å; F24-F103 HydrophobicContact CD1-CB 3.72Å; F24-F103 HydrophobicContact CE1-CB 4Å; V93-F103 HydrophobicContact CG1-CE1 4.33Å; T97-F103 HydrophobicContact CG2-CB 4.47Å; T97-F103 HydrophobicContact CG2-CD1 3.59Å; T97-F103 HydrophobicContact CG2-CE1 3.84Å; T97-F103 HydrophobicContact CG2-CG 3.98Å; T97-F103 HydrophobicContact CG2-CZ 4.45Å; F103-L105 PolarHBondContact O-N 3.47Å; F103-L105 VanDerWaalsContact O-N 3.07Å; F103-G106 PolarHBondContact O-N 3.17Å; F103-C110 HydrophobicContact CD1-CB 4.14Å; F103-C110 HydrophobicContact CE1-CB 4.28Å; F103-E113 HydrophobicContact CE1-CB 4.4Å; F103-P180 HydrophobicContact CD2-CB 3.88Å; F103-P180 HydrophobicContact CD2-CG 3.92Å; F103-P180 HydrophobicContact CE2-CB 4Å; F103-P180 HydrophobicContact CE2-CG 4.34Å; F103-P180 HydrophobicContact CG-CG 4.46Å; F103-Q184 WeakPolarHBondContact CD2-O 3.4Å; F103-Q184 WeakPolarHBondContact CE2-O 3.23Å; F103-C185 VanDerWaalsContact CE2-CA 3.44Å; F103-C185 VanDerWaalsContact CZ-C 3.44Å; F103-S186 WeakPolarHBondContact CE2-O 3.49Å; F103-C187 VanDerWaalsContact CE1-SG 3.54Å; F103-C187 HydrophobicContact CZ-CB 4.22Å; F103-C187 WeakPolarHBondContact CZ-SG 3.33Å
104F96.3Very high97.7Very high89 Ų8936 Ų3639%0.3920%0.196SC..THydrogen-bonded Turntrans-60.8-18.4177.878.7-84.9000114.4A96 T97 Q100 Y102 G106A96-F104 HydrophobicContact CB-CE1 4.03Å; A96-F104 HydrophobicContact CB-CZ 4.32Å; T97-F104 HydrophobicContact CG2-CD1 4.5Å; Q100-F104 HydrophobicContact CB-CD1 4.07Å; Q100-F104 HydrophobicContact CG-CD1 3.69Å; Q100-F104 HydrophobicContact CG-CE1 3.86Å; Q100-F104 HydrophobicContact CG-CG 4.45Å; Y102-F104 VanDerWaalsContact C-N 3.33Å; Y102-F104 HydrophobicContact CD2-CB 4.14Å; Y102-F104 HydrophobicContact CE1-CB 4.2Å; Y102-F104 VanDerWaalsContact CE2-CA 3.5Å; Y102-F104 HydrophobicContact CE2-CB 3.46Å; Y102-F104 VanDerWaalsContact CE2-CB 3.46Å; Y102-F104 VanDerWaalsContact CZ-CB 3.48Å; Y102-F104 PolarHBondContact O-N 3.3Å; Y102-F104 VanDerWaalsContact O-N 3.08Å; F104-G106 PolarHBondContact O-N 3.38Å
105L96.6Very high97.7Very high75 Ų7537.7 Ų37.739%0.39320%0.203SC..THydrogen-bonded Turntrans-77.73.6174.1-64.1169.8000113V93 F103 G109V93-L105 HydrophobicContact CG1-CD1 3.91Å; F103-L105 PolarHBondContact O-N 3.47Å; F103-L105 VanDerWaalsContact O-N 3.07Å; L105-G109 PolarHBondContact O-N 3.05Å; L105-G109 VanDerWaalsContact O-N 3.11Å
106G97.4Very high97.7Very high19 Ų1938.5 Ų38.520%0.19621%0.205CC..Hα-helixtrans65.2-163.6177.800000113.7F24 F103 F104 T108 G109 C110F24-G106 VanDerWaalsContact CD1-C 3.41Å; F103-G106 PolarHBondContact O-N 3.17Å; F104-G106 PolarHBondContact O-N 3.38Å; G106-T108 VanDerWaalsContact C-N 3.26Å; G106-T108 PolarHBondContact O-N 3.3Å; G106-G109 PolarHBondContact O-N 3.17Å; G106-C110 PolarHBondContact O-N 2.85Å
107V97.6Very high97.6Very high51 Ų5137.8 Ų37.831%0.30920%0.199SC..Hα-helixtrans-60.1-37.8179.3-179.40000111.2N8 F24 G109 C110 N111N8-V107 HydrophobicContact CB-CG2 4.1Å; F24-V107 HydrophobicContact CD2-CG2 4.27Å; F24-V107 HydrophobicContact CE1-CG2 4.35Å; F24-V107 HydrophobicContact CE2-CG2 3.97Å; F24-V107 HydrophobicContact CZ-CG2 4Å; V107-G109 PolarHBondContact O-N 3.04Å; V107-C110 WeakPolarHBondContact O-CB 3.22Å; V107-C110 PolarHBondContact O-N 3.18Å; V107-N111 PolarHBondContact O-N 3.27Å
108T97.5Very high97.5Very high100 Ų10038.7 Ų38.761%0.61321%0.205SC*.Hα-helixtrans-61.5-45.2177.9-53.50000112G106 C110 N111 I112G106-T108 VanDerWaalsContact C-N 3.26Å; G106-T108 PolarHBondContact O-N 3.3Å; T108-C110 VanDerWaalsContact C-N 3.3Å; T108-C110 PolarHBondContact O-N 2.86Å; T108-N111 PolarHBondContact O-N 2.89Å; T108-I112 HydrophobicContact CG2-CD1 4.24Å; T108-I112 WeakPolarHBondContact O-CG1 3.29Å; T108-I112 PolarHBondContact O-N 2.9Å
109G97.8Very high97.4Very high5 Ų538.9 Ų38.95%0.05221%0.206CC..Hα-helixtrans-62-39175.300000112.6L105 G106 V107 I112 E113L105-G109 PolarHBondContact O-N 3.05Å; L105-G109 VanDerWaalsContact O-N 3.11Å; G106-G109 PolarHBondContact O-N 3.17Å; V107-G109 PolarHBondContact O-N 3.04Å; G109-I112 PolarHBondContact O-N 3.28Å; G109-E113 WeakPolarHBondContact O-CB 3.4Å; G109-E113 PolarHBondContact O-N 3.39Å
110C98.4Very high97.2Very high0 Ų034 Ų340%018%0.18CC..Hα-helixtrans-64.3-41.9175.3-176.20000112.8F24 F103 G106 V107 T108 E113 G114 C187F24-C110 HydrophobicContact CE1-CB 3.9Å; F24-C110 HydrophobicContact CZ-CB 4.39Å; F103-C110 HydrophobicContact CD1-CB 4.14Å; F103-C110 HydrophobicContact CE1-CB 4.28Å; G106-C110 PolarHBondContact O-N 2.85Å; V107-C110 WeakPolarHBondContact O-CB 3.22Å; V107-C110 PolarHBondContact O-N 3.18Å; T108-C110 VanDerWaalsContact C-N 3.3Å; T108-C110 PolarHBondContact O-N 2.86Å; C110-E113 PolarHBondContact O-N 3.46Å; C110-G114 PolarHBondContact O-N 3.33Å; C110-C187 WeakPolarHBondContact CA-SG 3.48Å; C110-C187 HydrophobicContact CB-CB 4.13Å; C110-C187 WeakPolarHBondContact CB-SG 3.45Å; C110-C187 WeakPolarHBondContact O-CB 3.47Å; C110-C187 WeakPolarHBondContact SG-CB 3.42Å; C110-C187 CovalentContact SG-SG 2.02Å; C110-C187 PolarHBondContact SG-SG 2.85Å
111N98.4Very high97Very high44 Ų4429.8 Ų29.824%0.23516%0.162CC..Hα-helixtrans-62.4-42.8174.8-76-14.6000111.8V107 T108 F115 L172V107-N111 PolarHBondContact O-N 3.27Å; T108-N111 PolarHBondContact O-N 2.89Å; N111-F115 WeakPolarHBondContact O-CB 3.07Å; N111-F115 PolarHBondContact O-N 3.14Å; N111-L172 HydrophobicContact CB-CD2 3.65Å
112I98.1Very high96.9Very high70 Ų7030.3 Ų30.336%0.35916%0.164SC..Hα-helixtrans-61.1-53.6174.9-68.8168.1000109.3V93 T108 G109 G114 F115 F116V93-I112 HydrophobicContact CG2-CG2 4.11Å; T108-I112 HydrophobicContact CG2-CD1 4.24Å; T108-I112 WeakPolarHBondContact O-CG1 3.29Å; T108-I112 PolarHBondContact O-N 2.9Å; G109-I112 PolarHBondContact O-N 3.28Å; I112-G114 PolarHBondContact O-N 3.06Å; I112-F115 PolarHBondContact O-N 2.95Å; I112-F116 HydrophobicContact CG2-CD2 3.77Å; I112-F116 HydrophobicContact CG2-CE2 3.92Å; I112-F116 VanDerWaalsContact O-CD2 3.24Å; I112-F116 WeakPolarHBondContact O-CD2 3.45Å; I112-F116 PolarHBondContact O-N 3.46Å
113E98.1Very high96.7Very high0 Ų028.1 Ų28.10%016%0.156CC..Hα-helixtrans-58.1-51.8-177.4-162.2-75.714300111.9V93 T94 F103 G109 C110 F115 F116 A117 C187 K296V93-E113 HydrophobicContact CB-CB 4.05Å; V93-E113 HydrophobicContact CB-CG 4.08Å; V93-E113 HydrophobicContact CG1-CB 3.74Å; V93-E113 HydrophobicContact CG1-CG 4.05Å; T94-E113 WeakPolarHBondContact OG1-CG 3.4Å; T94-E113 PolarHBondContact OG1-OE1 3.12Å; F103-E113 HydrophobicContact CE1-CB 4.4Å; G109-E113 WeakPolarHBondContact O-CB 3.4Å; G109-E113 PolarHBondContact O-N 3.39Å; C110-E113 PolarHBondContact O-N 3.46Å; E113-F115 PolarHBondContact O-N 3.34Å; E113-F116 PolarHBondContact O-N 3.4Å; E113-A117 VanDerWaalsContact O-CB 3.26Å; E113-A117 WeakPolarHBondContact O-CB 3.26Å; E113-A117 PolarHBondContact O-N 3.24Å; E113-C187 WeakPolarHBondContact OE2-CA 3.19Å; E113-C187 WeakPolarHBondContact OE2-CB 3.42Å; E113-C187 PolarHBondContact OE2-N 3.42Å; E113-K296 IonicContact OE1-NZ 2.72Å; E113-K296 PolarHBondContact OE1-NZ 3.31Å
114G97.8Very high96.4Very high0 Ų028.3 Ų28.30%016%0.158CC..Hα-helixtrans-62.8-42.1-179.800000112.9C110 I112 T118 Y178C110-G114 PolarHBondContact O-N 3.33Å; I112-G114 PolarHBondContact O-N 3.06Å; G114-T118 VanDerWaalsContact O-CB 3.23Å; G114-T118 WeakPolarHBondContact O-CB 2.84Å; G114-T118 PolarHBondContact O-N 3.09Å; G114-T118 PolarHBondContact O-OG1 2.87Å; G114-Y178 VanDerWaalsContact C-CZ 3.45Å; G114-Y178 WeakPolarHBondContact O-CE1 3.32Å; G114-Y178 PolarHBondContact O-OH 2.89Å
115F98.4Very high96.2Very high35 Ų3524.1 Ų24.115%0.15414%0.139CC..Hα-helixtrans-61.5-52.5177173.4-99.3000111.6F85 N111 I112 E113 A117 T118 M119 L165 A168 L172 Y178F85-F115 HydrophobicContact CE1-CD1 4.42Å; F85-F115 AromaticContact CE1-CE1 3.86Å; F85-F115 HydrophobicContact CE1-CE1 3.86Å; F85-F115 HydrophobicContact CZ-CE1 4.08Å; N111-F115 WeakPolarHBondContact O-CB 3.07Å; N111-F115 PolarHBondContact O-N 3.14Å; I112-F115 PolarHBondContact O-N 2.95Å; E113-F115 PolarHBondContact O-N 3.34Å; F115-A117 PolarHBondContact O-N 2.97Å; F115-T118 PolarHBondContact O-N 2.84Å; F115-M119 WeakPolarHBondContact O-CB 3.27Å; F115-M119 PolarHBondContact O-N 3.22Å; F115-L165 HydrophobicContact CZ-CD2 4.48Å; F115-A168 HydrophobicContact CD2-CB 3.89Å; F115-A168 WeakPolarHBondContact CD2-O 3.49Å; F115-A168 HydrophobicContact CE2-CB 3.94Å; F115-L172 HydrophobicContact CB-CD1 4.2Å; F115-L172 HydrophobicContact CD2-CD1 3.63Å; F115-L172 HydrophobicContact CE2-CD1 4.3Å; F115-L172 HydrophobicContact CG-CD1 4.06Å; F115-Y178 HydrophobicContact CB-CE2 4.08Å
116F97.7Very high96.2Very high47 Ų4720.8 Ų20.821%0.20612%0.121CC..Hα-helixtrans-65.5-39.5-177.8-83.6-91.7000111.8F85 M86 I112 E113 G120F85-F116 HydrophobicContact CB-CD1 4.49Å; F85-F116 HydrophobicContact CD1-CB 4.47Å; F85-F116 AromaticContact CD1-CD1 3.08Å; F85-F116 HydrophobicContact CD1-CD1 3.08Å; F85-F116 AromaticContact CD1-CE1 3.5Å; F85-F116 HydrophobicContact CD1-CE1 3.5Å; F85-F116 HydrophobicContact CD1-CG 4.05Å; F85-F116 HydrophobicContact CD2-CD1 4.09Å; F85-F116 AromaticContact CD2-CE1 3.69Å; F85-F116 HydrophobicContact CD2-CE1 3.69Å; F85-F116 AromaticContact CE1-CD1 3.04Å; F85-F116 HydrophobicContact CE1-CD1 3.04Å; F85-F116 AromaticContact CE1-CE1 3.16Å; F85-F116 HydrophobicContact CE1-CE1 3.16Å; F85-F116 AromaticContact CE1-CG 3.84Å; F85-F116 HydrophobicContact CE1-CG 3.84Å; F85-F116 AromaticContact CE1-CZ 3.99Å; F85-F116 HydrophobicContact CE1-CZ 3.99Å; F85-F116 HydrophobicContact CE2-CD1 4.07Å; F85-F116 AromaticContact CE2-CE1 3.38Å; F85-F116 HydrophobicContact CE2-CE1 3.38Å; F85-F116 HydrophobicContact CE2-CZ 4.15Å; F85-F116 AromaticContact CG-CD1 3.62Å; F85-F116 HydrophobicContact CG-CD1 3.62Å; F85-F116 AromaticContact CG-CE1 3.74Å; F85-F116 HydrophobicContact CG-CE1 3.74Å; F85-F116 AromaticContact CZ-CD1 3.57Å; F85-F116 HydrophobicContact CZ-CD1 3.57Å; F85-F116 AromaticContact CZ-CE1 3.08Å; F85-F116 HydrophobicContact CZ-CE1 3.08Å; F85-F116 AromaticContact CZ-CZ 3.69Å; F85-F116 HydrophobicContact CZ-CZ 3.69Å; F85-F116 VanDerWaalsContact O-CD1 3.22Å; F85-F116 WeakPolarHBondContact O-CD1 3.44Å; M86-F116 WeakPolarHBondContact CG-O 3.23Å; I112-F116 HydrophobicContact CG2-CD2 3.77Å; I112-F116 HydrophobicContact CG2-CE2 3.92Å; I112-F116 VanDerWaalsContact O-CD2 3.24Å; I112-F116 WeakPolarHBondContact O-CD2 3.45Å; I112-F116 PolarHBondContact O-N 3.46Å; E113-F116 PolarHBondContact O-N 3.4Å; F116-G120 PolarHBondContact O-N 2.93Å; F116-G120 VanDerWaalsContact O-N 3.11Å
117A95.8Very high95.9Very high13 Ų1320 Ų2011%0.10711%0.113CC..Hα-helixtrans-65.5-45.4176.100000112.3E113 F115 G121E113-A117 VanDerWaalsContact O-CB 3.26Å; E113-A117 WeakPolarHBondContact O-CB 3.26Å; E113-A117 PolarHBondContact O-N 3.24Å; F115-A117 PolarHBondContact O-N 2.97Å; A117-G121 PolarHBondContact O-N 3.31Å; A117-G121 VanDerWaalsContact O-N 3.12Å
118T96.6Very high95.5Very high20 Ų2018.1 Ų18.112%0.12310%0.101CC..Hα-helixtrans-64.7-49.4177.8-54.50000110.6G114 F115 G120 G121 E122 A168 Y178G114-T118 VanDerWaalsContact O-CB 3.23Å; G114-T118 WeakPolarHBondContact O-CB 2.84Å; G114-T118 PolarHBondContact O-N 3.09Å; G114-T118 PolarHBondContact O-OG1 2.87Å; F115-T118 PolarHBondContact O-N 2.84Å; T118-G120 PolarHBondContact O-N 3.32Å; T118-G121 PolarHBondContact O-N 3.44Å; T118-E122 HydrophobicContact CG2-CG 4.1Å; T118-E122 WeakPolarHBondContact O-CB 3.27Å; T118-E122 VanDerWaalsContact O-CG 3.25Å; T118-E122 WeakPolarHBondContact O-CG 3.36Å; T118-E122 PolarHBondContact O-N 3.39Å; T118-A168 HydrophobicContact CG2-CB 3.96Å; T118-Y178 VanDerWaalsContact CB-OH 3.26Å; T118-Y178 WeakPolarHBondContact CB-OH 3.4Å; T118-Y178 VanDerWaalsContact OG1-CE1 3.27Å; T118-Y178 WeakPolarHBondContact OG1-CE1 3.29Å; T118-Y178 PolarHBondContact OG1-OH 3.42Å
119M95.9Very high95.3Very high5 Ų513.4 Ų13.43%0.0257%0.072CC..Hα-helixtrans-56.5-48.1-178.7-173.468.8161.100111.4F85 F115 E122 I123 W161 L165 A168F85-M119 HydrophobicContact CD1-CB 4.41Å; F85-M119 HydrophobicContact CD1-CG 4.19Å; F85-M119 HydrophobicContact CE1-CB 4.28Å; F85-M119 HydrophobicContact CE1-CG 3.99Å; F115-M119 WeakPolarHBondContact O-CB 3.27Å; F115-M119 PolarHBondContact O-N 3.22Å; M119-E122 PolarHBondContact O-N 3.13Å; M119-I123 HydrophobicContact CE-CD1 4.2Å; M119-I123 HydrophobicContact CG-CD1 3.96Å; M119-I123 VanDerWaalsContact O-CG1 3.22Å; M119-I123 WeakPolarHBondContact O-CG1 3.42Å; M119-I123 PolarHBondContact O-N 2.88Å; M119-I123 HydrophobicContact SD-CD1 4.36Å; M119-W161 HydrophobicContact CE-CD2 4.47Å; M119-W161 HydrophobicContact CE-CE3 3.47Å; M119-W161 VanDerWaalsContact CE-CE3 3.47Å; M119-W161 HydrophobicContact CE-CZ3 3.72Å; M119-L165 HydrophobicContact CE-CD1 4.48Å; M119-L165 HydrophobicContact CE-CD2 3.53Å; M119-L165 HydrophobicContact CE-CG 3.7Å; M119-L165 HydrophobicContact SD-CD2 3.95Å; M119-L165 HydrophobicContact SD-CG 4.18Å; M119-A168 HydrophobicContact CB-CB 4.06Å; M119-A168 HydrophobicContact SD-CB 4.19Å
120G93.4Very high95Very high0 Ų013.9 Ų13.90%07%0.074CC..Hα-helixtrans-68.1-40.3179.300000113.8F116 T118 E122 I123 A124F116-G120 PolarHBondContact O-N 2.93Å; F116-G120 VanDerWaalsContact O-N 3.11Å; T118-G120 PolarHBondContact O-N 3.32Å; G120-E122 VanDerWaalsContact C-N 3.34Å; G120-E122 PolarHBondContact O-N 3.13Å; G120-I123 PolarHBondContact O-N 3.05Å; G120-A124 WeakPolarHBondContact O-CB 3.22Å; G120-A124 PolarHBondContact O-N 3.01Å
121G92.3Very high94.5Very high5 Ų514 Ų145%0.0528%0.075CC..Hα-helixtrans-61.1-41.4174.900000113A117 T118 A124 L125 W265A117-G121 PolarHBondContact O-N 3.31Å; A117-G121 VanDerWaalsContact O-N 3.12Å; T118-G121 PolarHBondContact O-N 3.44Å; G121-A124 WeakPolarHBondContact O-CB 3.44Å; G121-A124 PolarHBondContact O-N 3.16Å; G121-L125 PolarHBondContact O-N 3.23Å; G121-W265 VanDerWaalsContact CA-CZ2 3.45Å
122E95.5Very high94.1Very high12 Ų1211.9 Ų11.96%0.0566%0.063CC..Hα-helixtrans-70-43.1176.9-70.4-67.3157.900112.4T118 M119 G120 A124 L125 W126 S164 C167 H211T118-E122 HydrophobicContact CG2-CG 4.1Å; T118-E122 WeakPolarHBondContact O-CB 3.27Å; T118-E122 VanDerWaalsContact O-CG 3.25Å; T118-E122 WeakPolarHBondContact O-CG 3.36Å; T118-E122 PolarHBondContact O-N 3.39Å; M119-E122 PolarHBondContact O-N 3.13Å; G120-E122 VanDerWaalsContact C-N 3.34Å; G120-E122 PolarHBondContact O-N 3.13Å; E122-A124 PolarHBondContact O-N 2.96Å; E122-L125 PolarHBondContact O-N 3.27Å; E122-L125 VanDerWaalsContact O-N 3.15Å; E122-W126 VanDerWaalsContact O-CD1 3.22Å; E122-W126 PolarHBondContact O-N 3.27Å; E122-W126 PolarHBondContact OE2-NE1 2.97Å; E122-S164 WeakPolarHBondContact CB-OG 2.84Å; E122-C167 HydrophobicContact CG-CB 3.92Å; E122-C167 PolarHBondContact OE1-SG 3Å; E122-C167 VanDerWaalsContact OE1-SG 3.36Å; E122-H211 WeakPolarHBondContact OE1-CB 3.25Å; E122-H211 IonicContact OE1-CG 3.64Å; E122-H211 IonicContact OE1-ND1 3.8Å; E122-H211 IonicContact OE2-CE1 3.82Å; E122-H211 IonicContact OE2-CG 3.49Å; E122-H211 IonicContact OE2-ND1 3.44Å; E122-H211 PolarHBondContact OE2-ND1 2.88Å
123I94.8Very high93.8Very high0 Ų011.6 Ų11.60%06%0.062CC..Hα-helixtrans-61-39.5176.9-67.7166.3000109.1N78 A82 M119 G120 S127 W161 S164N78-I123 WeakPolarHBondContact ND2-CG2 3.22Å; A82-I123 HydrophobicContact CB-CB 3.74Å; A82-I123 HydrophobicContact CB-CD1 4.09Å; A82-I123 HydrophobicContact CB-CG2 3.59Å; M119-I123 HydrophobicContact CE-CD1 4.2Å; M119-I123 HydrophobicContact CG-CD1 3.96Å; M119-I123 VanDerWaalsContact O-CG1 3.22Å; M119-I123 WeakPolarHBondContact O-CG1 3.42Å; M119-I123 PolarHBondContact O-N 2.88Å; M119-I123 HydrophobicContact SD-CD1 4.36Å; G120-I123 PolarHBondContact O-N 3.05Å; I123-S127 WeakPolarHBondContact O-CB 3.49Å; I123-S127 PolarHBondContact O-N 3.48Å; I123-S127 PolarHBondContact O-OG 3.44Å; I123-W161 HydrophobicContact CD1-CD2 3.93Å; I123-W161 HydrophobicContact CD1-CE3 4.07Å; I123-W161 HydrophobicContact CD1-CH2 4.07Å; I123-W161 HydrophobicContact CD1-CZ2 3.94Å; I123-W161 HydrophobicContact CD1-CZ3 4.13Å; I123-S164 WeakPolarHBondContact CA-OG 3.35Å; I123-S164 WeakPolarHBondContact CG1-OG 3.26Å; I123-S164 PolarHBondContact N-OG 2.9Å
124A90.6Very high93.3Very high5 Ų512.4 Ų12.44%0.0417%0.065CC..Hα-helixtrans-61.9-47.2175.700000112.3L79 G120 G121 E122 S127 L128L79-A124 VanDerWaalsContact CD1-CA 3.48Å; L79-A124 HydrophobicContact CD1-CB 3.36Å; G120-A124 WeakPolarHBondContact O-CB 3.22Å; G120-A124 PolarHBondContact O-N 3.01Å; G121-A124 WeakPolarHBondContact O-CB 3.44Å; G121-A124 PolarHBondContact O-N 3.16Å; E122-A124 PolarHBondContact O-N 2.96Å; A124-S127 WeakPolarHBondContact O-CB 3.42Å; A124-S127 PolarHBondContact O-N 3.44Å; A124-L128 WeakPolarHBondContact O-CG 3.49Å; A124-L128 PolarHBondContact O-N 3.43Å; A124-L128 VanDerWaalsContact O-N 3.14Å
125L92.4Very high92.8Very high0 Ų015.3 Ų15.30%08%0.076CC..Hα-helixtrans-60-52.5177.6174.362.5000112.1G121 E122 S127 L128 V129 H211 P215 I219 Y261G121-L125 PolarHBondContact O-N 3.23Å; E122-L125 PolarHBondContact O-N 3.27Å; E122-L125 VanDerWaalsContact O-N 3.15Å; L125-S127 PolarHBondContact O-N 2.96Å; L125-L128 WeakPolarHBondContact O-CB 3.37Å; L125-L128 PolarHBondContact O-N 3.16Å; L125-V129 PolarHBondContact O-N 3.17Å; L125-V129 VanDerWaalsContact O-N 3.12Å; L125-H211 WeakPolarHBondContact CD2-O 3.38Å; L125-P215 HydrophobicContact CD1-CB 3.67Å; L125-P215 HydrophobicContact CD1-CG 4.46Å; L125-P215 HydrophobicContact CD2-CB 4.01Å; L125-P215 HydrophobicContact CD2-CG 3.89Å; L125-P215 HydrophobicContact CG-CB 3.96Å; L125-P215 HydrophobicContact CG-CG 4.26Å; L125-I219 HydrophobicContact CD1-CD1 4.5Å; L125-Y261 HydrophobicContact CB-CE2 3.88Å; L125-Y261 WeakPolarHBondContact CB-OH 3.47Å; L125-Y261 HydrophobicContact CD1-CD1 4.39Å; L125-Y261 HydrophobicContact CD1-CE1 3.58Å; L125-Y261 HydrophobicContact CD1-CE2 3.89Å; L125-Y261 VanDerWaalsContact CD1-OH 3.26Å; L125-Y261 WeakPolarHBondContact CD1-OH 3.29Å; L125-Y261 HydrophobicContact CG-CE2 4.44Å
126W95.2Very high92.4Very high6 Ų615.9 Ų15.92%0.0238%0.078CC..Hα-helixtrans-68.2-27.5-178.1-72.3105.7000112.2E122 L128 V129 V130 F159 T160 M163 L210 H211 P215E122-W126 VanDerWaalsContact O-CD1 3.22Å; E122-W126 PolarHBondContact O-N 3.27Å; E122-W126 PolarHBondContact OE2-NE1 2.97Å; W126-L128 VanDerWaalsContact C-N 3.33Å; W126-V129 HydrophobicContact CE3-CB 4.08Å; W126-V129 HydrophobicContact CE3-CG1 4.19Å; W126-V129 HydrophobicContact CE3-CG2 4Å; W126-V129 HydrophobicContact CZ3-CG1 4.27Å; W126-V129 HydrophobicContact CZ3-CG2 4.32Å; W126-V129 PolarHBondContact O-N 2.93Å; W126-V130 WeakPolarHBondContact O-CG2 3.5Å; W126-V130 PolarHBondContact O-N 3.38Å; W126-F159 HydrophobicContact CD2-CE1 4.37Å; W126-F159 AromaticContact CE3-CE1 3.56Å; W126-F159 HydrophobicContact CE3-CE1 3.56Å; W126-F159 AromaticContact CE3-CZ 3.93Å; W126-F159 HydrophobicContact CE3-CZ 3.93Å; W126-F159 AromaticContact CZ3-CE1 3.94Å; W126-F159 HydrophobicContact CZ3-CE1 3.94Å; W126-F159 AromaticContact CZ3-CZ 3.87Å; W126-F159 HydrophobicContact CZ3-CZ 3.87Å; W126-T160 VanDerWaalsContact C-CG2 3.48Å; W126-T160 HydrophobicContact CB-CG2 3.82Å; W126-M163 HydrophobicContact CD2-CB 3.72Å; W126-M163 HydrophobicContact CD2-CG 3.95Å; W126-M163 HydrophobicContact CE3-CG 4.26Å; W126-M163 HydrophobicContact CG-CB 3.74Å; W126-M163 HydrophobicContact CG-CG 4.36Å; W126-M163 HydrophobicContact CH2-CE 3.73Å; W126-M163 HydrophobicContact CZ2-CB 4.18Å; W126-M163 HydrophobicContact CZ2-CE 3.44Å; W126-M163 VanDerWaalsContact CZ2-CE 3.44Å; W126-M163 HydrophobicContact CZ2-CG 4.27Å; W126-L210 WeakPolarHBondContact CZ2-O 3.26Å; W126-H211 AromaticContact CE2-ND1 3.96Å; W126-H211 AromaticContact NE1-CE1 3.63Å; W126-H211 AromaticContact NE1-ND1 3.26Å; W126-H211 PolarHBondContact NE1-ND1 3.12Å; W126-P215 HydrophobicContact CH2-CG 3.81Å; W126-P215 HydrophobicContact CZ2-CG 3.86Å; W126-P215 HydrophobicContact CZ3-CG 4.24Å
127S91.4Very high92Very high3 Ų315 Ų152%0.0218%0.075CC..Hα-helixtrans-62.5-39.9170-68.70000112N78 I123 A124 L125 V130 L131N78-S127 PolarHBondContact ND2-OG 2.83Å; I123-S127 WeakPolarHBondContact O-CB 3.49Å; I123-S127 PolarHBondContact O-N 3.48Å; I123-S127 PolarHBondContact O-OG 3.44Å; A124-S127 WeakPolarHBondContact O-CB 3.42Å; A124-S127 PolarHBondContact O-N 3.44Å; L125-S127 PolarHBondContact O-N 2.96Å; S127-V130 PolarHBondContact O-N 3.3Å; S127-L131 WeakPolarHBondContact O-CB 3.49Å; S127-L131 PolarHBondContact O-N 2.88Å
128L88.6Confident91.5Very high10 Ų1017.3 Ų17.35%0.0529%0.088CC..Hα-helixtrans-65.7-38.8174-65.9172.3000112.1A124 L125 W126 L131 A132 I219 M257 Y261A124-L128 WeakPolarHBondContact O-CG 3.49Å; A124-L128 PolarHBondContact O-N 3.43Å; A124-L128 VanDerWaalsContact O-N 3.14Å; L125-L128 WeakPolarHBondContact O-CB 3.37Å; L125-L128 PolarHBondContact O-N 3.16Å; W126-L128 VanDerWaalsContact C-N 3.33Å; L128-L131 PolarHBondContact O-N 3.25Å; L128-A132 WeakPolarHBondContact O-CB 3.22Å; L128-A132 PolarHBondContact O-N 3.4Å; L128-I219 HydrophobicContact CB-CD1 3.95Å; L128-M257 HydrophobicContact CD2-CE 3.28Å; L128-Y261 HydrophobicContact CD1-CD2 3.38Å; L128-Y261 HydrophobicContact CD1-CE2 4.25Å; L128-Y261 HydrophobicContact CD1-CG 3.57Å
129V93.3Very high90.9Very high2 Ų219.1 Ų19.11%0.01210%0.098CC..Hα-helixtrans-61.4-50.3174.7176.10000110.9L125 W126 L131 A132 I133 P215 I218 I219L125-V129 PolarHBondContact O-N 3.17Å; L125-V129 VanDerWaalsContact O-N 3.12Å; W126-V129 HydrophobicContact CE3-CB 4.08Å; W126-V129 HydrophobicContact CE3-CG1 4.19Å; W126-V129 HydrophobicContact CE3-CG2 4Å; W126-V129 HydrophobicContact CZ3-CG1 4.27Å; W126-V129 HydrophobicContact CZ3-CG2 4.32Å; W126-V129 PolarHBondContact O-N 2.93Å; V129-L131 VanDerWaalsContact C-N 3.3Å; V129-L131 PolarHBondContact O-N 3.16Å; V129-A132 PolarHBondContact O-N 3.2Å; V129-I133 HydrophobicContact CG1-CD1 3.95Å; V129-I133 WeakPolarHBondContact O-CG1 3.38Å; V129-I133 PolarHBondContact O-N 3.49Å; V129-P215 HydrophobicContact CG2-CB 3.66Å; V129-P215 HydrophobicContact CG2-CG 4.41Å; V129-I218 HydrophobicContact CG1-CB 4.4Å; V129-I218 HydrophobicContact CG1-CD1 4.32Å; V129-I218 HydrophobicContact CG1-CG2 3.85Å; V129-I219 HydrophobicContact CG2-CD1 3.91Å; V129-I219 HydrophobicContact CG2-CG1 4.02Å
130V92.6Very high90.5Very high14 Ų1420.2 Ų20.29%0.08511%0.106CC..Hα-helixtrans-60.1-42.5179.1171.90000110.8I75 W126 S127 I133 E134 F159 T160I75-V130 HydrophobicContact CD1-CB 4.21Å; I75-V130 HydrophobicContact CD1-CG1 3.62Å; I75-V130 HydrophobicContact CG1-CG1 4.28Å; W126-V130 WeakPolarHBondContact O-CG2 3.5Å; W126-V130 PolarHBondContact O-N 3.38Å; S127-V130 PolarHBondContact O-N 3.3Å; V130-I133 PolarHBondContact O-N 3.47Å; V130-E134 WeakPolarHBondContact O-CB 3.35Å; V130-E134 PolarHBondContact O-N 3.39Å; V130-F159 HydrophobicContact CG2-CD1 4Å; V130-T160 HydrophobicContact CG2-CG2 3.91Å
131L87.8Confident90.1Very high3 Ų327.4 Ų27.42%0.01614%0.138CC..Hα-helixtrans-64.8-41176.5-175.169.2000112.3L72 S127 L128 V129 I133 E134 R135 M253 M257L72-L131 HydrophobicContact CG-CD1 4.22Å; S127-L131 WeakPolarHBondContact O-CB 3.49Å; S127-L131 PolarHBondContact O-N 2.88Å; L128-L131 PolarHBondContact O-N 3.25Å; V129-L131 VanDerWaalsContact C-N 3.3Å; V129-L131 PolarHBondContact O-N 3.16Å; L131-I133 VanDerWaalsContact C-N 3.32Å; L131-I133 PolarHBondContact O-N 3.21Å; L131-E134 PolarHBondContact O-N 3.41Å; L131-R135 HydrophobicContact CD1-CG 4.36Å; L131-R135 HydrophobicContact CG-CG 4.38Å; L131-R135 WeakPolarHBondContact O-CB 3.38Å; L131-R135 VanDerWaalsContact O-CG 3.28Å; L131-R135 WeakPolarHBondContact O-CG 3.38Å; L131-R135 PolarHBondContact O-N 3.06Å; L131-M253 HydrophobicContact CD2-CE 4.1Å; L131-M257 HydrophobicContact CD2-CE 3.16Å; L131-M257 HydrophobicContact CD2-SD 3.71Å
132A89.8Confident89.6Confident0 Ų030.2 Ų30.20%016%0.155CC..Hα-helixtrans-61.5-42.7177.300000111.4L128 V129 Y136 I219 C222 Y223L128-A132 WeakPolarHBondContact O-CB 3.22Å; L128-A132 PolarHBondContact O-N 3.4Å; V129-A132 PolarHBondContact O-N 3.2Å; A132-Y136 WeakPolarHBondContact O-CB 3.41Å; A132-Y136 PolarHBondContact O-N 3.34Å; A132-I219 HydrophobicContact CB-CG1 4.19Å; A132-C222 HydrophobicContact CB-CB 3.87Å; A132-C222 WeakPolarHBondContact O-CB 3.45Å; A132-Y223 HydrophobicContact CB-CD2 4.35Å; A132-Y223 HydrophobicContact CB-CE1 4.19Å; A132-Y223 HydrophobicContact CB-CE2 3.98Å
133I91.6Very high89Confident64 Ų6434 Ų3433%0.32817%0.174SC..Hα-helixtrans-65.1-46.9176.2-66.8168.8000111.1V129 V130 L131 R135 Y136 I137 I218V129-I133 HydrophobicContact CG1-CD1 3.95Å; V129-I133 WeakPolarHBondContact O-CG1 3.38Å; V129-I133 PolarHBondContact O-N 3.49Å; V130-I133 PolarHBondContact O-N 3.47Å; L131-I133 VanDerWaalsContact C-N 3.32Å; L131-I133 PolarHBondContact O-N 3.21Å; I133-R135 PolarHBondContact O-N 3.42Å; I133-Y136 PolarHBondContact O-N 3.01Å; I133-I137 HydrophobicContact CG2-CD1 3.67Å; I133-I137 HydrophobicContact CG2-CG1 4.36Å; I133-I137 WeakPolarHBondContact O-CG1 3.37Å; I133-I137 PolarHBondContact O-N 3.1Å; I133-I218 HydrophobicContact CD1-CG2 4.14Å; I133-I218 HydrophobicContact CG1-CG2 4.06Å
134E88.6Confident88.1Confident16 Ų1640.5 Ų40.58%0.07521%0.214CC..Hα-helixtrans-56.6-50.1177.6-179.9-85.1163.400111V130 L131 Y136 I137 V138 F148V130-E134 WeakPolarHBondContact O-CB 3.35Å; V130-E134 PolarHBondContact O-N 3.39Å; L131-E134 PolarHBondContact O-N 3.41Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 3.09Å; E134-I137 PolarHBondContact O-N 3.36Å; E134-V138 HydrophobicContact CG-CG2 4.39Å; E134-V138 WeakPolarHBondContact O-CB 3.3Å; E134-V138 WeakPolarHBondContact O-CG2 3.43Å; E134-V138 PolarHBondContact O-N 3.02Å; E134-V138 WeakPolarHBondContact OE1-CG2 3.22Å; E134-F148 HydrophobicContact CB-CD2 4.42Å; E134-F148 HydrophobicContact CB-CE2 4.13Å; E134-F148 HydrophobicContact CB-CZ 4.23Å; E134-F148 HydrophobicContact CG-CD1 3.88Å; E134-F148 HydrophobicContact CG-CD2 4.05Å; E134-F148 HydrophobicContact CG-CE1 3.92Å; E134-F148 HydrophobicContact CG-CE2 4.08Å; E134-F148 HydrophobicContact CG-CG 3.94Å; E134-F148 HydrophobicContact CG-CZ 4.01Å
135R87.3Confident87.7Confident61 Ų6148.1 Ų48.123%0.2325%0.254CS..Hα-helixtrans-61-43179.2-72.5-58.5-161.3-16814.5112L72 L131 I133 V139 Y223 L226L72-R135 VanDerWaalsContact CD1-CZ 3.42Å; L131-R135 HydrophobicContact CD1-CG 4.36Å; L131-R135 HydrophobicContact CG-CG 4.38Å; L131-R135 WeakPolarHBondContact O-CB 3.38Å; L131-R135 VanDerWaalsContact O-CG 3.28Å; L131-R135 WeakPolarHBondContact O-CG 3.38Å; L131-R135 PolarHBondContact O-N 3.06Å; I133-R135 PolarHBondContact O-N 3.42Å; R135-V139 WeakPolarHBondContact O-CB 3.38Å; R135-V139 WeakPolarHBondContact O-CG2 3.4Å; R135-V139 PolarHBondContact O-N 3.16Å; R135-Y223 HydrophobicContact CB-CE1 4.3Å; R135-Y223 HydrophobicContact CG-CE1 4.48Å; R135-L226 HydrophobicContact CB-CD2 4.16Å
136Y89.4Confident87.4Confident48 Ų4851.6 Ų51.619%0.18827%0.269CS..Hα-helixtrans-59.4-48.9175.7170.2-111.4000111.4A132 I133 E134 C140 P142 R225A132-Y136 WeakPolarHBondContact O-CB 3.41Å; A132-Y136 PolarHBondContact O-N 3.34Å; I133-Y136 PolarHBondContact O-N 3.01Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 3.09Å; Y136-C140 HydrophobicContact CD2-CB 3.83Å; Y136-C140 VanDerWaalsContact CD2-SG 3.56Å; Y136-C140 HydrophobicContact CE2-CB 3.75Å; Y136-C140 WeakPolarHBondContact O-CA 3.44Å; Y136-C140 WeakPolarHBondContact O-CB 3.39Å; Y136-C140 PolarHBondContact O-N 3.3Å; Y136-P142 HydrophobicContact CE1-CB 4.4Å; Y136-P142 HydrophobicContact CE1-CG 3.89Å; Y136-R225 HydrophobicContact CD2-CB 3.81Å; Y136-R225 HydrophobicContact CE2-CB 3.62Å; Y136-R225 HydrophobicContact CE2-CG 4.13Å
137I89.1Confident86.9Confident29 Ų2961.5 Ų61.515%0.14931%0.306CS..Hα-helixtrans-65.4-46.1-178.4-67.2169.6000111.7I133 E134 K141 M143 F146I133-I137 HydrophobicContact CG2-CD1 3.67Å; I133-I137 HydrophobicContact CG2-CG1 4.36Å; I133-I137 WeakPolarHBondContact O-CG1 3.37Å; I133-I137 PolarHBondContact O-N 3.1Å; E134-I137 PolarHBondContact O-N 3.36Å; I137-K141 VanDerWaalsContact O-CA 3.29Å; I137-K141 WeakPolarHBondContact O-CA 3.41Å; I137-K141 PolarHBondContact O-N 3.5Å; I137-K141 VanDerWaalsContact O-N 3.1Å; I137-M143 HydrophobicContact CG2-CE 4.34Å; I137-F146 HydrophobicContact CG2-CD1 3.38Å; I137-F146 HydrophobicContact CG2-CE1 3.59Å
138V84.8Confident86.5Confident60 Ų6062.9 Ų62.936%0.36431%0.312SS..Hα-helixtrans-69.3-39-174.7170.10000112.1E134 F148E134-V138 HydrophobicContact CG-CG2 4.39Å; E134-V138 WeakPolarHBondContact O-CB 3.3Å; E134-V138 WeakPolarHBondContact O-CG2 3.43Å; E134-V138 PolarHBondContact O-N 3.02Å; E134-V138 WeakPolarHBondContact OE1-CG2 3.22Å; V138-F148 HydrophobicContact CG2-CB 3.8Å
139V84.6Confident86.4Confident58 Ų5866 Ų6635%0.35233%0.328SS..Hα-helixtrans-91.6-45.7-175.1-179.20000111.9R135 K141 L226 V230R135-V139 WeakPolarHBondContact O-CB 3.38Å; R135-V139 WeakPolarHBondContact O-CG2 3.4Å; R135-V139 PolarHBondContact O-N 3.16Å; V139-K141 VanDerWaalsContact C-N 3.32Å; V139-L226 HydrophobicContact CB-CD1 3.41Å; V139-L226 VanDerWaalsContact CB-CD1 3.41Å; V139-L226 HydrophobicContact CG1-CD1 3.52Å; V139-L226 HydrophobicContact CG2-CD1 3.76Å; V139-V230 HydrophobicContact CG1-CG2 3.77Å
140C87.4Confident86Confident28 Ų2870.7 Ų70.719%0.18935%0.351CS..Hα-helixtrans-81.7-14.8-177.4-52.80000112.9Y136 T229Y136-C140 HydrophobicContact CD2-CB 3.83Å; Y136-C140 VanDerWaalsContact CD2-SG 3.56Å; Y136-C140 HydrophobicContact CE2-CB 3.75Å; Y136-C140 WeakPolarHBondContact O-CA 3.44Å; Y136-C140 WeakPolarHBondContact O-CB 3.39Å; Y136-C140 PolarHBondContact O-N 3.3Å; C140-T229 PolarHBondContact SG-OG1 2.99Å; C140-T229 VanDerWaalsContact SG-OG1 3.34Å
141K84.9Confident85.9Confident151 Ų15179.5 Ų79.566%0.65738%0.382SS*.  trans40.558.1179.8-62.8-172.5178.7178.90113.1I137 V139 M143I137-K141 VanDerWaalsContact O-CA 3.29Å; I137-K141 WeakPolarHBondContact O-CA 3.41Å; I137-K141 PolarHBondContact O-N 3.5Å; I137-K141 VanDerWaalsContact O-N 3.1Å; V139-K141 VanDerWaalsContact C-N 3.32Å; K141-M143 PolarHBondContact O-N 3.25Å
142P81.9Confident86Confident64 Ų6482.6 Ų82.642%0.41640%0.396SS..SBendtrans-62.7-15.6177.229.4-36.1000112.5Y136Y136-P142 HydrophobicContact CE1-CB 4.4Å; Y136-P142 HydrophobicContact CE1-CG 3.89Å
143M83.9Confident86Confident92 Ų9282.6 Ų82.645%0.45340%0.397SS..SBendtrans-126123.7176.5-62.9176-75.500109.5I137 K141 N145 F146I137-M143 HydrophobicContact CG2-CE 4.34Å; K141-M143 PolarHBondContact O-N 3.25Å; M143-N145 PolarHBondContact O-N 2.97Å; M143-F146 HydrophobicContact CB-CB 3.81Å; M143-F146 HydrophobicContact CE-CB 4.01Å; M143-F146 HydrophobicContact CE-CD1 4.07Å; M143-F146 HydrophobicContact CE-CD2 4.25Å; M143-F146 HydrophobicContact CE-CG 3.83Å; M143-F146 HydrophobicContact SD-CB 4.37Å
144T75.4Confident85.9Confident136 Ų13683.8 Ų83.883%0.83440%0.403SS*.THydrogen-bonded Turntrans-67.5-32.2-169.8-30.80000114.1
145N82.2Confident86.2Confident165 Ų16587.4 Ų87.488%0.88243%0.426SS*.THydrogen-bonded Turntrans-110.79.3-173.5-67.3-28.1000114M143M143-N145 PolarHBondContact O-N 2.97Å
146F86.3Confident86.5Confident74 Ų7485 Ų8533%0.32542%0.419SS..  trans-91.3129.8-179.3-176.7-91.7000111.1I137 M143 F148 H152I137-F146 HydrophobicContact CG2-CD1 3.38Å; I137-F146 HydrophobicContact CG2-CE1 3.59Å; M143-F146 HydrophobicContact CB-CB 3.81Å; M143-F146 HydrophobicContact CE-CB 4.01Å; M143-F146 HydrophobicContact CE-CD1 4.07Å; M143-F146 HydrophobicContact CE-CD2 4.25Å; M143-F146 HydrophobicContact CE-CG 3.83Å; M143-F146 HydrophobicContact SD-CB 4.37Å; F146-F148 HydrophobicContact CE1-CB 4.23Å; F146-F148 HydrophobicContact CE1-CD2 4.19Å; F146-H152 AromaticContact CE2-CE1 3.82Å; F146-H152 AromaticContact CE2-NE2 3.42Å; F146-H152 WeakPolarHBondContact CE2-NE2 3.32Å; F146-H152 AromaticContact CZ-CD2 3.72Å; F146-H152 AromaticContact CZ-CE1 3.8Å; F146-H152 AromaticContact CZ-NE2 3.52Å
147R83.1Confident86.8Confident213 Ų21384.1 Ų84.180%0.80442%0.419SS*.  trans-122.6117.7172.5-174175.8178.4176.90.2109.9N149R147-N149 PolarHBondContact O-N 3.44Å
148F83.6Confident87.1Confident33 Ų3385 Ų8515%0.14543%0.431CS..  trans-62.2127.2172.1-157.5-84.3000109.2P71 E134 V138 F146 H152 A153P71-F148 HydrophobicContact CB-CD1 3.58Å; P71-F148 HydrophobicContact CB-CE1 3.64Å; P71-F148 HydrophobicContact CG-CD1 3.99Å; P71-F148 HydrophobicContact CG-CE1 4.41Å; E134-F148 HydrophobicContact CB-CD2 4.42Å; E134-F148 HydrophobicContact CB-CE2 4.13Å; E134-F148 HydrophobicContact CB-CZ 4.23Å; E134-F148 HydrophobicContact CG-CD1 3.88Å; E134-F148 HydrophobicContact CG-CD2 4.05Å; E134-F148 HydrophobicContact CG-CE1 3.92Å; E134-F148 HydrophobicContact CG-CE2 4.08Å; E134-F148 HydrophobicContact CG-CG 3.94Å; E134-F148 HydrophobicContact CG-CZ 4.01Å; V138-F148 HydrophobicContact CG2-CB 3.8Å; F146-F148 HydrophobicContact CE1-CB 4.23Å; F146-F148 HydrophobicContact CE1-CD2 4.19Å; F148-H152 HydrophobicContact CD1-CB 4.22Å; F148-H152 HydrophobicContact CD2-CB 3.96Å; F148-H152 HydrophobicContact CE1-CB 3.89Å; F148-H152 HydrophobicContact CE2-CB 3.63Å; F148-H152 HydrophobicContact CG-CB 4.25Å; F148-H152 HydrophobicContact CZ-CB 3.6Å; F148-A153 HydrophobicContact CE1-CB 3.95Å
149N86.1Confident87.7Confident74 Ų7486 Ų8640%0.39643%0.43SS..  trans-132.4179.2-177.270.124.2000109.9R147 R151 H152 A153R147-N149 PolarHBondContact O-N 3.44Å; N149-R151 VanDerWaalsContact C-N 3.29Å; N149-R151 PolarHBondContact O-N 3.48Å; N149-R151 WeakPolarHBondContact OD1-CB 3.35Å; N149-R151 PolarHBondContact OD1-N 3.18Å; N149-H152 VanDerWaalsContact CG-ND1 3.31Å; N149-H152 PolarHBondContact N-ND1 3.41Å; N149-H152 PolarHBondContact O-N 3.14Å; N149-H152 VanDerWaalsContact O-N 3.17Å; N149-H152 PolarHBondContact OD1-N 3.04Å; N149-H152 PolarHBondContact OD1-ND1 3.29Å; N149-A153 PolarHBondContact O-N 2.83Å
150E85.6Confident88.3Confident102 Ų10283.2 Ų83.248%0.47741%0.414SS..Hα-helixtrans-58-36.9-178.1-178.2171.8-157.900113.8Y74 H152 A153 I154Y74-E150 HydrophobicContact CE2-CG 3.82Å; Y74-E150 PolarHBondContact OH-OE1 3.08Å; E150-H152 VanDerWaalsContact C-N 3.31Å; E150-H152 PolarHBondContact O-N 3.11Å; E150-A153 WeakPolarHBondContact O-CB 3.45Å; E150-A153 PolarHBondContact O-N 3.11Å; E150-A153 VanDerWaalsContact O-N 3.09Å; E150-I154 HydrophobicContact CG-CD1 3.99Å; E150-I154 HydrophobicContact CG-CG1 4.48Å; E150-I154 WeakPolarHBondContact O-CG1 3.42Å; E150-I154 PolarHBondContact O-N 3.26Å
151R89.7Confident88.8Confident199 Ų19985.3 Ų85.375%0.75142%0.418SS*.Hα-helixtrans-61-41.9177.9-169.9178.3-175.2178.21.6111.4N149 A153 I154 V155N149-R151 VanDerWaalsContact C-N 3.29Å; N149-R151 PolarHBondContact O-N 3.48Å; N149-R151 WeakPolarHBondContact OD1-CB 3.35Å; N149-R151 PolarHBondContact OD1-N 3.18Å; R151-A153 VanDerWaalsContact C-N 3.33Å; R151-I154 PolarHBondContact O-N 2.72Å; R151-V155 VanDerWaalsContact O-CG2 3.3Å; R151-V155 WeakPolarHBondContact O-CG2 3.33Å; R151-V155 PolarHBondContact O-N 2.95Å
152H91Very high89.4Confident67 Ų6783 Ų8331%0.3141%0.411SS..Hα-helixtrans-66.7-36.4175.7-58.496.6000111.7F146 F148 N149 E150 V155 G156F146-H152 AromaticContact CE2-CE1 3.82Å; F146-H152 AromaticContact CE2-NE2 3.42Å; F146-H152 WeakPolarHBondContact CE2-NE2 3.32Å; F146-H152 AromaticContact CZ-CD2 3.72Å; F146-H152 AromaticContact CZ-CE1 3.8Å; F146-H152 AromaticContact CZ-NE2 3.52Å; F148-H152 HydrophobicContact CD1-CB 4.22Å; F148-H152 HydrophobicContact CD2-CB 3.96Å; F148-H152 HydrophobicContact CE1-CB 3.89Å; F148-H152 HydrophobicContact CE2-CB 3.63Å; F148-H152 HydrophobicContact CG-CB 4.25Å; F148-H152 HydrophobicContact CZ-CB 3.6Å; N149-H152 VanDerWaalsContact CG-ND1 3.31Å; N149-H152 PolarHBondContact N-ND1 3.41Å; N149-H152 PolarHBondContact O-N 3.14Å; N149-H152 VanDerWaalsContact O-N 3.17Å; N149-H152 PolarHBondContact OD1-N 3.04Å; N149-H152 PolarHBondContact OD1-ND1 3.29Å; E150-H152 VanDerWaalsContact C-N 3.31Å; E150-H152 PolarHBondContact O-N 3.11Å; H152-V155 PolarHBondContact O-N 3.28Å; H152-G156 PolarHBondContact O-N 3.01Å
153A89.1Confident90.2Very high1 Ų181.2 Ų81.21%0.00840%0.398CS..Hα-helixtrans-62.7-46.6175.300000111.7P71 Y74 F148 N149 E150 R151 G156 V157P71-A153 HydrophobicContact CB-CB 4.01Å; Y74-A153 HydrophobicContact CD2-CB 4.14Å; Y74-A153 HydrophobicContact CG-CB 4.32Å; F148-A153 HydrophobicContact CE1-CB 3.95Å; N149-A153 PolarHBondContact O-N 2.83Å; E150-A153 WeakPolarHBondContact O-CB 3.45Å; E150-A153 PolarHBondContact O-N 3.11Å; E150-A153 VanDerWaalsContact O-N 3.09Å; R151-A153 VanDerWaalsContact C-N 3.33Å; A153-G156 PolarHBondContact O-N 3.35Å; A153-V157 WeakPolarHBondContact O-CG2 3.49Å; A153-V157 PolarHBondContact O-N 3.46Å
154I90.6Very high90.9Very high89 Ų8976.9 Ų76.946%0.45638%0.376SS..Hα-helixtrans-63.4-42.9178.3-66166.7000111E150 R151 G156 V157 A158E150-I154 HydrophobicContact CG-CD1 3.99Å; E150-I154 HydrophobicContact CG-CG1 4.48Å; E150-I154 WeakPolarHBondContact O-CG1 3.42Å; E150-I154 PolarHBondContact O-N 3.26Å; R151-I154 PolarHBondContact O-N 2.72Å; I154-G156 VanDerWaalsContact C-N 3.31Å; I154-G156 PolarHBondContact O-N 3.04Å; I154-V157 PolarHBondContact O-N 3.01Å; I154-A158 PolarHBondContact O-N 3.33Å
155V94.4Very high91.9Very high92 Ų9273.5 Ų73.556%0.55835%0.353SS*.Hα-helixtrans-61.3-41.9174.2170.70000110.8R151 H152 A158 F159R151-V155 VanDerWaalsContact O-CG2 3.3Å; R151-V155 WeakPolarHBondContact O-CG2 3.33Å; R151-V155 PolarHBondContact O-N 2.95Å; H152-V155 PolarHBondContact O-N 3.28Å; V155-A158 PolarHBondContact O-N 3.28Å; V155-F159 WeakPolarHBondContact O-CB 3.36Å; V155-F159 PolarHBondContact O-N 2.88Å
156G94.3Very high92.7Very high9 Ų968 Ų689%0.09333%0.325CS..Hα-helixtrans-59.2-45.5174.100000112.4H152 A153 I154 F159 T160H152-G156 PolarHBondContact O-N 3.01Å; A153-G156 PolarHBondContact O-N 3.35Å; I154-G156 VanDerWaalsContact C-N 3.31Å; I154-G156 PolarHBondContact O-N 3.04Å; G156-F159 WeakPolarHBondContact O-CB 3.32Å; G156-F159 PolarHBondContact O-N 3.24Å; G156-T160 VanDerWaalsContact O-CG2 3.32Å; G156-T160 WeakPolarHBondContact O-CG2 3.4Å; G156-T160 PolarHBondContact O-N 3.18Å
157V94.6Very high93.3Very high30 Ų3064.4 Ų64.418%0.18231%0.31CS..Hα-helixtrans-59-52.9174170.30000110.5I75 N78 A153 I154 F159 T160 W161I75-V157 HydrophobicContact CD1-CG2 4.04Å; N78-V157 HydrophobicContact CB-CG1 4.39Å; N78-V157 HydrophobicContact CB-CG2 4.12Å; A153-V157 WeakPolarHBondContact O-CG2 3.49Å; A153-V157 PolarHBondContact O-N 3.46Å; I154-V157 PolarHBondContact O-N 3.01Å; V157-F159 PolarHBondContact O-N 3.34Å; V157-T160 PolarHBondContact O-N 3.03Å; V157-T160 PolarHBondContact O-OG1 3.31Å; V157-W161 VanDerWaalsContact O-CD1 3.31Å; V157-W161 PolarHBondContact O-N 3.09Å
158A96.3Very high94Very high48 Ų4854.3 Ų54.340%0.39727%0.271SS..Hα-helixtrans-56.3-40.8178.500000112.2I154 V155 T160 W161 I162I154-A158 PolarHBondContact O-N 3.33Å; V155-A158 PolarHBondContact O-N 3.28Å; A158-T160 PolarHBondContact O-N 2.9Å; A158-W161 PolarHBondContact O-N 2.9Å; A158-I162 WeakPolarHBondContact O-CG1 3.21Å; A158-I162 PolarHBondContact O-N 3.15Å
159F97.3Very high94.7Very high81 Ų8156.4 Ų56.436%0.35528%0.284SS..Hα-helixtrans-58.7-44.2174.6172.2-101.1000112.3W126 V130 V155 G156 V157 W161 I162 M163W126-F159 HydrophobicContact CD2-CE1 4.37Å; W126-F159 AromaticContact CE3-CE1 3.56Å; W126-F159 HydrophobicContact CE3-CE1 3.56Å; W126-F159 AromaticContact CE3-CZ 3.93Å; W126-F159 HydrophobicContact CE3-CZ 3.93Å; W126-F159 AromaticContact CZ3-CE1 3.94Å; W126-F159 HydrophobicContact CZ3-CE1 3.94Å; W126-F159 AromaticContact CZ3-CZ 3.87Å; W126-F159 HydrophobicContact CZ3-CZ 3.87Å; V130-F159 HydrophobicContact CG2-CD1 4Å; V155-F159 WeakPolarHBondContact O-CB 3.36Å; V155-F159 PolarHBondContact O-N 2.88Å; G156-F159 WeakPolarHBondContact O-CB 3.32Å; G156-F159 PolarHBondContact O-N 3.24Å; V157-F159 PolarHBondContact O-N 3.34Å; F159-W161 VanDerWaalsContact C-N 3.31Å; F159-W161 PolarHBondContact O-N 3.26Å; F159-I162 PolarHBondContact O-N 2.88Å; F159-M163 HydrophobicContact CD1-CG 4.33Å; F159-M163 HydrophobicContact CD2-CG 3.96Å; F159-M163 HydrophobicContact CD2-SD 4.45Å; F159-M163 HydrophobicContact CE1-CG 3.9Å; F159-M163 HydrophobicContact CE2-CG 3.48Å; F159-M163 VanDerWaalsContact CE2-CG 3.48Å; F159-M163 HydrophobicContact CE2-SD 3.7Å; F159-M163 HydrophobicContact CG-CG 4.36Å; F159-M163 HydrophobicContact CZ-CG 3.44Å; F159-M163 VanDerWaalsContact CZ-CG 3.44Å; F159-M163 HydrophobicContact CZ-SD 3.99Å; F159-M163 WeakPolarHBondContact O-CG 3.44Å; F159-M163 PolarHBondContact O-N 3.47Å
160T97Very high95.2Very high0 Ų053.9 Ų53.90%027%0.271CS..Hα-helixtrans-58.9-41.8177.466.80000112.5N78 W126 V130 G156 V157 A158 S164N78-T160 PolarHBondContact ND2-OG1 2.93Å; W126-T160 VanDerWaalsContact C-CG2 3.48Å; W126-T160 HydrophobicContact CB-CG2 3.82Å; V130-T160 HydrophobicContact CG2-CG2 3.91Å; G156-T160 VanDerWaalsContact O-CG2 3.32Å; G156-T160 WeakPolarHBondContact O-CG2 3.4Å; G156-T160 PolarHBondContact O-N 3.18Å; V157-T160 PolarHBondContact O-N 3.03Å; V157-T160 PolarHBondContact O-OG1 3.31Å; A158-T160 PolarHBondContact O-N 2.9Å; T160-S164 WeakPolarHBondContact O-CB 3.45Å; T160-S164 PolarHBondContact O-N 2.65Å; T160-S164 PolarHBondContact O-OG 3.44Å
161W97.6Very high95.8Very high72 Ų7249.3 Ų49.327%0.27325%0.251SS..Hα-helixtrans-68-42.7178.9-77.274.5000111.9N78 V81 M119 I123 V157 A158 F159 S164 L165N78-W161 PolarHBondContact OD1-NE1 3.32Å; V81-W161 HydrophobicContact CG1-CH2 4.28Å; V81-W161 HydrophobicContact CG1-CZ2 3.89Å; M119-W161 HydrophobicContact CE-CD2 4.47Å; M119-W161 HydrophobicContact CE-CE3 3.47Å; M119-W161 VanDerWaalsContact CE-CE3 3.47Å; M119-W161 HydrophobicContact CE-CZ3 3.72Å; I123-W161 HydrophobicContact CD1-CD2 3.93Å; I123-W161 HydrophobicContact CD1-CE3 4.07Å; I123-W161 HydrophobicContact CD1-CH2 4.07Å; I123-W161 HydrophobicContact CD1-CZ2 3.94Å; I123-W161 HydrophobicContact CD1-CZ3 4.13Å; V157-W161 VanDerWaalsContact O-CD1 3.31Å; V157-W161 PolarHBondContact O-N 3.09Å; A158-W161 PolarHBondContact O-N 2.9Å; F159-W161 VanDerWaalsContact C-N 3.31Å; F159-W161 PolarHBondContact O-N 3.26Å; W161-S164 PolarHBondContact O-N 2.95Å; W161-L165 WeakPolarHBondContact O-CG 3.14Å; W161-L165 PolarHBondContact O-N 3.4Å
162I98.2Very high96.2Very high102 Ų10243.3 Ų43.352%0.52323%0.233SC..Hα-helixtrans-59.7-52177.2-68.9167.1000109.9A158 F159 S164 L165 T166A158-I162 WeakPolarHBondContact O-CG1 3.21Å; A158-I162 PolarHBondContact O-N 3.15Å; F159-I162 PolarHBondContact O-N 2.88Å; I162-S164 VanDerWaalsContact C-N 3.28Å; I162-S164 PolarHBondContact O-N 3.47Å; I162-L165 PolarHBondContact O-N 3.06Å; I162-T166 WeakPolarHBondContact O-CG2 3.48Å; I162-T166 PolarHBondContact O-N 3.46Å
163M98.1Very high96.5Very high27 Ų2744.7 Ų44.713%0.13325%0.249CC..Hα-helixtrans-61.9-38.2178.6-64.8-53.7-62.100111.6W126 F159 L165 T166 C167 L210 H211W126-M163 HydrophobicContact CD2-CB 3.72Å; W126-M163 HydrophobicContact CD2-CG 3.95Å; W126-M163 HydrophobicContact CE3-CG 4.26Å; W126-M163 HydrophobicContact CG-CB 3.74Å; W126-M163 HydrophobicContact CG-CG 4.36Å; W126-M163 HydrophobicContact CH2-CE 3.73Å; W126-M163 HydrophobicContact CZ2-CB 4.18Å; W126-M163 HydrophobicContact CZ2-CE 3.44Å; W126-M163 VanDerWaalsContact CZ2-CE 3.44Å; W126-M163 HydrophobicContact CZ2-CG 4.27Å; F159-M163 HydrophobicContact CD1-CG 4.33Å; F159-M163 HydrophobicContact CD2-CG 3.96Å; F159-M163 HydrophobicContact CD2-SD 4.45Å; F159-M163 HydrophobicContact CE1-CG 3.9Å; F159-M163 HydrophobicContact CE2-CG 3.48Å; F159-M163 VanDerWaalsContact CE2-CG 3.48Å; F159-M163 HydrophobicContact CE2-SD 3.7Å; F159-M163 HydrophobicContact CG-CG 4.36Å; F159-M163 HydrophobicContact CZ-CG 3.44Å; F159-M163 VanDerWaalsContact CZ-CG 3.44Å; F159-M163 HydrophobicContact CZ-SD 3.99Å; F159-M163 WeakPolarHBondContact O-CG 3.44Å; F159-M163 PolarHBondContact O-N 3.47Å; M163-L165 VanDerWaalsContact C-N 3.31Å; M163-L165 PolarHBondContact O-N 3.3Å; M163-T166 PolarHBondContact O-N 2.89Å; M163-T166 PolarHBondContact O-OG1 2.91Å; M163-C167 PolarHBondContact O-N 2.68Å; M163-L210 HydrophobicContact CE-CD1 4.17Å; M163-L210 HydrophobicContact CE-CD2 3.94Å; M163-L210 HydrophobicContact CE-CG 4.08Å; M163-H211 PolarHBondContact O-CE1 2.91Å
164S97.6Very high96.7Very high0 Ų046.8 Ų46.80%027%0.271CS..Hα-helixtrans-64.6-38.5177.5-54.60000112.3E122 I123 T160 W161 I162 T166 C167 A168E122-S164 WeakPolarHBondContact CB-OG 2.84Å; I123-S164 WeakPolarHBondContact CA-OG 3.35Å; I123-S164 WeakPolarHBondContact CG1-OG 3.26Å; I123-S164 PolarHBondContact N-OG 2.9Å; T160-S164 WeakPolarHBondContact O-CB 3.45Å; T160-S164 PolarHBondContact O-N 2.65Å; T160-S164 PolarHBondContact O-OG 3.44Å; W161-S164 PolarHBondContact O-N 2.95Å; I162-S164 VanDerWaalsContact C-N 3.28Å; I162-S164 PolarHBondContact O-N 3.47Å; S164-T166 VanDerWaalsContact C-N 3.34Å; S164-T166 PolarHBondContact O-N 3.47Å; S164-C167 PolarHBondContact O-N 2.87Å; S164-A168 WeakPolarHBondContact O-CB 3.36Å; S164-A168 PolarHBondContact O-N 2.53Å
165L98.1Very high97Very high65 Ų6547 Ų4734%0.3427%0.266SS..Hα-helixtrans-66.5-33.5174.6-72.5168.5000112.5F115 M119 W161 I162 M163 C167 L169 P170F115-L165 HydrophobicContact CZ-CD2 4.48Å; M119-L165 HydrophobicContact CE-CD1 4.48Å; M119-L165 HydrophobicContact CE-CD2 3.53Å; M119-L165 HydrophobicContact CE-CG 3.7Å; M119-L165 HydrophobicContact SD-CD2 3.95Å; M119-L165 HydrophobicContact SD-CG 4.18Å; W161-L165 WeakPolarHBondContact O-CG 3.14Å; W161-L165 PolarHBondContact O-N 3.4Å; I162-L165 PolarHBondContact O-N 3.06Å; M163-L165 VanDerWaalsContact C-N 3.31Å; M163-L165 PolarHBondContact O-N 3.3Å; L165-C167 PolarHBondContact O-N 2.9Å; L165-L169 WeakPolarHBondContact O-CB 3.25Å; L165-L169 PolarHBondContact O-N 3.15Å; L165-P170 WeakPolarHBondContact O-CD 3.31Å
166T98.1Very high97.2Very high49 Ų4942.6 Ų42.630%0.30124%0.24SC..Hα-helixtrans-65.6-17.4175.866.80000113I162 M163 S164 P170 Y206 H211I162-T166 WeakPolarHBondContact O-CG2 3.48Å; I162-T166 PolarHBondContact O-N 3.46Å; M163-T166 PolarHBondContact O-N 2.89Å; M163-T166 PolarHBondContact O-OG1 2.91Å; S164-T166 VanDerWaalsContact C-N 3.34Å; S164-T166 PolarHBondContact O-N 3.47Å; T166-P170 WeakPolarHBondContact O-CD 2.98Å; T166-P170 WeakPolarHBondContact O-CG 3.35Å; T166-Y206 VanDerWaalsContact CB-OH 3.22Å; T166-Y206 WeakPolarHBondContact CB-OH 3.32Å; T166-Y206 PolarHBondContact O-OH 3.38Å; T166-Y206 PolarHBondContact OG1-OH 3.49Å; T166-H211 PolarHBondContact OG1-CE1 3.37Å; T166-H211 PolarHBondContact OG1-NE2 3.01Å
167C97.9Very high97.4Very high0 Ų043.5 Ų43.50%024%0.24CC..Hα-helixtrans-99.7-46.5173-172.70000112.5E122 M163 S164 L165 P171 F203E122-C167 HydrophobicContact CG-CB 3.92Å; E122-C167 PolarHBondContact OE1-SG 3Å; E122-C167 VanDerWaalsContact OE1-SG 3.36Å; M163-C167 PolarHBondContact O-N 2.68Å; S164-C167 PolarHBondContact O-N 2.87Å; L165-C167 PolarHBondContact O-N 2.9Å; C167-P171 WeakPolarHBondContact O-CD 3.49Å; C167-F203 WeakPolarHBondContact O-CZ 3.34Å
168A98Very high97.5Very high0 Ų042.3 Ų42.30%023%0.233CC..Hα-helixtrans-77.6-29.8-173.400000114.2F115 T118 M119 S164 Y178F115-A168 HydrophobicContact CD2-CB 3.89Å; F115-A168 WeakPolarHBondContact CD2-O 3.49Å; F115-A168 HydrophobicContact CE2-CB 3.94Å; T118-A168 HydrophobicContact CG2-CB 3.96Å; M119-A168 HydrophobicContact CB-CB 4.06Å; M119-A168 HydrophobicContact SD-CB 4.19Å; S164-A168 WeakPolarHBondContact O-CB 3.36Å; S164-A168 PolarHBondContact O-N 2.53Å; A168-Y178 WeakPolarHBondContact CA-OH 3.38Å; A168-Y178 PolarHBondContact O-OH 3.47Å; A168-Y178 VanDerWaalsContact O-OH 3.14Å
169L98.3Very high97.6Very high77 Ų7740 Ų4040%0.40321%0.214SC..SBendtrans-81.7-41.5-174.9-166.864.7000114.3L165 P171 L172 C173L165-L169 WeakPolarHBondContact O-CB 3.25Å; L165-L169 PolarHBondContact O-N 3.15Å; L169-P171 VanDerWaalsContact C-CD 3.45Å; L169-L172 HydrophobicContact CD1-CD1 4.4Å; L169-L172 WeakPolarHBondContact O-CA 3.39Å; L169-L172 WeakPolarHBondContact O-CB 2.89Å; L169-L172 PolarHBondContact O-N 2.85Å; L169-C173 PolarHBondContact O-N 3.45Å
170P98.3Very high97.7Very high21 Ų2136.2 Ų36.214%0.13620%0.197CC..G310 helixtrans-55.7-36.8-175.2-23.631.5000116.2L165 T166 L172 C173 G174 W175 F203L165-P170 WeakPolarHBondContact O-CD 3.31Å; T166-P170 WeakPolarHBondContact O-CD 2.98Å; T166-P170 WeakPolarHBondContact O-CG 3.35Å; P170-L172 PolarHBondContact O-N 2.99Å; P170-L172 VanDerWaalsContact O-N 3.14Å; P170-C173 CarbonylContact O-C 3.36Å; P170-C173 WeakPolarHBondContact O-CA 3.45Å; P170-C173 PolarHBondContact O-N 3Å; P170-G174 PolarHBondContact O-N 3.38Å; P170-W175 CarbonylContact C-O 3.25Å; P170-W175 HydrophobicContact CB-CB 3.97Å; P170-W175 HydrophobicContact CB-CD2 4.38Å; P170-W175 HydrophobicContact CB-CE3 3.78Å; P170-W175 HydrophobicContact CG-CE3 4.18Å; P170-W175 PolarHBondContact O-N 2.97Å; P170-W175 VanDerWaalsContact O-O 3.11Å; P170-F203 HydrophobicContact CB-CD2 4.27Å; P170-F203 HydrophobicContact CB-CE2 3.77Å; P170-F203 HydrophobicContact CG-CE2 4.04Å
171P97.9Very high97.7Very high7 Ų736.5 Ų36.55%0.04520%0.198CC..G310 helixtrans-60.4-21.4174.1-25.534.9000114.3C167 L169 W175 Y178 I189 F203C167-P171 WeakPolarHBondContact O-CD 3.49Å; L169-P171 VanDerWaalsContact C-CD 3.45Å; P171-W175 VanDerWaalsContact CA-O 3.29Å; P171-W175 WeakPolarHBondContact CA-O 3.06Å; P171-W175 VanDerWaalsContact N-O 3.13Å; P171-Y178 HydrophobicContact CB-CD2 3.9Å; P171-Y178 HydrophobicContact CB-CE2 3.74Å; P171-Y178 HydrophobicContact CB-CG 4.4Å; P171-Y178 HydrophobicContact CG-CE2 4.2Å; P171-I189 HydrophobicContact CB-CD1 4.27Å; P171-I189 HydrophobicContact CG-CD1 3.48Å; P171-I189 VanDerWaalsContact CG-CD1 3.48Å; P171-F203 HydrophobicContact CG-CE1 4.06Å; P171-F203 HydrophobicContact CG-CE2 4.27Å; P171-F203 HydrophobicContact CG-CZ 3.74Å
172L97.6Very high97.6Very high72 Ų7233.1 Ų33.138%0.37719%0.186SC..G310 helixtrans-87.7-15173.4-56.1-179.5000112.6N111 F115 L169 P170 Y178N111-L172 HydrophobicContact CB-CD2 3.65Å; F115-L172 HydrophobicContact CB-CD1 4.2Å; F115-L172 HydrophobicContact CD2-CD1 3.63Å; F115-L172 HydrophobicContact CE2-CD1 4.3Å; F115-L172 HydrophobicContact CG-CD1 4.06Å; L169-L172 HydrophobicContact CD1-CD1 4.4Å; L169-L172 WeakPolarHBondContact O-CA 3.39Å; L169-L172 WeakPolarHBondContact O-CB 2.89Å; L169-L172 PolarHBondContact O-N 2.85Å; P170-L172 PolarHBondContact O-N 2.99Å; P170-L172 VanDerWaalsContact O-N 3.14Å; L172-Y178 HydrophobicContact CD2-CD2 3.8Å; L172-Y178 HydrophobicContact CD2-CE2 4.02Å; L172-Y178 HydrophobicContact CG-CD2 4.45Å; L172-Y178 HydrophobicContact CG-CE2 4.2Å
173C97Very high97.6Very high96 Ų9628.5 Ų28.565%0.64916%0.162SC*.THydrogen-bonded Turntrans-11319.6-174.9-60.30000113L169 P170L169-C173 PolarHBondContact O-N 3.45Å; P170-C173 CarbonylContact O-C 3.36Å; P170-C173 WeakPolarHBondContact O-CA 3.45Å; P170-C173 PolarHBondContact O-N 3Å
174G93.8Very high97.5Very high46 Ų4627.2 Ų27.247%0.47416%0.156SC..THydrogen-bonded Turntrans88.17.9172.900000115.6P170P170-G174 PolarHBondContact O-N 3.38Å
175W97.5Very high97.5Very high92 Ų9227.2 Ų27.235%0.34816%0.156SC..SBendtrans-110.3103.2168.7-172.629.1000109.6P170 P171 S202 F203 Y206P170-W175 CarbonylContact C-O 3.25Å; P170-W175 HydrophobicContact CB-CB 3.97Å; P170-W175 HydrophobicContact CB-CD2 4.38Å; P170-W175 HydrophobicContact CB-CE3 3.78Å; P170-W175 HydrophobicContact CG-CE3 4.18Å; P170-W175 PolarHBondContact O-N 2.97Å; P170-W175 VanDerWaalsContact O-O 3.11Å; P171-W175 VanDerWaalsContact CA-O 3.29Å; P171-W175 WeakPolarHBondContact CA-O 3.06Å; P171-W175 VanDerWaalsContact N-O 3.13Å; W175-S202 PolarHBondContact NE1-OG 3.34Å; W175-F203 HydrophobicContact CD2-CB 4.43Å; W175-F203 AromaticContact CD2-CD2 3.7Å; W175-F203 HydrophobicContact CD2-CD2 3.7Å; W175-F203 AromaticContact CE2-CD2 3.88Å; W175-F203 AromaticContact CE3-CD2 3.94Å; W175-F203 HydrophobicContact CE3-CD2 3.94Å; W175-F203 HydrophobicContact CE3-CE2 4.43Å; W175-F203 HydrophobicContact CG-CB 4.45Å; W175-F203 HydrophobicContact CG-CD2 4.07Å; W175-F203 HydrophobicContact CH2-CD2 4.44Å; W175-F203 HydrophobicContact CZ2-CB 4.4Å; W175-F203 HydrophobicContact CZ2-CD2 4.26Å; W175-F203 HydrophobicContact CZ3-CD2 4.29Å; W175-Y206 AromaticContact CH2-CD1 3.86Å; W175-Y206 HydrophobicContact CH2-CD1 3.86Å; W175-Y206 AromaticContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CE1 4.34Å; W175-Y206 HydrophobicContact CH2-CE2 4.4Å; W175-Y206 AromaticContact CH2-CG 3.63Å; W175-Y206 HydrophobicContact CH2-CG 3.63Å; W175-Y206 HydrophobicContact CZ2-CG 4.24Å; W175-Y206 HydrophobicContact CZ3-CD1 4.25Å; W175-Y206 HydrophobicContact CZ3-CE1 4.34Å; W175-Y206 HydrophobicContact CZ3-CG 4.41Å
176S97.6Very high97.5Very high1 Ų124.2 Ų24.21%0.00714%0.14CC..SBendtrans65.5-168.2-158.9-161.50000112.9L198 N200 F203S176-L198 PolarHBondContact N-O 3.12Å; S176-N200 WeakPolarHBondContact CA-OD1 3.3Å; S176-F203 VanDerWaalsContact CB-CD1 3.44Å; S176-F203 VanDerWaalsContact CB-CG 3.43Å
177R97.8Very high97.5Very high28 Ų2822 Ų2211%0.10613%0.127CC..  trans-158.9161.1176.455.6171177.9-162.72.4111.2P7 I179 D190 T193 L198P7-R177 PolarHBondContact O-NH1 3.44Å; R177-I179 HydrophobicContact CG-CG2 3.9Å; R177-D190 HydrophobicContact CG-CB 3.88Å; R177-D190 IonicContact CZ-OD2 3.02Å; R177-D190 VanDerWaalsContact CZ-OD2 3.32Å; R177-D190 IonicContact NE-OD2 2.63Å; R177-D190 PolarHBondContact NE-OD2 3.05Å; R177-D190 IonicContact NH2-OD2 2.77Å; R177-D190 PolarHBondContact NH2-OD2 3.47Å; R177-D190 PolarHBondContact O-N 3.28Å; R177-D190 VanDerWaalsContact O-N 3.11Å; R177-T193 PolarHBondContact NH2-OG1 3.08Å; R177-L198 HydrophobicContact CB-CD1 4.3Å; R177-L198 HydrophobicContact CG-CD1 3.84Å
178Y98.4Very high97.5Very high4 Ų422.2 Ų22.22%0.01613%0.129CC..EExtended strand (participates in β ladder)trans-87.8128.4166.2-69.8-64.9000110.7G114 F115 T118 A168 P171 L172 G188 I189G114-Y178 VanDerWaalsContact C-CZ 3.45Å; G114-Y178 WeakPolarHBondContact O-CE1 3.32Å; G114-Y178 PolarHBondContact O-OH 2.89Å; F115-Y178 HydrophobicContact CB-CE2 4.08Å; T118-Y178 VanDerWaalsContact CB-OH 3.26Å; T118-Y178 WeakPolarHBondContact CB-OH 3.4Å; T118-Y178 VanDerWaalsContact OG1-CE1 3.27Å; T118-Y178 WeakPolarHBondContact OG1-CE1 3.29Å; T118-Y178 PolarHBondContact OG1-OH 3.42Å; A168-Y178 WeakPolarHBondContact CA-OH 3.38Å; A168-Y178 PolarHBondContact O-OH 3.47Å; A168-Y178 VanDerWaalsContact O-OH 3.14Å; P171-Y178 HydrophobicContact CB-CD2 3.9Å; P171-Y178 HydrophobicContact CB-CE2 3.74Å; P171-Y178 HydrophobicContact CB-CG 4.4Å; P171-Y178 HydrophobicContact CG-CE2 4.2Å; L172-Y178 HydrophobicContact CD2-CD2 3.8Å; L172-Y178 HydrophobicContact CD2-CE2 4.02Å; L172-Y178 HydrophobicContact CG-CD2 4.45Å; L172-Y178 HydrophobicContact CG-CE2 4.2Å; Y178-G188 WeakPolarHBondContact CA-O 3.14Å; Y178-I189 HydrophobicContact CD1-CD1 4.01Å; Y178-I189 HydrophobicContact CE1-CD1 3.41Å; Y178-I189 VanDerWaalsContact CE1-CD1 3.41Å; Y178-I189 HydrophobicContact CE1-CG1 4.33Å
179I98.1Very high97.4Very high1 Ų122.4 Ų22.41%0.00513%0.13CC..EExtended strand (participates in β ladder)trans-133.2155.1175.662.2166.7000111.6N8 R177 C187 G188 D190 Y192N8-I179 WeakPolarHBondContact O-CG2 3.34Å; R177-I179 HydrophobicContact CG-CG2 3.9Å; I179-C187 VanDerWaalsContact O-CA 3.32Å; I179-C187 WeakPolarHBondContact O-CA 3.4Å; I179-G188 PolarHBondContact N-O 3.36Å; I179-G188 PolarHBondContact O-N 2.93Å; I179-D190 HydrophobicContact CD1-CB 3.94Å; I179-D190 VanDerWaalsContact CD1-CG 3.45Å; I179-D190 WeakPolarHBondContact CD1-OD1 3.5Å; I179-D190 HydrophobicContact CG1-CB 4.02Å; I179-Y192 HydrophobicContact CD1-CD2 3.63Å; I179-Y192 HydrophobicContact CD1-CE2 4.44Å; I179-Y192 HydrophobicContact CD1-CG 4.31Å; I179-Y192 HydrophobicContact CG1-CD2 4.27Å
180P98.3Very high97.4Very high0 Ų018.7 Ų18.70%011%0.11CC..EExtended strand (participates in β ladder)trans-63.5136.9177.2-22.835000112.3P23 F24 F103 Q184 S186P23-P180 HydrophobicContact CB-CB 4.4Å; P23-P180 HydrophobicContact CB-CG 4.32Å; P23-P180 HydrophobicContact CG-CB 4.34Å; P23-P180 HydrophobicContact CG-CG 3.99Å; F24-P180 HydrophobicContact CE1-CG 3.72Å; F24-P180 HydrophobicContact CE2-CG 4.35Å; F24-P180 HydrophobicContact CZ-CG 3.58Å; F103-P180 HydrophobicContact CD2-CB 3.88Å; F103-P180 HydrophobicContact CD2-CG 3.92Å; F103-P180 HydrophobicContact CE2-CB 4Å; F103-P180 HydrophobicContact CE2-CG 4.34Å; F103-P180 HydrophobicContact CG-CG 4.46Å; P180-Q184 HydrophobicContact CB-CB 4.11Å; P180-Q184 PolarHBondContact O-OE1 3.18Å; P180-S186 CarbonylContact C-O 3.41Å; P180-S186 VanDerWaalsContact CA-O 3.32Å; P180-S186 WeakPolarHBondContact CA-O 3.39Å
181E97.1Very high97.2Very high6 Ų618 Ų183%0.02811%0.105CC..EExtended strand (participates in β ladder)trans-119.9152-175.655176.9-163.400112.6M183 Q184 S186 Y191 Y192 Y268 M288 A292E181-M183 PolarHBondContact O-N 2.72Å; E181-Q184 WeakPolarHBondContact O-CA 3.38Å; E181-Q184 PolarHBondContact O-N 3.18Å; E181-S186 WeakPolarHBondContact CG-O 3.18Å; E181-S186 PolarHBondContact N-O 3.48Å; E181-S186 PolarHBondContact OE1-OG 3.15Å; E181-S186 VanDerWaalsContact OE1-OG 3.05Å; E181-Y191 WeakPolarHBondContact CB-OH 3.13Å; E181-Y191 PolarHBondContact OE2-OH 3.15Å; E181-Y192 HydrophobicContact CB-CE2 4.01Å; E181-Y192 WeakPolarHBondContact CB-OH 3.4Å; E181-Y268 PolarHBondContact OE2-OH 3.01Å; E181-M288 HydrophobicContact CB-CG 4.18Å; E181-A292 WeakPolarHBondContact OE1-CB 3.45Å
182G96.2Very high97Very high1 Ų117.8 Ų17.81%0.0110%0.103CC..THydrogen-bonded Turntrans60.1-119.8178.300000113.9Q184 Y192 P285 T289G182-Q184 PolarHBondContact O-N 2.98Å; G182-Q184 PolarHBondContact O-NE2 3.35Å; G182-Y192 PolarHBondContact N-OH 3.21Å; G182-P285 CarbonylContact C-O 3.27Å; G182-P285 WeakPolarHBondContact CA-O 3.3Å; G182-P285 WeakPolarHBondContact O-CB 3.31Å; G182-T289 WeakPolarHBondContact CA-OG1 3.23Å
183M97.5Very high96.8Very high5 Ų514.4 Ų14.43%0.0259%0.086CC..THydrogen-bonded Turntrans-70.43.7172.3-72.2178.251.400114.1A32 K36 Y37 L40 E181 P285 T289A32-M183 HydrophobicContact CB-CE 3.56Å; A32-M183 HydrophobicContact CB-CG 4.24Å; A32-M183 HydrophobicContact CB-SD 3.91Å; K36-M183 HydrophobicContact CB-CE 3.78Å; K36-M183 HydrophobicContact CB-SD 4.35Å; Y37-M183 HydrophobicContact CD1-CE 3.79Å; Y37-M183 HydrophobicContact CD2-CE 3.58Å; Y37-M183 HydrophobicContact CE1-CB 4.11Å; Y37-M183 HydrophobicContact CE1-CE 3.66Å; Y37-M183 WeakPolarHBondContact CE1-O 3.16Å; Y37-M183 HydrophobicContact CE2-CE 3.44Å; Y37-M183 VanDerWaalsContact CE2-CE 3.44Å; Y37-M183 HydrophobicContact CG-CE 3.76Å; Y37-M183 VanDerWaalsContact CZ-CE 3.47Å; Y37-M183 PolarHBondContact OH-O 3.02Å; Y37-M183 VanDerWaalsContact OH-O 3.08Å; L40-M183 HydrophobicContact CD1-CE 3.87Å; L40-M183 HydrophobicContact CD1-SD 4.04Å; E181-M183 PolarHBondContact O-N 2.72Å; M183-P285 HydrophobicContact CG-CB 4.11Å; M183-T289 HydrophobicContact CG-CG2 4.29Å; M183-T289 WeakPolarHBondContact CG-OG1 3.37Å; M183-T289 PolarHBondContact N-OG1 3.32Å; M183-T289 HydrophobicContact SD-CG2 4.03Å
184Q97.6Very high96.3Very high0 Ų013.2 Ų13.20%08%0.077CC..THydrogen-bonded Turntrans69.337.5173.5-41-70-68.400113.6P23 Q28 L31 F103 P180 E181 G182P23-Q184 HydrophobicContact CB-CB 3.83Å; P23-Q184 HydrophobicContact CB-CG 4.21Å; Q28-Q184 HydrophobicContact CG-CB 3.97Å; Q28-Q184 HydrophobicContact CG-CG 4.2Å; L31-Q184 HydrophobicContact CD1-CG 3.56Å; F103-Q184 WeakPolarHBondContact CD2-O 3.4Å; F103-Q184 WeakPolarHBondContact CE2-O 3.23Å; P180-Q184 HydrophobicContact CB-CB 4.11Å; P180-Q184 PolarHBondContact O-OE1 3.18Å; E181-Q184 WeakPolarHBondContact O-CA 3.38Å; E181-Q184 PolarHBondContact O-N 3.18Å; G182-Q184 PolarHBondContact O-N 2.98Å; G182-Q184 PolarHBondContact O-NE2 3.35Å
185C96.3Very high96.1Very high1 Ų112.1 Ų12.11%0.0076%0.061CC..THydrogen-bonded Turntrans-122.5-1172.9-60.40000113.5Y37 T94 T97 A98 F103 F293Y37-C185 WeakPolarHBondContact CD1-SG 3.4Å; Y37-C185 WeakPolarHBondContact CE1-SG 3.12Å; T94-C185 WeakPolarHBondContact CG2-O 3.29Å; T97-C185 PolarHBondContact OG1-O 3.3Å; T97-C185 VanDerWaalsContact OG1-O 3.06Å; A98-C185 HydrophobicContact CB-CB 4.3Å; F103-C185 VanDerWaalsContact CE2-CA 3.44Å; F103-C185 VanDerWaalsContact CZ-C 3.44Å; C185-F293 HydrophobicContact CB-CZ 4.42Å
186S97.7Very high95.6Very high1 Ų113.3 Ų13.31%0.0078%0.081CC..EExtended strand (participates in β ladder)trans-124.9155.5169.7-176.80000107.2F103 P180 E181 K296F103-S186 WeakPolarHBondContact CE2-O 3.49Å; P180-S186 CarbonylContact C-O 3.41Å; P180-S186 VanDerWaalsContact CA-O 3.32Å; P180-S186 WeakPolarHBondContact CA-O 3.39Å; E181-S186 WeakPolarHBondContact CG-O 3.18Å; E181-S186 PolarHBondContact N-O 3.48Å; E181-S186 PolarHBondContact OE1-OG 3.15Å; E181-S186 VanDerWaalsContact OE1-OG 3.05Å; S186-K296 WeakPolarHBondContact OG-CE 3.37Å; S186-K296 PolarHBondContact OG-NZ 3Å
187C98.4Very high95.3Very high4 Ų422.1 Ų22.13%0.02712%0.121CC..EExtended strand (participates in β ladder)trans-118.1144.9173.8-76.20000110.9F103 C110 E113 I179F103-C187 VanDerWaalsContact CE1-SG 3.54Å; F103-C187 HydrophobicContact CZ-CB 4.22Å; F103-C187 WeakPolarHBondContact CZ-SG 3.33Å; C110-C187 WeakPolarHBondContact CA-SG 3.48Å; C110-C187 HydrophobicContact CB-CB 4.13Å; C110-C187 WeakPolarHBondContact CB-SG 3.45Å; C110-C187 WeakPolarHBondContact O-CB 3.47Å; C110-C187 WeakPolarHBondContact SG-CB 3.42Å; C110-C187 CovalentContact SG-SG 2.02Å; C110-C187 PolarHBondContact SG-SG 2.85Å; E113-C187 WeakPolarHBondContact OE2-CA 3.19Å; E113-C187 WeakPolarHBondContact OE2-CB 3.42Å; E113-C187 PolarHBondContact OE2-N 3.42Å; I179-C187 VanDerWaalsContact O-CA 3.32Å; I179-C187 WeakPolarHBondContact O-CA 3.4Å
188G97.4Very high95Very high3 Ų323 Ų233%0.03113%0.128CC..EExtended strand (participates in β ladder)trans-146.7178.1-179.400000111Y178 I179Y178-G188 WeakPolarHBondContact CA-O 3.14Å; I179-G188 PolarHBondContact N-O 3.36Å; I179-G188 PolarHBondContact O-N 2.93Å
189I97.6Very high94.9Very high4 Ų423.7 Ų23.72%0.02114%0.136CC..EExtended strand (participates in β ladder)trans-62144.8175.1-58.5-58.9000109.8P171 Y178 Y191 F203 V204 M207P171-I189 HydrophobicContact CB-CD1 4.27Å; P171-I189 HydrophobicContact CG-CD1 3.48Å; P171-I189 VanDerWaalsContact CG-CD1 3.48Å; Y178-I189 HydrophobicContact CD1-CD1 4.01Å; Y178-I189 HydrophobicContact CE1-CD1 3.41Å; Y178-I189 VanDerWaalsContact CE1-CD1 3.41Å; Y178-I189 HydrophobicContact CE1-CG1 4.33Å; I189-Y191 WeakPolarHBondContact O-CD1 3.02Å; I189-Y191 WeakPolarHBondContact O-CE1 3.38Å; I189-Y191 PolarHBondContact O-N 3.44Å; I189-F203 HydrophobicContact CB-CE1 4.46Å; I189-F203 HydrophobicContact CD1-CE1 3.7Å; I189-F203 HydrophobicContact CD1-CZ 4.25Å; I189-F203 HydrophobicContact CG1-CE1 4.03Å; I189-F203 HydrophobicContact CG2-CD1 3.6Å; I189-F203 HydrophobicContact CG2-CE1 3.57Å; I189-V204 HydrophobicContact CG2-CG2 4.32Å; I189-M207 HydrophobicContact CG1-SD 4.22Å
190D97.1Very high94.7Very high0 Ų023.7 Ų23.70%014%0.136CC..  trans-74.888.1177.3-168.2-9.5000112.6R177 I179 Y192 T193 N200R177-D190 HydrophobicContact CG-CB 3.88Å; R177-D190 IonicContact CZ-OD2 3.02Å; R177-D190 VanDerWaalsContact CZ-OD2 3.32Å; R177-D190 IonicContact NE-OD2 2.63Å; R177-D190 PolarHBondContact NE-OD2 3.05Å; R177-D190 IonicContact NH2-OD2 2.77Å; R177-D190 PolarHBondContact NH2-OD2 3.47Å; R177-D190 PolarHBondContact O-N 3.28Å; R177-D190 VanDerWaalsContact O-N 3.11Å; I179-D190 HydrophobicContact CD1-CB 3.94Å; I179-D190 VanDerWaalsContact CD1-CG 3.45Å; I179-D190 WeakPolarHBondContact CD1-OD1 3.5Å; I179-D190 HydrophobicContact CG1-CB 4.02Å; D190-Y192 PolarHBondContact OD1-N 3.24Å; D190-Y192 VanDerWaalsContact OD1-N 3.08Å; D190-T193 VanDerWaalsContact CG-OG1 3.26Å; D190-T193 PolarHBondContact OD1-N 3.04Å; D190-T193 PolarHBondContact OD1-OG1 3.18Å; D190-T193 PolarHBondContact OD2-OG1 3.46Å; D190-N200 PolarHBondContact OD2-ND2 3.24Å
191Y95.3Very high94.6Very high5 Ų526.5 Ų26.52%0.0215%0.154CC..  trans-92.9-0.7166.145.5-99.4000112.6E181 I189 A272 I275 F276 Q279 M288E181-Y191 WeakPolarHBondContact CB-OH 3.13Å; E181-Y191 PolarHBondContact OE2-OH 3.15Å; I189-Y191 WeakPolarHBondContact O-CD1 3.02Å; I189-Y191 WeakPolarHBondContact O-CE1 3.38Å; I189-Y191 PolarHBondContact O-N 3.44Å; Y191-A272 HydrophobicContact CD1-CB 3.86Å; Y191-A272 HydrophobicContact CD2-CB 4.48Å; Y191-A272 HydrophobicContact CE1-CB 4.04Å; Y191-A272 HydrophobicContact CG-CB 4.15Å; Y191-I275 HydrophobicContact CD2-CB 3.81Å; Y191-I275 HydrophobicContact CD2-CD1 4.18Å; Y191-I275 HydrophobicContact CD2-CG2 3.64Å; Y191-I275 HydrophobicContact CE2-CB 4.25Å; Y191-I275 HydrophobicContact CE2-CD1 3.72Å; Y191-I275 HydrophobicContact CE2-CG2 4.15Å; Y191-F276 WeakPolarHBondContact O-CA 3.24Å; Y191-Q279 PolarHBondContact O-NE2 3.08Å; Y191-M288 HydrophobicContact CE1-CE 3.88Å; Y191-M288 HydrophobicContact CE2-CE 4.17Å; Y191-M288 VanDerWaalsContact CZ-CE 3.42Å; Y191-M288 WeakPolarHBondContact OH-CE 3.2Å; Y191-M288 VanDerWaalsContact OH-CG 3.28Å; Y191-M288 WeakPolarHBondContact OH-CG 3.24Å
192Y93.8Very high94.6Very high4 Ų429.1 Ų29.12%0.01617%0.173CC..SBendtrans-86.6-39.3-174.7-67-82.1000113.2Y10 I179 E181 G182 D190 I275 Q279 F283Y10-Y192 AromaticContact CD1-CD1 3.56Å; Y10-Y192 HydrophobicContact CD1-CD1 3.56Å; Y10-Y192 HydrophobicContact CD1-CE1 4.27Å; Y10-Y192 AromaticContact CD1-CG 3.93Å; Y10-Y192 HydrophobicContact CD1-CG 3.93Å; Y10-Y192 AromaticContact CE1-CD1 3.97Å; Y10-Y192 HydrophobicContact CE1-CD1 3.97Å; Y10-Y192 HydrophobicContact CG-CD1 4.29Å; Y10-Y192 HydrophobicContact CG-CG 4.22Å; I179-Y192 HydrophobicContact CD1-CD2 3.63Å; I179-Y192 HydrophobicContact CD1-CE2 4.44Å; I179-Y192 HydrophobicContact CD1-CG 4.31Å; I179-Y192 HydrophobicContact CG1-CD2 4.27Å; E181-Y192 HydrophobicContact CB-CE2 4.01Å; E181-Y192 WeakPolarHBondContact CB-OH 3.4Å; G182-Y192 PolarHBondContact N-OH 3.21Å; D190-Y192 PolarHBondContact OD1-N 3.24Å; D190-Y192 VanDerWaalsContact OD1-N 3.08Å; Y192-I275 HydrophobicContact CD1-CG2 3.57Å; Y192-I275 HydrophobicContact CE1-CD1 3.89Å; Y192-I275 HydrophobicContact CE1-CG2 3.89Å; Y192-I275 HydrophobicContact CG-CG2 4.23Å; Y192-Q279 WeakPolarHBondContact O-CG 3.48Å; Y192-F283 AromaticContact CD1-CE2 3.61Å; Y192-F283 HydrophobicContact CD1-CE2 3.61Å; Y192-F283 AromaticContact CD1-CZ 3.76Å; Y192-F283 HydrophobicContact CD1-CZ 3.76Å; Y192-F283 HydrophobicContact CE1-CD2 4.33Å; Y192-F283 AromaticContact CE1-CE2 3.53Å; Y192-F283 HydrophobicContact CE1-CE2 3.53Å; Y192-F283 HydrophobicContact CE1-CZ 4.14Å
193T92.8Very high94.7Very high1 Ų129 Ų291%0.00617%0.172CC..  trans-116.2135.5-171.572.40000111.8E5 Y10 R177 D190 T195 N200E5-T193 HydrophobicContact CG-CG2 3.97Å; E5-T193 WeakPolarHBondContact OE1-CG2 3.24Å; Y10-T193 HydrophobicContact CD2-CG2 4.02Å; Y10-T193 HydrophobicContact CG-CG2 4.42Å; R177-T193 PolarHBondContact NH2-OG1 3.08Å; D190-T193 VanDerWaalsContact CG-OG1 3.26Å; D190-T193 PolarHBondContact OD1-N 3.04Å; D190-T193 PolarHBondContact OD1-OG1 3.18Å; D190-T193 PolarHBondContact OD2-OG1 3.46Å; T193-T195 PolarHBondContact O-N 2.85Å; T193-T195 VanDerWaalsContact O-N 3.07Å; T193-T195 PolarHBondContact OG1-OG1 2.92Å; T193-N200 WeakPolarHBondContact O-CB 3.44Å; T193-N200 PolarHBondContact O-ND2 3.35Å; T193-N200 PolarHBondContact OG1-ND2 3.32Å; T193-N200 VanDerWaalsContact OG1-ND2 3.12Å
194P87.1Confident94.6Very high70 Ų7028.9 Ų28.946%0.45517%0.172SC..  trans-84.459.8172.433.6-32.7000110.5P196P194-P196 WeakPolarHBondContact O-CD 3.12Å; P194-P196 WeakPolarHBondContact O-CG 3.43Å
195T89Confident94.6Very high24 Ų2432.8 Ų32.815%0.14719%0.191CC..  trans-76.4103.4179.6-56.60000109.9T193 E197 L198 G199 N200T193-T195 PolarHBondContact O-N 2.85Å; T193-T195 VanDerWaalsContact O-N 3.07Å; T193-T195 PolarHBondContact OG1-OG1 2.92Å; T195-E197 VanDerWaalsContact C-N 3.33Å; T195-E197 HydrophobicContact CG2-CB 4.41Å; T195-E197 PolarHBondContact O-N 2.94Å; T195-L198 HydrophobicContact CG2-CB 4.23Å; T195-L198 HydrophobicContact CG2-CD1 4.02Å; T195-L198 HydrophobicContact CG2-CG 3.98Å; T195-L198 PolarHBondContact O-N 3.05Å; T195-G199 PolarHBondContact O-N 3.13Å; T195-N200 PolarHBondContact O-N 3.23Å
196P87.3Confident94.7Very high117 Ų11735.1 Ų35.176%0.7620%0.2SC*.G310 helixtrans-71.6-30.5-171.5-17.234.4000112.2P194 L198 G199P194-P196 WeakPolarHBondContact O-CD 3.12Å; P194-P196 WeakPolarHBondContact O-CG 3.43Å; P196-L198 PolarHBondContact O-N 2.61Å; P196-G199 PolarHBondContact O-N 3.04Å
197E90.6Very high94.6Very high185 Ų18537 Ų3786%0.86421%0.209SC*.G310 helixtrans-59.6-33.5178.1-62.4178-177.200112.6T195T195-E197 VanDerWaalsContact C-N 3.33Å; T195-E197 HydrophobicContact CG2-CB 4.41Å; T195-E197 PolarHBondContact O-N 2.94Å
198L91.9Very high94.6Very high46 Ų4637.8 Ų37.824%0.24121%0.212CC..G310 helixtrans-93.8-8176.2-62.9176.6000112.6S176 R177 T195 P196 N200S176-L198 PolarHBondContact N-O 3.12Å; R177-L198 HydrophobicContact CB-CD1 4.3Å; R177-L198 HydrophobicContact CG-CD1 3.84Å; T195-L198 HydrophobicContact CG2-CB 4.23Å; T195-L198 HydrophobicContact CG2-CD1 4.02Å; T195-L198 HydrophobicContact CG2-CG 3.98Å; T195-L198 PolarHBondContact O-N 3.05Å; P196-L198 PolarHBondContact O-N 2.61Å; L198-N200 VanDerWaalsContact C-N 3.31Å; L198-N200 WeakPolarHBondContact CB-OD1 3.33Å; L198-N200 PolarHBondContact O-N 3.45Å
199G95.6Very high94.5Very high19 Ų1941 Ų4120%0.19623%0.232CC..THydrogen-bonded Turntrans65.727.1-17800000114.6T195 P196 T201 S202 F203T195-G199 PolarHBondContact O-N 3.13Å; P196-G199 PolarHBondContact O-N 3.04Å; G199-T201 VanDerWaalsContact C-N 3.3Å; G199-T201 PolarHBondContact O-N 2.99Å; G199-S202 PolarHBondContact O-N 2.91Å; G199-S202 PolarHBondContact O-OG 3.13Å; G199-F203 PolarHBondContact O-N 2.99Å; G199-F203 VanDerWaalsContact O-N 3.08Å
200N94.9Very high94.5Very high1 Ų143 Ų431%0.00524%0.242CC..Hα-helixtrans-46.8-49.7-176.6-72.4-0.4000112.8S176 D190 T193 T195 L198 S202 F203 V204S176-N200 WeakPolarHBondContact CA-OD1 3.3Å; D190-N200 PolarHBondContact OD2-ND2 3.24Å; T193-N200 WeakPolarHBondContact O-CB 3.44Å; T193-N200 PolarHBondContact O-ND2 3.35Å; T193-N200 PolarHBondContact OG1-ND2 3.32Å; T193-N200 VanDerWaalsContact OG1-ND2 3.12Å; T195-N200 PolarHBondContact O-N 3.23Å; L198-N200 VanDerWaalsContact C-N 3.31Å; L198-N200 WeakPolarHBondContact CB-OD1 3.33Å; L198-N200 PolarHBondContact O-N 3.45Å; N200-S202 VanDerWaalsContact C-N 3.34Å; N200-S202 PolarHBondContact O-N 3.48Å; N200-F203 PolarHBondContact O-N 2.66Å; N200-V204 WeakPolarHBondContact O-CG2 3.47Å; N200-V204 PolarHBondContact O-N 2.89Å
201T95.1Very high94.5Very high60 Ų6043.2 Ų43.237%0.36824%0.243SC..Hα-helixtrans-57.8-45.6-179.4-52.10000112.5G199 F203 I205 F276G199-T201 VanDerWaalsContact C-N 3.3Å; G199-T201 PolarHBondContact O-N 2.99Å; T201-F203 VanDerWaalsContact C-N 3.34Å; T201-F203 PolarHBondContact O-N 3.49Å; T201-I205 HydrophobicContact CG2-CD1 4.15Å; T201-I205 WeakPolarHBondContact O-CG1 3.35Å; T201-I205 PolarHBondContact O-N 3.38Å; T201-I205 VanDerWaalsContact O-N 3.16Å; T201-F276 HydrophobicContact CG2-CE2 3.95Å; T201-F276 HydrophobicContact CG2-CZ 3.81Å
202S97.1Very high94.4Very high60 Ų6044.7 Ų44.742%0.4225%0.25SC..Hα-helixtrans-66-38.6179.467.30000112W175 G199 N200 Y206W175-S202 PolarHBondContact NE1-OG 3.34Å; G199-S202 PolarHBondContact O-N 2.91Å; G199-S202 PolarHBondContact O-OG 3.13Å; N200-S202 VanDerWaalsContact C-N 3.34Å; N200-S202 PolarHBondContact O-N 3.48Å; S202-Y206 WeakPolarHBondContact O-CB 3.41Å; S202-Y206 PolarHBondContact O-N 2.93Å
203F97.8Very high94.4Very high0 Ų047.1 Ų47.10%027%0.267CS..Hα-helixtrans-68.7-42.5179.1-175.6-92.9000112.1C167 P170 P171 W175 S176 I189 G199 N200 T201 I205 Y206 M207C167-F203 WeakPolarHBondContact O-CZ 3.34Å; P170-F203 HydrophobicContact CB-CD2 4.27Å; P170-F203 HydrophobicContact CB-CE2 3.77Å; P170-F203 HydrophobicContact CG-CE2 4.04Å; P171-F203 HydrophobicContact CG-CE1 4.06Å; P171-F203 HydrophobicContact CG-CE2 4.27Å; P171-F203 HydrophobicContact CG-CZ 3.74Å; W175-F203 HydrophobicContact CD2-CB 4.43Å; W175-F203 AromaticContact CD2-CD2 3.7Å; W175-F203 HydrophobicContact CD2-CD2 3.7Å; W175-F203 AromaticContact CE2-CD2 3.88Å; W175-F203 AromaticContact CE3-CD2 3.94Å; W175-F203 HydrophobicContact CE3-CD2 3.94Å; W175-F203 HydrophobicContact CE3-CE2 4.43Å; W175-F203 HydrophobicContact CG-CB 4.45Å; W175-F203 HydrophobicContact CG-CD2 4.07Å; W175-F203 HydrophobicContact CH2-CD2 4.44Å; W175-F203 HydrophobicContact CZ2-CB 4.4Å; W175-F203 HydrophobicContact CZ2-CD2 4.26Å; W175-F203 HydrophobicContact CZ3-CD2 4.29Å; S176-F203 VanDerWaalsContact CB-CD1 3.44Å; S176-F203 VanDerWaalsContact CB-CG 3.43Å; I189-F203 HydrophobicContact CB-CE1 4.46Å; I189-F203 HydrophobicContact CD1-CE1 3.7Å; I189-F203 HydrophobicContact CD1-CZ 4.25Å; I189-F203 HydrophobicContact CG1-CE1 4.03Å; I189-F203 HydrophobicContact CG2-CD1 3.6Å; I189-F203 HydrophobicContact CG2-CE1 3.57Å; G199-F203 PolarHBondContact O-N 2.99Å; G199-F203 VanDerWaalsContact O-N 3.08Å; N200-F203 PolarHBondContact O-N 2.66Å; T201-F203 VanDerWaalsContact C-N 3.34Å; T201-F203 PolarHBondContact O-N 3.49Å; F203-I205 PolarHBondContact O-N 3.07Å; F203-Y206 HydrophobicContact CD2-CD1 4.17Å; F203-Y206 HydrophobicContact CE2-CD1 4.09Å; F203-Y206 HydrophobicContact CE2-CE1 4.23Å; F203-Y206 WeakPolarHBondContact O-CB 3.32Å; F203-Y206 PolarHBondContact O-N 3.38Å; F203-M207 HydrophobicContact CE1-CB 4.5Å; F203-M207 WeakPolarHBondContact O-CB 3.41Å; F203-M207 PolarHBondContact O-N 2.91Å
204V96.9Very high94.6Very high2 Ų250.5 Ų50.51%0.01228%0.284CS..Hα-helixtrans-62.4-44.3177175.10000110.6I189 N200 Y206 M207 F208 F276I189-V204 HydrophobicContact CG2-CG2 4.32Å; N200-V204 WeakPolarHBondContact O-CG2 3.47Å; N200-V204 PolarHBondContact O-N 2.89Å; V204-Y206 VanDerWaalsContact C-N 3.33Å; V204-Y206 PolarHBondContact O-N 3.47Å; V204-M207 PolarHBondContact O-N 3.19Å; V204-F208 HydrophobicContact CG1-CD2 3.76Å; V204-F208 HydrophobicContact CG1-CE2 3.91Å; V204-F208 WeakPolarHBondContact O-CD2 3.07Å; V204-F208 PolarHBondContact O-N 3.06Å; V204-F276 HydrophobicContact CB-CD2 4.05Å; V204-F276 HydrophobicContact CB-CE2 4.01Å; V204-F276 HydrophobicContact CB-CG 4.45Å; V204-F276 HydrophobicContact CB-CZ 4.36Å; V204-F276 HydrophobicContact CG1-CB 4.17Å; V204-F276 HydrophobicContact CG1-CD1 3.87Å; V204-F276 HydrophobicContact CG1-CD2 3.73Å; V204-F276 HydrophobicContact CG1-CE1 4.16Å; V204-F276 HydrophobicContact CG1-CE2 4.05Å; V204-F276 HydrophobicContact CG1-CG 3.63Å; V204-F276 HydrophobicContact CG1-CZ 4.24Å; V204-F276 HydrophobicContact CG2-CD2 4.29Å
205I97.1Very high94.9Very high81 Ų8147.1 Ų47.142%0.41526%0.263SS..Hα-helixtrans-61.3-43.6175.5-66.5167.4000111T201 F203 T209 F276T201-I205 HydrophobicContact CG2-CD1 4.15Å; T201-I205 WeakPolarHBondContact O-CG1 3.35Å; T201-I205 PolarHBondContact O-N 3.38Å; T201-I205 VanDerWaalsContact O-N 3.16Å; F203-I205 PolarHBondContact O-N 3.07Å; I205-T209 VanDerWaalsContact O-CB 3.29Å; I205-T209 WeakPolarHBondContact O-CB 2.93Å; I205-T209 PolarHBondContact O-N 3.18Å; I205-T209 PolarHBondContact O-OG1 3Å; I205-F276 HydrophobicContact CD1-CZ 4.4Å; I205-F276 HydrophobicContact CG1-CE1 4.23Å; I205-F276 HydrophobicContact CG1-CZ 4.04Å
206Y97.9Very high95.1Very high51 Ų5148.3 Ų48.320%0.227%0.268CS..Hα-helixtrans-57-50.3174.7161-98.9000111.8T166 W175 S202 F203 V204 T209 L210 H211T166-Y206 VanDerWaalsContact CB-OH 3.22Å; T166-Y206 WeakPolarHBondContact CB-OH 3.32Å; T166-Y206 PolarHBondContact O-OH 3.38Å; T166-Y206 PolarHBondContact OG1-OH 3.49Å; W175-Y206 AromaticContact CH2-CD1 3.86Å; W175-Y206 HydrophobicContact CH2-CD1 3.86Å; W175-Y206 AromaticContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CD2 3.94Å; W175-Y206 HydrophobicContact CH2-CE1 4.34Å; W175-Y206 HydrophobicContact CH2-CE2 4.4Å; W175-Y206 AromaticContact CH2-CG 3.63Å; W175-Y206 HydrophobicContact CH2-CG 3.63Å; W175-Y206 HydrophobicContact CZ2-CG 4.24Å; W175-Y206 HydrophobicContact CZ3-CD1 4.25Å; W175-Y206 HydrophobicContact CZ3-CE1 4.34Å; W175-Y206 HydrophobicContact CZ3-CG 4.41Å; S202-Y206 WeakPolarHBondContact O-CB 3.41Å; S202-Y206 PolarHBondContact O-N 2.93Å; F203-Y206 HydrophobicContact CD2-CD1 4.17Å; F203-Y206 HydrophobicContact CE2-CD1 4.09Å; F203-Y206 HydrophobicContact CE2-CE1 4.23Å; F203-Y206 WeakPolarHBondContact O-CB 3.32Å; F203-Y206 PolarHBondContact O-N 3.38Å; V204-Y206 VanDerWaalsContact C-N 3.33Å; V204-Y206 PolarHBondContact O-N 3.47Å; Y206-T209 PolarHBondContact O-N 2.82Å; Y206-L210 HydrophobicContact CD2-CB 4.41Å; Y206-L210 HydrophobicContact CD2-CD2 4.29Å; Y206-L210 HydrophobicContact CE2-CB 4.2Å; Y206-L210 HydrophobicContact CE2-CD2 3.36Å; Y206-L210 HydrophobicContact CE2-CG 4.42Å; Y206-L210 WeakPolarHBondContact O-CB 3.27Å; Y206-L210 PolarHBondContact O-N 3.18Å; Y206-H211 AromaticContact CE1-CD2 3.78Å; Y206-H211 AromaticContact CE1-NE2 3.84Å; Y206-H211 AromaticContact CZ-CD2 3.86Å; Y206-H211 AromaticContact CZ-NE2 3.56Å; Y206-H211 PolarHBondContact OH-NE2 3.49Å; Y206-H211 VanDerWaalsContact OH-NE2 3.11Å
207M97.1Very high95.4Very high39 Ų3947.7 Ų47.719%0.19226%0.262CS..Hα-helixtrans-59.2-51.5179.4-176.3-162.9178.900111.2I189 F203 V204 T209 H211 F212I189-M207 HydrophobicContact CG1-SD 4.22Å; F203-M207 HydrophobicContact CE1-CB 4.5Å; F203-M207 WeakPolarHBondContact O-CB 3.41Å; F203-M207 PolarHBondContact O-N 2.91Å; V204-M207 PolarHBondContact O-N 3.19Å; M207-T209 PolarHBondContact O-N 3.2Å; M207-H211 HydrophobicContact CG-CB 4.27Å; M207-H211 CarbonylContact O-C 3.58Å; M207-H211 VanDerWaalsContact O-CA 3.22Å; M207-H211 WeakPolarHBondContact O-CA 3.23Å; M207-H211 VanDerWaalsContact O-CB 3.23Å; M207-H211 WeakPolarHBondContact O-CB 3.25Å; M207-H211 PolarHBondContact O-N 3.36Å; M207-F212 PolarHBondContact O-N 2.88Å
208F96.6Very high95.7Very high21 Ų2141.3 Ų41.39%0.09223%0.233CC..Hα-helixtrans-67.1-25.8-179.2-86.3-89.4000113.6V204 F212 S213 A269 A272 W273V204-F208 HydrophobicContact CG1-CD2 3.76Å; V204-F208 HydrophobicContact CG1-CE2 3.91Å; V204-F208 WeakPolarHBondContact O-CD2 3.07Å; V204-F208 PolarHBondContact O-N 3.06Å; F208-F212 HydrophobicContact CD1-CD1 4.2Å; F208-F212 HydrophobicContact CD1-CG 4.5Å; F208-F212 WeakPolarHBondContact O-CB 3.36Å; F208-S213 WeakPolarHBondContact O-CB 3.22Å; F208-S213 PolarHBondContact O-N 3.08Å; F208-S213 PolarHBondContact O-OG 3.48Å; F208-A269 HydrophobicContact CE1-CB 4Å; F208-A269 WeakPolarHBondContact CE1-O 3.32Å; F208-A269 HydrophobicContact CZ-CB 4.48Å; F208-A269 VanDerWaalsContact CZ-O 3.26Å; F208-A269 WeakPolarHBondContact CZ-O 3.44Å; F208-A272 HydrophobicContact CE2-CB 4.48Å; F208-A272 HydrophobicContact CZ-CB 4.06Å; F208-W273 HydrophobicContact CB-CE3 4.01Å; F208-W273 HydrophobicContact CB-CZ3 3.76Å; F208-W273 HydrophobicContact CD1-CD2 4.38Å; F208-W273 AromaticContact CD1-CE3 3.66Å; F208-W273 HydrophobicContact CD1-CE3 3.66Å; F208-W273 HydrophobicContact CD1-CZ3 4.29Å; F208-W273 AromaticContact CD2-CE3 3.58Å; F208-W273 HydrophobicContact CD2-CE3 3.58Å; F208-W273 AromaticContact CD2-CZ3 3.95Å; F208-W273 HydrophobicContact CD2-CZ3 3.95Å; F208-W273 HydrophobicContact CE1-CB 3.75Å; F208-W273 HydrophobicContact CE1-CD2 4.44Å; F208-W273 AromaticContact CE1-CE3 3.97Å; F208-W273 HydrophobicContact CE1-CE3 3.97Å; F208-W273 HydrophobicContact CE1-CG 4.41Å; F208-W273 HydrophobicContact CE2-CB 4.48Å; F208-W273 AromaticContact CE2-CE3 3.89Å; F208-W273 HydrophobicContact CE2-CE3 3.89Å; F208-W273 AromaticContact CG-CE3 3.45Å; F208-W273 HydrophobicContact CG-CE3 3.45Å; F208-W273 VanDerWaalsContact CG-CE3 3.45Å; F208-W273 AromaticContact CG-CZ3 3.73Å; F208-W273 HydrophobicContact CG-CZ3 3.73Å; F208-W273 HydrophobicContact CZ-CB 3.73Å; F208-W273 HydrophobicContact CZ-CE3 4.07Å
209T96.9Very high95.7Very high71 Ų7139.6 Ų39.644%0.43622%0.224SC..Iπ-helixtrans-81-58.4177.4-550000110.8I205 Y206 M207 S213 I214I205-T209 VanDerWaalsContact O-CB 3.29Å; I205-T209 WeakPolarHBondContact O-CB 2.93Å; I205-T209 PolarHBondContact O-N 3.18Å; I205-T209 PolarHBondContact O-OG1 3Å; Y206-T209 PolarHBondContact O-N 2.82Å; M207-T209 PolarHBondContact O-N 3.2Å; T209-S213 PolarHBondContact O-N 2.85Å; T209-I214 WeakPolarHBondContact O-CG1 3.4Å; T209-I214 PolarHBondContact O-N 3.4Å
210L97.4Very high95.5Very high46 Ų4640.9 Ų40.924%0.24124%0.237CC..Iπ-helixtrans-83.9-35.6-171.7-17662.2000113.5W126 M163 Y206 I214 P215W126-L210 WeakPolarHBondContact CZ2-O 3.26Å; M163-L210 HydrophobicContact CE-CD1 4.17Å; M163-L210 HydrophobicContact CE-CD2 3.94Å; M163-L210 HydrophobicContact CE-CG 4.08Å; Y206-L210 HydrophobicContact CD2-CB 4.41Å; Y206-L210 HydrophobicContact CD2-CD2 4.29Å; Y206-L210 HydrophobicContact CE2-CB 4.2Å; Y206-L210 HydrophobicContact CE2-CD2 3.36Å; Y206-L210 HydrophobicContact CE2-CG 4.42Å; Y206-L210 WeakPolarHBondContact O-CB 3.27Å; Y206-L210 PolarHBondContact O-N 3.18Å; L210-I214 HydrophobicContact CD1-CD1 3.92Å; L210-P215 WeakPolarHBondContact O-CD 3.46Å; L210-P215 WeakPolarHBondContact O-CG 3.41Å
211H96.4Very high95.5Very high4 Ų446.4 Ų46.42%0.01926%0.262CS..Iπ-helixtrans-104.613.3-174-66.4-82.6000113E122 L125 W126 M163 T166 Y206 M207E122-H211 WeakPolarHBondContact OE1-CB 3.25Å; E122-H211 IonicContact OE1-CG 3.64Å; E122-H211 IonicContact OE1-ND1 3.8Å; E122-H211 IonicContact OE2-CE1 3.82Å; E122-H211 IonicContact OE2-CG 3.49Å; E122-H211 IonicContact OE2-ND1 3.44Å; E122-H211 PolarHBondContact OE2-ND1 2.88Å; L125-H211 WeakPolarHBondContact CD2-O 3.38Å; W126-H211 AromaticContact CE2-ND1 3.96Å; W126-H211 AromaticContact NE1-CE1 3.63Å; W126-H211 AromaticContact NE1-ND1 3.26Å; W126-H211 PolarHBondContact NE1-ND1 3.12Å; M163-H211 PolarHBondContact O-CE1 2.91Å; T166-H211 PolarHBondContact OG1-CE1 3.37Å; T166-H211 PolarHBondContact OG1-NE2 3.01Å; Y206-H211 AromaticContact CE1-CD2 3.78Å; Y206-H211 AromaticContact CE1-NE2 3.84Å; Y206-H211 AromaticContact CZ-CD2 3.86Å; Y206-H211 AromaticContact CZ-NE2 3.56Å; Y206-H211 PolarHBondContact OH-NE2 3.49Å; Y206-H211 VanDerWaalsContact OH-NE2 3.11Å; M207-H211 HydrophobicContact CG-CB 4.27Å; M207-H211 CarbonylContact O-C 3.58Å; M207-H211 VanDerWaalsContact O-CA 3.22Å; M207-H211 WeakPolarHBondContact O-CA 3.23Å; M207-H211 VanDerWaalsContact O-CB 3.23Å; M207-H211 WeakPolarHBondContact O-CB 3.25Å; M207-H211 PolarHBondContact O-N 3.36Å
212F92.4Very high95.4Very high37 Ų3743.9 Ų43.916%0.16225%0.246CC..Iπ-helixtrans-145.8-64.6174.3-177.1-100.9000111.4M207 F208 P215 L216 M266 A269M207-F212 PolarHBondContact O-N 2.88Å; F208-F212 HydrophobicContact CD1-CD1 4.2Å; F208-F212 HydrophobicContact CD1-CG 4.5Å; F208-F212 WeakPolarHBondContact O-CB 3.36Å; F212-P215 WeakPolarHBondContact O-CD 3.31Å; F212-L216 HydrophobicContact CD1-CD1 4.2Å; F212-L216 HydrophobicContact CD2-CD1 4.31Å; F212-L216 HydrophobicContact CE1-CD1 3.92Å; F212-L216 HydrophobicContact CE2-CD1 4.03Å; F212-L216 HydrophobicContact CG-CD1 4.4Å; F212-L216 HydrophobicContact CZ-CD1 3.84Å; F212-L216 WeakPolarHBondContact O-CB 3.28Å; F212-L216 VanDerWaalsContact O-CG 3.25Å; F212-L216 WeakPolarHBondContact O-CG 3.45Å; F212-L216 PolarHBondContact O-N 3.18Å; F212-L216 VanDerWaalsContact O-N 3.12Å; F212-M266 HydrophobicContact CE2-SD 3.92Å; F212-M266 HydrophobicContact CZ-CE 4.34Å; F212-M266 HydrophobicContact CZ-SD 3.46Å; F212-M266 WeakPolarHBondContact CZ-SD 3.41Å; F212-A269 HydrophobicContact CD2-CB 4.07Å; F212-A269 HydrophobicContact CE2-CB 3.51Å; F212-A269 HydrophobicContact CZ-CB 3.82Å
213S94.5Very high95.1Very high55 Ų5541.5 Ų41.539%0.38523%0.228SC..Iπ-helixtrans-64.9-49.7-173.9-56.40000113F208 T209 L216 V217F208-S213 WeakPolarHBondContact O-CB 3.22Å; F208-S213 PolarHBondContact O-N 3.08Å; F208-S213 PolarHBondContact O-OG 3.48Å; T209-S213 PolarHBondContact O-N 2.85Å; S213-L216 PolarHBondContact O-N 3.36Å; S213-V217 WeakPolarHBondContact O-CG2 3.39Å; S213-V217 PolarHBondContact O-N 3.19Å
214I96.5Very high94.8Very high71 Ų7143.1 Ų43.136%0.36424%0.244SC..Hα-helixtrans-60.6-51.2179.5-73.2173.7000111.8T209 L210 L216 V217 I218T209-I214 WeakPolarHBondContact O-CG1 3.4Å; T209-I214 PolarHBondContact O-N 3.4Å; L210-I214 HydrophobicContact CD1-CD1 3.92Å; I214-L216 VanDerWaalsContact C-N 3.33Å; I214-L216 PolarHBondContact O-N 2.93Å; I214-V217 PolarHBondContact O-N 2.93Å; I214-I218 HydrophobicContact CG2-CD1 3.72Å; I214-I218 HydrophobicContact CG2-CG1 4.43Å; I214-I218 WeakPolarHBondContact O-CG1 3.18Å; I214-I218 PolarHBondContact O-N 2.61Å
215P94.9Very high94.6Very high0 Ų049.1 Ų49.10%027%0.267CS..Hα-helixtrans-54.1-44.9175.4-32.938000113.6L125 W126 V129 L210 F212 V217 I218 I219L125-P215 HydrophobicContact CD1-CB 3.67Å; L125-P215 HydrophobicContact CD1-CG 4.46Å; L125-P215 HydrophobicContact CD2-CB 4.01Å; L125-P215 HydrophobicContact CD2-CG 3.89Å; L125-P215 HydrophobicContact CG-CB 3.96Å; L125-P215 HydrophobicContact CG-CG 4.26Å; W126-P215 HydrophobicContact CH2-CG 3.81Å; W126-P215 HydrophobicContact CZ2-CG 3.86Å; W126-P215 HydrophobicContact CZ3-CG 4.24Å; V129-P215 HydrophobicContact CG2-CB 3.66Å; V129-P215 HydrophobicContact CG2-CG 4.41Å; L210-P215 WeakPolarHBondContact O-CD 3.46Å; L210-P215 WeakPolarHBondContact O-CG 3.41Å; F212-P215 WeakPolarHBondContact O-CD 3.31Å; P215-V217 PolarHBondContact O-N 3.02Å; P215-I218 PolarHBondContact O-N 2.64Å; P215-I219 WeakPolarHBondContact O-CB 3.41Å; P215-I219 VanDerWaalsContact O-CG1 3.24Å; P215-I219 WeakPolarHBondContact O-CG1 3.46Å; P215-I219 PolarHBondContact O-N 3.28Å
216L91.8Very high94.2Very high48 Ų4845.3 Ų45.325%0.25125%0.247SC..Hα-helixtrans-63.8-40.2178.7-71.3179.6000112.4F212 S213 I214 G220 L262F212-L216 HydrophobicContact CD1-CD1 4.2Å; F212-L216 HydrophobicContact CD2-CD1 4.31Å; F212-L216 HydrophobicContact CE1-CD1 3.92Å; F212-L216 HydrophobicContact CE2-CD1 4.03Å; F212-L216 HydrophobicContact CG-CD1 4.4Å; F212-L216 HydrophobicContact CZ-CD1 3.84Å; F212-L216 WeakPolarHBondContact O-CB 3.28Å; F212-L216 VanDerWaalsContact O-CG 3.25Å; F212-L216 WeakPolarHBondContact O-CG 3.45Å; F212-L216 PolarHBondContact O-N 3.18Å; F212-L216 VanDerWaalsContact O-N 3.12Å; S213-L216 PolarHBondContact O-N 3.36Å; I214-L216 VanDerWaalsContact C-N 3.33Å; I214-L216 PolarHBondContact O-N 2.93Å; L216-G220 PolarHBondContact O-N 2.88Å; L216-L262 HydrophobicContact CD1-CD2 4.44Å; L216-L262 HydrophobicContact CD2-CD2 3.77Å
217V94.9Very high93.8Very high105 Ų10544.6 Ų44.664%0.63625%0.247SC*.Hα-helixtrans-63.5-45.2175.3170.90000110.9S213 I214 P215 G220 F221S213-V217 WeakPolarHBondContact O-CG2 3.39Å; S213-V217 PolarHBondContact O-N 3.19Å; I214-V217 PolarHBondContact O-N 2.93Å; P215-V217 PolarHBondContact O-N 3.02Å; V217-G220 PolarHBondContact O-N 3.27Å; V217-F221 WeakPolarHBondContact O-CB 3.36Å; V217-F221 PolarHBondContact O-N 3.27Å
218I95.8Very high93.6Very high51 Ų5146.4 Ų46.426%0.26226%0.263SS..Hα-helixtrans-63-49.7179.1-65.2167.1000110.5V129 I133 I214 P215 G220 F221 C222V129-I218 HydrophobicContact CG1-CB 4.4Å; V129-I218 HydrophobicContact CG1-CD1 4.32Å; V129-I218 HydrophobicContact CG1-CG2 3.85Å; I133-I218 HydrophobicContact CD1-CG2 4.14Å; I133-I218 HydrophobicContact CG1-CG2 4.06Å; I214-I218 HydrophobicContact CG2-CD1 3.72Å; I214-I218 HydrophobicContact CG2-CG1 4.43Å; I214-I218 WeakPolarHBondContact O-CG1 3.18Å; I214-I218 PolarHBondContact O-N 2.61Å; P215-I218 PolarHBondContact O-N 2.64Å; I218-G220 VanDerWaalsContact C-N 3.35Å; I218-G220 PolarHBondContact O-N 3.42Å; I218-F221 PolarHBondContact O-N 2.94Å; I218-C222 WeakPolarHBondContact O-CB 3.34Å; I218-C222 PolarHBondContact O-N 3Å; I218-C222 PolarHBondContact O-SG 2.66Å
219I92.7Very high93.2Very high10 Ų1047.6 Ų47.65%0.05127%0.272CS..Hα-helixtrans-59.3-47.6179-69.8167.8000110.2L125 L128 V129 A132 P215 F221 C222 Y223 V258L125-I219 HydrophobicContact CD1-CD1 4.5Å; L128-I219 HydrophobicContact CB-CD1 3.95Å; V129-I219 HydrophobicContact CG2-CD1 3.91Å; V129-I219 HydrophobicContact CG2-CG1 4.02Å; A132-I219 HydrophobicContact CB-CG1 4.19Å; P215-I219 WeakPolarHBondContact O-CB 3.41Å; P215-I219 VanDerWaalsContact O-CG1 3.24Å; P215-I219 WeakPolarHBondContact O-CG1 3.46Å; P215-I219 PolarHBondContact O-N 3.28Å; I219-F221 PolarHBondContact O-N 3.39Å; I219-C222 PolarHBondContact O-N 2.82Å; I219-Y223 HydrophobicContact CG2-CD2 3.61Å; I219-Y223 HydrophobicContact CG2-CE2 3.84Å; I219-Y223 WeakPolarHBondContact O-CB 3.49Å; I219-Y223 PolarHBondContact O-N 3.25Å; I219-V258 HydrophobicContact CG2-CG2 3.83Å
220G91.8Very high92.8Very high46 Ų4645.1 Ų45.147%0.47426%0.256SS..Hα-helixtrans-60.3-43.9178.500000112.7L216 V217 I218 G224L216-G220 PolarHBondContact O-N 2.88Å; V217-G220 PolarHBondContact O-N 3.27Å; I218-G220 VanDerWaalsContact C-N 3.35Å; I218-G220 PolarHBondContact O-N 3.42Å; G220-G224 WeakPolarHBondContact O-CA 3.4Å; G220-G224 PolarHBondContact O-N 3.42Å
221F93.9Very high92.3Very high117 Ų11750.2 Ų50.251%0.51327%0.272SS..Hα-helixtrans-63.9-53.7176.3173.8-96.8000112.1V217 I218 I219 Y223 G224 R225V217-F221 WeakPolarHBondContact O-CB 3.36Å; V217-F221 PolarHBondContact O-N 3.27Å; I218-F221 PolarHBondContact O-N 2.94Å; I219-F221 PolarHBondContact O-N 3.39Å; F221-Y223 PolarHBondContact O-N 2.92Å; F221-G224 PolarHBondContact O-N 2.78Å; F221-R225 HydrophobicContact CD2-CG 4.4Å; F221-R225 HydrophobicContact CE1-CG 4.27Å; F221-R225 HydrophobicContact CE2-CG 4Å; F221-R225 HydrophobicContact CZ-CG 3.92Å; F221-R225 WeakPolarHBondContact O-CG 3.46Å; F221-R225 PolarHBondContact O-N 2.92Å
222C93.3Very high92Very high6 Ų652.6 Ų52.64%0.04129%0.293CS..Hα-helixtrans-58.8-48.1-177-76.20000111.5A132 I218 I219 R225 L226A132-C222 HydrophobicContact CB-CB 3.87Å; A132-C222 WeakPolarHBondContact O-CB 3.45Å; I218-C222 WeakPolarHBondContact O-CB 3.34Å; I218-C222 PolarHBondContact O-N 3Å; I218-C222 PolarHBondContact O-SG 2.66Å; I219-C222 PolarHBondContact O-N 2.82Å; C222-R225 PolarHBondContact O-N 3.35Å; C222-L226 WeakPolarHBondContact O-CB 3.48Å; C222-L226 PolarHBondContact O-N 2.65Å
223Y90.1Very high91.7Very high11 Ų1152.9 Ų52.94%0.04330%0.302CS..Hα-helixtrans-74.3-31.2179.5-73.4-36.2000113.5A132 R135 I219 F221 L226 L227 V254 V258A132-Y223 HydrophobicContact CB-CD2 4.35Å; A132-Y223 HydrophobicContact CB-CE1 4.19Å; A132-Y223 HydrophobicContact CB-CE2 3.98Å; R135-Y223 HydrophobicContact CB-CE1 4.3Å; R135-Y223 HydrophobicContact CG-CE1 4.48Å; I219-Y223 HydrophobicContact CG2-CD2 3.61Å; I219-Y223 HydrophobicContact CG2-CE2 3.84Å; I219-Y223 WeakPolarHBondContact O-CB 3.49Å; I219-Y223 PolarHBondContact O-N 3.25Å; F221-Y223 PolarHBondContact O-N 2.92Å; Y223-L226 HydrophobicContact CD1-CD2 3.69Å; Y223-L226 HydrophobicContact CE1-CD2 4.08Å; Y223-L226 WeakPolarHBondContact O-CB 3.47Å; Y223-L226 PolarHBondContact O-N 3.36Å; Y223-L227 WeakPolarHBondContact O-CB 3.37Å; Y223-L227 VanDerWaalsContact O-CG 3.29Å; Y223-L227 WeakPolarHBondContact O-CG 3.04Å; Y223-L227 PolarHBondContact O-N 2.94Å; Y223-V254 HydrophobicContact CD1-CB 4.39Å; Y223-V254 HydrophobicContact CD1-CG1 4Å; Y223-V254 HydrophobicContact CD1-CG2 3.58Å; Y223-V254 HydrophobicContact CD2-CG1 3.85Å; Y223-V254 HydrophobicContact CE1-CG2 3.79Å; Y223-V254 HydrophobicContact CE2-CG1 4.47Å; Y223-V254 HydrophobicContact CG-CB 4.42Å; Y223-V254 HydrophobicContact CG-CG1 3.57Å; Y223-V254 HydrophobicContact CG-CG2 4.07Å; Y223-V258 HydrophobicContact CD2-CG2 3.56Å; Y223-V258 HydrophobicContact CE2-CG2 3.78Å
224G91.2Very high91.4Very high33 Ų3350.5 Ų50.534%0.3429%0.286SS..Hα-helixtrans-58.6-48.817000000111.7G220 F221 L227 C228G220-G224 WeakPolarHBondContact O-CA 3.4Å; G220-G224 PolarHBondContact O-N 3.42Å; F221-G224 PolarHBondContact O-N 2.78Å; G224-L227 PolarHBondContact O-N 2.96Å; G224-C228 PolarHBondContact O-N 3.05Å; G224-C228 PolarHBondContact O-SG 3.14Å
225R92.8Very high90.9Very high128 Ų12849.9 Ų49.948%0.48329%0.291SS..Hα-helixtrans-65.7-38.4176.6-66.4-59.4-60.7-175-3112.8Y136 F221 C222 C228 T229Y136-R225 HydrophobicContact CD2-CB 3.81Å; Y136-R225 HydrophobicContact CE2-CB 3.62Å; Y136-R225 HydrophobicContact CE2-CG 4.13Å; F221-R225 HydrophobicContact CD2-CG 4.4Å; F221-R225 HydrophobicContact CE1-CG 4.27Å; F221-R225 HydrophobicContact CE2-CG 4Å; F221-R225 HydrophobicContact CZ-CG 3.92Å; F221-R225 WeakPolarHBondContact O-CG 3.46Å; F221-R225 PolarHBondContact O-N 2.92Å; C222-R225 PolarHBondContact O-N 3.35Å; R225-C228 PolarHBondContact O-N 3.12Å; R225-T229 WeakPolarHBondContact O-CB 3.44Å; R225-T229 PolarHBondContact O-N 2.95Å; R225-T229 PolarHBondContact O-OG1 3.26Å
226L90.1Very high90.7Very high1 Ų157.3 Ų57.31%0.00533%0.33CS..Hα-helixtrans-57.6-52.6174.4-177.967.7000110.7R135 V139 C222 Y223 C228 T229 V230 V250 V254R135-L226 HydrophobicContact CB-CD2 4.16Å; V139-L226 HydrophobicContact CB-CD1 3.41Å; V139-L226 VanDerWaalsContact CB-CD1 3.41Å; V139-L226 HydrophobicContact CG1-CD1 3.52Å; V139-L226 HydrophobicContact CG2-CD1 3.76Å; C222-L226 WeakPolarHBondContact O-CB 3.48Å; C222-L226 PolarHBondContact O-N 2.65Å; Y223-L226 HydrophobicContact CD1-CD2 3.69Å; Y223-L226 HydrophobicContact CE1-CD2 4.08Å; Y223-L226 WeakPolarHBondContact O-CB 3.47Å; Y223-L226 PolarHBondContact O-N 3.36Å; L226-C228 PolarHBondContact O-N 3.11Å; L226-T229 PolarHBondContact O-N 3.36Å; L226-V230 HydrophobicContact CD1-CG2 4.16Å; L226-V230 HydrophobicContact CG-CG2 4.42Å; L226-V230 VanDerWaalsContact O-CG2 3.27Å; L226-V230 WeakPolarHBondContact O-CG2 3.14Å; L226-V230 PolarHBondContact O-N 3.42Å; L226-V250 HydrophobicContact CD2-CG1 3.82Å; L226-V250 HydrophobicContact CG-CG1 4.13Å; L226-V254 HydrophobicContact CD2-CG2 3.74Å
227L89.7Confident90.4Very high36 Ų3660 Ų6019%0.18834%0.341CS..Hα-helixtrans-61.1-43.3-180-70.2174.1000112.2Y223 G224 T229 R231 T251 V254Y223-L227 WeakPolarHBondContact O-CB 3.37Å; Y223-L227 VanDerWaalsContact O-CG 3.29Å; Y223-L227 WeakPolarHBondContact O-CG 3.04Å; Y223-L227 PolarHBondContact O-N 2.94Å; G224-L227 PolarHBondContact O-N 2.96Å; L227-T229 VanDerWaalsContact C-N 3.32Å; L227-T229 PolarHBondContact O-N 3.31Å; L227-R231 VanDerWaalsContact O-CB 3.29Å; L227-R231 WeakPolarHBondContact O-CB 3.31Å; L227-R231 VanDerWaalsContact O-CG 3.24Å; L227-R231 WeakPolarHBondContact O-CG 3.25Å; L227-R231 PolarHBondContact O-N 2.83Å; L227-T251 HydrophobicContact CD2-CG2 3.89Å; L227-T251 VanDerWaalsContact CD2-OG1 3.26Å; L227-T251 WeakPolarHBondContact CD2-OG1 3.49Å; L227-V254 HydrophobicContact CD1-CG1 4.49Å
228C91.7Very high89.6Confident78 Ų7862 Ų6253%0.52734%0.344SS..Hα-helixtrans-58.2-44.8175.2-69.70000112G224 R225 L226 A232G224-C228 PolarHBondContact O-N 3.05Å; G224-C228 PolarHBondContact O-SG 3.14Å; R225-C228 PolarHBondContact O-N 3.12Å; L226-C228 PolarHBondContact O-N 3.11Å; C228-A232 WeakPolarHBondContact O-CB 3.47Å; C228-A232 PolarHBondContact O-N 2.85Å
229T89.2Confident89.1Confident46 Ų4668.9 Ų68.928%0.28238%0.375SS..Hα-helixtrans-68.1-46.3-176.8-54.60000111.5C140 R225 L226 L227 A232 A233C140-T229 PolarHBondContact SG-OG1 2.99Å; C140-T229 VanDerWaalsContact SG-OG1 3.34Å; R225-T229 WeakPolarHBondContact O-CB 3.44Å; R225-T229 PolarHBondContact O-N 2.95Å; R225-T229 PolarHBondContact O-OG1 3.26Å; L226-T229 PolarHBondContact O-N 3.36Å; L227-T229 VanDerWaalsContact C-N 3.32Å; L227-T229 PolarHBondContact O-N 3.31Å; T229-A232 PolarHBondContact O-N 3.13Å; T229-A233 PolarHBondContact O-N 3.24Å
230V87.3Confident88.7Confident19 Ų1970 Ų7012%0.11538%0.383CS..Hα-helixtrans-68-38.4-178.6-175.70000110.8V139 L226 A233 A234 E247 V250V139-V230 HydrophobicContact CG1-CG2 3.77Å; L226-V230 HydrophobicContact CD1-CG2 4.16Å; L226-V230 HydrophobicContact CG-CG2 4.42Å; L226-V230 VanDerWaalsContact O-CG2 3.27Å; L226-V230 WeakPolarHBondContact O-CG2 3.14Å; L226-V230 PolarHBondContact O-N 3.42Å; V230-A233 PolarHBondContact O-N 2.83Å; V230-A234 WeakPolarHBondContact O-CB 3.2Å; V230-A234 PolarHBondContact O-N 3.28Å; V230-E247 HydrophobicContact CB-CG 4.42Å; V230-E247 HydrophobicContact CG1-CB 3.58Å; V230-E247 HydrophobicContact CG1-CG 3.51Å; V230-V250 HydrophobicContact CG2-CG1 4.38Å
231R88.1Confident88.3Confident152 Ų15275.8 Ų75.857%0.57440%0.398SS*.Hα-helixtrans-64.2-41.2173.3-74179.2177.91791.1112.9L227 A234 A235L227-R231 VanDerWaalsContact O-CB 3.29Å; L227-R231 WeakPolarHBondContact O-CB 3.31Å; L227-R231 VanDerWaalsContact O-CG 3.24Å; L227-R231 WeakPolarHBondContact O-CG 3.25Å; L227-R231 PolarHBondContact O-N 2.83Å; R231-A234 PolarHBondContact O-N 2.85Å; R231-A235 WeakPolarHBondContact O-CB 2.97Å; R231-A235 PolarHBondContact O-N 3.02Å
232A89.5Confident87.7Confident55 Ų5575.4 Ų75.446%0.45541%0.406SS..Hα-helixtrans-63.6-43.3176.100000111.6C228 T229 A235 L236C228-A232 WeakPolarHBondContact O-CB 3.47Å; C228-A232 PolarHBondContact O-N 2.85Å; T229-A232 PolarHBondContact O-N 3.13Å; A232-A235 PolarHBondContact O-N 3.41Å; A232-L236 WeakPolarHBondContact O-CG 3.47Å; A232-L236 PolarHBondContact O-N 3.33Å; A232-L236 VanDerWaalsContact O-N 3.09Å
233A86.3Confident86.9Confident43 Ų4376.5 Ų76.536%0.35541%0.412SS..Hα-helixtrans-63.1-42.8175.800000112.3T229 V230 A235 L236 Q237T229-A233 PolarHBondContact O-N 3.24Å; V230-A233 PolarHBondContact O-N 2.83Å; A233-A235 VanDerWaalsContact C-N 3.32Å; A233-A235 PolarHBondContact O-N 3.21Å; A233-L236 PolarHBondContact O-N 3.33Å; A233-Q237 PolarHBondContact O-N 3.4Å
234A87Confident86.2Confident5 Ų578.5 Ų78.54%0.04142%0.422CS..Hα-helixtrans-63.8-36.2175.300000112.3V230 R231 Q237 Q238 Q244 E247V230-A234 WeakPolarHBondContact O-CB 3.2Å; V230-A234 PolarHBondContact O-N 3.28Å; R231-A234 PolarHBondContact O-N 2.85Å; A234-Q237 CarbonylContact O-C 3.31Å; A234-Q237 VanDerWaalsContact O-C 3.31Å; A234-Q237 PolarHBondContact O-N 3.24Å; A234-Q238 PolarHBondContact O-N 3.43Å; A234-Q244 PolarHBondContact O-NE2 3.43Å; A234-E247 HydrophobicContact CB-CB 4.23Å; A234-E247 HydrophobicContact CB-CG 4.23Å
235A87.7Confident85.6Confident58 Ų5883.3 Ų83.348%0.47943%0.43SS..Hα-helixtrans-68.7-31.4175.800000113.1R231 A232 A233 Q238R231-A235 WeakPolarHBondContact O-CB 2.97Å; R231-A235 PolarHBondContact O-N 3.02Å; A232-A235 PolarHBondContact O-N 3.41Å; A233-A235 VanDerWaalsContact C-N 3.32Å; A233-A235 PolarHBondContact O-N 3.21Å; A235-Q238 WeakPolarHBondContact O-CG 3.4Å
236L89.1Confident84.8Confident155 Ų15579.6 Ų79.681%0.81243%0.426SS*.Hα-helixtrans-76.9-27.4174.4-68.9171.4000112.7A232 A233A232-L236 WeakPolarHBondContact O-CG 3.47Å; A232-L236 PolarHBondContact O-N 3.33Å; A232-L236 VanDerWaalsContact O-N 3.09Å; A233-L236 PolarHBondContact O-N 3.33Å
237Q86.3Confident84.3Confident105 Ų10580.8 Ų80.849%0.49143%0.432SS..  trans-118.155.1-177.6-63.9-176.4-19.100111.2A233 A234 E239 S240 T243A233-Q237 PolarHBondContact O-N 3.4Å; A234-Q237 CarbonylContact O-C 3.31Å; A234-Q237 VanDerWaalsContact O-C 3.31Å; A234-Q237 PolarHBondContact O-N 3.24Å; Q237-E239 VanDerWaalsContact C-N 3.25Å; Q237-E239 PolarHBondContact O-N 3.18Å; Q237-S240 PolarHBondContact O-N 3.29Å; Q237-T243 HydrophobicContact CB-CG2 4.22Å; Q237-T243 PolarHBondContact OE1-OG1 3.04Å
238Q78.9Confident83.7Confident148 Ų14885.7 Ų85.769%0.69245%0.452SS*.THydrogen-bonded Turntrans-61.1-33.6-177.2-77.4-179.4-900113.3A234 A235 S240A234-Q238 PolarHBondContact O-N 3.43Å; A235-Q238 WeakPolarHBondContact O-CG 3.4Å; Q238-S240 VanDerWaalsContact C-N 3.3Å; Q238-S240 PolarHBondContact O-N 3.48Å
239E83.8Confident83.1Confident194 Ų19485.6 Ų85.691%0.90744%0.443SS*.THydrogen-bonded Turntrans-78.2-13.1-179.1-58.8-165.7157.400113.6Q237 E241Q237-E239 VanDerWaalsContact C-N 3.25Å; Q237-E239 PolarHBondContact O-N 3.18Å; E239-E241 PolarHBondContact O-N 2.95Å
240S85.7Confident82.5Confident33 Ų3385.4 Ų85.423%0.23144%0.442CS..  trans-85.499.2179.2178.80000111Q237 Q238 T242 T243 Q244Q237-S240 PolarHBondContact O-N 3.29Å; Q238-S240 VanDerWaalsContact C-N 3.3Å; Q238-S240 PolarHBondContact O-N 3.48Å; S240-T242 PolarHBondContact O-N 3.28Å; S240-T242 PolarHBondContact OG-OG1 2.75Å; S240-T243 WeakPolarHBondContact CB-OG1 3.36Å; S240-T243 PolarHBondContact O-N 3.27Å; S240-T243 VanDerWaalsContact O-N 3.1Å; S240-T243 PolarHBondContact OG-N 3.48Å; S240-T243 PolarHBondContact OG-OG1 3.37Å; S240-Q244 WeakPolarHBondContact O-CG 3.28Å; S240-Q244 PolarHBondContact O-N 3.4Å
241E81.9Confident81.9Confident169 Ų16985.3 Ų85.379%0.7944%0.442SS*.Hα-helixtrans-54.5-36.2172.7-67-171.5164.500112.2E239 Q244 R245E239-E241 PolarHBondContact O-N 2.95Å; E241-Q244 PolarHBondContact O-N 3.04Å; E241-R245 WeakPolarHBondContact O-CB 3.37Å; E241-R245 PolarHBondContact O-N 3.42Å
242T81.8Confident81.6Confident109 Ų10984 Ų8467%0.66944%0.437SS*.Hα-helixtrans-64.6-42.2178.164.10000112.2S240 R245 A246S240-T242 PolarHBondContact O-N 3.28Å; S240-T242 PolarHBondContact OG-OG1 2.75Å; T242-R245 PolarHBondContact O-N 3.49Å; T242-A246 WeakPolarHBondContact O-CB 3.42Å; T242-A246 PolarHBondContact O-N 2.99Å
243T77.7Confident81.1Confident29 Ų2983 Ų8318%0.17842%0.423CS..Hα-helixtrans-68-42.1178.1-53.30000110.9Q237 S240 R245 A246 E247Q237-T243 HydrophobicContact CB-CG2 4.22Å; Q237-T243 PolarHBondContact OE1-OG1 3.04Å; S240-T243 WeakPolarHBondContact CB-OG1 3.36Å; S240-T243 PolarHBondContact O-N 3.27Å; S240-T243 VanDerWaalsContact O-N 3.1Å; S240-T243 PolarHBondContact OG-N 3.48Å; S240-T243 PolarHBondContact OG-OG1 3.37Å; T243-R245 PolarHBondContact O-N 3.11Å; T243-A246 PolarHBondContact O-N 3.23Å; T243-E247 PolarHBondContact O-N 3.36Å
244Q74.1Confident80.5Confident52 Ų5281.4 Ų81.424%0.24341%0.409CS..Hα-helixtrans-63.2-40.6176.1-66.3-63.4-28.400112.3A234 S240 E241 E247 K248A234-Q244 PolarHBondContact O-NE2 3.43Å; S240-Q244 WeakPolarHBondContact O-CG 3.28Å; S240-Q244 PolarHBondContact O-N 3.4Å; E241-Q244 PolarHBondContact O-N 3.04Å; Q244-E247 PolarHBondContact O-N 2.81Å; Q244-K248 WeakPolarHBondContact O-CG 3.47Å; Q244-K248 PolarHBondContact O-N 2.93Å; Q244-K248 VanDerWaalsContact O-N 3.14Å
245R78.8Confident80.2Confident135 Ų13585.1 Ų85.151%0.50943%0.427SS..Hα-helixtrans-66.8-42.4176.6-177172.9174.8174.3-5.8111.8E241 T242 T243 E247 K248 E249 R311E241-R245 WeakPolarHBondContact O-CB 3.37Å; E241-R245 PolarHBondContact O-N 3.42Å; T242-R245 PolarHBondContact O-N 3.49Å; T243-R245 PolarHBondContact O-N 3.11Å; R245-E247 VanDerWaalsContact C-N 3.32Å; R245-E247 PolarHBondContact O-N 3.02Å; R245-K248 PolarHBondContact O-N 3.41Å; R245-E249 IonicContact NE-OE1 3.32Å; R245-E249 PolarHBondContact NE-OE1 3.41Å; R245-E249 WeakPolarHBondContact O-CG 3.49Å; R245-E249 PolarHBondContact O-N 3.41Å; R245-R311 VanDerWaalsContact NH2-NH2 3.12Å
246A75.9Confident80Confident50 Ų5084.7 Ų84.741%0.41342%0.419SS..Hα-helixtrans-60.9-40.8175.500000111.6T242 T243 E249 V250T242-A246 WeakPolarHBondContact O-CB 3.42Å; T242-A246 PolarHBondContact O-N 2.99Å; T243-A246 PolarHBondContact O-N 3.23Å; A246-E249 PolarHBondContact O-N 3.14Å; A246-V250 VanDerWaalsContact O-CG2 3.31Å; A246-V250 WeakPolarHBondContact O-CG2 3.04Å; A246-V250 PolarHBondContact O-N 2.78Å
247E79.4Confident79.4Confident25 Ų2577.4 Ų77.412%0.11738%0.38CS..Hα-helixtrans-57.8-52.2173.9-175.5-78.6150.500111.9V230 A234 T243 Q244 R245 E249 V250 T251V230-E247 HydrophobicContact CB-CG 4.42Å; V230-E247 HydrophobicContact CG1-CB 3.58Å; V230-E247 HydrophobicContact CG1-CG 3.51Å; A234-E247 HydrophobicContact CB-CB 4.23Å; A234-E247 HydrophobicContact CB-CG 4.23Å; T243-E247 PolarHBondContact O-N 3.36Å; Q244-E247 PolarHBondContact O-N 2.81Å; R245-E247 VanDerWaalsContact C-N 3.32Å; R245-E247 PolarHBondContact O-N 3.02Å; E247-E249 VanDerWaalsContact C-N 3.3Å; E247-E249 PolarHBondContact O-N 2.77Å; E247-V250 PolarHBondContact O-N 2.77Å; E247-T251 WeakPolarHBondContact O-CB 3.37Å; E247-T251 PolarHBondContact O-N 2.89Å; E247-T251 PolarHBondContact O-OG1 2.65Å; E247-T251 PolarHBondContact OE1-OG1 3.48Å
248K77.2Confident79Confident140 Ų14074.3 Ų74.361%0.60937%0.369SS*.Hα-helixtrans-60.5-40.6-179.1-71.8177.2-177.91750112.2Q244 R245 R252Q244-K248 WeakPolarHBondContact O-CG 3.47Å; Q244-K248 PolarHBondContact O-N 2.93Å; Q244-K248 VanDerWaalsContact O-N 3.14Å; R245-K248 PolarHBondContact O-N 3.41Å; K248-R252 WeakPolarHBondContact O-CB 3.45Å; K248-R252 PolarHBondContact O-N 2.95Å
249E79.3Confident79.3Confident75 Ų7571.6 Ų71.635%0.3536%0.358SS..Hα-helixtrans-66.5-43.1178.8-73.7-175.2175.700111.8R245 A246 E247 M253 R311R245-E249 IonicContact NE-OE1 3.32Å; R245-E249 PolarHBondContact NE-OE1 3.41Å; R245-E249 WeakPolarHBondContact O-CG 3.49Å; R245-E249 PolarHBondContact O-N 3.41Å; A246-E249 PolarHBondContact O-N 3.14Å; E247-E249 VanDerWaalsContact C-N 3.3Å; E247-E249 PolarHBondContact O-N 2.77Å; E249-M253 WeakPolarHBondContact O-CB 3.14Å; E249-M253 PolarHBondContact O-N 3.38Å; E249-R311 IonicContact OE1-NH2 3.84Å
250V75.8Confident79.2Confident42 Ų4263.1 Ų63.126%0.25532%0.32SS..Hα-helixtrans-65.4-48.8176.2173.10000110.9L226 V230 A246 E247 R252 M253 V254L226-V250 HydrophobicContact CD2-CG1 3.82Å; L226-V250 HydrophobicContact CG-CG1 4.13Å; V230-V250 HydrophobicContact CG2-CG1 4.38Å; A246-V250 VanDerWaalsContact O-CG2 3.31Å; A246-V250 WeakPolarHBondContact O-CG2 3.04Å; A246-V250 PolarHBondContact O-N 2.78Å; E247-V250 PolarHBondContact O-N 2.77Å; V250-R252 VanDerWaalsContact C-N 3.33Å; V250-R252 PolarHBondContact O-N 3.34Å; V250-M253 PolarHBondContact O-N 3.29Å; V250-V254 HydrophobicContact CG1-CG2 4.48Å; V250-V254 WeakPolarHBondContact O-CG2 3.31Å; V250-V254 PolarHBondContact O-N 3.34Å
251T75.9Confident78.9Confident17 Ų1762.3 Ų62.310%0.10431%0.312CS..Hα-helixtrans-58.9-44.5178.4-66.50000111.2L227 E247 M253 V254 I255L227-T251 HydrophobicContact CD2-CG2 3.89Å; L227-T251 VanDerWaalsContact CD2-OG1 3.26Å; L227-T251 WeakPolarHBondContact CD2-OG1 3.49Å; E247-T251 WeakPolarHBondContact O-CB 3.37Å; E247-T251 PolarHBondContact O-N 2.89Å; E247-T251 PolarHBondContact O-OG1 2.65Å; E247-T251 PolarHBondContact OE1-OG1 3.48Å; T251-M253 PolarHBondContact O-N 3.21Å; T251-V254 PolarHBondContact O-N 2.76Å; T251-I255 HydrophobicContact CG2-CD1 3.79Å; T251-I255 VanDerWaalsContact O-CG1 3.28Å; T251-I255 WeakPolarHBondContact O-CG1 3.39Å; T251-I255 PolarHBondContact O-N 3.13Å; T251-I255 VanDerWaalsContact O-N 3.08Å
252R81.9Confident79.1Confident126 Ų12656.9 Ų56.948%0.47529%0.288SS..Hα-helixtrans-61.7-45.1175.8-171-177.579.5-171.54.6111.9K248 V250 I255 V256K248-R252 WeakPolarHBondContact O-CB 3.45Å; K248-R252 PolarHBondContact O-N 2.95Å; V250-R252 VanDerWaalsContact C-N 3.33Å; V250-R252 PolarHBondContact O-N 3.34Å; R252-I255 PolarHBondContact O-N 3.22Å; R252-V256 HydrophobicContact CG-CG2 4.32Å; R252-V256 WeakPolarHBondContact O-CB 3.11Å; R252-V256 VanDerWaalsContact O-CG2 3.26Å; R252-V256 WeakPolarHBondContact O-CG2 3.38Å; R252-V256 PolarHBondContact O-N 3.28Å
253M78.2Confident79.5Confident33 Ų3355.3 Ų55.316%0.16328%0.278CS..Hα-helixtrans-59.6-48179.5179.9-176.3164.400111.2L131 E249 V250 T251 I255 V256 M257 L309L131-M253 HydrophobicContact CD2-CE 4.1Å; E249-M253 WeakPolarHBondContact O-CB 3.14Å; E249-M253 PolarHBondContact O-N 3.38Å; V250-M253 PolarHBondContact O-N 3.29Å; T251-M253 PolarHBondContact O-N 3.21Å; M253-I255 PolarHBondContact O-N 3.42Å; M253-V256 PolarHBondContact O-N 3.37Å; M253-M257 HydrophobicContact CE-SD 3.5Å; M253-M257 VanDerWaalsContact CE-SD 3.5Å; M253-M257 HydrophobicContact CG-CG 4.49Å; M253-M257 HydrophobicContact CG-SD 3.94Å; M253-M257 WeakPolarHBondContact O-CB 3.45Å; M253-M257 VanDerWaalsContact O-CG 3.23Å; M253-M257 WeakPolarHBondContact O-CG 3.27Å; M253-M257 PolarHBondContact O-N 3.23Å; M253-L309 HydrophobicContact CB-CD1 4.49Å; M253-L309 HydrophobicContact CG-CD1 4.24Å
254V74.8Confident79.9Confident9 Ų954 Ų546%0.05527%0.27CS..Hα-helixtrans-57.8-51178.1169.40000111.6Y223 L226 L227 V250 T251 V256 M257 V258Y223-V254 HydrophobicContact CD1-CB 4.39Å; Y223-V254 HydrophobicContact CD1-CG1 4Å; Y223-V254 HydrophobicContact CD1-CG2 3.58Å; Y223-V254 HydrophobicContact CD2-CG1 3.85Å; Y223-V254 HydrophobicContact CE1-CG2 3.79Å; Y223-V254 HydrophobicContact CE2-CG1 4.47Å; Y223-V254 HydrophobicContact CG-CB 4.42Å; Y223-V254 HydrophobicContact CG-CG1 3.57Å; Y223-V254 HydrophobicContact CG-CG2 4.07Å; L226-V254 HydrophobicContact CD2-CG2 3.74Å; L227-V254 HydrophobicContact CD1-CG1 4.49Å; V250-V254 HydrophobicContact CG1-CG2 4.48Å; V250-V254 WeakPolarHBondContact O-CG2 3.31Å; V250-V254 PolarHBondContact O-N 3.34Å; T251-V254 PolarHBondContact O-N 2.76Å; V254-V256 PolarHBondContact O-N 2.77Å; V254-M257 PolarHBondContact O-N 3.43Å; V254-V258 WeakPolarHBondContact O-CG2 3.37Å; V254-V258 PolarHBondContact O-N 2.84Å
255I80.8Confident80.7Confident83 Ų8353.4 Ų53.443%0.42627%0.265SS..Hα-helixtrans-59.6-49.6-177.6-71.7171.4000110.2T251 R252 M253 M257 I259T251-I255 HydrophobicContact CG2-CD1 3.79Å; T251-I255 VanDerWaalsContact O-CG1 3.28Å; T251-I255 WeakPolarHBondContact O-CG1 3.39Å; T251-I255 PolarHBondContact O-N 3.13Å; T251-I255 VanDerWaalsContact O-N 3.08Å; R252-I255 PolarHBondContact O-N 3.22Å; M253-I255 PolarHBondContact O-N 3.42Å; I255-M257 VanDerWaalsContact C-N 3.34Å; I255-M257 PolarHBondContact O-N 3.01Å; I255-I259 HydrophobicContact CG2-CD1 3.47Å; I255-I259 VanDerWaalsContact CG2-CD1 3.47Å; I255-I259 HydrophobicContact CG2-CG1 4.32Å; I255-I259 WeakPolarHBondContact O-CB 3.5Å; I255-I259 WeakPolarHBondContact O-CG1 3.22Å; I255-I259 PolarHBondContact O-N 3.31Å
256V83.5Confident81.4Confident50 Ų5050.2 Ų50.230%0.30326%0.257SS..Hα-helixtrans-62.2-43.7-177.5173.60000110.9R252 M253 V254 S260 I305 L309R252-V256 HydrophobicContact CG-CG2 4.32Å; R252-V256 WeakPolarHBondContact O-CB 3.11Å; R252-V256 VanDerWaalsContact O-CG2 3.26Å; R252-V256 WeakPolarHBondContact O-CG2 3.38Å; R252-V256 PolarHBondContact O-N 3.28Å; M253-V256 PolarHBondContact O-N 3.37Å; V254-V256 PolarHBondContact O-N 2.77Å; V256-S260 WeakPolarHBondContact O-CB 3.47Å; V256-S260 PolarHBondContact O-N 2.98Å; V256-S260 PolarHBondContact O-OG 3.03Å; V256-I305 HydrophobicContact CG1-CB 4.44Å; V256-I305 HydrophobicContact CG1-CD1 4.1Å; V256-I305 HydrophobicContact CG1-CG1 4.08Å; V256-I305 HydrophobicContact CG1-CG2 3.57Å; V256-L309 HydrophobicContact CB-CD1 4.14Å; V256-L309 HydrophobicContact CG1-CD1 4.03Å
257M75.8Confident82.4Confident1 Ų150.2 Ų50.21%0.00525%0.253CS..Hα-helixtrans-68.7-42.5-177.2-71.5-17263.100113.8L128 L131 M253 V254 I255 S260 Y261 Y306L128-M257 HydrophobicContact CD2-CE 3.28Å; L131-M257 HydrophobicContact CD2-CE 3.16Å; L131-M257 HydrophobicContact CD2-SD 3.71Å; M253-M257 HydrophobicContact CE-SD 3.5Å; M253-M257 VanDerWaalsContact CE-SD 3.5Å; M253-M257 HydrophobicContact CG-CG 4.49Å; M253-M257 HydrophobicContact CG-SD 3.94Å; M253-M257 WeakPolarHBondContact O-CB 3.45Å; M253-M257 VanDerWaalsContact O-CG 3.23Å; M253-M257 WeakPolarHBondContact O-CG 3.27Å; M253-M257 PolarHBondContact O-N 3.23Å; V254-M257 PolarHBondContact O-N 3.43Å; I255-M257 VanDerWaalsContact C-N 3.34Å; I255-M257 PolarHBondContact O-N 3.01Å; M257-S260 WeakPolarHBondContact CA-OG 3.38Å; M257-S260 PolarHBondContact O-OG 2.85Å; M257-Y261 PolarHBondContact O-N 3.14Å; M257-Y306 HydrophobicContact CE-CE1 3.47Å; M257-Y306 VanDerWaalsContact CE-CE1 3.47Å; M257-Y306 VanDerWaalsContact CE-OH 3.29Å; M257-Y306 WeakPolarHBondContact CE-OH 3.41Å; M257-Y306 HydrophobicContact CG-CE1 4.38Å; M257-Y306 HydrophobicContact SD-CE1 3.89Å
258V78.2Confident83.2Confident41 Ų4150.5 Ų50.525%0.24825%0.253CS..Hα-helixtrans-69.5-46.6177.9175.10000110.2I219 Y223 V254 S260 Y261 L262I219-V258 HydrophobicContact CG2-CG2 3.83Å; Y223-V258 HydrophobicContact CD2-CG2 3.56Å; Y223-V258 HydrophobicContact CE2-CG2 3.78Å; V254-V258 WeakPolarHBondContact O-CG2 3.37Å; V254-V258 PolarHBondContact O-N 2.84Å; V258-S260 VanDerWaalsContact C-N 3.32Å; V258-S260 PolarHBondContact O-N 2.69Å; V258-Y261 PolarHBondContact O-N 3.4Å; V258-L262 HydrophobicContact CG1-CD1 3.85Å; V258-L262 HydrophobicContact CG1-CG 4.34Å; V258-L262 WeakPolarHBondContact O-CG 3.44Å; V258-L262 PolarHBondContact O-N 3.25Å
259I84.8Confident84.1Confident91 Ų9144.3 Ų44.347%0.46723%0.228SC..Hα-helixtrans-62.4-41.8179.2-69178.6000110.5I255 Y261 L262 V263I255-I259 HydrophobicContact CG2-CD1 3.47Å; I255-I259 VanDerWaalsContact CG2-CD1 3.47Å; I255-I259 HydrophobicContact CG2-CG1 4.32Å; I255-I259 WeakPolarHBondContact O-CB 3.5Å; I255-I259 WeakPolarHBondContact O-CG1 3.22Å; I255-I259 PolarHBondContact O-N 3.31Å; I259-Y261 VanDerWaalsContact C-N 3.32Å; I259-Y261 PolarHBondContact O-N 2.92Å; I259-L262 PolarHBondContact O-N 3.02Å; I259-V263 HydrophobicContact CG2-CG2 3.82Å; I259-V263 VanDerWaalsContact O-CB 3.3Å; I259-V263 WeakPolarHBondContact O-CB 3.35Å; I259-V263 WeakPolarHBondContact O-CG2 3.42Å; I259-V263 PolarHBondContact O-N 3.11Å
260S83.1Confident84.9Confident15 Ų1544.7 Ų44.711%0.10524%0.236CC..Hα-helixtrans-62-41-179.760.10000112.6V256 M257 V258 C264 I305V256-S260 WeakPolarHBondContact O-CB 3.47Å; V256-S260 PolarHBondContact O-N 2.98Å; V256-S260 PolarHBondContact O-OG 3.03Å; M257-S260 WeakPolarHBondContact CA-OG 3.38Å; M257-S260 PolarHBondContact O-OG 2.85Å; V258-S260 VanDerWaalsContact C-N 3.32Å; V258-S260 PolarHBondContact O-N 2.69Å; S260-C264 WeakPolarHBondContact O-CB 3.44Å; S260-C264 PolarHBondContact O-N 2.9Å; S260-I305 WeakPolarHBondContact OG-CD1 3.44Å
261Y79.1Confident85.9Confident17 Ų1744 Ų447%0.06723%0.231CC..Hα-helixtrans-67.1-47.6176.8-175.6-93.9000111.3L125 L128 M257 V258 I259 V263 C264 W265L125-Y261 HydrophobicContact CB-CE2 3.88Å; L125-Y261 WeakPolarHBondContact CB-OH 3.47Å; L125-Y261 HydrophobicContact CD1-CD1 4.39Å; L125-Y261 HydrophobicContact CD1-CE1 3.58Å; L125-Y261 HydrophobicContact CD1-CE2 3.89Å; L125-Y261 VanDerWaalsContact CD1-OH 3.26Å; L125-Y261 WeakPolarHBondContact CD1-OH 3.29Å; L125-Y261 HydrophobicContact CG-CE2 4.44Å; L128-Y261 HydrophobicContact CD1-CD2 3.38Å; L128-Y261 HydrophobicContact CD1-CE2 4.25Å; L128-Y261 HydrophobicContact CD1-CG 3.57Å; M257-Y261 PolarHBondContact O-N 3.14Å; V258-Y261 PolarHBondContact O-N 3.4Å; I259-Y261 VanDerWaalsContact C-N 3.32Å; I259-Y261 PolarHBondContact O-N 2.92Å; Y261-V263 PolarHBondContact O-N 3.14Å; Y261-C264 PolarHBondContact O-N 2.94Å; Y261-W265 AromaticContact CD2-CD1 3.55Å; Y261-W265 HydrophobicContact CD2-CG 4.46Å; Y261-W265 HydrophobicContact CE1-CB 4.19Å; Y261-W265 HydrophobicContact CE1-CG 4.47Å; Y261-W265 HydrophobicContact CE2-CB 4.49Å; Y261-W265 AromaticContact CE2-CD1 3.29Å; Y261-W265 AromaticContact CE2-CG 3.92Å; Y261-W265 HydrophobicContact CE2-CG 3.92Å; Y261-W265 AromaticContact CE2-NE1 3.72Å; Y261-W265 AromaticContact CZ-CD1 3.73Å; Y261-W265 AromaticContact CZ-CG 3.9Å; Y261-W265 PolarHBondContact O-N 3.48Å
262L86Confident86.9Confident55 Ų5543.3 Ų43.329%0.28823%0.228SC..Hα-helixtrans-61.6-46.2179.9-70.1176000111.7L216 V258 I259 C264 M266L216-L262 HydrophobicContact CD1-CD2 4.44Å; L216-L262 HydrophobicContact CD2-CD2 3.77Å; V258-L262 HydrophobicContact CG1-CD1 3.85Å; V258-L262 HydrophobicContact CG1-CG 4.34Å; V258-L262 WeakPolarHBondContact O-CG 3.44Å; V258-L262 PolarHBondContact O-N 3.25Å; I259-L262 PolarHBondContact O-N 3.02Å; L262-C264 PolarHBondContact O-N 2.77Å; L262-M266 HydrophobicContact CB-CG 3.83Å; L262-M266 HydrophobicContact CD2-CG 3.58Å; L262-M266 HydrophobicContact CD2-SD 3.67Å; L262-M266 HydrophobicContact CG-CG 4.31Å; L262-M266 WeakPolarHBondContact O-CA 3.42Å; L262-M266 WeakPolarHBondContact O-CB 3.34Å; L262-M266 WeakPolarHBondContact O-CG 3.33Å; L262-M266 PolarHBondContact O-N 2.91Å
263V88.6Confident87.6Confident76 Ų7642.9 Ų42.946%0.46123%0.226SC..Hα-helixtrans-57-42.1179.4165.20000110.6I259 Y261 P267 F294I259-V263 HydrophobicContact CG2-CG2 3.82Å; I259-V263 VanDerWaalsContact O-CB 3.3Å; I259-V263 WeakPolarHBondContact O-CB 3.35Å; I259-V263 WeakPolarHBondContact O-CG2 3.42Å; I259-V263 PolarHBondContact O-N 3.11Å; Y261-V263 PolarHBondContact O-N 3.14Å; V263-P267 WeakPolarHBondContact O-CD 3.11Å; V263-P267 VanDerWaalsContact O-CG 3.26Å; V263-P267 WeakPolarHBondContact O-CG 3.4Å; V263-F294 HydrophobicContact CG1-CE1 3.89Å; V263-F294 HydrophobicContact CG1-CZ 3.92Å; V263-F294 VanDerWaalsContact O-CE1 3.29Å; V263-F294 WeakPolarHBondContact O-CE1 3.49Å
264C87.7Confident88.5Confident0 Ų046.4 Ų46.40%024%0.238CC..Hα-helixtrans-76.6-45.4-175.9-172.90000114.2S260 Y261 L262 A295 Y301S260-C264 WeakPolarHBondContact O-CB 3.44Å; S260-C264 PolarHBondContact O-N 2.9Å; Y261-C264 PolarHBondContact O-N 2.94Å; L262-C264 PolarHBondContact O-N 2.77Å; C264-A295 WeakPolarHBondContact SG-CA 3.22Å; C264-A295 PolarHBondContact SG-O 2.9Å; C264-Y301 HydrophobicContact CB-CE1 3.71Å; C264-Y301 WeakPolarHBondContact CB-OH 3.49Å; C264-Y301 VanDerWaalsContact SG-CE1 3.56Å; C264-Y301 PolarHBondContact SG-OH 2.91Å
265W91.1Very high89.5Confident40 Ų4046 Ų4615%0.15224%0.236CC..Hα-helixtrans-99.6-25.9-170.2-7097.4000114G121 Y261 Y268 A269 A295G121-W265 VanDerWaalsContact CA-CZ2 3.45Å; Y261-W265 AromaticContact CD2-CD1 3.55Å; Y261-W265 HydrophobicContact CD2-CG 4.46Å; Y261-W265 HydrophobicContact CE1-CB 4.19Å; Y261-W265 HydrophobicContact CE1-CG 4.47Å; Y261-W265 HydrophobicContact CE2-CB 4.49Å; Y261-W265 AromaticContact CE2-CD1 3.29Å; Y261-W265 AromaticContact CE2-CG 3.92Å; Y261-W265 HydrophobicContact CE2-CG 3.92Å; Y261-W265 AromaticContact CE2-NE1 3.72Å; Y261-W265 AromaticContact CZ-CD1 3.73Å; Y261-W265 AromaticContact CZ-CG 3.9Å; Y261-W265 PolarHBondContact O-N 3.48Å; W265-Y268 PolarHBondContact O-N 3.36Å; W265-A269 WeakPolarHBondContact O-CB 3.38Å; W265-A269 PolarHBondContact O-N 3.44Å; W265-A295 HydrophobicContact CE3-CB 4.23Å; W265-A295 HydrophobicContact CH2-CB 4.41Å; W265-A295 HydrophobicContact CZ3-CB 4.16Å
266M92.4Very high90.2Very high69 Ų6943.4 Ų43.434%0.3422%0.222SC..Hα-helixtrans-59.7-41.9178-68.6-73.6-59.500113F212 L262 Y268 A269 T270F212-M266 HydrophobicContact CE2-SD 3.92Å; F212-M266 HydrophobicContact CZ-CE 4.34Å; F212-M266 HydrophobicContact CZ-SD 3.46Å; F212-M266 WeakPolarHBondContact CZ-SD 3.41Å; L262-M266 HydrophobicContact CB-CG 3.83Å; L262-M266 HydrophobicContact CD2-CG 3.58Å; L262-M266 HydrophobicContact CD2-SD 3.67Å; L262-M266 HydrophobicContact CG-CG 4.31Å; L262-M266 WeakPolarHBondContact O-CA 3.42Å; L262-M266 WeakPolarHBondContact O-CB 3.34Å; L262-M266 WeakPolarHBondContact O-CG 3.33Å; L262-M266 PolarHBondContact O-N 2.91Å; M266-Y268 VanDerWaalsContact C-N 3.31Å; M266-Y268 PolarHBondContact O-N 3.48Å; M266-A269 PolarHBondContact O-N 3.47Å; M266-T270 VanDerWaalsContact O-CB 3.22Å; M266-T270 WeakPolarHBondContact O-CB 3.32Å; M266-T270 PolarHBondContact O-N 3.18Å; M266-T270 PolarHBondContact O-OG1 2.67Å
267P96.3Very high90.8Very high50 Ų5044 Ų4433%0.32523%0.232SC..Hα-helixtrans-59.7-43.2176.8-25.236.3000112V263 V271 P291V263-P267 WeakPolarHBondContact O-CD 3.11Å; V263-P267 VanDerWaalsContact O-CG 3.26Å; V263-P267 WeakPolarHBondContact O-CG 3.4Å; P267-V271 WeakPolarHBondContact O-CG2 3.4Å; P267-V271 PolarHBondContact O-N 3.24Å; P267-V271 VanDerWaalsContact O-N 3.09Å; P267-P291 HydrophobicContact CB-CB 3.86Å
268Y96.3Very high91.7Very high30 Ų3046.9 Ų46.912%0.11825%0.247CC..Hα-helixtrans-63.6-53.2176.8-175.1-88000111.6E181 W265 M266 T270 V271 A272 M288 A292E181-Y268 PolarHBondContact OE2-OH 3.01Å; W265-Y268 PolarHBondContact O-N 3.36Å; M266-Y268 VanDerWaalsContact C-N 3.31Å; M266-Y268 PolarHBondContact O-N 3.48Å; Y268-T270 VanDerWaalsContact C-N 3.28Å; Y268-T270 PolarHBondContact O-N 3.16Å; Y268-V271 PolarHBondContact O-N 2.87Å; Y268-A272 HydrophobicContact CE1-CB 4.42Å; Y268-A272 WeakPolarHBondContact O-CB 3.02Å; Y268-A272 PolarHBondContact O-N 2.8Å; Y268-M288 HydrophobicContact CD1-CE 4.29Å; Y268-M288 HydrophobicContact CD2-CE 3.42Å; Y268-M288 VanDerWaalsContact CD2-CE 3.42Å; Y268-M288 HydrophobicContact CD2-SD 4.45Å; Y268-M288 HydrophobicContact CE1-CE 3.94Å; Y268-M288 HydrophobicContact CE2-CE 3.04Å; Y268-M288 HydrophobicContact CE2-SD 4.41Å; Y268-M288 HydrophobicContact CG-CE 4.05Å; Y268-A292 HydrophobicContact CD2-CB 4.07Å; Y268-A292 HydrophobicContact CE2-CB 3.9Å
269A95.9Very high92.4Very high11 Ų1147.6 Ų47.69%0.09125%0.248CC..Hα-helixtrans-59.2-40-18000000111.9F208 F212 W265 M266 W273F208-A269 HydrophobicContact CE1-CB 4Å; F208-A269 WeakPolarHBondContact CE1-O 3.32Å; F208-A269 HydrophobicContact CZ-CB 4.48Å; F208-A269 VanDerWaalsContact CZ-O 3.26Å; F208-A269 WeakPolarHBondContact CZ-O 3.44Å; F212-A269 HydrophobicContact CD2-CB 4.07Å; F212-A269 HydrophobicContact CE2-CB 3.51Å; F212-A269 HydrophobicContact CZ-CB 3.82Å; W265-A269 WeakPolarHBondContact O-CB 3.38Å; W265-A269 PolarHBondContact O-N 3.44Å; M266-A269 PolarHBondContact O-N 3.47Å; A269-W273 VanDerWaalsContact O-CB 3.3Å; A269-W273 WeakPolarHBondContact O-CB 3.36Å; A269-W273 PolarHBondContact O-N 2.86Å
270T96.1Very high92.4Very high83 Ų8345.2 Ų45.251%0.50925%0.245SC..Hα-helixtrans-65.3-46178.6-56.70000111.4M266 Y268 Y274M266-T270 VanDerWaalsContact O-CB 3.22Å; M266-T270 WeakPolarHBondContact O-CB 3.32Å; M266-T270 PolarHBondContact O-N 3.18Å; M266-T270 PolarHBondContact O-OG1 2.67Å; Y268-T270 VanDerWaalsContact C-N 3.28Å; Y268-T270 PolarHBondContact O-N 3.16Å; T270-Y274 VanDerWaalsContact O-CB 3.25Å; T270-Y274 WeakPolarHBondContact O-CB 3.26Å; T270-Y274 PolarHBondContact O-N 2.82Å
271V96.9Very high92.6Very high26 Ų2646.8 Ų46.816%0.15826%0.255CS..Hα-helixtrans-69.5-41.1178.91760000111.3P267 Y268 Y274 I275 M287 M288 P291P267-V271 WeakPolarHBondContact O-CG2 3.4Å; P267-V271 PolarHBondContact O-N 3.24Å; P267-V271 VanDerWaalsContact O-N 3.09Å; Y268-V271 PolarHBondContact O-N 2.87Å; V271-Y274 PolarHBondContact O-N 2.83Å; V271-I275 HydrophobicContact CG1-CD1 3.77Å; V271-I275 HydrophobicContact CG1-CG1 4.34Å; V271-I275 VanDerWaalsContact O-CG1 3.31Å; V271-I275 WeakPolarHBondContact O-CG1 3.22Å; V271-I275 PolarHBondContact O-N 2.99Å; V271-M287 HydrophobicContact CG1-CG 3.95Å; V271-M287 HydrophobicContact CG1-SD 4.47Å; V271-M288 HydrophobicContact CB-SD 3.95Å; V271-M288 HydrophobicContact CG1-CB 4.39Å; V271-M288 HydrophobicContact CG1-SD 3.48Å; V271-M288 WeakPolarHBondContact CG1-SD 3.5Å; V271-P291 HydrophobicContact CB-CG 4.23Å; V271-P291 HydrophobicContact CG2-CG 4.04Å
272A96.9Very high93.1Very high3 Ų351.7 Ų51.73%0.02528%0.282CS..Hα-helixtrans-60.6-45.9175.600000111.7Y191 F208 Y268 I275 F276 M288Y191-A272 HydrophobicContact CD1-CB 3.86Å; Y191-A272 HydrophobicContact CD2-CB 4.48Å; Y191-A272 HydrophobicContact CE1-CB 4.04Å; Y191-A272 HydrophobicContact CG-CB 4.15Å; F208-A272 HydrophobicContact CE2-CB 4.48Å; F208-A272 HydrophobicContact CZ-CB 4.06Å; Y268-A272 HydrophobicContact CE1-CB 4.42Å; Y268-A272 WeakPolarHBondContact O-CB 3.02Å; Y268-A272 PolarHBondContact O-N 2.8Å; A272-I275 PolarHBondContact O-N 2.7Å; A272-F276 WeakPolarHBondContact O-CB 3.49Å; A272-F276 PolarHBondContact O-N 2.95Å; A272-M288 HydrophobicContact CB-CE 4.12Å
273W96.9Very high93.4Very high117 Ų11749.3 Ų49.344%0.44327%0.269SS..Hα-helixtrans-64.6-40.7175.3-172.6-99.1000112.2F208 A269 F276 A277F208-W273 HydrophobicContact CB-CE3 4.01Å; F208-W273 HydrophobicContact CB-CZ3 3.76Å; F208-W273 HydrophobicContact CD1-CD2 4.38Å; F208-W273 AromaticContact CD1-CE3 3.66Å; F208-W273 HydrophobicContact CD1-CE3 3.66Å; F208-W273 HydrophobicContact CD1-CZ3 4.29Å; F208-W273 AromaticContact CD2-CE3 3.58Å; F208-W273 HydrophobicContact CD2-CE3 3.58Å; F208-W273 AromaticContact CD2-CZ3 3.95Å; F208-W273 HydrophobicContact CD2-CZ3 3.95Å; F208-W273 HydrophobicContact CE1-CB 3.75Å; F208-W273 HydrophobicContact CE1-CD2 4.44Å; F208-W273 AromaticContact CE1-CE3 3.97Å; F208-W273 HydrophobicContact CE1-CE3 3.97Å; F208-W273 HydrophobicContact CE1-CG 4.41Å; F208-W273 HydrophobicContact CE2-CB 4.48Å; F208-W273 AromaticContact CE2-CE3 3.89Å; F208-W273 HydrophobicContact CE2-CE3 3.89Å; F208-W273 AromaticContact CG-CE3 3.45Å; F208-W273 HydrophobicContact CG-CE3 3.45Å; F208-W273 VanDerWaalsContact CG-CE3 3.45Å; F208-W273 AromaticContact CG-CZ3 3.73Å; F208-W273 HydrophobicContact CG-CZ3 3.73Å; F208-W273 HydrophobicContact CZ-CB 3.73Å; F208-W273 HydrophobicContact CZ-CE3 4.07Å; A269-W273 VanDerWaalsContact O-CB 3.3Å; A269-W273 WeakPolarHBondContact O-CB 3.36Å; A269-W273 PolarHBondContact O-N 2.86Å; W273-F276 HydrophobicContact CD2-CD1 4.43Å; W273-F276 HydrophobicContact CE3-CD1 4.02Å; W273-F276 HydrophobicContact CH2-CD1 4.36Å; W273-F276 HydrophobicContact CH2-CE1 4.19Å; W273-F276 AromaticContact CZ3-CD1 3.99Å; W273-F276 HydrophobicContact CZ3-CD1 3.99Å; W273-F276 HydrophobicContact CZ3-CE1 4.07Å; W273-F276 PolarHBondContact O-N 3.49Å; W273-A277 WeakPolarHBondContact O-CB 3.42Å; W273-A277 PolarHBondContact O-N 3.31Å
274Y96.8Very high93.4Very high107 Ų10747.4 Ų47.442%0.4226%0.264SS..Hα-helixtrans-60.5-46.3176.7174.3-96.2000111.6T270 V271 A277 N278 M287T270-Y274 VanDerWaalsContact O-CB 3.25Å; T270-Y274 WeakPolarHBondContact O-CB 3.26Å; T270-Y274 PolarHBondContact O-N 2.82Å; V271-Y274 PolarHBondContact O-N 2.83Å; Y274-A277 PolarHBondContact O-N 2.99Å; Y274-N278 WeakPolarHBondContact O-CB 3.48Å; Y274-N278 PolarHBondContact O-N 3.46Å; Y274-N278 PolarHBondContact O-ND2 3.45Å; Y274-M287 HydrophobicContact CD1-SD 4.34Å; Y274-M287 HydrophobicContact CE1-SD 4.26Å
275I96.3Very high93.6Very high1 Ų148.2 Ų48.21%0.00527%0.27CS..Hα-helixtrans-63.6-43.9177.1-67.1166.6000110.2Y191 Y192 V271 A272 A277 N278 Q279 F283 M288Y191-I275 HydrophobicContact CD2-CB 3.81Å; Y191-I275 HydrophobicContact CD2-CD1 4.18Å; Y191-I275 HydrophobicContact CD2-CG2 3.64Å; Y191-I275 HydrophobicContact CE2-CB 4.25Å; Y191-I275 HydrophobicContact CE2-CD1 3.72Å; Y191-I275 HydrophobicContact CE2-CG2 4.15Å; Y192-I275 HydrophobicContact CD1-CG2 3.57Å; Y192-I275 HydrophobicContact CE1-CD1 3.89Å; Y192-I275 HydrophobicContact CE1-CG2 3.89Å; Y192-I275 HydrophobicContact CG-CG2 4.23Å; V271-I275 HydrophobicContact CG1-CD1 3.77Å; V271-I275 HydrophobicContact CG1-CG1 4.34Å; V271-I275 VanDerWaalsContact O-CG1 3.31Å; V271-I275 WeakPolarHBondContact O-CG1 3.22Å; V271-I275 PolarHBondContact O-N 2.99Å; A272-I275 PolarHBondContact O-N 2.7Å; I275-A277 PolarHBondContact O-N 2.94Å; I275-N278 CarbonylContact O-C 3.55Å; I275-N278 VanDerWaalsContact O-C 3.27Å; I275-N278 PolarHBondContact O-N 3.14Å; I275-Q279 WeakPolarHBondContact O-CG 3.49Å; I275-Q279 PolarHBondContact O-N 3.36Å; I275-F283 HydrophobicContact CG1-CG 4.5Å; I275-F283 HydrophobicContact CG2-CE1 4.15Å; I275-F283 HydrophobicContact CG2-CE2 4.37Å; I275-F283 HydrophobicContact CG2-CZ 3.93Å; I275-M288 HydrophobicContact CD1-CB 4.4Å; I275-M288 HydrophobicContact CD1-SD 4.46Å
276F96.4Very high93.8Very high29 Ų2948.9 Ų48.913%0.12728%0.278CS..Hα-helixtrans-59.1-44.1176.2173.4-112.6000113Y191 T201 V204 I205 A272 W273 N278 Q279Y191-F276 WeakPolarHBondContact O-CA 3.24Å; T201-F276 HydrophobicContact CG2-CE2 3.95Å; T201-F276 HydrophobicContact CG2-CZ 3.81Å; V204-F276 HydrophobicContact CB-CD2 4.05Å; V204-F276 HydrophobicContact CB-CE2 4.01Å; V204-F276 HydrophobicContact CB-CG 4.45Å; V204-F276 HydrophobicContact CB-CZ 4.36Å; V204-F276 HydrophobicContact CG1-CB 4.17Å; V204-F276 HydrophobicContact CG1-CD1 3.87Å; V204-F276 HydrophobicContact CG1-CD2 3.73Å; V204-F276 HydrophobicContact CG1-CE1 4.16Å; V204-F276 HydrophobicContact CG1-CE2 4.05Å; V204-F276 HydrophobicContact CG1-CG 3.63Å; V204-F276 HydrophobicContact CG1-CZ 4.24Å; V204-F276 HydrophobicContact CG2-CD2 4.29Å; I205-F276 HydrophobicContact CD1-CZ 4.4Å; I205-F276 HydrophobicContact CG1-CE1 4.23Å; I205-F276 HydrophobicContact CG1-CZ 4.04Å; A272-F276 WeakPolarHBondContact O-CB 3.49Å; A272-F276 PolarHBondContact O-N 2.95Å; W273-F276 HydrophobicContact CD2-CD1 4.43Å; W273-F276 HydrophobicContact CE3-CD1 4.02Å; W273-F276 HydrophobicContact CH2-CD1 4.36Å; W273-F276 HydrophobicContact CH2-CE1 4.19Å; W273-F276 AromaticContact CZ3-CD1 3.99Å; W273-F276 HydrophobicContact CZ3-CD1 3.99Å; W273-F276 HydrophobicContact CZ3-CE1 4.07Å; W273-F276 PolarHBondContact O-N 3.49Å; F276-N278 VanDerWaalsContact C-N 3.26Å; F276-N278 PolarHBondContact O-N 3.43Å; F276-Q279 WeakPolarHBondContact O-CG 3.25Å
277A95.9Very high93.9Very high62 Ų6249.4 Ų49.451%0.51228%0.281SS..Hα-helixtrans-74.1-17.3179.200000113.2W273 Y274 I275W273-A277 WeakPolarHBondContact O-CB 3.42Å; W273-A277 PolarHBondContact O-N 3.31Å; Y274-A277 PolarHBondContact O-N 2.99Å; I275-A277 PolarHBondContact O-N 2.94Å
278N94.6Very high93.9Very high61 Ų6147.1 Ų47.133%0.32627%0.266SS..THydrogen-bonded Turntrans-129.640.9-173.9-60.7-86.4000111.8Y274 I275 F276 G280 T281Y274-N278 WeakPolarHBondContact O-CB 3.48Å; Y274-N278 PolarHBondContact O-N 3.46Å; Y274-N278 PolarHBondContact O-ND2 3.45Å; I275-N278 CarbonylContact O-C 3.55Å; I275-N278 VanDerWaalsContact O-C 3.27Å; I275-N278 PolarHBondContact O-N 3.14Å; F276-N278 VanDerWaalsContact C-N 3.26Å; F276-N278 PolarHBondContact O-N 3.43Å; N278-G280 PolarHBondContact O-N 3.29Å; N278-T281 HydrophobicContact CB-CG2 3.9Å; N278-T281 WeakPolarHBondContact O-CB 3.35Å; N278-T281 VanDerWaalsContact O-CG2 3.29Å; N278-T281 WeakPolarHBondContact O-CG2 3.34Å; N278-T281 PolarHBondContact O-N 2.92Å; N278-T281 VanDerWaalsContact O-N 3.15Å; N278-T281 PolarHBondContact O-OG1 2.94Å
279Q92.1Very high94Very high57 Ų5746.1 Ų46.127%0.26626%0.263SS..THydrogen-bonded Turntrans-56138.5-179-71175.3-19.600111.6Y191 Y192 I275 F276 T281Y191-Q279 PolarHBondContact O-NE2 3.08Å; Y192-Q279 WeakPolarHBondContact O-CG 3.48Å; I275-Q279 WeakPolarHBondContact O-CG 3.49Å; I275-Q279 PolarHBondContact O-N 3.36Å; F276-Q279 WeakPolarHBondContact O-CG 3.25Å; Q279-T281 PolarHBondContact O-N 3.03Å
280G83.9Confident94.1Very high40 Ų4050.9 Ų50.941%0.41229%0.286SS..THydrogen-bonded Turntrans78.2-4-17800000115.7N2 N278N2-G280 WeakPolarHBondContact CB-O 3.22Å; N2-G280 PolarHBondContact ND2-O 3.2Å; N278-G280 PolarHBondContact O-N 3.29Å
281T89.2Confident94.1Very high49 Ų4947.4 Ų47.430%0.30126%0.264SS..SBendtrans-71.4169.3169.864.20000111.8N278 Q279 F283N278-T281 HydrophobicContact CB-CG2 3.9Å; N278-T281 WeakPolarHBondContact O-CB 3.35Å; N278-T281 VanDerWaalsContact O-CG2 3.29Å; N278-T281 WeakPolarHBondContact O-CG2 3.34Å; N278-T281 PolarHBondContact O-N 2.92Å; N278-T281 VanDerWaalsContact O-N 3.15Å; N278-T281 PolarHBondContact O-OG1 2.94Å; Q279-T281 PolarHBondContact O-N 3.03Å; T281-F283 VanDerWaalsContact O-CD1 3.25Å; T281-F283 WeakPolarHBondContact O-CD1 3.43Å; T281-F283 VanDerWaalsContact O-CE1 3.26Å; T281-F283 WeakPolarHBondContact O-CE1 3.41Å; T281-F283 PolarHBondContact O-N 3.06Å
282N89.1Confident94.1Very high120 Ų12046.3 Ų46.364%0.64226%0.258SS*.  trans-85.2111.6178.7-172.815.3000110.3N2N2-N282 HydrophobicContact CB-CB 4.04Å
283F90.9Very high94.1Very high5 Ų546.6 Ų46.62%0.02226%0.259CS..  trans-129.9137.3170.941.8-93.4000108.7Y10 P12 Y192 I275 T281 M287Y10-F283 HydrophobicContact CD1-CE2 4.23Å; Y10-F283 HydrophobicContact CD1-CZ 4.31Å; Y10-F283 AromaticContact CE1-CE2 3.46Å; Y10-F283 HydrophobicContact CE1-CE2 3.46Å; Y10-F283 VanDerWaalsContact CE1-CE2 3.46Å; Y10-F283 AromaticContact CE1-CZ 3.37Å; Y10-F283 HydrophobicContact CE1-CZ 3.37Å; Y10-F283 AromaticContact CZ-CZ 3.75Å; P12-F283 HydrophobicContact CB-CD2 3.72Å; P12-F283 HydrophobicContact CB-CE2 3.77Å; P12-F283 WeakPolarHBondContact CB-O 3.33Å; Y192-F283 AromaticContact CD1-CE2 3.61Å; Y192-F283 HydrophobicContact CD1-CE2 3.61Å; Y192-F283 AromaticContact CD1-CZ 3.76Å; Y192-F283 HydrophobicContact CD1-CZ 3.76Å; Y192-F283 HydrophobicContact CE1-CD2 4.33Å; Y192-F283 AromaticContact CE1-CE2 3.53Å; Y192-F283 HydrophobicContact CE1-CE2 3.53Å; Y192-F283 HydrophobicContact CE1-CZ 4.14Å; I275-F283 HydrophobicContact CG1-CG 4.5Å; I275-F283 HydrophobicContact CG2-CE1 4.15Å; I275-F283 HydrophobicContact CG2-CE2 4.37Å; I275-F283 HydrophobicContact CG2-CZ 3.93Å; T281-F283 VanDerWaalsContact O-CD1 3.25Å; T281-F283 WeakPolarHBondContact O-CD1 3.43Å; T281-F283 VanDerWaalsContact O-CE1 3.26Å; T281-F283 WeakPolarHBondContact O-CE1 3.41Å; T281-F283 PolarHBondContact O-N 3.06Å; F283-M287 HydrophobicContact CB-CE 4.28Å; F283-M287 HydrophobicContact CB-SD 3.83Å
284G90.1Very high94.1Very high35 Ų3545.3 Ų45.336%0.36126%0.257SS..  trans-80.6158.6179.500000112.7V286 M287G284-V286 VanDerWaalsContact C-N 3.26Å; G284-V286 PolarHBondContact O-N 2.63Å; G284-M287 WeakPolarHBondContact O-CB 3.41Å; G284-M287 PolarHBondContact O-N 2.87Å
285P91.9Very high94Very high18 Ų1840.4 Ų40.412%0.11724%0.238CC..Hα-helixtrans-60.6-33.3-178.623.4-34.2000113.3P12 L31 G182 M183 M287 T289P12-P285 HydrophobicContact CG-CB 3.94Å; L31-P285 HydrophobicContact CB-CB 4.23Å; L31-P285 HydrophobicContact CB-CG 3.98Å; L31-P285 HydrophobicContact CD1-CB 4.36Å; L31-P285 HydrophobicContact CD2-CG 4.32Å; L31-P285 WeakPolarHBondContact O-CG 3.41Å; G182-P285 CarbonylContact C-O 3.27Å; G182-P285 WeakPolarHBondContact CA-O 3.3Å; G182-P285 WeakPolarHBondContact O-CB 3.31Å; M183-P285 HydrophobicContact CG-CB 4.11Å; P285-M287 VanDerWaalsContact C-N 3.27Å; P285-M287 PolarHBondContact O-N 3.35Å; P285-T289 PolarHBondContact O-N 2.95Å; P285-T289 PolarHBondContact O-OG1 3.01Å; P285-T289 VanDerWaalsContact O-OG1 3.13Å
286V94.5Very high93.9Very high53 Ų5340.8 Ų40.832%0.32124%0.24SC..Hα-helixtrans-68-27.7-178.1179.30000112.4G284 M288 T289 I290G284-V286 VanDerWaalsContact C-N 3.26Å; G284-V286 PolarHBondContact O-N 2.63Å; V286-M288 VanDerWaalsContact C-N 3.28Å; V286-M288 PolarHBondContact O-N 2.93Å; V286-T289 PolarHBondContact O-N 2.87Å; V286-I290 HydrophobicContact CG1-CD1 3.56Å; V286-I290 HydrophobicContact CG1-CG1 3.85Å; V286-I290 PolarHBondContact O-N 2.85Å; V286-I290 VanDerWaalsContact O-N 3.13Å
287M95.4Very high93.8Very high80 Ų8040.2 Ų40.239%0.39424%0.239SC..Hα-helixtrans-58-40.6-176.7-177.1-177.2-76.700111.9V271 Y274 F283 G284 P285 P291V271-M287 HydrophobicContact CG1-CG 3.95Å; V271-M287 HydrophobicContact CG1-SD 4.47Å; Y274-M287 HydrophobicContact CD1-SD 4.34Å; Y274-M287 HydrophobicContact CE1-SD 4.26Å; F283-M287 HydrophobicContact CB-CE 4.28Å; F283-M287 HydrophobicContact CB-SD 3.83Å; G284-M287 WeakPolarHBondContact O-CB 3.41Å; G284-M287 PolarHBondContact O-N 2.87Å; P285-M287 VanDerWaalsContact C-N 3.27Å; P285-M287 PolarHBondContact O-N 3.35Å; M287-P291 WeakPolarHBondContact O-CD 3.39Å; M287-P291 VanDerWaalsContact O-CG 3.32Å; M287-P291 WeakPolarHBondContact O-CG 3.45Å
288M96.3Very high93.6Very high3 Ų337.3 Ų37.32%0.01522%0.216CC..Hα-helixtrans-91.5-29.4177-165.954.6176.100113E181 Y191 Y268 V271 A272 I275 V286 I290 P291 A292E181-M288 HydrophobicContact CB-CG 4.18Å; Y191-M288 HydrophobicContact CE1-CE 3.88Å; Y191-M288 HydrophobicContact CE2-CE 4.17Å; Y191-M288 VanDerWaalsContact CZ-CE 3.42Å; Y191-M288 WeakPolarHBondContact OH-CE 3.2Å; Y191-M288 VanDerWaalsContact OH-CG 3.28Å; Y191-M288 WeakPolarHBondContact OH-CG 3.24Å; Y268-M288 HydrophobicContact CD1-CE 4.29Å; Y268-M288 HydrophobicContact CD2-CE 3.42Å; Y268-M288 VanDerWaalsContact CD2-CE 3.42Å; Y268-M288 HydrophobicContact CD2-SD 4.45Å; Y268-M288 HydrophobicContact CE1-CE 3.94Å; Y268-M288 HydrophobicContact CE2-CE 3.04Å; Y268-M288 HydrophobicContact CE2-SD 4.41Å; Y268-M288 HydrophobicContact CG-CE 4.05Å; V271-M288 HydrophobicContact CB-SD 3.95Å; V271-M288 HydrophobicContact CG1-CB 4.39Å; V271-M288 HydrophobicContact CG1-SD 3.48Å; V271-M288 WeakPolarHBondContact CG1-SD 3.5Å; A272-M288 HydrophobicContact CB-CE 4.12Å; I275-M288 HydrophobicContact CD1-CB 4.4Å; I275-M288 HydrophobicContact CD1-SD 4.46Å; V286-M288 VanDerWaalsContact C-N 3.28Å; V286-M288 PolarHBondContact O-N 2.93Å; M288-I290 PolarHBondContact O-N 2.93Å; M288-P291 VanDerWaalsContact O-CD 3.3Å; M288-P291 WeakPolarHBondContact O-CD 3.41Å; M288-P291 WeakPolarHBondContact O-CG 3.41Å; M288-P291 HydrophobicContact SD-CG 4.18Å; M288-A292 WeakPolarHBondContact O-CB 3.32Å; M288-A292 PolarHBondContact O-N 2.9Å
289T97.7Very high93.5Very high8 Ų834.4 Ų34.45%0.04920%0.2CC..Hα-helixtrans-60.4-44.2178.3-68.20000113L40 G182 M183 P285 V286 F293L40-T289 HydrophobicContact CD1-CG2 3.9Å; L40-T289 HydrophobicContact CD2-CG2 3.86Å; G182-T289 WeakPolarHBondContact CA-OG1 3.23Å; M183-T289 HydrophobicContact CG-CG2 4.29Å; M183-T289 WeakPolarHBondContact CG-OG1 3.37Å; M183-T289 PolarHBondContact N-OG1 3.32Å; M183-T289 HydrophobicContact SD-CG2 4.03Å; P285-T289 PolarHBondContact O-N 2.95Å; P285-T289 PolarHBondContact O-OG1 3.01Å; P285-T289 VanDerWaalsContact O-OG1 3.13Å; V286-T289 PolarHBondContact O-N 2.87Å; T289-F293 HydrophobicContact CG2-CD2 3.82Å; T289-F293 HydrophobicContact CG2-CE2 4.04Å; T289-F293 WeakPolarHBondContact O-CB 3.38Å; T289-F293 VanDerWaalsContact O-CD2 3.28Å; T289-F293 WeakPolarHBondContact O-CD2 3.41Å; T289-F293 PolarHBondContact O-N 3.15Å
290I97.1Very high93.4Very high112 Ų11232.9 Ų32.957%0.57419%0.193SC*.Hα-helixtrans-58.9-57.9-179.2-66.9173.3000111.5V286 M288 A292 F294V286-I290 HydrophobicContact CG1-CD1 3.56Å; V286-I290 HydrophobicContact CG1-CG1 3.85Å; V286-I290 PolarHBondContact O-N 2.85Å; V286-I290 VanDerWaalsContact O-N 3.13Å; M288-I290 PolarHBondContact O-N 2.93Å; I290-A292 PolarHBondContact O-N 3.39Å; I290-F294 VanDerWaalsContact O-CB 3.23Å; I290-F294 WeakPolarHBondContact O-CB 3.18Å; I290-F294 PolarHBondContact O-N 2.91Å
291P97.3Very high93.4Very high9 Ų933 Ų336%0.05818%0.182CC..Hα-helixtrans-68-33.5-178.826.9-35.7000113.2P267 V271 M287 M288 F294 A295P267-P291 HydrophobicContact CB-CB 3.86Å; V271-P291 HydrophobicContact CB-CG 4.23Å; V271-P291 HydrophobicContact CG2-CG 4.04Å; M287-P291 WeakPolarHBondContact O-CD 3.39Å; M287-P291 VanDerWaalsContact O-CG 3.32Å; M287-P291 WeakPolarHBondContact O-CG 3.45Å; M288-P291 VanDerWaalsContact O-CD 3.3Å; M288-P291 WeakPolarHBondContact O-CD 3.41Å; M288-P291 WeakPolarHBondContact O-CG 3.41Å; M288-P291 HydrophobicContact SD-CG 4.18Å; P291-F294 PolarHBondContact O-N 2.95Å; P291-A295 WeakPolarHBondContact O-CB 3.41Å; P291-A295 PolarHBondContact O-N 3.19Å
292A96.9Very high93.1Very high4 Ų431.1 Ų31.13%0.03317%0.17CC..Hα-helixtrans-62.1-47.4176.200000112.5E181 Y268 M288 I290 A295 K296E181-A292 WeakPolarHBondContact OE1-CB 3.45Å; Y268-A292 HydrophobicContact CD2-CB 4.07Å; Y268-A292 HydrophobicContact CE2-CB 3.9Å; M288-A292 WeakPolarHBondContact O-CB 3.32Å; M288-A292 PolarHBondContact O-N 2.9Å; I290-A292 PolarHBondContact O-N 3.39Å; A292-A295 PolarHBondContact O-N 3.09Å; A292-K296 WeakPolarHBondContact O-CG 3.36Å; A292-K296 PolarHBondContact O-N 3.42Å
293F97Very high92.8Very high9 Ų925.6 Ų25.64%0.03914%0.141CC..Hα-helixtrans-74-33.2177.6-79.7-102.1000111.8L40 Y43 M44 T94 C185 T289 A295 K296L40-F293 HydrophobicContact CB-CE1 3.99Å; L40-F293 HydrophobicContact CB-CZ 4.24Å; L40-F293 HydrophobicContact CD1-CE1 4.42Å; L40-F293 HydrophobicContact CD1-CE2 4.08Å; L40-F293 HydrophobicContact CD1-CZ 3.91Å; L40-F293 HydrophobicContact CD2-CD1 3.8Å; L40-F293 HydrophobicContact CD2-CD2 4.04Å; L40-F293 HydrophobicContact CD2-CE1 3.89Å; L40-F293 HydrophobicContact CD2-CE2 4.14Å; L40-F293 HydrophobicContact CD2-CG 3.85Å; L40-F293 HydrophobicContact CD2-CZ 4.06Å; L40-F293 HydrophobicContact CG-CE1 4.31Å; L40-F293 HydrophobicContact CG-CZ 4.29Å; Y43-F293 HydrophobicContact CD1-CB 4.39Å; Y43-F293 AromaticContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CD1-CD1 3.96Å; Y43-F293 HydrophobicContact CE1-CB 4.03Å; Y43-F293 HydrophobicContact CE1-CD1 4.24Å; Y43-F293 WeakPolarHBondContact CE1-O 3.35Å; Y43-F293 PolarHBondContact OH-O 3.31Å; M44-F293 HydrophobicContact CG-CD1 4.27Å; M44-F293 HydrophobicContact CG-CE1 3.79Å; M44-F293 HydrophobicContact SD-CD1 3.65Å; M44-F293 HydrophobicContact SD-CE1 3.64Å; T94-F293 HydrophobicContact CG2-CE1 3.6Å; T94-F293 HydrophobicContact CG2-CZ 3.67Å; C185-F293 HydrophobicContact CB-CZ 4.42Å; T289-F293 HydrophobicContact CG2-CD2 3.82Å; T289-F293 HydrophobicContact CG2-CE2 4.04Å; T289-F293 WeakPolarHBondContact O-CB 3.38Å; T289-F293 VanDerWaalsContact O-CD2 3.28Å; T289-F293 WeakPolarHBondContact O-CD2 3.41Å; T289-F293 PolarHBondContact O-N 3.15Å; F293-A295 VanDerWaalsContact C-N 3.31Å; F293-A295 PolarHBondContact O-N 2.94Å; F293-K296 WeakPolarHBondContact O-CB 3.45Å; F293-K296 PolarHBondContact O-N 3Å
294F96.3Very high92.4Very high90 Ų9028.7 Ų28.740%0.39516%0.157SC..Hα-helixtrans-62.8-38.8172.7-171.9-107.6000112V263 I290 P291 K296 S297V263-F294 HydrophobicContact CG1-CE1 3.89Å; V263-F294 HydrophobicContact CG1-CZ 3.92Å; V263-F294 VanDerWaalsContact O-CE1 3.29Å; V263-F294 WeakPolarHBondContact O-CE1 3.49Å; I290-F294 VanDerWaalsContact O-CB 3.23Å; I290-F294 WeakPolarHBondContact O-CB 3.18Å; I290-F294 PolarHBondContact O-N 2.91Å; P291-F294 PolarHBondContact O-N 2.95Å; F294-K296 PolarHBondContact O-N 3.01Å; F294-S297 VanDerWaalsContact O-CB 3.29Å; F294-S297 WeakPolarHBondContact O-CB 3.39Å; F294-S297 PolarHBondContact O-N 2.84Å; F294-S297 PolarHBondContact O-OG 2.89Å
295A94.9Very high91.9Very high4 Ų428.1 Ų28.13%0.03315%0.145CC..Hα-helixtrans-59-37.1175.100000112.2C264 W265 P291 A292 F293 S297 A298C264-A295 WeakPolarHBondContact SG-CA 3.22Å; C264-A295 PolarHBondContact SG-O 2.9Å; W265-A295 HydrophobicContact CE3-CB 4.23Å; W265-A295 HydrophobicContact CH2-CB 4.41Å; W265-A295 HydrophobicContact CZ3-CB 4.16Å; P291-A295 WeakPolarHBondContact O-CB 3.41Å; P291-A295 PolarHBondContact O-N 3.19Å; A292-A295 PolarHBondContact O-N 3.09Å; F293-A295 VanDerWaalsContact C-N 3.31Å; F293-A295 PolarHBondContact O-N 2.94Å; A295-S297 PolarHBondContact O-N 3.19Å; A295-A298 WeakPolarHBondContact O-CB 3.48Å; A295-A298 PolarHBondContact O-N 3.36Å
296K95.3Very high91Very high8 Ų828.4 Ų28.44%0.03514%0.144CC..Hα-helixtrans-63.3-21.1176.7-62.8179.9-160.7-71.80113.1M44 L47 F91 T94 E113 S186 A292 F293 F294 A298 A299M44-K296 HydrophobicContact CE-CD 3.99Å; M44-K296 HydrophobicContact SD-CD 3.98Å; L47-K296 HydrophobicContact CD1-CB 3.91Å; F91-K296 HydrophobicContact CD1-CB 4.5Å; F91-K296 HydrophobicContact CD1-CD 4.2Å; F91-K296 HydrophobicContact CD1-CG 4.43Å; F91-K296 HydrophobicContact CE1-CB 3.63Å; F91-K296 HydrophobicContact CE1-CD 4Å; F91-K296 HydrophobicContact CE1-CG 3.74Å; F91-K296 HydrophobicContact CZ-CB 3.73Å; F91-K296 HydrophobicContact CZ-CG 4.34Å; F91-K296 WeakPolarHBondContact CZ-O 3.39Å; T94-K296 HydrophobicContact CG2-CD 4.46Å; E113-K296 IonicContact OE1-NZ 2.72Å; E113-K296 PolarHBondContact OE1-NZ 3.31Å; S186-K296 WeakPolarHBondContact OG-CE 3.37Å; S186-K296 PolarHBondContact OG-NZ 3Å; A292-K296 WeakPolarHBondContact O-CG 3.36Å; A292-K296 PolarHBondContact O-N 3.42Å; F293-K296 WeakPolarHBondContact O-CB 3.45Å; F293-K296 PolarHBondContact O-N 3Å; F294-K296 PolarHBondContact O-N 3.01Å; K296-A298 PolarHBondContact O-N 3.4Å; K296-A298 VanDerWaalsContact O-N 3.15Å; K296-A299 PolarHBondContact O-N 2.91Å
297S93.8Very high90.1Very high17 Ų1727 Ų2712%0.11913%0.134CC..THydrogen-bonded Turntrans-64-15.317373.20000114Y43 F294 A295 A299 L300 Y301Y43-S297 WeakPolarHBondContact OH-CB 3.05Å; F294-S297 VanDerWaalsContact O-CB 3.29Å; F294-S297 WeakPolarHBondContact O-CB 3.39Å; F294-S297 PolarHBondContact O-N 2.84Å; F294-S297 PolarHBondContact O-OG 2.89Å; A295-S297 PolarHBondContact O-N 3.19Å; S297-A299 PolarHBondContact O-N 3.48Å; S297-L300 PolarHBondContact O-N 3.17Å; S297-Y301 VanDerWaalsContact C-CD1 3.48Å; S297-Y301 WeakPolarHBondContact O-CD1 2.98Å; S297-Y301 PolarHBondContact O-N 3.36Å; S297-Y301 VanDerWaalsContact O-N 3.12Å
298A91.4Very high89.2Confident2 Ų228 Ų282%0.01714%0.141CC..Hα-helixtrans-48.5-44.217300000113.3A295 K296 L300 Y301 N302A295-A298 WeakPolarHBondContact O-CB 3.48Å; A295-A298 PolarHBondContact O-N 3.36Å; K296-A298 PolarHBondContact O-N 3.4Å; K296-A298 VanDerWaalsContact O-N 3.15Å; A298-L300 PolarHBondContact O-N 2.89Å; A298-Y301 WeakPolarHBondContact CA-OH 3.36Å; A298-Y301 HydrophobicContact CB-CE1 3.98Å; A298-Y301 VanDerWaalsContact CB-OH 3.27Å; A298-Y301 WeakPolarHBondContact CB-OH 3.28Å; A298-Y301 VanDerWaalsContact N-CE1 3.29Å; A298-Y301 PolarHBondContact O-N 3.29Å; A298-N302 WeakPolarHBondContact O-CB 3.46Å; A298-N302 PolarHBondContact O-N 2.92Å; A298-N302 VanDerWaalsContact O-N 3.08Å; A298-N302 PolarHBondContact O-ND2 2.97Å
299A91.7Very high88.1Confident0 Ų029.8 Ų29.80%015%0.15CC..Hα-helixtrans-61-20.1-179.200000113.3A51 N55 D83 V87 F91 K296 S297A51-A299 HydrophobicContact CB-CB 4.23Å; N55-A299 PolarHBondContact ND2-O 3.4Å; D83-A299 HydrophobicContact CB-CB 4.09Å; V87-A299 HydrophobicContact CG2-CB 4.28Å; F91-A299 HydrophobicContact CE2-CB 3.77Å; F91-A299 HydrophobicContact CZ-CB 3.76Å; K296-A299 PolarHBondContact O-N 2.91Å; S297-A299 PolarHBondContact O-N 3.48Å
300L91Very high86.9Confident24 Ų2430.9 Ų30.913%0.12616%0.156CC..Hα-helixtrans-96.9-52.7177.4179.160.6000112.5F46 L47 T50 A51 S297 A298 N302 P303 I304F46-L300 HydrophobicContact CE1-CD2 3.82Å; F46-L300 HydrophobicContact CZ-CD2 3.89Å; L47-L300 HydrophobicContact CD2-CB 4.41Å; L47-L300 HydrophobicContact CD2-CD2 4.43Å; T50-L300 WeakPolarHBondContact OG1-CD2 3.47Å; A51-L300 HydrophobicContact CB-CB 4.27Å; S297-L300 PolarHBondContact O-N 3.17Å; A298-L300 PolarHBondContact O-N 2.89Å; L300-N302 VanDerWaalsContact C-N 3.33Å; L300-N302 PolarHBondContact O-N 3.21Å; L300-P303 WeakPolarHBondContact O-CD 3.38Å; L300-I304 HydrophobicContact CD1-CD1 4.02Å; L300-I304 HydrophobicContact CG-CD1 3.96Å; L300-I304 WeakPolarHBondContact O-CG1 3.21Å
301Y84Confident85.9Confident44 Ų4430.9 Ų30.917%0.17315%0.149CC..Hα-helixtrans-74.4-26-171.271.6-109.7000112.4C264 S297 A298 I304 I305C264-Y301 HydrophobicContact CB-CE1 3.71Å; C264-Y301 WeakPolarHBondContact CB-OH 3.49Å; C264-Y301 VanDerWaalsContact SG-CE1 3.56Å; C264-Y301 PolarHBondContact SG-OH 2.91Å; S297-Y301 VanDerWaalsContact C-CD1 3.48Å; S297-Y301 WeakPolarHBondContact O-CD1 2.98Å; S297-Y301 PolarHBondContact O-N 3.36Å; S297-Y301 VanDerWaalsContact O-N 3.12Å; A298-Y301 WeakPolarHBondContact CA-OH 3.36Å; A298-Y301 HydrophobicContact CB-CE1 3.98Å; A298-Y301 VanDerWaalsContact CB-OH 3.27Å; A298-Y301 WeakPolarHBondContact CB-OH 3.28Å; A298-Y301 VanDerWaalsContact N-CE1 3.29Å; A298-Y301 PolarHBondContact O-N 3.29Å; Y301-I304 PolarHBondContact O-N 2.9Å; Y301-I305 HydrophobicContact CD2-CD1 3.77Å; Y301-I305 HydrophobicContact CE2-CD1 4.4Å; Y301-I305 WeakPolarHBondContact O-CG1 3.4Å; Y301-I305 PolarHBondContact O-N 3.21Å
302N83.1Confident84.9Confident8 Ų834.6 Ų34.64%0.04317%0.165CC..Hα-helixtrans-53.9-62.9178.1-82.2-17.2000110.1L79 A298 L300 I304 I305 Y306L79-N302 HydrophobicContact CD2-CB 3.88Å; L79-N302 HydrophobicContact CG-CB 4.46Å; A298-N302 WeakPolarHBondContact O-CB 3.46Å; A298-N302 PolarHBondContact O-N 2.92Å; A298-N302 VanDerWaalsContact O-N 3.08Å; A298-N302 PolarHBondContact O-ND2 2.97Å; L300-N302 VanDerWaalsContact C-N 3.33Å; L300-N302 PolarHBondContact O-N 3.21Å; N302-I304 VanDerWaalsContact C-N 3.28Å; N302-I304 PolarHBondContact O-N 3.39Å; N302-I305 WeakPolarHBondContact O-CB 3.41Å; N302-I305 PolarHBondContact O-N 2.94Å; N302-I305 VanDerWaalsContact O-N 3.17Å; N302-Y306 VanDerWaalsContact C-CD2 3.48Å; N302-Y306 HydrophobicContact CB-CE2 4.2Å; N302-Y306 WeakPolarHBondContact O-CD2 3.1Å; N302-Y306 VanDerWaalsContact O-CE2 3.27Å; N302-Y306 WeakPolarHBondContact O-CE2 3.31Å; N302-Y306 PolarHBondContact O-N 3.32Å
303P82.1Confident84Confident5 Ų534.6 Ų34.63%0.03217%0.165CC..Hα-helixtrans-53.4-40.5175.3-29.434000114.6V54 N55 L300 I305 Y306 I307V54-P303 HydrophobicContact CG1-CB 3.46Å; V54-P303 VanDerWaalsContact CG1-CB 3.46Å; V54-P303 HydrophobicContact CG1-CG 4.2Å; N55-P303 WeakPolarHBondContact OD1-CG 3.44Å; L300-P303 WeakPolarHBondContact O-CD 3.38Å; P303-I305 VanDerWaalsContact C-N 3.31Å; P303-I305 PolarHBondContact O-N 3.37Å; P303-Y306 PolarHBondContact O-N 3.15Å; P303-Y306 VanDerWaalsContact O-N 3.16Å; P303-I307 HydrophobicContact CB-CD1 4.3Å; P303-I307 WeakPolarHBondContact O-CB 3.34Å; P303-I307 WeakPolarHBondContact O-CD1 3.33Å; P303-I307 WeakPolarHBondContact O-CG1 3.24Å; P303-I307 PolarHBondContact O-N 3.11Å
304I83.3Confident83.3Confident69 Ų6938.4 Ų38.435%0.35418%0.179SC..Hα-helixtrans-59.1-46.1-179.2-67.3172.2000110.2L300 Y301 N302 Y306 I307 L308L300-I304 HydrophobicContact CD1-CD1 4.02Å; L300-I304 HydrophobicContact CG-CD1 3.96Å; L300-I304 WeakPolarHBondContact O-CG1 3.21Å; Y301-I304 PolarHBondContact O-N 2.9Å; N302-I304 VanDerWaalsContact C-N 3.28Å; N302-I304 PolarHBondContact O-N 3.39Å; I304-Y306 VanDerWaalsContact C-N 3.33Å; I304-Y306 PolarHBondContact O-N 2.67Å; I304-I307 PolarHBondContact O-N 2.86Å; I304-L308 HydrophobicContact CG2-CD1 3.75Å; I304-L308 HydrophobicContact CG2-CG 4.33Å; I304-L308 WeakPolarHBondContact O-CB 3.21Å; I304-L308 VanDerWaalsContact O-CG 3.22Å; I304-L308 WeakPolarHBondContact O-CG 3.39Å; I304-L308 PolarHBondContact O-N 3.3Å
305I79.9Confident82.7Confident24 Ų2436.8 Ų36.812%0.12317%0.174CC..Hα-helixtrans-58.2-47.6176.8-71.7172.4000110.2V256 S260 Y301 N302 P303 L308 L309V256-I305 HydrophobicContact CG1-CB 4.44Å; V256-I305 HydrophobicContact CG1-CD1 4.1Å; V256-I305 HydrophobicContact CG1-CG1 4.08Å; V256-I305 HydrophobicContact CG1-CG2 3.57Å; S260-I305 WeakPolarHBondContact OG-CD1 3.44Å; Y301-I305 HydrophobicContact CD2-CD1 3.77Å; Y301-I305 HydrophobicContact CE2-CD1 4.4Å; Y301-I305 WeakPolarHBondContact O-CG1 3.4Å; Y301-I305 PolarHBondContact O-N 3.21Å; N302-I305 WeakPolarHBondContact O-CB 3.41Å; N302-I305 PolarHBondContact O-N 2.94Å; N302-I305 VanDerWaalsContact O-N 3.17Å; P303-I305 VanDerWaalsContact C-N 3.31Å; P303-I305 PolarHBondContact O-N 3.37Å; I305-L308 PolarHBondContact O-N 3.38Å; I305-L309 HydrophobicContact CG2-CD1 3.54Å; I305-L309 HydrophobicContact CG2-CG 4.31Å; I305-L309 VanDerWaalsContact O-CB 3.27Å; I305-L309 WeakPolarHBondContact O-CB 3.42Å; I305-L309 WeakPolarHBondContact O-CG 3.46Å; I305-L309 PolarHBondContact O-N 2.98Å
306Y71.7Confident82Confident23 Ų2337.5 Ų37.59%0.0918%0.179CC..Hα-helixtrans-68.4-40.6-177.7-61.1-64.5000113.3L76 L79 M257 N302 P303 I304 L308 L309 N310L76-Y306 HydrophobicContact CD2-CD1 3.22Å; L76-Y306 HydrophobicContact CD2-CD2 3.89Å; L76-Y306 HydrophobicContact CD2-CE1 3.58Å; L76-Y306 HydrophobicContact CD2-CE2 4.3Å; L76-Y306 HydrophobicContact CD2-CG 3.37Å; L79-Y306 HydrophobicContact CD2-CD2 3.99Å; L79-Y306 HydrophobicContact CD2-CE2 3.16Å; M257-Y306 HydrophobicContact CE-CE1 3.47Å; M257-Y306 VanDerWaalsContact CE-CE1 3.47Å; M257-Y306 VanDerWaalsContact CE-OH 3.29Å; M257-Y306 WeakPolarHBondContact CE-OH 3.41Å; M257-Y306 HydrophobicContact CG-CE1 4.38Å; M257-Y306 HydrophobicContact SD-CE1 3.89Å; N302-Y306 VanDerWaalsContact C-CD2 3.48Å; N302-Y306 HydrophobicContact CB-CE2 4.2Å; N302-Y306 WeakPolarHBondContact O-CD2 3.1Å; N302-Y306 VanDerWaalsContact O-CE2 3.27Å; N302-Y306 WeakPolarHBondContact O-CE2 3.31Å; N302-Y306 PolarHBondContact O-N 3.32Å; P303-Y306 PolarHBondContact O-N 3.15Å; P303-Y306 VanDerWaalsContact O-N 3.16Å; I304-Y306 VanDerWaalsContact C-N 3.33Å; I304-Y306 PolarHBondContact O-N 2.67Å; Y306-L308 VanDerWaalsContact C-N 3.33Å; Y306-L308 PolarHBondContact O-N 2.87Å; Y306-L309 PolarHBondContact O-N 3.38Å; Y306-N310 VanDerWaalsContact O-CB 3.22Å; Y306-N310 WeakPolarHBondContact O-CB 3.2Å; Y306-N310 PolarHBondContact O-N 3.04Å
307I76.6Confident81.5Confident23 Ų2338.3 Ų38.312%0.11818%0.183CC..Hα-helixtrans-61.6-43.3175.9-68.3160000110.2V54 P303 I304 F313 R314 M317V54-I307 HydrophobicContact CG1-CD1 3.93Å; P303-I307 HydrophobicContact CB-CD1 4.3Å; P303-I307 WeakPolarHBondContact O-CB 3.34Å; P303-I307 WeakPolarHBondContact O-CD1 3.33Å; P303-I307 WeakPolarHBondContact O-CG1 3.24Å; P303-I307 PolarHBondContact O-N 3.11Å; I304-I307 PolarHBondContact O-N 2.86Å; I307-F313 HydrophobicContact CG1-CD1 3.85Å; I307-F313 HydrophobicContact CG1-CE1 3.74Å; I307-R314 HydrophobicContact CG2-CG 4.48Å; I307-R314 WeakPolarHBondContact O-CB 3.42Å; I307-M317 HydrophobicContact CD1-CE 3.69Å; I307-M317 HydrophobicContact CD1-SD 3.67Å; I307-M317 HydrophobicContact CG1-CE 4.5Å; I307-M317 HydrophobicContact CG1-SD 3.83Å; I307-M317 HydrophobicContact CG2-SD 3.85Å
308L76.6Confident81Confident101 Ų10139.6 Ų39.653%0.52919%0.188SC..Hα-helixtrans-73-33.4-178.9-68.3177.3000112.8I304 I305 Y306I304-L308 HydrophobicContact CG2-CD1 3.75Å; I304-L308 HydrophobicContact CG2-CG 4.33Å; I304-L308 WeakPolarHBondContact O-CB 3.21Å; I304-L308 VanDerWaalsContact O-CG 3.22Å; I304-L308 WeakPolarHBondContact O-CG 3.39Å; I304-L308 PolarHBondContact O-N 3.3Å; I305-L308 PolarHBondContact O-N 3.38Å; Y306-L308 VanDerWaalsContact C-N 3.33Å; Y306-L308 PolarHBondContact O-N 2.87Å
309L71.5Confident80.6Confident41 Ų4141.5 Ų41.522%0.21520%0.2CC..Hα-helixtrans-84.1-28.1-178.8-67.4178.3000113.3M253 V256 I305 Y306M253-L309 HydrophobicContact CB-CD1 4.49Å; M253-L309 HydrophobicContact CG-CD1 4.24Å; V256-L309 HydrophobicContact CB-CD1 4.14Å; V256-L309 HydrophobicContact CG1-CD1 4.03Å; I305-L309 HydrophobicContact CG2-CD1 3.54Å; I305-L309 HydrophobicContact CG2-CG 4.31Å; I305-L309 VanDerWaalsContact O-CB 3.27Å; I305-L309 WeakPolarHBondContact O-CB 3.42Å; I305-L309 WeakPolarHBondContact O-CG 3.46Å; I305-L309 PolarHBondContact O-N 2.98Å; Y306-L309 PolarHBondContact O-N 3.38Å
310N74.4Confident80.1Confident32 Ų3243.9 Ų43.917%0.17121%0.212CC..  trans-100.195.5-178.9-170.4-25.1000111.5N73 Y306 Q312 F313 R314N73-N310 PolarHBondContact OD1-ND2 2.91Å; Y306-N310 VanDerWaalsContact O-CB 3.22Å; Y306-N310 WeakPolarHBondContact O-CB 3.2Å; Y306-N310 PolarHBondContact O-N 3.04Å; N310-Q312 VanDerWaalsContact C-N 3.3Å; N310-Q312 PolarHBondContact O-N 3.23Å; N310-Q312 WeakPolarHBondContact OD1-CB 3.47Å; N310-Q312 PolarHBondContact OD1-N 3.17Å; N310-F313 HydrophobicContact CB-CB 3.74Å; N310-F313 WeakPolarHBondContact O-CB 3.34Å; N310-F313 PolarHBondContact O-N 3.04Å; N310-F313 VanDerWaalsContact O-N 3.16Å; N310-F313 PolarHBondContact OD1-N 2.61Å; N310-R314 PolarHBondContact O-N 3.34Å
311R75.2Confident79.8Confident112 Ų11246.9 Ų46.942%0.42323%0.231SC..Hα-helixtrans-55.6-41.9179.5-66.9-174.6-175.1-1460.3112.9R245 E249 F313 R314 N315R245-R311 VanDerWaalsContact NH2-NH2 3.12Å; E249-R311 IonicContact OE1-NH2 3.84Å; R311-F313 VanDerWaalsContact C-N 3.34Å; R311-R314 PolarHBondContact O-N 3.05Å; R311-N315 WeakPolarHBondContact O-CB 3.29Å; R311-N315 PolarHBondContact O-N 3.07Å; R311-N315 PolarHBondContact O-OD1 2.02Å
312Q75.3Confident79.8Confident87 Ų8747 Ų4741%0.40724%0.238SC..Hα-helixtrans-62.7-44.8179.7-172.9-171-11.800110.6K67 L68 N310 N315 C316K67-Q312 PolarHBondContact O-NE2 2.94Å; L68-Q312 HydrophobicContact CD2-CG 3.86Å; N310-Q312 VanDerWaalsContact C-N 3.3Å; N310-Q312 PolarHBondContact O-N 3.23Å; N310-Q312 WeakPolarHBondContact OD1-CB 3.47Å; N310-Q312 PolarHBondContact OD1-N 3.17Å; Q312-N315 PolarHBondContact O-N 2.92Å; Q312-C316 PolarHBondContact O-N 2.87Å; Q312-C316 PolarHBondContact O-SG 3.36Å
313F78.6Confident79.7Confident4 Ų452.5 Ų52.52%0.01828%0.275CS..Hα-helixtrans-61.7-49.5176.9-166.8-90.5000111.9T58 V61 T62 L68 I307 N310 R311 N315 C316 M317T58-F313 HydrophobicContact CG2-CE1 4.36Å; T58-F313 HydrophobicContact CG2-CE2 4.43Å; T58-F313 HydrophobicContact CG2-CZ 3.73Å; V61-F313 HydrophobicContact CB-CZ 4.21Å; V61-F313 HydrophobicContact CG1-CE2 4.2Å; V61-F313 HydrophobicContact CG1-CZ 4.15Å; T62-F313 WeakPolarHBondContact OG1-CE2 3.37Å; L68-F313 HydrophobicContact CD1-CD2 3.87Å; L68-F313 HydrophobicContact CD1-CE2 4.09Å; L68-F313 HydrophobicContact CD2-CD2 4.38Å; I307-F313 HydrophobicContact CG1-CD1 3.85Å; I307-F313 HydrophobicContact CG1-CE1 3.74Å; N310-F313 HydrophobicContact CB-CB 3.74Å; N310-F313 WeakPolarHBondContact O-CB 3.34Å; N310-F313 PolarHBondContact O-N 3.04Å; N310-F313 VanDerWaalsContact O-N 3.16Å; N310-F313 PolarHBondContact OD1-N 2.61Å; R311-F313 VanDerWaalsContact C-N 3.34Å; F313-N315 VanDerWaalsContact C-N 3.31Å; F313-N315 PolarHBondContact O-N 3.21Å; F313-C316 PolarHBondContact O-N 2.89Å; F313-M317 HydrophobicContact CE1-SD 4.09Å; F313-M317 WeakPolarHBondContact O-CB 3.45Å; F313-M317 PolarHBondContact O-N 2.97Å
314R83.1Confident79.1Confident88 Ų8855 Ų5533%0.33230%0.302SS..Hα-helixtrans-55.4-45.3178.7-171.217665.7-1645.4112.3I307 N310 R311 M317 L318I307-R314 HydrophobicContact CG2-CG 4.48Å; I307-R314 WeakPolarHBondContact O-CB 3.42Å; N310-R314 PolarHBondContact O-N 3.34Å; R311-R314 PolarHBondContact O-N 3.05Å; R314-M317 PolarHBondContact O-N 3.38Å; R314-L318 HydrophobicContact CG-CD1 4.17Å; R314-L318 WeakPolarHBondContact O-CB 3.4Å; R314-L318 WeakPolarHBondContact O-CG 3.35Å; R314-L318 PolarHBondContact O-N 3.39Å
315N82.6Confident78.4Confident56 Ų5659.4 Ų59.430%0.29932%0.319SS..Hα-helixtrans-64.8-45-179.5-70.2-5.2000111.5R311 Q312 F313 M317 L318 T319R311-N315 WeakPolarHBondContact O-CB 3.29Å; R311-N315 PolarHBondContact O-N 3.07Å; R311-N315 PolarHBondContact O-OD1 2.02Å; Q312-N315 PolarHBondContact O-N 2.92Å; F313-N315 VanDerWaalsContact C-N 3.31Å; F313-N315 PolarHBondContact O-N 3.21Å; N315-M317 VanDerWaalsContact C-N 3.35Å; N315-M317 PolarHBondContact O-N 2.91Å; N315-L318 PolarHBondContact O-N 3.19Å; N315-T319 PolarHBondContact O-N 3.37Å; N315-T319 PolarHBondContact O-OG1 2.97Å
316C81.8Confident77.8Confident19 Ų1960.3 Ų60.313%0.12832%0.324CS..Hα-helixtrans-62.5-40.9175-69.40000112.4V61 L68 Q312 F313 T319 I320V61-C316 HydrophobicContact CG1-CB 3.95Å; L68-C316 HydrophobicContact CD1-CB 3.95Å; Q312-C316 PolarHBondContact O-N 2.87Å; Q312-C316 PolarHBondContact O-SG 3.36Å; F313-C316 PolarHBondContact O-N 2.89Å; C316-T319 PolarHBondContact O-N 2.65Å; C316-I320 PolarHBondContact O-N 3.25Å; C316-I320 VanDerWaalsContact O-N 3.13Å
317M83.3Confident77.2Confident26 Ų2663.1 Ų63.113%0.12835%0.345CS..Hα-helixtrans-62.7-44.8177.1-171.6178.7-171.300111.5L57 V61 I307 F313 R314 N315 T319 I320 V321L57-M317 HydrophobicContact CB-CE 4.25Å; L57-M317 HydrophobicContact CD2-CE 3.23Å; L57-M317 HydrophobicContact CD2-CG 4.1Å; L57-M317 HydrophobicContact CG-CE 3.67Å; L57-M317 HydrophobicContact CG-CG 4.27Å; V61-M317 HydrophobicContact CG1-CB 4.43Å; V61-M317 HydrophobicContact CG2-CB 4.23Å; V61-M317 HydrophobicContact CG2-CG 4.18Å; I307-M317 HydrophobicContact CD1-CE 3.69Å; I307-M317 HydrophobicContact CD1-SD 3.67Å; I307-M317 HydrophobicContact CG1-CE 4.5Å; I307-M317 HydrophobicContact CG1-SD 3.83Å; I307-M317 HydrophobicContact CG2-SD 3.85Å; F313-M317 HydrophobicContact CE1-SD 4.09Å; F313-M317 WeakPolarHBondContact O-CB 3.45Å; F313-M317 PolarHBondContact O-N 2.97Å; R314-M317 PolarHBondContact O-N 3.38Å; N315-M317 VanDerWaalsContact C-N 3.35Å; N315-M317 PolarHBondContact O-N 2.91Å; M317-T319 PolarHBondContact O-N 3.45Å; M317-I320 PolarHBondContact O-N 3.28Å; M317-V321 WeakPolarHBondContact O-CG2 3.41Å; M317-V321 PolarHBondContact O-N 2.96Å
318L83.5Confident76.6Confident43 Ų4369.4 Ų69.423%0.22537%0.372CS..Hα-helixtrans-61.8-41.9175.1-74.2169.2000111.9R314 N315 I320 V321 C322 F328R314-L318 HydrophobicContact CG-CD1 4.17Å; R314-L318 WeakPolarHBondContact O-CB 3.4Å; R314-L318 WeakPolarHBondContact O-CG 3.35Å; R314-L318 PolarHBondContact O-N 3.39Å; N315-L318 PolarHBondContact O-N 3.19Å; L318-I320 VanDerWaalsContact C-N 3.27Å; L318-I320 PolarHBondContact O-N 2.84Å; L318-V321 PolarHBondContact O-N 3.3Å; L318-C322 WeakPolarHBondContact O-CB 3.47Å; L318-C322 PolarHBondContact O-N 2.89Å; L318-F328 HydrophobicContact CD1-CD2 4.01Å
319T83.3Confident75.5Confident43 Ų4366 Ų6626%0.26436%0.36SS..Hα-helixtrans-58.1-39.9175-56.20000112.1N315 C316 M317 C323 G324N315-T319 PolarHBondContact O-N 3.37Å; N315-T319 PolarHBondContact O-OG1 2.97Å; C316-T319 PolarHBondContact O-N 2.65Å; M317-T319 PolarHBondContact O-N 3.45Å; T319-C323 PolarHBondContact O-N 2.95Å; T319-G324 WeakPolarHBondContact O-CA 3.43Å; T319-G324 PolarHBondContact O-N 2.89Å
320I81.3Confident74.3Confident49 Ų4972.4 Ų72.425%0.25139%0.389SS..Hα-helixtrans-70.7-48.6177.4-75169.1000111.3L57 Y60 V61 Q64 H65 C316 M317 L318 C322 C323L57-I320 HydrophobicContact CD1-CG2 4.21Å; Y60-I320 HydrophobicContact CD1-CD1 4.3Å; Y60-I320 HydrophobicContact CD1-CG2 4.32Å; Y60-I320 HydrophobicContact CE1-CD1 4.22Å; Y60-I320 HydrophobicContact CE1-CG2 4.07Å; V61-I320 HydrophobicContact CB-CD1 4.09Å; V61-I320 HydrophobicContact CG1-CD1 4.23Å; V61-I320 HydrophobicContact CG2-CD1 3.64Å; Q64-I320 HydrophobicContact CB-CD1 4.4Å; H65-I320 VanDerWaalsContact NE2-CD1 3.31Å; H65-I320 WeakPolarHBondContact NE2-CD1 3.12Å; C316-I320 PolarHBondContact O-N 3.25Å; C316-I320 VanDerWaalsContact O-N 3.13Å; M317-I320 PolarHBondContact O-N 3.28Å; L318-I320 VanDerWaalsContact C-N 3.27Å; L318-I320 PolarHBondContact O-N 2.84Å; I320-C322 VanDerWaalsContact C-N 3.29Å; I320-C322 PolarHBondContact O-N 3.45Å; I320-C323 PolarHBondContact O-N 3.27Å
321V83.9Confident72.4Confident87 Ų8778.9 Ų78.953%0.52742%0.418SS..Hα-helixtrans-65.4-33.4-177.7173.70000111.9L57 M317 L318L57-V321 HydrophobicContact CD2-CG2 3.7Å; M317-V321 WeakPolarHBondContact O-CG2 3.41Å; M317-V321 PolarHBondContact O-N 2.96Å; L318-V321 PolarHBondContact O-N 3.3Å
322C84.8Confident70.6Confident47 Ų4782.8 Ų82.832%0.31844%0.441SS..THydrogen-bonded Turntrans-98.227.8179.6-62.10000113.1L318 I320 G324 K325L318-C322 WeakPolarHBondContact O-CB 3.47Å; L318-C322 PolarHBondContact O-N 2.89Å; I320-C322 VanDerWaalsContact C-N 3.29Å; I320-C322 PolarHBondContact O-N 3.45Å; C322-G324 VanDerWaalsContact C-N 3.34Å; C322-G324 PolarHBondContact O-N 3.34Å; C322-K325 WeakPolarHBondContact CB-O 3.43Å; C322-K325 PolarHBondContact O-N 3Å; C322-K325 VanDerWaalsContact O-N 3.13Å
323C80.9Confident68.4Low123 Ų12383.4 Ų83.483%0.83145%0.452SS*.THydrogen-bonded Turntrans51.245.2171.8-59.50000114.5T319 I320T319-C323 PolarHBondContact O-N 2.95Å; I320-C323 PolarHBondContact O-N 3.27Å
324G70.2Confident66Low57 Ų5789 Ų8959%0.58849%0.491SS*.THydrogen-bonded Turntrans95.4-3.7177.300000115.2T319 C322T319-G324 WeakPolarHBondContact O-CA 3.43Å; T319-G324 PolarHBondContact O-N 2.89Å; C322-G324 VanDerWaalsContact C-N 3.34Å; C322-G324 PolarHBondContact O-N 3.34Å
325K68.6Low63.3Low163 Ų16391.4 Ų91.471%0.70952%0.516SS*.  trans-101.8137.8176.2-62-179.4-178.7177.80110C322 P327C322-K325 WeakPolarHBondContact CB-O 3.43Å; C322-K325 PolarHBondContact O-N 3Å; C322-K325 VanDerWaalsContact O-N 3.13Å; K325-P327 WeakPolarHBondContact O-CD 3.46Å
326N67.1Low60.7Low43 Ų4392.8 Ų92.823%0.2354%0.535CS..  trans-109.297.1167.5-172.54.2000109F328 G329N326-F328 PolarHBondContact O-N 2.81Å; N326-F328 VanDerWaalsContact O-N 3.09Å; N326-F328 PolarHBondContact OD1-N 3.12Å; N326-G329 VanDerWaalsContact CG-N 3.27Å; N326-G329 WeakPolarHBondContact ND2-CA 3.42Å; N326-G329 PolarHBondContact ND2-N 3.47Å; N326-G329 PolarHBondContact O-N 3.41Å; N326-G329 VanDerWaalsContact O-N 3.1Å; N326-G329 PolarHBondContact OD1-N 3.41Å
327P58.7Low58.2Low82 Ų8297.5 Ų97.553%0.53257%0.568SS.*THydrogen-bonded Turntrans-65.7-12.4-176.425-32.1000113.8K325K325-P327 WeakPolarHBondContact O-CD 3.46Å
328F63.1Low55.4Low155 Ų155101.1 Ų101.168%0.6860%0.596SS**THydrogen-bonded Turntrans-120.712.6177.6-56.2-74.5000112.6L318 N326 E330L318-F328 HydrophobicContact CD1-CD2 4.01Å; N326-F328 PolarHBondContact O-N 2.81Å; N326-F328 VanDerWaalsContact O-N 3.09Å; N326-F328 PolarHBondContact OD1-N 3.12Å; F328-E330 PolarHBondContact O-N 3.35Å
329G55.2Low53Low28 Ų28107.7 Ų107.729%0.28962%0.623SS.*  trans-66.3117168.500000107.2N326 E331N326-G329 VanDerWaalsContact CG-N 3.27Å; N326-G329 WeakPolarHBondContact ND2-CA 3.42Å; N326-G329 PolarHBondContact ND2-N 3.47Å; N326-G329 PolarHBondContact O-N 3.41Å; N326-G329 VanDerWaalsContact O-N 3.1Å; N326-G329 PolarHBondContact OD1-N 3.41Å; G329-E331 PolarHBondContact O-N 3.48Å
330E44.8Very low50.3Low176 Ų176111.9 Ų111.982%0.82265%0.648SS**  trans-50.4118.9151.1-74.2171.5176.400104.7F328 E332F328-E330 PolarHBondContact O-N 3.35Å; E330-E332 VanDerWaalsContact C-N 3.27Å; E330-E332 PolarHBondContact O-N 3.18Å
331E36.1Very low47.7Very low168 Ų168117.1 Ų117.179%0.78567%0.672SS**  trans-52.2106162.8-73.1-178.4164.200104.7G329 T333G329-E331 PolarHBondContact O-N 3.48Å; E331-T333 PolarHBondContact O-N 3.2Å; E331-T333 PolarHBondContact O-OG1 3.44Å
332E36.7Very low45Very low194 Ų194117.7 Ų117.791%0.90769%0.685SS**  trans-61.683.5151.6-84.1-176171.900103.7E330 S334E330-E332 VanDerWaalsContact C-N 3.27Å; E330-E332 PolarHBondContact O-N 3.18Å; E332-S334 PolarHBondContact O-N 3.14Å
333T28.3Very low42.4Very low101 Ų101120.1 Ų120.162%0.6270%0.703SS**  trans-50.9119169-360000104E331 T335E331-T333 PolarHBondContact O-N 3.2Å; E331-T333 PolarHBondContact O-OG1 3.44Å; T333-T335 PolarHBondContact O-N 3.22Å; T333-T335 PolarHBondContact O-OG1 3.1Å; T333-T335 VanDerWaalsContact O-OG1 3.1Å
334S28.8Very low39.9Very low122 Ų122119.8 Ų119.885%0.85370%0.702SS**  trans-39.184.1170.2-51.30000110.5E332 A336E332-S334 PolarHBondContact O-N 3.14Å; S334-A336 VanDerWaalsContact C-N 3.31Å; S334-A336 PolarHBondContact O-N 3.42Å; S334-A336 VanDerWaalsContact O-N 3.1Å
335T27.1Very low38Very low138 Ų138124.8 Ų124.885%0.84771%0.714SS**  trans-82.298.8167.6-9.80000102.8T333 S337T333-T335 PolarHBondContact O-N 3.22Å; T333-T335 PolarHBondContact O-OG1 3.1Å; T333-T335 VanDerWaalsContact O-OG1 3.1Å; T335-S337 PolarHBondContact O-N 2.94Å
336A27.4Very low36Very low84 Ų84122 Ų12269%0.69471%0.714SS**  trans-32.8135.7172.400000110.6S334 S338S334-A336 VanDerWaalsContact C-N 3.31Å; S334-A336 PolarHBondContact O-N 3.42Å; S334-A336 VanDerWaalsContact O-N 3.1Å; A336-S338 VanDerWaalsContact C-N 3.27Å; A336-S338 PolarHBondContact O-N 3.32Å
337S28.8Very low34.4Very low119 Ų119125 Ų12583%0.83275%0.745SS**  trans-34.390.4161.9-174.90000111.3T335 K339T335-S337 PolarHBondContact O-N 2.94Å; S337-K339 PolarHBondContact O-N 3.07Å
338S25.6Very low33Very low102 Ų102125.7 Ų125.771%0.71375%0.752SS**  trans-86.697.8163.8-178.30000105.2A336 T340A336-S338 VanDerWaalsContact C-N 3.27Å; A336-S338 PolarHBondContact O-N 3.32Å; S338-T340 PolarHBondContact O-N 3.26Å
339K32.6Very low31.4Very low180 Ų180126.7 Ų126.778%0.78376%0.759SS**  trans-41.7110.2164.4-70.3173.5176.2175.30108.8S337S337-K339 PolarHBondContact O-N 3.07Å
340T27Very low30.3Very low131 Ų131131 Ų13180%0.80478%0.78SS**  trans-100.392.1152.2-47.70000105.8S338 A342S338-T340 PolarHBondContact O-N 3.26Å; T340-A342 PolarHBondContact O-N 3.11Å; T340-A342 VanDerWaalsContact O-N 3.13Å
341Q26.1Very low29.6Very low160 Ų160127.1 Ų127.175%0.74878%0.777SS**  trans-55.2114161.3-85.6176.1-23.800106.9S343Q341-S343 VanDerWaalsContact C-N 3.28Å; Q341-S343 PolarHBondContact O-N 3.18Å
342A28.1Very low30.2Very low98 Ų98124.8 Ų124.881%0.8178%0.777SS**  trans-68.395.4159.700000106.9T340 S344T340-A342 PolarHBondContact O-N 3.11Å; T340-A342 VanDerWaalsContact O-N 3.13Å; A342-S344 PolarHBondContact O-N 2.71Å
343S28.4Very low30.1Very low99 Ų99124 Ų12469%0.69280%0.804SS**  trans-6596.7165.3-42.90000107.6Q341 I345Q341-S343 VanDerWaalsContact C-N 3.28Å; Q341-S343 PolarHBondContact O-N 3.18Å; S343-I345 PolarHBondContact O-N 3.08Å
344S30Very low30.2Very low116 Ų116125.2 Ų125.281%0.81181%0.813SS**  trans-66.6101163.352.40000107.7A342 S346A342-S344 PolarHBondContact O-N 2.71Å; S344-S346 PolarHBondContact O-N 2.79Å
345I29Very low30.3Very low162 Ų162125.3 Ų125.383%0.83181%0.811SS**  trans-63.2117.7170.5-65.5173.3000107.3S343 A347S343-I345 PolarHBondContact O-N 3.08Å; I345-A347 PolarHBondContact O-N 3.09Å
346S27.3Very low30.5Very low103 Ų103124.6 Ų124.672%0.7281%0.809SS**  trans-61.5125.4174.4-165.70000109.8S344 S348S344-S346 PolarHBondContact O-N 2.79Å; S346-S348 PolarHBondContact O-N 3.39Å
347A32.8Very low30.6Very low106 Ų106127 Ų12788%0.87682%0.815SS**  trans-72.3109.6166.700000108.3I345I345-A347 PolarHBondContact O-N 3.09Å
348S29.8Very low30.7Very low98 Ų98127.5 Ų127.569%0.68581%0.814SS**  trans-135.4144.7166.2174.70000108.5S346S346-S348 PolarHBondContact O-N 3.39Å
349Q30.2Very low31.1Very low176 Ų176129.2 Ų129.282%0.82282%0.821SS**  trans97.6130.2172.3-54.8-165.9-4.400115.3
350V32.3Very low31Very low118 Ų118125.6 Ų125.672%0.71582%0.824SS**  cis-167.3141.52.7135.20000105
351A29.3Very low31.3Very low94 Ų94125.2 Ų125.278%0.77783%0.826SS**  trans-97.9139.6160.500000108.6
352P47.5Very low31.7Very low119 Ų119122.3 Ų122.377%0.77383%0.832SS**  trans-99153.9161.318.20.1000111.8
353A35.9Very low32.1Very low178 Ų178124.5 Ų124.5100%1.47183%0.834SS**  trans-62.70-178.500000115.1

Retrieved 353 of 353 residues in 505.1 ms (Link to these results)

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