A0A096NAT5_PAPAN Loading...

EBP cholestenol delta-isomerase

AlphaFold DB , UniProt , Accession A0A096NAT5, Species PAPAN (Papio anubis, Olive baboon), Gene EBP, Length 230 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.3Very low67.1Low241 Ų24197.9 Ų97.9100%1.18758%0.581SS**  0990-70.1176.9-167.100107.1T3M1-T3 PolarHBondContact O-N 3.44Å
2T40.5Very low69.5Low133 Ų13397.8 Ų97.882%0.81656%0.563SS**  trans-74.5104.1175.641.90000107.7N4T2-N4 PolarHBondContact O-N 3.09Å
3T51.7Low71.5Confident129 Ų12991.4 Ų91.479%0.79153%0.527SS*.  trans-66.199.7168.648.90000106.9M1 A5M1-T3 PolarHBondContact O-N 3.44Å; T3-A5 PolarHBondContact O-N 3.1Å
4N49.9Very low73.2Confident135 Ų13595.1 Ų95.172%0.72254%0.537SS*.  trans-62.582.9164.9-80.8-10.4000107.2T2 G6T2-N4 PolarHBondContact O-N 3.09Å; N4-G6 PolarHBondContact O-N 3.49Å
5A60.4Low74.5Confident91 Ų9199 Ų9975%0.75255%0.549SS*.PPolyproline II helixtrans-69.2118.5163.700000105.5T3T3-A5 PolarHBondContact O-N 3.1Å
6G58.9Low75.6Confident30 Ų3095.4 Ų95.431%0.30953%0.528SS..PPolyproline II helixtrans-56.7172.8170.800000111.1N4 L8N4-G6 PolarHBondContact O-N 3.49Å; G6-L8 PolarHBondContact O-N 3.22Å
7P63.1Low76.7Confident54 Ų54101.1 Ų101.135%0.35154%0.539SS..PPolyproline II helixtrans-54.8133.9178.924.3-33.6000110.9H9 L18P7-H9 PolarHBondContact O-N 3.3Å; P7-L18 VanDerWaalsContact CG-O 3.23Å; P7-L18 WeakPolarHBondContact CG-O 3.27Å
8L86.2Confident77.6Confident169 Ų16996.1 Ų96.189%0.88551%0.513SS*.PPolyproline II helixtrans-63.7124.4179.5-177.470.8000109.6G6 F21G6-L8 PolarHBondContact O-N 3.22Å; L8-F21 WeakPolarHBondContact O-CE1 3.46Å
9H94.6Very high78.3Confident17 Ų1796.9 Ų96.98%0.07952%0.517CS..  trans-124.4156.2178.864.572.2000111.8P7 Y11 L16 L18 F21P7-H9 PolarHBondContact O-N 3.3Å; H9-Y11 VanDerWaalsContact C-N 3.34Å; H9-Y11 HydrophobicContact CB-CD2 3.87Å; H9-Y11 HydrophobicContact CB-CE2 4.36Å; H9-Y11 PolarHBondContact CE1-O 3.27Å; H9-Y11 AromaticContact ND1-CD2 3.89Å; H9-Y11 PolarHBondContact ND1-N 3.11Å; H9-Y11 PolarHBondContact ND1-O 3.41Å; H9-L16 PolarHBondContact NE2-O 3.05Å; H9-L18 HydrophobicContact CB-CD1 4.02Å; H9-F21 HydrophobicContact CB-CD1 3.7Å; H9-F21 HydrophobicContact CB-CE1 3.85Å; H9-F21 HydrophobicContact CB-CG 4.08Å; H9-F21 HydrophobicContact CB-CZ 4.38Å
10P95.6Very high79Confident75 Ų7598.5 Ų98.549%0.48753%0.526SS..SBendtrans-82.4-10.2-178.133.4-36.4000114F21 K106P10-F21 HydrophobicContact CG-CZ 4.43Å; P10-K106 HydrophobicContact CG-CD 4.49Å; P10-K106 HydrophobicContact CG-CG 4.2Å
11Y97.1Very high79.8Confident3 Ų394.9 Ų94.91%0.01251%0.506CS..PPolyproline II helixtrans-73.9150.1-172.5-49-68.2000113.3H9 L18 F21 K102 A105 K106 I112H9-Y11 VanDerWaalsContact C-N 3.34Å; H9-Y11 HydrophobicContact CB-CD2 3.87Å; H9-Y11 HydrophobicContact CB-CE2 4.36Å; H9-Y11 PolarHBondContact CE1-O 3.27Å; H9-Y11 AromaticContact ND1-CD2 3.89Å; H9-Y11 PolarHBondContact ND1-N 3.11Å; H9-Y11 PolarHBondContact ND1-O 3.41Å; Y11-L18 HydrophobicContact CD2-CD1 3.48Å; Y11-L18 VanDerWaalsContact CD2-CD1 3.48Å; Y11-L18 HydrophobicContact CE2-CD1 4.09Å; Y11-L18 HydrophobicContact CG-CD1 4.41Å; Y11-F21 AromaticContact CE2-CD2 3.84Å; Y11-F21 HydrophobicContact CE2-CD2 3.84Å; Y11-F21 AromaticContact CE2-CE2 3.65Å; Y11-F21 HydrophobicContact CE2-CE2 3.65Å; Y11-F21 HydrophobicContact CE2-CZ 4.38Å; Y11-K102 WeakPolarHBondContact CE1-O 3.45Å; Y11-K102 WeakPolarHBondContact OH-CB 3.41Å; Y11-K102 WeakPolarHBondContact OH-CG 3.32Å; Y11-K102 PolarHBondContact OH-O 2.9Å; Y11-A105 HydrophobicContact CD1-CB 4.24Å; Y11-A105 VanDerWaalsContact CD1-O 3.29Å; Y11-A105 WeakPolarHBondContact CD1-O 3.39Å; Y11-A105 HydrophobicContact CE1-CB 3.8Å; Y11-K106 HydrophobicContact CD1-CG 4.26Å; Y11-K106 HydrophobicContact CE1-CG 3.93Å; Y11-I112 HydrophobicContact CD1-CD1 4.01Å; Y11-I112 HydrophobicContact CD2-CD1 3.3Å; Y11-I112 HydrophobicContact CD2-CG1 4.49Å; Y11-I112 HydrophobicContact CE1-CD1 4.4Å; Y11-I112 HydrophobicContact CE1-CG2 4.23Å; Y11-I112 HydrophobicContact CE2-CD1 3.74Å; Y11-I112 HydrophobicContact CE2-CG2 4.35Å; Y11-I112 HydrophobicContact CG-CD1 3.42Å; Y11-I112 VanDerWaalsContact CG-CD1 3.42Å; Y11-I112 HydrophobicContact CG-CG1 4.37Å
12W95.9Very high82.5Confident97 Ų9786.5 Ų86.537%0.36747%0.467SS..SBendtrans-102.9136.3173.4-169.2-97.7000109.6Q14 S109 H176W12-Q14 HydrophobicContact CE3-CG 3.71Å; W12-Q14 HydrophobicContact CZ3-CB 4.42Å; W12-Q14 HydrophobicContact CZ3-CG 3.77Å; W12-S109 VanDerWaalsContact O-CB 3.25Å; W12-S109 WeakPolarHBondContact O-CB 3.39Å; W12-S109 PolarHBondContact O-OG 3.06Å; W12-H176 CarbonylContact O-C 3.18Å
13P95.9Very high85.1Confident14 Ų1484.1 Ų84.19%0.09145%0.454CS..SBendcis-80.4144.75.231.5-31.9000113.3H15 L16 Q175P13-H15 VanDerWaalsContact CB-CE1 3.48Å; P13-H15 WeakPolarHBondContact CB-CE1 3.47Å; P13-H15 PolarHBondContact O-N 3.42Å; P13-L16 HydrophobicContact CG-CD1 4.34Å; P13-L16 HydrophobicContact CG-CD2 4.41Å; P13-L16 HydrophobicContact CG-CG 4.01Å; P13-L16 VanDerWaalsContact O-CG 3.28Å; P13-L16 WeakPolarHBondContact O-CG 3.49Å; P13-L16 PolarHBondContact O-N 2.91Å; P13-Q175 VanDerWaalsContact CD-O 3.3Å; P13-Q175 WeakPolarHBondContact CD-O 2.88Å
14Q94.4Very high87.3Confident143 Ų14379.7 Ų79.767%0.66843%0.426SS*.THydrogen-bonded Turntrans-66.2-11-172.8-74.5174.3-26.100115.3W12 L16W12-Q14 HydrophobicContact CE3-CG 3.71Å; W12-Q14 HydrophobicContact CZ3-CB 4.42Å; W12-Q14 HydrophobicContact CZ3-CG 3.77Å; Q14-L16 VanDerWaalsContact C-N 3.35Å
15H92.4Very high89.6Confident154 Ų15478.3 Ų78.371%0.71342%0.418SS*.THydrogen-bonded Turntrans-89.4-1.3179.467.6-97.1000113.3P13P13-H15 VanDerWaalsContact CB-CE1 3.48Å; P13-H15 WeakPolarHBondContact CB-CE1 3.47Å; P13-H15 PolarHBondContact O-N 3.42Å
16L93.3Very high91.3Very high41 Ų4177.4 Ų77.422%0.21540%0.399CS..  trans-56.9148.4173.4-70.4172.3000110.5H9 P13 Q14 L18 L113H9-L16 PolarHBondContact NE2-O 3.05Å; P13-L16 HydrophobicContact CG-CD1 4.34Å; P13-L16 HydrophobicContact CG-CD2 4.41Å; P13-L16 HydrophobicContact CG-CG 4.01Å; P13-L16 VanDerWaalsContact O-CG 3.28Å; P13-L16 WeakPolarHBondContact O-CG 3.49Å; P13-L16 PolarHBondContact O-N 2.91Å; Q14-L16 VanDerWaalsContact C-N 3.35Å; L16-L18 HydrophobicContact CB-CD2 4.32Å; L16-L18 HydrophobicContact CB-CG 4.22Å; L16-L113 HydrophobicContact CD1-CD1 4.31Å; L16-L113 HydrophobicContact CD1-CD2 4.02Å; L16-L113 HydrophobicContact CD2-CD2 4.1Å
17R93.1Very high93.1Very high192 Ų19278.8 Ų78.873%0.72540%0.402SS*.  trans-109.4102172.5-68.2-174-178.6177.40.9108.2
18L93.7Very high94.6Very high11 Ų1178.2 Ų78.26%0.05840%0.398CS..  trans-108.271.5-178.4-56.5-179.8000109.2P7 H9 Y11 L16 N20 F21 L91 I112 L113P7-L18 VanDerWaalsContact CG-O 3.23Å; P7-L18 WeakPolarHBondContact CG-O 3.27Å; H9-L18 HydrophobicContact CB-CD1 4.02Å; Y11-L18 HydrophobicContact CD2-CD1 3.48Å; Y11-L18 VanDerWaalsContact CD2-CD1 3.48Å; Y11-L18 HydrophobicContact CE2-CD1 4.09Å; Y11-L18 HydrophobicContact CG-CD1 4.41Å; L16-L18 HydrophobicContact CB-CD2 4.32Å; L16-L18 HydrophobicContact CB-CG 4.22Å; L18-N20 PolarHBondContact O-N 3.35Å; L18-N20 VanDerWaalsContact O-N 3.11Å; L18-F21 HydrophobicContact CB-CB 3.95Å; L18-F21 WeakPolarHBondContact O-CB 3.24Å; L18-F21 PolarHBondContact O-N 3.35Å; L18-L91 HydrophobicContact CB-CD1 4.28Å; L18-L91 HydrophobicContact CB-CD2 4.34Å; L18-L91 HydrophobicContact CD1-CD2 4.08Å; L18-L91 HydrophobicContact CD2-CD1 4.21Å; L18-L91 HydrophobicContact CD2-CD2 4.45Å; L18-I112 HydrophobicContact CD1-CD1 3.38Å; L18-I112 HydrophobicContact CD2-CD1 4.19Å; L18-I112 HydrophobicContact CG-CD1 4.44Å; L18-L113 HydrophobicContact CD2-CD2 4.37Å
19D90.4Very high95Very high113 Ų11377.9 Ų77.960%0.60439%0.385SS*.THydrogen-bonded Turntrans-60.4-27.9-166.3-64.2-25.2000113.9
20N91.8Very high95Very high128 Ų12880.9 Ų80.968%0.68440%0.399SS*.THydrogen-bonded Turntrans-96.412.6178.7-62.1-29000113.6L18 V22 L91L18-N20 PolarHBondContact O-N 3.35Å; L18-N20 VanDerWaalsContact O-N 3.11Å; N20-V22 PolarHBondContact O-N 3.01Å; N20-L91 CarbonylContact O-C 3.53Å
21F96.1Very high95Very high23 Ų2377.4 Ų77.410%0.10138%0.376CS..  trans-67.1123.1-177.1172.3-114.9000112L8 H9 P10 Y11 L18 P23 L91L8-F21 WeakPolarHBondContact O-CE1 3.46Å; H9-F21 HydrophobicContact CB-CD1 3.7Å; H9-F21 HydrophobicContact CB-CE1 3.85Å; H9-F21 HydrophobicContact CB-CG 4.08Å; H9-F21 HydrophobicContact CB-CZ 4.38Å; P10-F21 HydrophobicContact CG-CZ 4.43Å; Y11-F21 AromaticContact CE2-CD2 3.84Å; Y11-F21 HydrophobicContact CE2-CD2 3.84Å; Y11-F21 AromaticContact CE2-CE2 3.65Å; Y11-F21 HydrophobicContact CE2-CE2 3.65Å; Y11-F21 HydrophobicContact CE2-CZ 4.38Å; L18-F21 HydrophobicContact CB-CB 3.95Å; L18-F21 WeakPolarHBondContact O-CB 3.24Å; L18-F21 PolarHBondContact O-N 3.35Å; F21-P23 HydrophobicContact CE1-CG 3.82Å; F21-P23 HydrophobicContact CZ-CB 4.25Å; F21-P23 HydrophobicContact CZ-CG 3.96Å; F21-L91 HydrophobicContact CD2-CD2 4.37Å
22V96.8Very high94.8Very high64 Ų6480.3 Ų80.339%0.38839%0.391SS..  trans-120.3122169.8-171.40000108.8N20 L91 Q94 K102N20-V22 PolarHBondContact O-N 3.01Å; V22-L91 PolarHBondContact N-O 3.44Å; V22-Q94 VanDerWaalsContact CG1-NE2 3.26Å; V22-K102 PolarHBondContact O-NZ 3.05Å
23P96.4Very high94.8Very high83 Ų8377.7 Ų77.754%0.53939%0.391SS..  trans-57147.7174.4-23.532.7000112.1F21 D25 Q94F21-P23 HydrophobicContact CE1-CG 3.82Å; F21-P23 HydrophobicContact CZ-CB 4.25Å; F21-P23 HydrophobicContact CZ-CG 3.96Å; P23-D25 PolarHBondContact O-N 3.49Å; P23-Q94 PolarHBondContact O-NE2 3.38Å
24N97.6Very high94.7Very high36 Ų3678.1 Ų78.119%0.19340%0.397CS..  trans-55.3135.3172.4-706.4000110.8Q99 K102N24-Q99 HydrophobicContact CB-CB 4.43Å; N24-Q99 HydrophobicContact CB-CG 4.26Å; N24-Q99 VanDerWaalsContact CB-OE1 3.24Å; N24-Q99 PolarHBondContact ND2-O 3.02Å; N24-K102 WeakPolarHBondContact OD1-CB 3.39Å; N24-K102 WeakPolarHBondContact OD1-CD 3.13Å; N24-K102 WeakPolarHBondContact OD1-CE 3.45Å; N24-K102 PolarHBondContact OD1-NZ 3.23Å; N24-K102 VanDerWaalsContact OD1-NZ 3.12Å
25D97.1Very high94.6Very high106 Ų10673.2 Ų73.257%0.56738%0.375SS*.SBendtrans-85-23.8171.765-4.7000112P23 Q99P23-D25 PolarHBondContact O-N 3.49Å; D25-Q99 VanDerWaalsContact OD1-CD 3.23Å; D25-Q99 PolarHBondContact OD1-NE2 3.36Å; D25-Q99 PolarHBondContact OD1-OE1 3.02Å; D25-Q99 VanDerWaalsContact OD1-OE1 3.09Å
26H96.3Very high94.6Very high73 Ų7372.6 Ų72.634%0.33837%0.371SS..SBendtrans-84.7129.2168.2-66-49.9000110.8H30 I31 Q99H26-H30 HydrophobicContact CB-CB 4.41Å; H26-I31 HydrophobicContact CB-CG1 4.29Å; H26-Q99 PolarHBondContact CD2-NE2 2.83Å
27P96.4Very high94.7Very high59 Ų5974.3 Ų74.338%0.38339%0.386SS..  trans-70.1151.4171.732.7-36.4000109.8W29 H30P27-W29 HydrophobicContact CG-CG 4.45Å; P27-W29 VanDerWaalsContact CG-NE1 3.32Å; P27-W29 PolarHBondContact O-N 2.82Å; P27-H30 WeakPolarHBondContact CD-ND1 3.41Å; P27-H30 WeakPolarHBondContact CG-ND1 3.43Å; P27-H30 WeakPolarHBondContact O-CB 3.33Å; P27-H30 PolarHBondContact O-N 3.01Å
28T94.5Very high94.9Very high42 Ų4268.3 Ų68.326%0.25837%0.371SS..Hα-helixtrans-49.3-35.6-175.5-50.20000113.9H30 I31 L32 E103T28-H30 VanDerWaalsContact C-N 3.34Å; T28-H30 PolarHBondContact O-N 3.46Å; T28-I31 WeakPolarHBondContact O-CB 3.24Å; T28-I31 PolarHBondContact O-N 3.43Å; T28-L32 HydrophobicContact CG2-CD1 4.15Å; T28-L32 HydrophobicContact CG2-CG 4.32Å; T28-L32 WeakPolarHBondContact O-CG 3.41Å; T28-L32 PolarHBondContact O-N 3.02Å; T28-E103 VanDerWaalsContact CG2-CD 3.45Å; T28-E103 HydrophobicContact CG2-CG 3.82Å; T28-E103 PolarHBondContact OG1-OE2 3.21Å
29W94.6Very high95Very high162 Ų16268.9 Ų68.961%0.61438%0.375SS*.Hα-helixtrans-65.4-32.8179.676.2-98.3000113.6P27 I31 A33P27-W29 HydrophobicContact CG-CG 4.45Å; P27-W29 VanDerWaalsContact CG-NE1 3.32Å; P27-W29 PolarHBondContact O-N 2.82Å; W29-I31 VanDerWaalsContact C-N 3.35Å; W29-A33 VanDerWaalsContact O-CB 3.27Å; W29-A33 WeakPolarHBondContact O-CB 3.48Å; W29-A33 PolarHBondContact O-N 3.07Å
30H96.4Very high95.3Very high80 Ų8065.1 Ų65.137%0.3736%0.362SS..Hα-helixtrans-66.8-41.2174.9-83.684.8000110.5H26 P27 T28 A33 G34H26-H30 HydrophobicContact CB-CB 4.41Å; P27-H30 WeakPolarHBondContact CD-ND1 3.41Å; P27-H30 WeakPolarHBondContact CG-ND1 3.43Å; P27-H30 WeakPolarHBondContact O-CB 3.33Å; P27-H30 PolarHBondContact O-N 3.01Å; T28-H30 VanDerWaalsContact C-N 3.34Å; T28-H30 PolarHBondContact O-N 3.46Å; H30-A33 PolarHBondContact O-N 2.69Å; H30-G34 PolarHBondContact O-N 3.21Å
31I95.6Very high95.6Very high1 Ų163.5 Ų63.51%0.00536%0.357CS..Hα-helixtrans-62.3-48.5177.3-60.2172.5000110H26 T28 W29 A33 G34 L35 F96 Q99 L100H26-I31 HydrophobicContact CB-CG1 4.29Å; T28-I31 WeakPolarHBondContact O-CB 3.24Å; T28-I31 PolarHBondContact O-N 3.43Å; W29-I31 VanDerWaalsContact C-N 3.35Å; I31-A33 PolarHBondContact O-N 2.94Å; I31-G34 PolarHBondContact O-N 3.2Å; I31-L35 PolarHBondContact O-N 3.46Å; I31-F96 HydrophobicContact CB-CZ 4.45Å; I31-F96 HydrophobicContact CG1-CE2 4.47Å; I31-F96 HydrophobicContact CG2-CZ 4.29Å; I31-F96 WeakPolarHBondContact O-CZ 3.27Å; I31-Q99 HydrophobicContact CD1-CB 3.94Å; I31-L100 HydrophobicContact CG2-CB 3.79Å; I31-L100 HydrophobicContact CG2-CD1 3.42Å; I31-L100 VanDerWaalsContact CG2-CD1 3.42Å; I31-L100 HydrophobicContact CG2-CG 4.2Å
32L92.1Very high95.6Very high64 Ų6464.6 Ų64.634%0.33536%0.364SS..Hα-helixtrans-61.3-44.7176.5-68.5176.1000111.7T28 G34 L35 F36T28-L32 HydrophobicContact CG2-CD1 4.15Å; T28-L32 HydrophobicContact CG2-CG 4.32Å; T28-L32 WeakPolarHBondContact O-CG 3.41Å; T28-L32 PolarHBondContact O-N 3.02Å; L32-G34 VanDerWaalsContact C-N 3.33Å; L32-G34 PolarHBondContact O-N 3.11Å; L32-L35 PolarHBondContact O-N 2.99Å; L32-F36 HydrophobicContact CB-CD2 4.29Å; L32-F36 HydrophobicContact CB-CE2 4.35Å; L32-F36 HydrophobicContact CD2-CE2 4.41Å; L32-F36 WeakPolarHBondContact O-CB 3.46Å; L32-F36 WeakPolarHBondContact O-CD2 3.37Å; L32-F36 PolarHBondContact O-N 3.48Å
33A95.2Very high95.7Very high43 Ų4364.3 Ų64.336%0.35536%0.362SS..Hα-helixtrans-60-42.6177.900000111.9W29 H30 I31 S37W29-A33 VanDerWaalsContact O-CB 3.27Å; W29-A33 WeakPolarHBondContact O-CB 3.48Å; W29-A33 PolarHBondContact O-N 3.07Å; H30-A33 PolarHBondContact O-N 2.69Å; I31-A33 PolarHBondContact O-N 2.94Å; A33-S37 VanDerWaalsContact O-CB 3.25Å; A33-S37 WeakPolarHBondContact O-CB 3.44Å; A33-S37 PolarHBondContact O-N 3.36Å; A33-S37 PolarHBondContact O-OG 3.43Å
34G94.3Very high95.8Very high22 Ų2264.4 Ų64.423%0.22736%0.361CS..Hα-helixtrans-61.7-49.3174.700000112.2H30 I31 L32 S37 V38H30-G34 PolarHBondContact O-N 3.21Å; I31-G34 PolarHBondContact O-N 3.2Å; L32-G34 VanDerWaalsContact C-N 3.33Å; L32-G34 PolarHBondContact O-N 3.11Å; G34-S37 PolarHBondContact O-N 3.07Å; G34-V38 WeakPolarHBondContact O-CG2 3.47Å; G34-V38 PolarHBondContact O-N 3.2Å
35L93.3Very high95.8Very high41 Ų4165.5 Ų65.522%0.21537%0.369CS..Hα-helixtrans-60.2-48.3178.7-177.763.7000112.1I31 L32 S37 V38 T39 F74 I79 L100I31-L35 PolarHBondContact O-N 3.46Å; L32-L35 PolarHBondContact O-N 2.99Å; L35-S37 VanDerWaalsContact C-N 3.33Å; L35-S37 PolarHBondContact O-N 3.39Å; L35-V38 PolarHBondContact O-N 3.34Å; L35-T39 HydrophobicContact CD1-CG2 4.17Å; L35-T39 WeakPolarHBondContact O-CB 3.48Å; L35-T39 VanDerWaalsContact O-CG2 3.32Å; L35-T39 WeakPolarHBondContact O-CG2 3.27Å; L35-T39 PolarHBondContact O-N 3.45Å; L35-T39 PolarHBondContact O-OG1 2.98Å; L35-F74 HydrophobicContact CD1-CE1 4.24Å; L35-I79 HydrophobicContact CD1-CD1 3.74Å; L35-L100 HydrophobicContact CD2-CD1 4.41Å
36F91.6Very high95.9Very high140 Ų14061 Ų6161%0.61435%0.346SS*.Hα-helixtrans-65.2-35178.2-79.2-63.8000112.6L32 T39 G40L32-F36 HydrophobicContact CB-CD2 4.29Å; L32-F36 HydrophobicContact CB-CE2 4.35Å; L32-F36 HydrophobicContact CD2-CE2 4.41Å; L32-F36 WeakPolarHBondContact O-CB 3.46Å; L32-F36 WeakPolarHBondContact O-CD2 3.37Å; L32-F36 PolarHBondContact O-N 3.48Å; F36-T39 WeakPolarHBondContact CA-OG1 3.29Å; F36-T39 PolarHBondContact O-OG1 3.28Å; F36-G40 WeakPolarHBondContact O-CA 3.39Å; F36-G40 PolarHBondContact O-N 3.03Å
37S95.6Very high95.9Very high77 Ų7761.5 Ų61.554%0.53834%0.344SS..Hα-helixtrans-67-49.2177.3-60.70000111.4A33 G34 L35 G40 V41A33-S37 VanDerWaalsContact O-CB 3.25Å; A33-S37 WeakPolarHBondContact O-CB 3.44Å; A33-S37 PolarHBondContact O-N 3.36Å; A33-S37 PolarHBondContact O-OG 3.43Å; G34-S37 PolarHBondContact O-N 3.07Å; L35-S37 VanDerWaalsContact C-N 3.33Å; L35-S37 PolarHBondContact O-N 3.39Å; S37-G40 PolarHBondContact O-N 3.39Å; S37-V41 WeakPolarHBondContact O-CG2 3.19Å; S37-V41 PolarHBondContact O-N 3.49Å
38V96.7Very high96Very high66 Ų6663.1 Ų63.140%0.435%0.349SS..Hα-helixtrans-65.2-46.2-180175.50000111.1G34 L35 G40 V41 L42 F74G34-V38 WeakPolarHBondContact O-CG2 3.47Å; G34-V38 PolarHBondContact O-N 3.2Å; L35-V38 PolarHBondContact O-N 3.34Å; V38-G40 VanDerWaalsContact C-N 3.33Å; V38-G40 PolarHBondContact O-N 3.07Å; V38-V41 PolarHBondContact O-N 3.43Å; V38-L42 HydrophobicContact CG1-CD1 4.21Å; V38-L42 WeakPolarHBondContact O-CG 3.26Å; V38-L42 PolarHBondContact O-N 3.17Å; V38-F74 HydrophobicContact CB-CZ 4.34Å; V38-F74 HydrophobicContact CG1-CD2 4.41Å; V38-F74 HydrophobicContact CG1-CE1 4Å; V38-F74 HydrophobicContact CG1-CE2 3.74Å; V38-F74 HydrophobicContact CG1-CZ 3.51Å
39T95.7Very high96Very high24 Ų2465.7 Ų65.715%0.14736%0.361CS..Hα-helixtrans-64-38.2176.353.30000111.8L35 F36 L42 V43 V71 F74L35-T39 HydrophobicContact CD1-CG2 4.17Å; L35-T39 WeakPolarHBondContact O-CB 3.48Å; L35-T39 VanDerWaalsContact O-CG2 3.32Å; L35-T39 WeakPolarHBondContact O-CG2 3.27Å; L35-T39 PolarHBondContact O-N 3.45Å; L35-T39 PolarHBondContact O-OG1 2.98Å; F36-T39 WeakPolarHBondContact CA-OG1 3.29Å; F36-T39 PolarHBondContact O-OG1 3.28Å; T39-L42 PolarHBondContact O-N 3.22Å; T39-V43 WeakPolarHBondContact O-CG2 3.49Å; T39-V43 PolarHBondContact O-N 2.91Å; T39-V71 HydrophobicContact CG2-CG1 4.39Å; T39-F74 HydrophobicContact CG2-CD1 4.31Å; T39-F74 HydrophobicContact CG2-CE1 4.25Å
40G96.8Very high96Very high33 Ų3358.1 Ų58.134%0.3433%0.333SS..Hα-helixtrans-59.6-46.4173.600000112.6F36 S37 V38 L42 V43 V44F36-G40 WeakPolarHBondContact O-CA 3.39Å; F36-G40 PolarHBondContact O-N 3.03Å; S37-G40 PolarHBondContact O-N 3.39Å; V38-G40 VanDerWaalsContact C-N 3.33Å; V38-G40 PolarHBondContact O-N 3.07Å; G40-L42 PolarHBondContact O-N 2.89Å; G40-V43 PolarHBondContact O-N 3.4Å; G40-V44 WeakPolarHBondContact O-CB 3.3Å; G40-V44 VanDerWaalsContact O-CG2 3.32Å; G40-V44 WeakPolarHBondContact O-CG2 3.38Å; G40-V44 PolarHBondContact O-N 2.9Å
41V98.1Very high95.8Very high94 Ų9456.6 Ų56.657%0.5734%0.339SS*.Hα-helixtrans-61.1-44.9174.6171.60000111S37 V38 V43 V44 T45S37-V41 WeakPolarHBondContact O-CG2 3.19Å; S37-V41 PolarHBondContact O-N 3.49Å; V38-V41 PolarHBondContact O-N 3.43Å; V41-V43 PolarHBondContact O-N 3.34Å; V41-V44 PolarHBondContact O-N 2.89Å; V41-T45 HydrophobicContact CG1-CG2 4.16Å; V41-T45 WeakPolarHBondContact O-CB 3.49Å; V41-T45 VanDerWaalsContact O-CG2 3.22Å; V41-T45 WeakPolarHBondContact O-CG2 3.49Å; V41-T45 PolarHBondContact O-N 2.79Å; V41-T45 PolarHBondContact O-OG1 3.17Å
42L97.5Very high95.7Very high46 Ų4667.1 Ų67.124%0.24138%0.378CS..Hα-helixtrans-61.2-43.5177.3-75.1170.5000112.7V38 T39 G40 T45 T46 F74V38-L42 HydrophobicContact CG1-CD1 4.21Å; V38-L42 WeakPolarHBondContact O-CG 3.26Å; V38-L42 PolarHBondContact O-N 3.17Å; T39-L42 PolarHBondContact O-N 3.22Å; G40-L42 PolarHBondContact O-N 2.89Å; L42-T45 WeakPolarHBondContact CA-OG1 3.35Å; L42-T45 PolarHBondContact O-OG1 3.38Å; L42-T46 WeakPolarHBondContact O-CB 3.36Å; L42-T46 PolarHBondContact O-N 3.22Å; L42-T46 PolarHBondContact O-OG1 2.86Å; L42-F74 HydrophobicContact CD1-CB 3.44Å; L42-F74 VanDerWaalsContact CD1-CB 3.44Å; L42-F74 HydrophobicContact CD1-CD1 3.79Å; L42-F74 HydrophobicContact CD1-CD2 3.88Å; L42-F74 HydrophobicContact CD1-CG 3.41Å; L42-F74 VanDerWaalsContact CD1-CG 3.41Å
43V98.3Very high95.7Very high58 Ų5866.3 Ų66.335%0.35238%0.381SS..Hα-helixtrans-65-48.3177.9169.70000110.6T39 G40 V41 T46 W47 C67 V71T39-V43 WeakPolarHBondContact O-CG2 3.49Å; T39-V43 PolarHBondContact O-N 2.91Å; G40-V43 PolarHBondContact O-N 3.4Å; V41-V43 PolarHBondContact O-N 3.34Å; V43-T46 PolarHBondContact O-N 2.97Å; V43-W47 WeakPolarHBondContact O-CB 3.24Å; V43-W47 PolarHBondContact O-N 3.33Å; V43-C67 HydrophobicContact CG1-CB 4.19Å; V43-C67 HydrophobicContact CG2-CB 4.39Å; V43-V71 HydrophobicContact CG2-CG2 3.72Å
44V98.3Very high95.7Very high86 Ų8665.2 Ų65.252%0.52137%0.372SS..Hα-helixtrans-62.6-46.9-179.8170.90000111G40 V41 W47 L48G40-V44 WeakPolarHBondContact O-CB 3.3Å; G40-V44 VanDerWaalsContact O-CG2 3.32Å; G40-V44 WeakPolarHBondContact O-CG2 3.38Å; G40-V44 PolarHBondContact O-N 2.9Å; V41-V44 PolarHBondContact O-N 2.89Å; V44-W47 PolarHBondContact O-N 3.18Å; V44-L48 HydrophobicContact CG1-CD1 4.07Å; V44-L48 VanDerWaalsContact O-CG 3.29Å; V44-L48 WeakPolarHBondContact O-CG 3.37Å; V44-L48 PolarHBondContact O-N 3.1Å
45T97.9Very high95.8Very high59 Ų5968.8 Ų68.836%0.36239%0.389SS..Hα-helixtrans-62.2-47.2178.951.50000111.4V41 L42 W47 L48 L49V41-T45 HydrophobicContact CG1-CG2 4.16Å; V41-T45 WeakPolarHBondContact O-CB 3.49Å; V41-T45 VanDerWaalsContact O-CG2 3.22Å; V41-T45 WeakPolarHBondContact O-CG2 3.49Å; V41-T45 PolarHBondContact O-N 2.79Å; V41-T45 PolarHBondContact O-OG1 3.17Å; L42-T45 WeakPolarHBondContact CA-OG1 3.35Å; L42-T45 PolarHBondContact O-OG1 3.38Å; T45-W47 VanDerWaalsContact C-N 3.33Å; T45-W47 PolarHBondContact O-N 2.97Å; T45-L48 PolarHBondContact O-N 3.3Å; T45-L49 WeakPolarHBondContact O-CB 3.47Å; T45-L49 VanDerWaalsContact O-CG 3.27Å; T45-L49 WeakPolarHBondContact O-CG 3.47Å; T45-L49 PolarHBondContact O-N 2.83Å
46T97.8Very high95.8Very high12 Ų1269.6 Ų69.67%0.07440%0.395CS..Hα-helixtrans-64-38.2177.6-53.20000111.9L42 V43 L49 S50 L66 A70 V137L42-T46 WeakPolarHBondContact O-CB 3.36Å; L42-T46 PolarHBondContact O-N 3.22Å; L42-T46 PolarHBondContact O-OG1 2.86Å; V43-T46 PolarHBondContact O-N 2.97Å; T46-L49 PolarHBondContact O-N 3.16Å; T46-S50 WeakPolarHBondContact O-CB 3.41Å; T46-S50 PolarHBondContact O-N 3.49Å; T46-S50 PolarHBondContact O-OG 3.02Å; T46-L66 HydrophobicContact CG2-CB 4.14Å; T46-A70 HydrophobicContact CG2-CB 3.93Å; T46-A70 VanDerWaalsContact OG1-CB 3.3Å; T46-A70 WeakPolarHBondContact OG1-CB 3.28Å; T46-V137 HydrophobicContact CG2-CG1 4.35Å
47W98.2Very high95.9Very high82 Ų8269.2 Ų69.231%0.31141%0.407SS..Hα-helixtrans-61.7-46175.6-178-101.6000112.1V43 V44 T45 S50 G51 T60 R63 L64V43-W47 WeakPolarHBondContact O-CB 3.24Å; V43-W47 PolarHBondContact O-N 3.33Å; V44-W47 PolarHBondContact O-N 3.18Å; T45-W47 VanDerWaalsContact C-N 3.33Å; T45-W47 PolarHBondContact O-N 2.97Å; W47-S50 PolarHBondContact O-OG 3.2Å; W47-G51 PolarHBondContact O-N 2.96Å; W47-T60 HydrophobicContact CH2-CG2 3.96Å; W47-R63 HydrophobicContact CE3-CB 3.95Å; W47-R63 HydrophobicContact CH2-CB 4.33Å; W47-R63 HydrophobicContact CZ3-CB 3.63Å; W47-R63 PolarHBondContact O-NH2 3.48Å; W47-L64 HydrophobicContact CE3-CD2 4.09Å; W47-L64 HydrophobicContact CH2-CD2 4.28Å; W47-L64 HydrophobicContact CH2-CG 4.4Å; W47-L64 HydrophobicContact CZ3-CD2 3.53Å; W47-L64 HydrophobicContact CZ3-CG 3.74Å
48L97.6Very high96Very high93 Ų9366.8 Ų66.849%0.48739%0.388SS..Hα-helixtrans-66.4-43.7177.3-67.5174.4000111.5V44 T45 G51 R52V44-L48 HydrophobicContact CG1-CD1 4.07Å; V44-L48 VanDerWaalsContact O-CG 3.29Å; V44-L48 WeakPolarHBondContact O-CG 3.37Å; V44-L48 PolarHBondContact O-N 3.1Å; T45-L48 PolarHBondContact O-N 3.3Å; L48-G51 PolarHBondContact O-N 3.48Å; L48-R52 PolarHBondContact O-N 3.4Å; L48-R52 VanDerWaalsContact O-N 3.13Å
49L94.9Very high96Very high97 Ų9766.1 Ų66.151%0.50839%0.394SS..Hα-helixtrans-61.7-43.5176.5-73.5173.8000111.7T45 T46 G51 R52 A53T45-L49 WeakPolarHBondContact O-CB 3.47Å; T45-L49 VanDerWaalsContact O-CG 3.27Å; T45-L49 WeakPolarHBondContact O-CG 3.47Å; T45-L49 PolarHBondContact O-N 2.83Å; T46-L49 PolarHBondContact O-N 3.16Å; L49-G51 PolarHBondContact O-N 3.05Å; L49-R52 PolarHBondContact O-N 3.25Å; L49-A53 WeakPolarHBondContact O-CA 3.22Å; L49-A53 VanDerWaalsContact O-CB 3.3Å; L49-A53 WeakPolarHBondContact O-CB 3.35Å; L49-A53 PolarHBondContact O-N 3.31Å
50S95.1Very high96.1Very high2 Ų269 Ų691%0.01441%0.412CS..Hα-helixtrans-64.3-24178.770.80000114T46 W47 A54 R63T46-S50 WeakPolarHBondContact O-CB 3.41Å; T46-S50 PolarHBondContact O-N 3.49Å; T46-S50 PolarHBondContact O-OG 3.02Å; W47-S50 PolarHBondContact O-OG 3.2Å; S50-A54 WeakPolarHBondContact O-CB 3.39Å; S50-R63 WeakPolarHBondContact OG-CB 3.22Å; S50-R63 WeakPolarHBondContact OG-CG 3.44Å; S50-R63 PolarHBondContact OG-NE 2.96Å
51G91.9Very high96.1Very high48 Ų4877.5 Ų77.550%0.49543%0.434SS..Hα-helixtrans-83.6-32.117400000113.9W47 L48 L49W47-G51 PolarHBondContact O-N 2.96Å; L48-G51 PolarHBondContact O-N 3.48Å; L49-G51 PolarHBondContact O-N 3.05Å
52R92.5Very high96.1Very high223 Ų22374.7 Ų74.784%0.84241%0.413SS*.Hα-helixtrans-103.1-36.4-172.4-68.9-173.6174.8174.3-0.6114.7L48 L49L48-R52 PolarHBondContact O-N 3.4Å; L48-R52 VanDerWaalsContact O-N 3.13Å; L49-R52 PolarHBondContact O-N 3.25Å
53A92.6Very high96.1Very high47 Ų4774.9 Ų74.939%0.38841%0.411SS..THydrogen-bonded Turntrans-99.1-8.3-170.900000113.6L49 V55L49-A53 WeakPolarHBondContact O-CA 3.22Å; L49-A53 VanDerWaalsContact O-CB 3.3Å; L49-A53 WeakPolarHBondContact O-CB 3.35Å; L49-A53 PolarHBondContact O-N 3.31Å; A53-V55 PolarHBondContact O-N 3.37Å
54A95.1Very high96.1Very high20 Ų2075.8 Ų75.817%0.16541%0.413CS..  trans-70.4129.1177.800000110.7S50 V56 L58 L141S50-A54 WeakPolarHBondContact O-CB 3.39Å; A54-V56 VanDerWaalsContact CB-O 3.3Å; A54-V56 WeakPolarHBondContact CB-O 3.24Å; A54-V56 PolarHBondContact O-N 3.06Å; A54-L58 HydrophobicContact CB-CD1 3.91Å; A54-L58 HydrophobicContact CB-CG 3.89Å; A54-L141 WeakPolarHBondContact CA-O 3.38Å; A54-L141 HydrophobicContact CB-CD2 4.02Å
55V95.4Very high96.1Very high96 Ų9672.3 Ų72.358%0.58239%0.392SS*.SBendtrans-64.1-29.2179.71750000111.6A53 L141A53-V55 PolarHBondContact O-N 3.37Å; V55-L141 PolarHBondContact N-O 2.75Å
56V94.1Very high96.2Very high58 Ų5869.5 Ų69.535%0.35238%0.375SS..SBendtrans-125.6148.9170-54.30000109.5A54 L58 Q143A54-V56 VanDerWaalsContact CB-O 3.3Å; A54-V56 WeakPolarHBondContact CB-O 3.24Å; A54-V56 PolarHBondContact O-N 3.06Å; V56-L58 HydrophobicContact CG2-CD2 4.33Å; V56-L58 PolarHBondContact O-N 3.11Å; V56-Q143 HydrophobicContact CB-CG 4.16Å; V56-Q143 HydrophobicContact CG1-CG 3.83Å; V56-Q143 VanDerWaalsContact CG2-CD 3.41Å; V56-Q143 HydrophobicContact CG2-CG 3.31Å; V56-Q143 VanDerWaalsContact CG2-NE2 3.3Å
57P94.8Very high96.2Very high133 Ų13369.2 Ų69.286%0.86437%0.374SS*.PPolyproline II helixtrans-55.8127.4175.2-25.334.7000111.6
58L96.3Very high96.2Very high25 Ų2567.2 Ų67.213%0.13137%0.366CS..PPolyproline II helixtrans-99.6133.7175.7-58.9179.9000109.8A54 V56 R62 R63 L66 L141A54-L58 HydrophobicContact CB-CD1 3.91Å; A54-L58 HydrophobicContact CB-CG 3.89Å; V56-L58 HydrophobicContact CG2-CD2 4.33Å; V56-L58 PolarHBondContact O-N 3.11Å; L58-R62 HydrophobicContact CB-CB 4.38Å; L58-R62 HydrophobicContact CB-CG 4.32Å; L58-R62 HydrophobicContact CD1-CG 4.29Å; L58-R62 HydrophobicContact CD2-CG 4.17Å; L58-R62 HydrophobicContact CG-CG 4.49Å; L58-R63 HydrophobicContact CB-CG 3.68Å; L58-R63 VanDerWaalsContact O-CD 3.29Å; L58-R63 WeakPolarHBondContact O-CD 3.21Å; L58-L66 HydrophobicContact CD1-CD1 3.7Å; L58-L141 HydrophobicContact CD1-CD2 4.41Å
59G96.7Very high96.3Very high52 Ų5262.8 Ų62.854%0.53634%0.343SS..PPolyproline II helixtrans-64.6158172.700000112.4W61 R62 R63G59-W61 VanDerWaalsContact C-N 3.32Å; G59-W61 PolarHBondContact O-N 2.82Å; G59-R62 PolarHBondContact O-N 3.16Å; G59-R63 WeakPolarHBondContact O-CG 3.34Å; G59-R63 PolarHBondContact O-N 2.88Å
60T97.2Very high96.5Very high84 Ų8458.5 Ų58.552%0.51532%0.322SS..Hα-helixtrans-47.9-49.5-176.8-51.30000113W47 R62 R63 L64W47-T60 HydrophobicContact CH2-CG2 3.96Å; T60-R62 PolarHBondContact O-N 3.08Å; T60-R63 WeakPolarHBondContact O-CB 3.36Å; T60-R63 PolarHBondContact O-N 2.69Å; T60-L64 PolarHBondContact O-N 2.86Å
61W97.5Very high96.6Very high213 Ų21359.4 Ų59.481%0.80733%0.327SS*.Hα-helixtrans-65.5-36.6-178.3-62.4117.9000113.5G59 R63 L64 S65G59-W61 VanDerWaalsContact C-N 3.32Å; G59-W61 PolarHBondContact O-N 2.82Å; W61-R63 VanDerWaalsContact C-N 3.34Å; W61-L64 HydrophobicContact CE3-CD1 3.7Å; W61-L64 HydrophobicContact CZ3-CD1 3.75Å; W61-L64 PolarHBondContact O-N 3.5Å; W61-S65 PolarHBondContact O-N 3.45Å
62R98Very high97Very high35 Ų3557.1 Ų57.113%0.13230%0.303CS..Hα-helixtrans-66.5-40.1174.2-176.76264.5-158.2-12.8110.9L58 G59 T60 L64 S65 L66 F140 D206L58-R62 HydrophobicContact CB-CB 4.38Å; L58-R62 HydrophobicContact CB-CG 4.32Å; L58-R62 HydrophobicContact CD1-CG 4.29Å; L58-R62 HydrophobicContact CD2-CG 4.17Å; L58-R62 HydrophobicContact CG-CG 4.49Å; G59-R62 PolarHBondContact O-N 3.16Å; T60-R62 PolarHBondContact O-N 3.08Å; R62-L64 VanDerWaalsContact C-N 3.34Å; R62-S65 PolarHBondContact O-N 3.43Å; R62-S65 PolarHBondContact O-OG 3.39Å; R62-L66 WeakPolarHBondContact O-CG 3.33Å; R62-L66 PolarHBondContact O-N 3.38Å; R62-F140 VanDerWaalsContact CD-CE1 3.42Å; R62-F140 HydrophobicContact CG-CD1 4.14Å; R62-F140 HydrophobicContact CG-CE1 4.38Å; R62-F140 VanDerWaalsContact NE-CE1 3.32Å; R62-D206 IonicContact CZ-OD2 3.73Å; R62-D206 IonicContact NH1-OD2 3.31Å; R62-D206 PolarHBondContact NH1-OD2 2.95Å; R62-D206 VanDerWaalsContact NH2-CG 3.31Å; R62-D206 IonicContact NH2-OD1 3.75Å; R62-D206 PolarHBondContact NH2-OD1 2.67Å; R62-D206 IonicContact NH2-OD2 3.86Å; R62-D206 PolarHBondContact NH2-OD2 3.37Å
63R98.2Very high97.3Very high50 Ų5046.5 Ų46.519%0.18926%0.263CS..Hα-helixtrans-64.9-40.4177.8-64.6175.962.6-164.3-2.9111.4W47 S50 L58 G59 T60 W61 L66 C67W47-R63 HydrophobicContact CE3-CB 3.95Å; W47-R63 HydrophobicContact CH2-CB 4.33Å; W47-R63 HydrophobicContact CZ3-CB 3.63Å; W47-R63 PolarHBondContact O-NH2 3.48Å; S50-R63 WeakPolarHBondContact OG-CB 3.22Å; S50-R63 WeakPolarHBondContact OG-CG 3.44Å; S50-R63 PolarHBondContact OG-NE 2.96Å; L58-R63 HydrophobicContact CB-CG 3.68Å; L58-R63 VanDerWaalsContact O-CD 3.29Å; L58-R63 WeakPolarHBondContact O-CD 3.21Å; G59-R63 WeakPolarHBondContact O-CG 3.34Å; G59-R63 PolarHBondContact O-N 2.88Å; T60-R63 WeakPolarHBondContact O-CB 3.36Å; T60-R63 PolarHBondContact O-N 2.69Å; W61-R63 VanDerWaalsContact C-N 3.34Å; R63-L66 PolarHBondContact O-N 3.1Å; R63-C67 PolarHBondContact O-N 2.9Å; R63-C67 VanDerWaalsContact O-N 3.11Å; R63-C67 PolarHBondContact O-SG 3.4Å
64L98.3Very high97.5Very high77 Ų7746 Ų4640%0.40325%0.252SS..Hα-helixtrans-62.2-41.2171.5-70.3176.4000111.7W47 T60 W61 R62 L66 C67 W68W47-L64 HydrophobicContact CE3-CD2 4.09Å; W47-L64 HydrophobicContact CH2-CD2 4.28Å; W47-L64 HydrophobicContact CH2-CG 4.4Å; W47-L64 HydrophobicContact CZ3-CD2 3.53Å; W47-L64 HydrophobicContact CZ3-CG 3.74Å; T60-L64 PolarHBondContact O-N 2.86Å; W61-L64 HydrophobicContact CE3-CD1 3.7Å; W61-L64 HydrophobicContact CZ3-CD1 3.75Å; W61-L64 PolarHBondContact O-N 3.5Å; R62-L64 VanDerWaalsContact C-N 3.34Å; L64-L66 VanDerWaalsContact C-N 3.29Å; L64-L66 PolarHBondContact O-N 3.46Å; L64-C67 WeakPolarHBondContact O-CB 3.46Å; L64-C67 PolarHBondContact O-N 3Å; L64-C67 VanDerWaalsContact O-N 3.13Å; L64-W68 PolarHBondContact O-N 3.27Å
65S98.6Very high97.7Very high12 Ų1246.3 Ų46.38%0.08425%0.251CS..Hα-helixtrans-64.6-33175.681.40000112.4W61 R62 C67 W68 F69W61-S65 PolarHBondContact O-N 3.45Å; R62-S65 PolarHBondContact O-N 3.43Å; R62-S65 PolarHBondContact O-OG 3.39Å; S65-C67 VanDerWaalsContact C-N 3.34Å; S65-W68 WeakPolarHBondContact O-CB 3.12Å; S65-W68 PolarHBondContact O-N 2.88Å; S65-F69 VanDerWaalsContact O-CD2 3.24Å; S65-F69 WeakPolarHBondContact O-CD2 3.48Å; S65-F69 PolarHBondContact O-N 3.39Å
66L98.6Very high97.9Very high0 Ų041.9 Ų41.90%022%0.224CC..Hα-helixtrans-66.7-37.9173.2-58.6-162.4000111.7T46 L58 R62 R63 L64 W68 F69 A70 V137 F140 L141T46-L66 HydrophobicContact CG2-CB 4.14Å; L58-L66 HydrophobicContact CD1-CD1 3.7Å; R62-L66 WeakPolarHBondContact O-CG 3.33Å; R62-L66 PolarHBondContact O-N 3.38Å; R63-L66 PolarHBondContact O-N 3.1Å; L64-L66 VanDerWaalsContact C-N 3.29Å; L64-L66 PolarHBondContact O-N 3.46Å; L66-W68 VanDerWaalsContact C-N 3.33Å; L66-F69 PolarHBondContact O-N 3.32Å; L66-A70 WeakPolarHBondContact O-CB 3.34Å; L66-A70 PolarHBondContact O-N 3.48Å; L66-V137 HydrophobicContact CB-CG1 4.47Å; L66-V137 WeakPolarHBondContact O-CG2 3.48Å; L66-F140 HydrophobicContact CD1-CB 4.04Å; L66-F140 HydrophobicContact CD2-CB 3.54Å; L66-F140 HydrophobicContact CD2-CD2 3.86Å; L66-F140 HydrophobicContact CD2-CG 3.78Å; L66-F140 HydrophobicContact CG-CB 4.42Å; L66-L141 HydrophobicContact CD1-CD2 3.87Å; L66-L141 HydrophobicContact CD1-CG 4.26Å
67C98.7Very high98.1Very high6 Ų642.4 Ų42.44%0.04122%0.224CC..Hα-helixtrans-62.9-42.7173.9-590000110.9V43 R63 L64 S65 A70 V71V43-C67 HydrophobicContact CG1-CB 4.19Å; V43-C67 HydrophobicContact CG2-CB 4.39Å; R63-C67 PolarHBondContact O-N 2.9Å; R63-C67 VanDerWaalsContact O-N 3.11Å; R63-C67 PolarHBondContact O-SG 3.4Å; L64-C67 WeakPolarHBondContact O-CB 3.46Å; L64-C67 PolarHBondContact O-N 3Å; L64-C67 VanDerWaalsContact O-N 3.13Å; S65-C67 VanDerWaalsContact C-N 3.34Å; C67-A70 PolarHBondContact O-N 3.43Å; C67-V71 WeakPolarHBondContact O-CG2 3.37Å; C67-V71 PolarHBondContact O-N 2.96Å
68W98.7Very high98.3Very high41 Ų4139 Ų3916%0.15520%0.201CC..Hα-helixtrans-56.6-52.4172.3168.2-100.9000111.9L64 S65 L66 A70 V71 C72 W196 L199 P200L64-W68 PolarHBondContact O-N 3.27Å; S65-W68 WeakPolarHBondContact O-CB 3.12Å; S65-W68 PolarHBondContact O-N 2.88Å; L66-W68 VanDerWaalsContact C-N 3.33Å; W68-A70 VanDerWaalsContact C-N 3.3Å; W68-A70 PolarHBondContact O-N 3.44Å; W68-V71 CarbonylContact O-C 3.59Å; W68-V71 WeakPolarHBondContact O-CB 3.48Å; W68-V71 PolarHBondContact O-N 2.96Å; W68-V71 VanDerWaalsContact O-N 3.08Å; W68-C72 VanDerWaalsContact CZ2-SG 3.54Å; W68-C72 PolarHBondContact NE1-SG 2.94Å; W68-C72 VanDerWaalsContact NE1-SG 3.44Å; W68-C72 PolarHBondContact O-N 3.22Å; W68-C72 PolarHBondContact O-SG 2.94Å; W68-C72 VanDerWaalsContact O-SG 3.37Å; W68-W196 HydrophobicContact CH2-CD2 4.18Å; W68-L199 HydrophobicContact CD2-CD1 4.14Å; W68-L199 HydrophobicContact CE3-CD1 3.68Å; W68-L199 HydrophobicContact CH2-CB 4.44Å; W68-L199 HydrophobicContact CH2-CD1 3.8Å; W68-L199 HydrophobicContact CZ2-CB 4.11Å; W68-L199 HydrophobicContact CZ2-CD1 4.23Å; W68-L199 HydrophobicContact CZ3-CD1 3.5Å; W68-P200 HydrophobicContact CZ2-CG 4.12Å
69F98.8Very high98.4Very high0 Ų038.4 Ų38.40%020%0.198CC..Hα-helixtrans-63-32.9178.6-83.3-68000113.4S65 L66 C72 G73 S133 V136 V137 Q151 V154 L203S65-F69 VanDerWaalsContact O-CD2 3.24Å; S65-F69 WeakPolarHBondContact O-CD2 3.48Å; S65-F69 PolarHBondContact O-N 3.39Å; L66-F69 PolarHBondContact O-N 3.32Å; F69-C72 PolarHBondContact O-N 2.88Å; F69-G73 PolarHBondContact O-N 2.85Å; F69-S133 WeakPolarHBondContact O-CB 3.15Å; F69-V136 HydrophobicContact CB-CG1 4.48Å; F69-V136 HydrophobicContact CD1-CB 4.22Å; F69-V136 HydrophobicContact CD1-CG1 4.16Å; F69-V136 HydrophobicContact CD1-CG2 4.45Å; F69-V136 HydrophobicContact CD2-CB 4.43Å; F69-V136 HydrophobicContact CD2-CG1 3.55Å; F69-V136 HydrophobicContact CE1-CG1 4.29Å; F69-V136 HydrophobicContact CE1-CG2 4.33Å; F69-V136 HydrophobicContact CE2-CG1 3.71Å; F69-V136 HydrophobicContact CG-CB 4.19Å; F69-V136 HydrophobicContact CG-CG1 3.81Å; F69-V136 HydrophobicContact CZ-CG1 4.09Å; F69-V137 HydrophobicContact CB-CG2 3.72Å; F69-Q151 HydrophobicContact CE2-CB 4.43Å; F69-Q151 HydrophobicContact CE2-CG 3.9Å; F69-Q151 HydrophobicContact CZ-CB 4.25Å; F69-Q151 HydrophobicContact CZ-CG 3.8Å; F69-V154 HydrophobicContact CD1-CG1 4.42Å; F69-V154 HydrophobicContact CE1-CB 4.16Å; F69-V154 HydrophobicContact CE1-CG1 3.82Å; F69-L203 HydrophobicContact CE2-CD1 3.72Å; F69-L203 HydrophobicContact CZ-CD1 3.87Å
70A98.7Very high98.5Very high7 Ų736.6 Ų36.66%0.05818%0.175CC..Hα-helixtrans-65.6-41.4172.900000111.7T46 L66 C67 W68 G73 F74 V137T46-A70 HydrophobicContact CG2-CB 3.93Å; T46-A70 VanDerWaalsContact OG1-CB 3.3Å; T46-A70 WeakPolarHBondContact OG1-CB 3.28Å; L66-A70 WeakPolarHBondContact O-CB 3.34Å; L66-A70 PolarHBondContact O-N 3.48Å; C67-A70 PolarHBondContact O-N 3.43Å; W68-A70 VanDerWaalsContact C-N 3.3Å; W68-A70 PolarHBondContact O-N 3.44Å; A70-G73 PolarHBondContact O-N 3.19Å; A70-F74 PolarHBondContact O-N 3.12Å; A70-V137 HydrophobicContact CB-CG2 4.38Å
71V98.6Very high98.5Very high21 Ų2133.1 Ų33.113%0.12716%0.156CC..Hα-helixtrans-65-45.3174.11720000111T39 V43 C67 W68 G73 F74 I75T39-V71 HydrophobicContact CG2-CG1 4.39Å; V43-V71 HydrophobicContact CG2-CG2 3.72Å; C67-V71 WeakPolarHBondContact O-CG2 3.37Å; C67-V71 PolarHBondContact O-N 2.96Å; W68-V71 CarbonylContact O-C 3.59Å; W68-V71 WeakPolarHBondContact O-CB 3.48Å; W68-V71 PolarHBondContact O-N 2.96Å; W68-V71 VanDerWaalsContact O-N 3.08Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-G73 PolarHBondContact O-N 3.43Å; V71-F74 PolarHBondContact O-N 2.92Å; V71-I75 HydrophobicContact CG1-CD1 3.71Å; V71-I75 HydrophobicContact CG1-CG1 4.31Å; V71-I75 WeakPolarHBondContact O-CG1 3.43Å; V71-I75 PolarHBondContact O-N 3.34Å
72C98.7Very high98.6Very high0 Ų025.8 Ų25.80%013%0.128CC..Hα-helixtrans-56.7-47.7173.5-65.50000111.4W68 F69 F74 I75 H76W68-C72 VanDerWaalsContact CZ2-SG 3.54Å; W68-C72 PolarHBondContact NE1-SG 2.94Å; W68-C72 VanDerWaalsContact NE1-SG 3.44Å; W68-C72 PolarHBondContact O-N 3.22Å; W68-C72 PolarHBondContact O-SG 2.94Å; W68-C72 VanDerWaalsContact O-SG 3.37Å; F69-C72 PolarHBondContact O-N 2.88Å; C72-F74 VanDerWaalsContact C-N 3.28Å; C72-F74 PolarHBondContact O-N 3.03Å; C72-I75 PolarHBondContact O-N 2.83Å; C72-H76 WeakPolarHBondContact O-CB 3.39Å; C72-H76 PolarHBondContact O-CD2 3.03Å; C72-H76 PolarHBondContact O-N 3.12Å
73G98.8Very high98.6Very high0 Ų024.1 Ų24.10%012%0.122CC..Hα-helixtrans-56.2-43.217800000112.3F69 A70 V71 L77F69-G73 PolarHBondContact O-N 2.85Å; A70-G73 PolarHBondContact O-N 3.19Å; V71-G73 VanDerWaalsContact C-N 3.33Å; V71-G73 PolarHBondContact O-N 3.43Å; G73-L77 WeakPolarHBondContact O-CB 3.2Å; G73-L77 VanDerWaalsContact O-CG 3.29Å; G73-L77 WeakPolarHBondContact O-CG 3.47Å; G73-L77 PolarHBondContact O-N 3.39Å
74F98.7Very high98.6Very high37 Ų3723.5 Ų23.516%0.16212%0.122CC..Hα-helixtrans-64.8-48.3175.3167.2-107.4000112.9L35 V38 T39 L42 A70 V71 C72 V78 I79L35-F74 HydrophobicContact CD1-CE1 4.24Å; V38-F74 HydrophobicContact CB-CZ 4.34Å; V38-F74 HydrophobicContact CG1-CD2 4.41Å; V38-F74 HydrophobicContact CG1-CE1 4Å; V38-F74 HydrophobicContact CG1-CE2 3.74Å; V38-F74 HydrophobicContact CG1-CZ 3.51Å; T39-F74 HydrophobicContact CG2-CD1 4.31Å; T39-F74 HydrophobicContact CG2-CE1 4.25Å; L42-F74 HydrophobicContact CD1-CB 3.44Å; L42-F74 VanDerWaalsContact CD1-CB 3.44Å; L42-F74 HydrophobicContact CD1-CD1 3.79Å; L42-F74 HydrophobicContact CD1-CD2 3.88Å; L42-F74 HydrophobicContact CD1-CG 3.41Å; L42-F74 VanDerWaalsContact CD1-CG 3.41Å; A70-F74 PolarHBondContact O-N 3.12Å; V71-F74 PolarHBondContact O-N 2.92Å; C72-F74 VanDerWaalsContact C-N 3.28Å; C72-F74 PolarHBondContact O-N 3.03Å; F74-V78 HydrophobicContact CD2-CB 3.9Å; F74-V78 HydrophobicContact CD2-CG1 4.47Å; F74-V78 HydrophobicContact CD2-CG2 3.65Å; F74-V78 HydrophobicContact CE2-CB 3.77Å; F74-V78 HydrophobicContact CE2-CG1 3.86Å; F74-V78 HydrophobicContact CE2-CG2 3.86Å; F74-V78 HydrophobicContact CZ-CG1 4.5Å; F74-V78 VanDerWaalsContact O-CB 3.25Å; F74-V78 WeakPolarHBondContact O-CB 3.29Å; F74-V78 PolarHBondContact O-N 2.91Å; F74-I79 HydrophobicContact CE1-CD1 3.91Å; F74-I79 HydrophobicContact CE1-CG1 4.32Å; F74-I79 HydrophobicContact CZ-CD1 4.43Å; F74-I79 HydrophobicContact CZ-CG1 4.43Å
75I98.6Very high98.6Very high25 Ų2525.6 Ų25.613%0.12813%0.133CC..Iπ-helixtrans-60.9-51.6-179.2-66.6171.9000109.9V71 C72 L77 I79 E80 W196V71-I75 HydrophobicContact CG1-CD1 3.71Å; V71-I75 HydrophobicContact CG1-CG1 4.31Å; V71-I75 WeakPolarHBondContact O-CG1 3.43Å; V71-I75 PolarHBondContact O-N 3.34Å; C72-I75 PolarHBondContact O-N 2.83Å; I75-L77 PolarHBondContact O-N 3.15Å; I75-I79 HydrophobicContact CB-CD1 4.43Å; I75-I79 HydrophobicContact CG1-CD1 4.05Å; I75-I79 HydrophobicContact CG2-CB 4.46Å; I75-I79 HydrophobicContact CG2-CD1 4.42Å; I75-I79 WeakPolarHBondContact O-CA 3.47Å; I75-I79 VanDerWaalsContact O-CB 3.31Å; I75-I79 WeakPolarHBondContact O-CB 3.34Å; I75-I79 PolarHBondContact O-N 3.47Å; I75-E80 HydrophobicContact CG2-CG 4.36Å; I75-E80 WeakPolarHBondContact CG2-OE1 3.13Å; I75-E80 PolarHBondContact O-N 3.28Å; I75-W196 HydrophobicContact CD1-CH2 3.81Å; I75-W196 HydrophobicContact CD1-CZ2 3.59Å; I75-W196 HydrophobicContact CG2-CZ2 4.29Å
76H98.7Very high98.6Very high3 Ų329.3 Ų29.31%0.01415%0.146CC..Iπ-helixtrans-63.5-44.6-178.9-60.2-36.9000112.3C72 E80 G81 A126 G130 Q158 W196C72-H76 WeakPolarHBondContact O-CB 3.39Å; C72-H76 PolarHBondContact O-CD2 3.03Å; C72-H76 PolarHBondContact O-N 3.12Å; H76-E80 WeakPolarHBondContact CA-OE2 3.44Å; H76-E80 IonicContact CE1-OE1 2.75Å; H76-E80 PolarHBondContact CE1-OE1 3.43Å; H76-E80 IonicContact CE1-OE2 3.03Å; H76-E80 IonicContact CG-OE1 3.77Å; H76-E80 IonicContact CG-OE2 3.48Å; H76-E80 IonicContact ND1-OE1 3.43Å; H76-E80 PolarHBondContact ND1-OE1 2.95Å; H76-E80 IonicContact ND1-OE2 3.52Å; H76-E80 PolarHBondContact ND1-OE2 3.05Å; H76-G81 PolarHBondContact O-N 2.93Å; H76-A126 VanDerWaalsContact O-CA 3.31Å; H76-A126 WeakPolarHBondContact O-CA 3.49Å; H76-A126 VanDerWaalsContact O-CB 3.28Å; H76-A126 WeakPolarHBondContact O-CB 3.46Å; H76-G130 VanDerWaalsContact CB-CA 3.5Å; H76-Q158 PolarHBondContact NE2-NE2 2.92Å; H76-W196 AromaticContact CE1-NE1 3.67Å
77L98.7Very high98.5Very high70 Ų7032.4 Ų32.437%0.36616%0.158SC..Iπ-helixtrans-78.7-34.2-176.2-74.1170.8000114.4G73 I75 G81 P131 L134G73-L77 WeakPolarHBondContact O-CB 3.2Å; G73-L77 VanDerWaalsContact O-CG 3.29Å; G73-L77 WeakPolarHBondContact O-CG 3.47Å; G73-L77 PolarHBondContact O-N 3.39Å; I75-L77 PolarHBondContact O-N 3.15Å; L77-G81 WeakPolarHBondContact O-CA 3.42Å; L77-P131 HydrophobicContact CD2-CG 3.9Å; L77-L134 HydrophobicContact CD1-CD1 3.55Å; L77-L134 HydrophobicContact CD1-CG 4.28Å
78V98.6Very high98.4Very high60 Ų6039.1 Ų39.136%0.36419%0.189SC..Iπ-helixtrans-104.7-45.5-170.9-177.10000110.9F74 W82 L97F74-V78 HydrophobicContact CD2-CB 3.9Å; F74-V78 HydrophobicContact CD2-CG1 4.47Å; F74-V78 HydrophobicContact CD2-CG2 3.65Å; F74-V78 HydrophobicContact CE2-CB 3.77Å; F74-V78 HydrophobicContact CE2-CG1 3.86Å; F74-V78 HydrophobicContact CE2-CG2 3.86Å; F74-V78 HydrophobicContact CZ-CG1 4.5Å; F74-V78 VanDerWaalsContact O-CB 3.25Å; F74-V78 WeakPolarHBondContact O-CB 3.29Å; F74-V78 PolarHBondContact O-N 2.91Å; V78-W82 WeakPolarHBondContact O-CB 3.42Å; V78-W82 PolarHBondContact O-N 3.17Å; V78-W82 VanDerWaalsContact O-N 3.15Å; V78-L97 HydrophobicContact CG1-CD1 3.88Å
79I98.4Very high98.3Very high13 Ų1342.1 Ų42.17%0.06721%0.207CC..Iπ-helixtrans-84.2-59.1-174.8-53.7179.4000109.4L35 F74 I75 G81 W82 F83 L97 L100 W101L35-I79 HydrophobicContact CD1-CD1 3.74Å; F74-I79 HydrophobicContact CE1-CD1 3.91Å; F74-I79 HydrophobicContact CE1-CG1 4.32Å; F74-I79 HydrophobicContact CZ-CD1 4.43Å; F74-I79 HydrophobicContact CZ-CG1 4.43Å; I75-I79 HydrophobicContact CB-CD1 4.43Å; I75-I79 HydrophobicContact CG1-CD1 4.05Å; I75-I79 HydrophobicContact CG2-CB 4.46Å; I75-I79 HydrophobicContact CG2-CD1 4.42Å; I75-I79 WeakPolarHBondContact O-CA 3.47Å; I75-I79 VanDerWaalsContact O-CB 3.31Å; I75-I79 WeakPolarHBondContact O-CB 3.34Å; I75-I79 PolarHBondContact O-N 3.47Å; I79-G81 VanDerWaalsContact C-N 3.31Å; I79-G81 PolarHBondContact O-N 3.22Å; I79-W82 WeakPolarHBondContact O-CB 3.24Å; I79-W82 PolarHBondContact O-N 3.06Å; I79-F83 PolarHBondContact O-N 3.04Å; I79-F83 VanDerWaalsContact O-N 3.13Å; I79-L97 HydrophobicContact CG1-CD2 4.25Å; I79-L100 HydrophobicContact CD1-CD2 4Å; I79-L100 HydrophobicContact CG1-CD2 4.33Å; I79-L100 HydrophobicContact CG2-CD2 3.71Å; I79-W101 HydrophobicContact CG2-CZ2 3.67Å; I79-W101 PolarHBondContact O-NE1 2.83Å
80E98.7Very high98.2Very high15 Ų1542.1 Ų42.17%0.0721%0.207CC..Iπ-helixtrans-65.5-40.5175.7-56.3170-15900110.3I75 H76 W82 F83 I84 W101 E122 T125I75-E80 HydrophobicContact CG2-CG 4.36Å; I75-E80 WeakPolarHBondContact CG2-OE1 3.13Å; I75-E80 PolarHBondContact O-N 3.28Å; H76-E80 WeakPolarHBondContact CA-OE2 3.44Å; H76-E80 IonicContact CE1-OE1 2.75Å; H76-E80 PolarHBondContact CE1-OE1 3.43Å; H76-E80 IonicContact CE1-OE2 3.03Å; H76-E80 IonicContact CG-OE1 3.77Å; H76-E80 IonicContact CG-OE2 3.48Å; H76-E80 IonicContact ND1-OE1 3.43Å; H76-E80 PolarHBondContact ND1-OE1 2.95Å; H76-E80 IonicContact ND1-OE2 3.52Å; H76-E80 PolarHBondContact ND1-OE2 3.05Å; E80-W82 PolarHBondContact O-N 2.95Å; E80-W82 VanDerWaalsContact O-N 3.14Å; E80-F83 WeakPolarHBondContact O-CB 3.22Å; E80-F83 PolarHBondContact O-N 2.98Å; E80-I84 WeakPolarHBondContact O-CD1 3.27Å; E80-I84 PolarHBondContact O-N 3.42Å; E80-I84 VanDerWaalsContact O-N 3.1Å; E80-W101 HydrophobicContact CB-CZ2 4.46Å; E80-W101 HydrophobicContact CG-CH2 4.32Å; E80-W101 HydrophobicContact CG-CZ2 4.1Å; E80-E122 WeakPolarHBondContact CB-OE2 3.38Å; E80-E122 WeakPolarHBondContact CG-OE2 3.3Å; E80-E122 VanDerWaalsContact OE2-OE2 3.12Å; E80-T125 WeakPolarHBondContact OE2-CB 3.34Å; E80-T125 PolarHBondContact OE2-OG1 3.25Å
81G98.6Very high98.1Very high10 Ų1043 Ų4310%0.10321%0.211CC..Hα-helixtrans-52.4-25.4166.800000115.9H76 L77 I79 I84 L85H76-G81 PolarHBondContact O-N 2.93Å; L77-G81 WeakPolarHBondContact O-CA 3.42Å; I79-G81 VanDerWaalsContact C-N 3.31Å; I79-G81 PolarHBondContact O-N 3.22Å; G81-I84 WeakPolarHBondContact O-CD1 3.4Å; G81-L85 VanDerWaalsContact O-CD1 3.32Å; G81-L85 WeakPolarHBondContact O-CD1 3.45Å; G81-L85 WeakPolarHBondContact O-CG 3.23Å
82W98.8Very high97.9Very high60 Ų6043.7 Ų43.723%0.22722%0.222CC..Hα-helixtrans-84.9-43.7172.3-179.8-82.2000111.1V78 I79 E80 I84 L85 Y86 A95 L97 S98V78-W82 WeakPolarHBondContact O-CB 3.42Å; V78-W82 PolarHBondContact O-N 3.17Å; V78-W82 VanDerWaalsContact O-N 3.15Å; I79-W82 WeakPolarHBondContact O-CB 3.24Å; I79-W82 PolarHBondContact O-N 3.06Å; E80-W82 PolarHBondContact O-N 2.95Å; E80-W82 VanDerWaalsContact O-N 3.14Å; W82-I84 PolarHBondContact O-N 3.45Å; W82-L85 PolarHBondContact O-N 2.88Å; W82-L85 VanDerWaalsContact O-N 3.17Å; W82-Y86 AromaticContact CD2-CD2 3.51Å; W82-Y86 HydrophobicContact CD2-CD2 3.51Å; W82-Y86 AromaticContact CD2-CE2 3.85Å; W82-Y86 HydrophobicContact CD2-CE2 3.85Å; W82-Y86 AromaticContact CE2-CD2 3.47Å; W82-Y86 VanDerWaalsContact CE2-CD2 3.47Å; W82-Y86 AromaticContact CE3-CD2 3.85Å; W82-Y86 HydrophobicContact CE3-CD2 3.85Å; W82-Y86 AromaticContact CE3-CE2 3.66Å; W82-Y86 HydrophobicContact CE3-CE2 3.66Å; W82-Y86 AromaticContact CG-CD2 3.93Å; W82-Y86 HydrophobicContact CG-CD2 3.93Å; W82-Y86 HydrophobicContact CH2-CD2 4.12Å; W82-Y86 AromaticContact CH2-CE2 3.87Å; W82-Y86 HydrophobicContact CH2-CE2 3.87Å; W82-Y86 AromaticContact CZ2-CD2 3.79Å; W82-Y86 HydrophobicContact CZ2-CD2 3.79Å; W82-Y86 HydrophobicContact CZ2-CE2 4.03Å; W82-Y86 HydrophobicContact CZ2-CG 4.22Å; W82-Y86 HydrophobicContact CZ3-CD2 4.15Å; W82-Y86 AromaticContact CZ3-CE2 3.69Å; W82-Y86 HydrophobicContact CZ3-CE2 3.69Å; W82-Y86 AromaticContact NE1-CD2 3.84Å; W82-Y86 WeakPolarHBondContact O-CD2 3.33Å; W82-Y86 PolarHBondContact O-N 3.49Å; W82-A95 HydrophobicContact CH2-CB 3.81Å; W82-A95 HydrophobicContact CZ2-CB 3.36Å; W82-L97 HydrophobicContact CB-CB 4.09Å; W82-L97 HydrophobicContact CB-CD1 3.86Å; W82-L97 HydrophobicContact CD2-CB 3.7Å; W82-L97 HydrophobicContact CD2-CD1 3.82Å; W82-L97 HydrophobicContact CD2-CG 4.39Å; W82-L97 HydrophobicContact CE3-CB 4.36Å; W82-L97 HydrophobicContact CE3-CD1 3.7Å; W82-L97 HydrophobicContact CG-CB 3.54Å; W82-L97 HydrophobicContact CG-CD1 3.9Å; W82-L97 HydrophobicContact CG-CG 4.38Å; W82-S98 PolarHBondContact NE1-OG 3.48Å
83F98.7Very high97.9Very high0 Ų045.9 Ų45.90%023%0.234CC..Hα-helixtrans-54.9-52.6179.5166.1-112.2000112I79 E80 L85 Y86 Y87 W101 Y111 T118 V119 E122I79-F83 PolarHBondContact O-N 3.04Å; I79-F83 VanDerWaalsContact O-N 3.13Å; E80-F83 WeakPolarHBondContact O-CB 3.22Å; E80-F83 PolarHBondContact O-N 2.98Å; F83-L85 PolarHBondContact O-N 3.48Å; F83-L85 VanDerWaalsContact O-N 3.12Å; F83-Y86 PolarHBondContact O-N 3.39Å; F83-Y86 VanDerWaalsContact O-N 3.13Å; F83-Y87 HydrophobicContact CE2-CG 4.32Å; F83-Y87 WeakPolarHBondContact O-CA 3.41Å; F83-Y87 VanDerWaalsContact O-CB 3.26Å; F83-Y87 WeakPolarHBondContact O-CB 3.34Å; F83-Y87 PolarHBondContact O-N 2.77Å; F83-W101 HydrophobicContact CB-CD2 4.08Å; F83-W101 VanDerWaalsContact CB-CE2 3.49Å; F83-W101 HydrophobicContact CB-CG 4.39Å; F83-W101 HydrophobicContact CB-CZ2 3.76Å; F83-W101 HydrophobicContact CG-CZ2 4.42Å; F83-Y111 HydrophobicContact CD1-CD1 4.2Å; F83-Y111 HydrophobicContact CD1-CE1 4.31Å; F83-Y111 AromaticContact CD2-CD1 3.99Å; F83-Y111 HydrophobicContact CD2-CD1 3.99Å; F83-Y111 AromaticContact CE1-CD1 3.97Å; F83-Y111 HydrophobicContact CE1-CD1 3.97Å; F83-Y111 HydrophobicContact CE1-CE1 4.16Å; F83-Y111 AromaticContact CE2-CD1 3.77Å; F83-Y111 HydrophobicContact CE2-CD1 3.77Å; F83-Y111 HydrophobicContact CE2-CG 4.43Å; F83-Y111 VanDerWaalsContact CE2-O 3.27Å; F83-Y111 WeakPolarHBondContact CE2-O 3.3Å; F83-Y111 HydrophobicContact CG-CD1 4.2Å; F83-Y111 AromaticContact CZ-CD1 3.76Å; F83-Y111 HydrophobicContact CZ-CD1 3.76Å; F83-Y111 HydrophobicContact CZ-CE1 4.37Å; F83-T118 HydrophobicContact CE1-CG2 4.13Å; F83-T118 HydrophobicContact CZ-CG2 4.13Å; F83-V119 HydrophobicContact CE1-CG2 4.18Å; F83-V119 HydrophobicContact CZ-CG2 3.88Å; F83-E122 HydrophobicContact CD1-CB 3.73Å; F83-E122 HydrophobicContact CD1-CG 3.79Å; F83-E122 HydrophobicContact CE1-CB 3.9Å; F83-E122 HydrophobicContact CE1-CG 3.77Å
84I98.1Very high97.8Very high36 Ų3648.5 Ų48.519%0.18525%0.246CC..Hα-helixtrans-64.8-21.9-177.381.5-60.1000114E80 G81 W82 E122 A126E80-I84 WeakPolarHBondContact O-CD1 3.27Å; E80-I84 PolarHBondContact O-N 3.42Å; E80-I84 VanDerWaalsContact O-N 3.1Å; G81-I84 WeakPolarHBondContact O-CD1 3.4Å; W82-I84 PolarHBondContact O-N 3.45Å; I84-E122 HydrophobicContact CG2-CB 3.81Å; I84-A126 HydrophobicContact CD1-CB 4.38Å
85L98.3Very high97.8Very high121 Ų12148.1 Ų48.163%0.63425%0.25SS*.Hα-helixtrans-85.8-27.8177.9-67.1178000112.4G81 W82 F83G81-L85 VanDerWaalsContact O-CD1 3.32Å; G81-L85 WeakPolarHBondContact O-CD1 3.45Å; G81-L85 WeakPolarHBondContact O-CG 3.23Å; W82-L85 PolarHBondContact O-N 2.88Å; W82-L85 VanDerWaalsContact O-N 3.17Å; F83-L85 PolarHBondContact O-N 3.48Å; F83-L85 VanDerWaalsContact O-N 3.12Å
86Y98.2Very high97.8Very high91 Ų9150.7 Ų50.736%0.35726%0.26SS..Hα-helixtrans-132.612.3-166.7-59-72.1000114.4W82 F83 E88 D89 L90W82-Y86 AromaticContact CD2-CD2 3.51Å; W82-Y86 HydrophobicContact CD2-CD2 3.51Å; W82-Y86 AromaticContact CD2-CE2 3.85Å; W82-Y86 HydrophobicContact CD2-CE2 3.85Å; W82-Y86 AromaticContact CE2-CD2 3.47Å; W82-Y86 VanDerWaalsContact CE2-CD2 3.47Å; W82-Y86 AromaticContact CE3-CD2 3.85Å; W82-Y86 HydrophobicContact CE3-CD2 3.85Å; W82-Y86 AromaticContact CE3-CE2 3.66Å; W82-Y86 HydrophobicContact CE3-CE2 3.66Å; W82-Y86 AromaticContact CG-CD2 3.93Å; W82-Y86 HydrophobicContact CG-CD2 3.93Å; W82-Y86 HydrophobicContact CH2-CD2 4.12Å; W82-Y86 AromaticContact CH2-CE2 3.87Å; W82-Y86 HydrophobicContact CH2-CE2 3.87Å; W82-Y86 AromaticContact CZ2-CD2 3.79Å; W82-Y86 HydrophobicContact CZ2-CD2 3.79Å; W82-Y86 HydrophobicContact CZ2-CE2 4.03Å; W82-Y86 HydrophobicContact CZ2-CG 4.22Å; W82-Y86 HydrophobicContact CZ3-CD2 4.15Å; W82-Y86 AromaticContact CZ3-CE2 3.69Å; W82-Y86 HydrophobicContact CZ3-CE2 3.69Å; W82-Y86 AromaticContact NE1-CD2 3.84Å; W82-Y86 WeakPolarHBondContact O-CD2 3.33Å; W82-Y86 PolarHBondContact O-N 3.49Å; F83-Y86 PolarHBondContact O-N 3.39Å; F83-Y86 VanDerWaalsContact O-N 3.13Å; Y86-E88 PolarHBondContact O-N 3.38Å; Y86-D89 PolarHBondContact O-N 3.24Å; Y86-D89 VanDerWaalsContact O-N 3.09Å; Y86-L90 PolarHBondContact O-N 2.83Å
87Y97.3Very high97.7Very high64 Ų6452 Ų5225%0.25127%0.267SS..THydrogen-bonded Turntrans-60.3-30.9-17673-88.4000113.2F83 D89 L90 V119F83-Y87 HydrophobicContact CE2-CG 4.32Å; F83-Y87 WeakPolarHBondContact O-CA 3.41Å; F83-Y87 VanDerWaalsContact O-CB 3.26Å; F83-Y87 WeakPolarHBondContact O-CB 3.34Å; F83-Y87 PolarHBondContact O-N 2.77Å; Y87-D89 VanDerWaalsContact C-N 3.3Å; Y87-D89 PolarHBondContact O-N 3.44Å; Y87-L90 WeakPolarHBondContact O-CB 3.29Å; Y87-L90 PolarHBondContact O-N 2.97Å; Y87-V119 HydrophobicContact CD1-CG2 4.31Å; Y87-V119 HydrophobicContact CD2-CG2 4.21Å; Y87-V119 HydrophobicContact CE1-CG1 4.14Å; Y87-V119 HydrophobicContact CE1-CG2 4.37Å; Y87-V119 HydrophobicContact CE2-CG2 4.28Å; Y87-V119 HydrophobicContact CG-CG2 4.25Å
88E96.3Very high97.7Very high148 Ų14848.6 Ų48.669%0.69225%0.25SC*.THydrogen-bonded Turntrans-69.2-29.1178.6-60.7-169.3164.700112.5Y86Y86-E88 PolarHBondContact O-N 3.38Å
89D96.6Very high97.7Very high103 Ų10345.8 Ų45.855%0.55123%0.232SC*.THydrogen-bonded Turntrans-94.7-8.7-178.1-62.7-48.9000112.8Y86 Y87 L91 G92 D93Y86-D89 PolarHBondContact O-N 3.24Å; Y86-D89 VanDerWaalsContact O-N 3.09Å; Y87-D89 VanDerWaalsContact C-N 3.3Å; Y87-D89 PolarHBondContact O-N 3.44Å; D89-L91 PolarHBondContact O-N 3.36Å; D89-G92 PolarHBondContact O-N 3.21Å; D89-G92 VanDerWaalsContact O-N 3.08Å; D89-D93 WeakPolarHBondContact O-CB 3.44Å; D89-D93 PolarHBondContact O-N 3.26Å
90L96.4Very high97.7Very high0 Ų046.2 Ų46.20%024%0.235CC..THydrogen-bonded Turntrans-55-35.6-166.1-162.878.6000114.2Y86 Y87 G92 W101 K102 I112Y86-L90 PolarHBondContact O-N 2.83Å; Y87-L90 WeakPolarHBondContact O-CB 3.29Å; Y87-L90 PolarHBondContact O-N 2.97Å; L90-G92 VanDerWaalsContact C-N 3.31Å; L90-G92 PolarHBondContact O-N 2.95Å; L90-W101 HydrophobicContact CD1-CB 3.68Å; L90-W101 HydrophobicContact CD1-CG 4.4Å; L90-W101 HydrophobicContact CD2-CB 3.83Å; L90-W101 HydrophobicContact CG-CB 4.28Å; L90-K102 HydrophobicContact CG-CG 4.25Å; L90-K102 VanDerWaalsContact O-CD 3.24Å; L90-K102 WeakPolarHBondContact O-CD 3.39Å; L90-K102 VanDerWaalsContact O-CE 3.31Å; L90-K102 WeakPolarHBondContact O-CE 3.42Å; L90-K102 WeakPolarHBondContact O-CG 3.39Å; L90-I112 HydrophobicContact CD2-CG2 3.89Å
91L95.8Very high97.7Very high27 Ų2746.1 Ų46.114%0.14123%0.234CC..THydrogen-bonded Turntrans-61.3-38.2-178-74.2176000112.7L18 N20 F21 V22 D89 I112L18-L91 HydrophobicContact CB-CD1 4.28Å; L18-L91 HydrophobicContact CB-CD2 4.34Å; L18-L91 HydrophobicContact CD1-CD2 4.08Å; L18-L91 HydrophobicContact CD2-CD1 4.21Å; L18-L91 HydrophobicContact CD2-CD2 4.45Å; N20-L91 CarbonylContact O-C 3.53Å; F21-L91 HydrophobicContact CD2-CD2 4.37Å; V22-L91 PolarHBondContact N-O 3.44Å; D89-L91 PolarHBondContact O-N 3.36Å; L91-I112 HydrophobicContact CD2-CB 3.95Å; L91-I112 HydrophobicContact CD2-CD1 4.2Å; L91-I112 HydrophobicContact CD2-CG2 4.15Å
92G96.1Very high97.7Very high35 Ų3545.7 Ų45.736%0.36123%0.229SC..THydrogen-bonded Turntrans-102.3-19.3-177.400000114.1D89 L90D89-G92 PolarHBondContact O-N 3.21Å; D89-G92 VanDerWaalsContact O-N 3.08Å; L90-G92 VanDerWaalsContact C-N 3.31Å; L90-G92 PolarHBondContact O-N 2.95Å
93D97.6Very high97.7Very high45 Ų4543 Ų4324%0.24122%0.219CC..  trans-71.1142.3-174.8-172.721.3000112.9D89 A95 S98 K102D89-D93 WeakPolarHBondContact O-CB 3.44Å; D89-D93 PolarHBondContact O-N 3.26Å; D93-A95 PolarHBondContact OD1-N 3.15Å; D93-A95 WeakPolarHBondContact OD2-CB 3.34Å; D93-S98 WeakPolarHBondContact OD2-CB 3.36Å; D93-S98 PolarHBondContact OD2-OG 3.23Å; D93-K102 WeakPolarHBondContact O-CE 3.15Å; D93-K102 PolarHBondContact O-NZ 3.2Å
94Q97.8Very high97.6Very high56 Ų5644.9 Ų44.926%0.26223%0.226SC..  trans-116.89.2179.8-58.8-66.720.200112.7V22 P23 Q99 K102V22-Q94 VanDerWaalsContact CG1-NE2 3.26Å; P23-Q94 PolarHBondContact O-NE2 3.38Å; Q94-Q99 PolarHBondContact O-NE2 3.01Å; Q94-K102 VanDerWaalsContact OE1-NZ 3.16Å
95A97.8Very high97.6Very high29 Ų2943.1 Ų43.124%0.2422%0.218CC..SBendtrans-56145165.100000110.9W82 D93 L97 S98 Q99W82-A95 HydrophobicContact CH2-CB 3.81Å; W82-A95 HydrophobicContact CZ2-CB 3.36Å; D93-A95 PolarHBondContact OD1-N 3.15Å; D93-A95 WeakPolarHBondContact OD2-CB 3.34Å; A95-L97 VanDerWaalsContact C-N 3.26Å; A95-L97 PolarHBondContact O-N 3.23Å; A95-S98 WeakPolarHBondContact O-CB 3.41Å; A95-S98 PolarHBondContact O-N 2.97Å; A95-Q99 WeakPolarHBondContact O-CG 3.49Å; A95-Q99 PolarHBondContact O-N 2.97Å
96F98Very high97.6Very high78 Ų7839.3 Ų39.334%0.34220%0.196SC..Hα-helixtrans-53.4-42.3-176.6179.8-85.8000113I31 Q99 L100I31-F96 HydrophobicContact CB-CZ 4.45Å; I31-F96 HydrophobicContact CG1-CE2 4.47Å; I31-F96 HydrophobicContact CG2-CZ 4.29Å; I31-F96 WeakPolarHBondContact O-CZ 3.27Å; F96-Q99 PolarHBondContact O-N 3.44Å; F96-L100 PolarHBondContact O-N 2.97Å
97L98.1Very high97.6Very high30 Ų3035.1 Ų35.116%0.15718%0.181CC..Hα-helixtrans-70.6-35.3179-67.1174.7000112.3V78 I79 W82 A95 Q99 L100 W101V78-L97 HydrophobicContact CG1-CD1 3.88Å; I79-L97 HydrophobicContact CG1-CD2 4.25Å; W82-L97 HydrophobicContact CB-CB 4.09Å; W82-L97 HydrophobicContact CB-CD1 3.86Å; W82-L97 HydrophobicContact CD2-CB 3.7Å; W82-L97 HydrophobicContact CD2-CD1 3.82Å; W82-L97 HydrophobicContact CD2-CG 4.39Å; W82-L97 HydrophobicContact CE3-CB 4.36Å; W82-L97 HydrophobicContact CE3-CD1 3.7Å; W82-L97 HydrophobicContact CG-CB 3.54Å; W82-L97 HydrophobicContact CG-CD1 3.9Å; W82-L97 HydrophobicContact CG-CG 4.38Å; A95-L97 VanDerWaalsContact C-N 3.26Å; A95-L97 PolarHBondContact O-N 3.23Å; L97-Q99 VanDerWaalsContact C-N 3.33Å; L97-L100 HydrophobicContact CD2-CD2 4.34Å; L97-L100 WeakPolarHBondContact O-CB 3.45Å; L97-L100 PolarHBondContact O-N 3.2Å; L97-W101 VanDerWaalsContact O-CD1 3.23Å; L97-W101 PolarHBondContact O-N 3Å
98S98.4Very high97.6Very high0 Ų032.1 Ų32.10%017%0.169CC..Hα-helixtrans-65-39.6172.3-67.30000112W82 D93 A95 L100 W101 K102W82-S98 PolarHBondContact NE1-OG 3.48Å; D93-S98 WeakPolarHBondContact OD2-CB 3.36Å; D93-S98 PolarHBondContact OD2-OG 3.23Å; A95-S98 WeakPolarHBondContact O-CB 3.41Å; A95-S98 PolarHBondContact O-N 2.97Å; S98-L100 VanDerWaalsContact C-N 3.34Å; S98-L100 PolarHBondContact O-N 3.45Å; S98-W101 PolarHBondContact O-N 3.25Å; S98-K102 PolarHBondContact O-N 2.99Å
99Q98.5Very high97.7Very high0 Ų025 Ų250%014%0.136CC..Hα-helixtrans-66.3-36175-67.3-168.959.300112.4N24 D25 H26 I31 Q94 A95 F96 L97 K102 E103N24-Q99 HydrophobicContact CB-CB 4.43Å; N24-Q99 HydrophobicContact CB-CG 4.26Å; N24-Q99 VanDerWaalsContact CB-OE1 3.24Å; N24-Q99 PolarHBondContact ND2-O 3.02Å; D25-Q99 VanDerWaalsContact OD1-CD 3.23Å; D25-Q99 PolarHBondContact OD1-NE2 3.36Å; D25-Q99 PolarHBondContact OD1-OE1 3.02Å; D25-Q99 VanDerWaalsContact OD1-OE1 3.09Å; H26-Q99 PolarHBondContact CD2-NE2 2.83Å; I31-Q99 HydrophobicContact CD1-CB 3.94Å; Q94-Q99 PolarHBondContact O-NE2 3.01Å; A95-Q99 WeakPolarHBondContact O-CG 3.49Å; A95-Q99 PolarHBondContact O-N 2.97Å; F96-Q99 PolarHBondContact O-N 3.44Å; L97-Q99 VanDerWaalsContact C-N 3.33Å; Q99-K102 PolarHBondContact O-N 3.43Å; Q99-E103 PolarHBondContact O-N 3.41Å
100L98.3Very high97.8Very high22 Ų2220.2 Ų20.212%0.11511%0.11CC..Hα-helixtrans-59.9-46.4171174.569.1000111.3I31 L35 I79 F96 L97 S98 E103 Y104I31-L100 HydrophobicContact CG2-CB 3.79Å; I31-L100 HydrophobicContact CG2-CD1 3.42Å; I31-L100 VanDerWaalsContact CG2-CD1 3.42Å; I31-L100 HydrophobicContact CG2-CG 4.2Å; L35-L100 HydrophobicContact CD2-CD1 4.41Å; I79-L100 HydrophobicContact CD1-CD2 4Å; I79-L100 HydrophobicContact CG1-CD2 4.33Å; I79-L100 HydrophobicContact CG2-CD2 3.71Å; F96-L100 PolarHBondContact O-N 2.97Å; L97-L100 HydrophobicContact CD2-CD2 4.34Å; L97-L100 WeakPolarHBondContact O-CB 3.45Å; L97-L100 PolarHBondContact O-N 3.2Å; S98-L100 VanDerWaalsContact C-N 3.34Å; S98-L100 PolarHBondContact O-N 3.45Å; L100-E103 WeakPolarHBondContact O-CB 3.2Å; L100-E103 PolarHBondContact O-N 3.32Å; L100-Y104 PolarHBondContact O-N 3.27Å
101W98.5Very high97.9Very high14 Ų1420.4 Ų20.45%0.05311%0.11CC..Hα-helixtrans-66.7-38.9177.1-82117.7000113I79 E80 F83 L90 L97 S98 E103 Y104 A105 Y111I79-W101 HydrophobicContact CG2-CZ2 3.67Å; I79-W101 PolarHBondContact O-NE1 2.83Å; E80-W101 HydrophobicContact CB-CZ2 4.46Å; E80-W101 HydrophobicContact CG-CH2 4.32Å; E80-W101 HydrophobicContact CG-CZ2 4.1Å; F83-W101 HydrophobicContact CB-CD2 4.08Å; F83-W101 VanDerWaalsContact CB-CE2 3.49Å; F83-W101 HydrophobicContact CB-CG 4.39Å; F83-W101 HydrophobicContact CB-CZ2 3.76Å; F83-W101 HydrophobicContact CG-CZ2 4.42Å; L90-W101 HydrophobicContact CD1-CB 3.68Å; L90-W101 HydrophobicContact CD1-CG 4.4Å; L90-W101 HydrophobicContact CD2-CB 3.83Å; L90-W101 HydrophobicContact CG-CB 4.28Å; L97-W101 VanDerWaalsContact O-CD1 3.23Å; L97-W101 PolarHBondContact O-N 3Å; S98-W101 PolarHBondContact O-N 3.25Å; W101-E103 VanDerWaalsContact C-N 3.3Å; W101-E103 PolarHBondContact O-N 3.46Å; W101-Y104 AromaticContact CE3-CD1 3.93Å; W101-Y104 HydrophobicContact CE3-CD1 3.93Å; W101-Y104 AromaticContact CZ3-CD1 3.63Å; W101-Y104 HydrophobicContact CZ3-CD1 3.63Å; W101-Y104 HydrophobicContact CZ3-CE1 4.1Å; W101-Y104 HydrophobicContact CZ3-CG 4.41Å; W101-Y104 PolarHBondContact O-N 3.27Å; W101-A105 WeakPolarHBondContact O-CB 3.49Å; W101-A105 PolarHBondContact O-N 3.29Å; W101-Y111 HydrophobicContact CD2-CD1 4.44Å; W101-Y111 AromaticContact CE3-CD1 3.5Å; W101-Y111 HydrophobicContact CE3-CD1 3.5Å; W101-Y111 VanDerWaalsContact CE3-CD1 3.5Å; W101-Y111 AromaticContact CE3-CE1 3.93Å; W101-Y111 HydrophobicContact CE3-CE1 3.93Å; W101-Y111 HydrophobicContact CE3-CG 4.01Å; W101-Y111 AromaticContact CH2-CD1 3.9Å; W101-Y111 HydrophobicContact CH2-CD1 3.9Å; W101-Y111 AromaticContact CH2-CE1 3.47Å; W101-Y111 HydrophobicContact CH2-CE1 3.47Å; W101-Y111 VanDerWaalsContact CH2-CE1 3.47Å; W101-Y111 AromaticContact CZ3-CD1 3.19Å; W101-Y111 HydrophobicContact CZ3-CD1 3.19Å; W101-Y111 HydrophobicContact CZ3-CD2 4.49Å; W101-Y111 AromaticContact CZ3-CE1 3.09Å; W101-Y111 HydrophobicContact CZ3-CE1 3.09Å; W101-Y111 HydrophobicContact CZ3-CE2 4.44Å; W101-Y111 AromaticContact CZ3-CG 3.91Å; W101-Y111 HydrophobicContact CZ3-CG 3.91Å; W101-Y111 AromaticContact CZ3-CZ 3.77Å
102K98.2Very high97.9Very high0 Ų019.6 Ų19.60%011%0.106CC..Hα-helixtrans-60.7-37170.3-79.8-169-83171.60112.4Y11 V22 N24 L90 D93 Q94 S98 Q99Y11-K102 WeakPolarHBondContact CE1-O 3.45Å; Y11-K102 WeakPolarHBondContact OH-CB 3.41Å; Y11-K102 WeakPolarHBondContact OH-CG 3.32Å; Y11-K102 PolarHBondContact OH-O 2.9Å; V22-K102 PolarHBondContact O-NZ 3.05Å; N24-K102 WeakPolarHBondContact OD1-CB 3.39Å; N24-K102 WeakPolarHBondContact OD1-CD 3.13Å; N24-K102 WeakPolarHBondContact OD1-CE 3.45Å; N24-K102 PolarHBondContact OD1-NZ 3.23Å; N24-K102 VanDerWaalsContact OD1-NZ 3.12Å; L90-K102 HydrophobicContact CG-CG 4.25Å; L90-K102 VanDerWaalsContact O-CD 3.24Å; L90-K102 WeakPolarHBondContact O-CD 3.39Å; L90-K102 VanDerWaalsContact O-CE 3.31Å; L90-K102 WeakPolarHBondContact O-CE 3.42Å; L90-K102 WeakPolarHBondContact O-CG 3.39Å; D93-K102 WeakPolarHBondContact O-CE 3.15Å; D93-K102 PolarHBondContact O-NZ 3.2Å; Q94-K102 VanDerWaalsContact OE1-NZ 3.16Å; S98-K102 PolarHBondContact O-N 2.99Å; Q99-K102 PolarHBondContact O-N 3.43Å
103E98.1Very high98Very high5 Ų521.3 Ų21.32%0.02311%0.107CC..Hα-helixtrans-65.7-49.9173.3179.764.5-137.600111.1T28 Q99 L100 W101 A105 K106 Y188T28-E103 VanDerWaalsContact CG2-CD 3.45Å; T28-E103 HydrophobicContact CG2-CG 3.82Å; T28-E103 PolarHBondContact OG1-OE2 3.21Å; Q99-E103 PolarHBondContact O-N 3.41Å; L100-E103 WeakPolarHBondContact O-CB 3.2Å; L100-E103 PolarHBondContact O-N 3.32Å; W101-E103 VanDerWaalsContact C-N 3.3Å; W101-E103 PolarHBondContact O-N 3.46Å; E103-A105 VanDerWaalsContact C-N 3.25Å; E103-A105 PolarHBondContact O-N 2.95Å; E103-K106 VanDerWaalsContact O-CB 3.32Å; E103-K106 WeakPolarHBondContact O-CB 3.47Å; E103-K106 WeakPolarHBondContact O-CG 3.27Å; E103-K106 PolarHBondContact O-N 3.41Å; E103-K106 VanDerWaalsContact O-N 3.13Å; E103-K106 IonicContact OE1-NZ 2.67Å; E103-K106 PolarHBondContact OE1-NZ 3.07Å; E103-K106 IonicContact OE2-NZ 3.6Å; E103-K106 PolarHBondContact OE2-NZ 2.85Å; E103-Y188 HydrophobicContact CG-CE2 4.02Å; E103-Y188 PolarHBondContact OE1-OH 3.13Å
104Y98.3Very high97.9Very high38 Ų3820 Ų2015%0.14910%0.103CC..Hα-helixtrans-61.3-36.8179.3-175.6-106.9000111.9L100 W101 K106 G107 D108 Y111 Y165 Y188 N193L100-Y104 PolarHBondContact O-N 3.27Å; W101-Y104 AromaticContact CE3-CD1 3.93Å; W101-Y104 HydrophobicContact CE3-CD1 3.93Å; W101-Y104 AromaticContact CZ3-CD1 3.63Å; W101-Y104 HydrophobicContact CZ3-CD1 3.63Å; W101-Y104 HydrophobicContact CZ3-CE1 4.1Å; W101-Y104 HydrophobicContact CZ3-CG 4.41Å; W101-Y104 PolarHBondContact O-N 3.27Å; Y104-K106 PolarHBondContact O-N 3.42Å; Y104-K106 VanDerWaalsContact O-N 3.09Å; Y104-G107 WeakPolarHBondContact O-CA 3.3Å; Y104-G107 PolarHBondContact O-N 3.31Å; Y104-D108 PolarHBondContact O-N 3.26Å; Y104-Y111 HydrophobicContact CD1-CD2 4Å; Y104-Y111 HydrophobicContact CD1-CE2 4.04Å; Y104-Y111 HydrophobicContact CD1-CG 4.39Å; Y104-Y111 AromaticContact CE1-CD2 3.86Å; Y104-Y111 HydrophobicContact CE1-CD2 3.86Å; Y104-Y111 AromaticContact CE1-CE2 3.45Å; Y104-Y111 HydrophobicContact CE1-CE2 3.45Å; Y104-Y111 VanDerWaalsContact CE1-CE2 3.45Å; Y104-Y111 AromaticContact CE1-CZ 3.85Å; Y104-Y165 PolarHBondContact OH-OH 3.23Å; Y104-Y188 HydrophobicContact CD2-CD2 4.45Å; Y104-Y188 HydrophobicContact CD2-CG 4.44Å; Y104-N193 PolarHBondContact OH-ND2 3.46Å; Y104-N193 PolarHBondContact OH-OD1 3.26Å
105A98.2Very high97.9Very high0 Ų019.5 Ų19.50%010%0.103CC..THydrogen-bonded Turntrans-65.6-12.717900000114.2Y11 W101 E103 G107 D108 S109 I112Y11-A105 HydrophobicContact CD1-CB 4.24Å; Y11-A105 VanDerWaalsContact CD1-O 3.29Å; Y11-A105 WeakPolarHBondContact CD1-O 3.39Å; Y11-A105 HydrophobicContact CE1-CB 3.8Å; W101-A105 WeakPolarHBondContact O-CB 3.49Å; W101-A105 PolarHBondContact O-N 3.29Å; E103-A105 VanDerWaalsContact C-N 3.25Å; E103-A105 PolarHBondContact O-N 2.95Å; A105-G107 PolarHBondContact O-N 3.48Å; A105-D108 VanDerWaalsContact CA-O 3.23Å; A105-D108 WeakPolarHBondContact CA-O 3.37Å; A105-D108 CarbonylContact O-C 3.48Å; A105-D108 PolarHBondContact O-N 3.47Å; A105-S109 WeakPolarHBondContact O-CA 3.27Å; A105-S109 PolarHBondContact O-N 3.2Å; A105-I112 HydrophobicContact CB-CB 4.43Å; A105-I112 HydrophobicContact CB-CG1 4.41Å; A105-I112 HydrophobicContact CB-CG2 3.51Å
106K97.3Very high98Very high40 Ų4024.7 Ų24.717%0.17413%0.126CC..THydrogen-bonded Turntrans-66.9-27.6166.8-60.5175.6-168.4166.40112P10 Y11 E103 Y104 Y184P10-K106 HydrophobicContact CG-CD 4.49Å; P10-K106 HydrophobicContact CG-CG 4.2Å; Y11-K106 HydrophobicContact CD1-CG 4.26Å; Y11-K106 HydrophobicContact CE1-CG 3.93Å; E103-K106 VanDerWaalsContact O-CB 3.32Å; E103-K106 WeakPolarHBondContact O-CB 3.47Å; E103-K106 WeakPolarHBondContact O-CG 3.27Å; E103-K106 PolarHBondContact O-N 3.41Å; E103-K106 VanDerWaalsContact O-N 3.13Å; E103-K106 IonicContact OE1-NZ 2.67Å; E103-K106 PolarHBondContact OE1-NZ 3.07Å; E103-K106 IonicContact OE2-NZ 3.6Å; E103-K106 PolarHBondContact OE2-NZ 2.85Å; Y104-K106 PolarHBondContact O-N 3.42Å; Y104-K106 VanDerWaalsContact O-N 3.09Å; K106-Y184 HydrophobicContact CB-CD1 3.8Å; K106-Y184 HydrophobicContact CB-CD2 4.39Å; K106-Y184 HydrophobicContact CB-CE1 3.73Å; K106-Y184 HydrophobicContact CB-CE2 4.31Å; K106-Y184 HydrophobicContact CB-CG 4.15Å; K106-Y184 HydrophobicContact CD-CE1 3.89Å; K106-Y184 HydrophobicContact CG-CE1 4.49Å
107G97.3Very high98Very high4 Ų423.5 Ų23.54%0.04112%0.121CC..THydrogen-bonded Turntrans-79.3-37.1169.200000113.5Y104 A105 Y184Y104-G107 WeakPolarHBondContact O-CA 3.3Å; Y104-G107 PolarHBondContact O-N 3.31Å; A105-G107 PolarHBondContact O-N 3.48Å; G107-Y184 WeakPolarHBondContact CA-O 3.32Å
108D98.3Very high98Very high0 Ų022 Ų220%011%0.114CC..  trans-149102.3-179.3-176.5-2.1000112.1Y104 A105 R110 Y111 Y165 H176 F189Y104-D108 PolarHBondContact O-N 3.26Å; A105-D108 VanDerWaalsContact CA-O 3.23Å; A105-D108 WeakPolarHBondContact CA-O 3.37Å; A105-D108 CarbonylContact O-C 3.48Å; A105-D108 PolarHBondContact O-N 3.47Å; D108-R110 PolarHBondContact O-N 2.77Å; D108-R110 VanDerWaalsContact O-N 3.11Å; D108-R110 VanDerWaalsContact OD1-CB 3.25Å; D108-R110 WeakPolarHBondContact OD1-CB 3.44Å; D108-R110 VanDerWaalsContact OD1-CG 3.31Å; D108-R110 WeakPolarHBondContact OD1-CG 3.47Å; D108-R110 IonicContact OD1-CZ 3.48Å; D108-R110 PolarHBondContact OD1-N 3.28Å; D108-R110 IonicContact OD1-NE 2.76Å; D108-R110 PolarHBondContact OD1-NE 2.95Å; D108-R110 IonicContact OD1-NH2 3.41Å; D108-R110 IonicContact OD2-CZ 3.78Å; D108-R110 VanDerWaalsContact OD2-CZ 3.31Å; D108-R110 IonicContact OD2-NE 3.33Å; D108-R110 PolarHBondContact OD2-NE 3.35Å; D108-R110 VanDerWaalsContact OD2-NE 3.1Å; D108-R110 IonicContact OD2-NH2 3.14Å; D108-R110 PolarHBondContact OD2-NH2 2.91Å; D108-Y111 HydrophobicContact CB-CD2 4.3Å; D108-Y111 PolarHBondContact O-N 2.88Å; D108-Y165 WeakPolarHBondContact OD2-CE2 3.44Å; D108-Y165 PolarHBondContact OD2-OH 3.43Å; D108-H176 CarbonylContact C-O 3.6Å; D108-H176 WeakPolarHBondContact CA-O 3.13Å; D108-F189 HydrophobicContact CB-CD2 4.38Å
109S98.3Very high98Very high0 Ų023.2 Ų23.20%012%0.12CC..THydrogen-bonded Turntrans-68.3-10.4-17676.70000113.2W12 A105 Y111 I112 L113 H176W12-S109 VanDerWaalsContact O-CB 3.25Å; W12-S109 WeakPolarHBondContact O-CB 3.39Å; W12-S109 PolarHBondContact O-OG 3.06Å; A105-S109 WeakPolarHBondContact O-CA 3.27Å; A105-S109 PolarHBondContact O-N 3.2Å; S109-Y111 PolarHBondContact O-N 2.79Å; S109-Y111 VanDerWaalsContact O-N 3.08Å; S109-I112 WeakPolarHBondContact O-CG1 3.26Å; S109-I112 PolarHBondContact O-N 3.5Å; S109-L113 VanDerWaalsContact O-CG 3.31Å; S109-L113 WeakPolarHBondContact O-CG 3.18Å; S109-L113 PolarHBondContact O-N 3.26Å; S109-L113 VanDerWaalsContact O-N 3.07Å; S109-H176 PolarHBondContact N-O 2.91Å; S109-H176 WeakPolarHBondContact OG-CB 3.5Å; S109-H176 PolarHBondContact OG-O 2.87Å
110R98.4Very high98Very high1 Ų127 Ų270%0.00415%0.146CC..Hα-helixtrans-56.9-26.9177-70179.3-63.61733.2112.7D108 L113 G114 D115 T168 E169 H176D108-R110 PolarHBondContact O-N 2.77Å; D108-R110 VanDerWaalsContact O-N 3.11Å; D108-R110 VanDerWaalsContact OD1-CB 3.25Å; D108-R110 WeakPolarHBondContact OD1-CB 3.44Å; D108-R110 VanDerWaalsContact OD1-CG 3.31Å; D108-R110 WeakPolarHBondContact OD1-CG 3.47Å; D108-R110 IonicContact OD1-CZ 3.48Å; D108-R110 PolarHBondContact OD1-N 3.28Å; D108-R110 IonicContact OD1-NE 2.76Å; D108-R110 PolarHBondContact OD1-NE 2.95Å; D108-R110 IonicContact OD1-NH2 3.41Å; D108-R110 IonicContact OD2-CZ 3.78Å; D108-R110 VanDerWaalsContact OD2-CZ 3.31Å; D108-R110 IonicContact OD2-NE 3.33Å; D108-R110 PolarHBondContact OD2-NE 3.35Å; D108-R110 VanDerWaalsContact OD2-NE 3.1Å; D108-R110 IonicContact OD2-NH2 3.14Å; D108-R110 PolarHBondContact OD2-NH2 2.91Å; R110-L113 PolarHBondContact O-N 3.06Å; R110-G114 PolarHBondContact O-N 3.03Å; R110-D115 HydrophobicContact CB-CB 3.74Å; R110-D115 HydrophobicContact CG-CB 4.06Å; R110-D115 PolarHBondContact O-N 3.08Å; R110-D115 VanDerWaalsContact O-N 3.08Å; R110-T168 PolarHBondContact NH1-OG1 3.3Å; R110-E169 WeakPolarHBondContact CD-OE2 3.18Å; R110-E169 IonicContact CZ-OE2 2.95Å; R110-E169 IonicContact NE-OE2 2.7Å; R110-E169 PolarHBondContact NE-OE2 2.9Å; R110-E169 IonicContact NH1-OE2 3.1Å; R110-E169 PolarHBondContact NH1-OE2 2.89Å; R110-E169 IonicContact NH2-OE2 2.8Å; R110-H176 HydrophobicContact CG-CB 3.8Å; R110-H176 VanDerWaalsContact CG-CG 3.46Å
111Y98.4Very high98Very high4 Ų426.9 Ų26.92%0.01615%0.145CC..Hα-helixtrans-72-30.1174.8-72.6-90.5000114.2F83 W101 Y104 D108 S109 T118 E122 Y165F83-Y111 HydrophobicContact CD1-CD1 4.2Å; F83-Y111 HydrophobicContact CD1-CE1 4.31Å; F83-Y111 AromaticContact CD2-CD1 3.99Å; F83-Y111 HydrophobicContact CD2-CD1 3.99Å; F83-Y111 AromaticContact CE1-CD1 3.97Å; F83-Y111 HydrophobicContact CE1-CD1 3.97Å; F83-Y111 HydrophobicContact CE1-CE1 4.16Å; F83-Y111 AromaticContact CE2-CD1 3.77Å; F83-Y111 HydrophobicContact CE2-CD1 3.77Å; F83-Y111 HydrophobicContact CE2-CG 4.43Å; F83-Y111 VanDerWaalsContact CE2-O 3.27Å; F83-Y111 WeakPolarHBondContact CE2-O 3.3Å; F83-Y111 HydrophobicContact CG-CD1 4.2Å; F83-Y111 AromaticContact CZ-CD1 3.76Å; F83-Y111 HydrophobicContact CZ-CD1 3.76Å; F83-Y111 HydrophobicContact CZ-CE1 4.37Å; W101-Y111 HydrophobicContact CD2-CD1 4.44Å; W101-Y111 AromaticContact CE3-CD1 3.5Å; W101-Y111 HydrophobicContact CE3-CD1 3.5Å; W101-Y111 VanDerWaalsContact CE3-CD1 3.5Å; W101-Y111 AromaticContact CE3-CE1 3.93Å; W101-Y111 HydrophobicContact CE3-CE1 3.93Å; W101-Y111 HydrophobicContact CE3-CG 4.01Å; W101-Y111 AromaticContact CH2-CD1 3.9Å; W101-Y111 HydrophobicContact CH2-CD1 3.9Å; W101-Y111 AromaticContact CH2-CE1 3.47Å; W101-Y111 HydrophobicContact CH2-CE1 3.47Å; W101-Y111 VanDerWaalsContact CH2-CE1 3.47Å; W101-Y111 AromaticContact CZ3-CD1 3.19Å; W101-Y111 HydrophobicContact CZ3-CD1 3.19Å; W101-Y111 HydrophobicContact CZ3-CD2 4.49Å; W101-Y111 AromaticContact CZ3-CE1 3.09Å; W101-Y111 HydrophobicContact CZ3-CE1 3.09Å; W101-Y111 HydrophobicContact CZ3-CE2 4.44Å; W101-Y111 AromaticContact CZ3-CG 3.91Å; W101-Y111 HydrophobicContact CZ3-CG 3.91Å; W101-Y111 AromaticContact CZ3-CZ 3.77Å; Y104-Y111 HydrophobicContact CD1-CD2 4Å; Y104-Y111 HydrophobicContact CD1-CE2 4.04Å; Y104-Y111 HydrophobicContact CD1-CG 4.39Å; Y104-Y111 AromaticContact CE1-CD2 3.86Å; Y104-Y111 HydrophobicContact CE1-CD2 3.86Å; Y104-Y111 AromaticContact CE1-CE2 3.45Å; Y104-Y111 HydrophobicContact CE1-CE2 3.45Å; Y104-Y111 VanDerWaalsContact CE1-CE2 3.45Å; Y104-Y111 AromaticContact CE1-CZ 3.85Å; D108-Y111 HydrophobicContact CB-CD2 4.3Å; D108-Y111 PolarHBondContact O-N 2.88Å; S109-Y111 PolarHBondContact O-N 2.79Å; S109-Y111 VanDerWaalsContact O-N 3.08Å; Y111-T118 HydrophobicContact CD1-CG2 3.81Å; Y111-T118 HydrophobicContact CD2-CG2 4.1Å; Y111-T118 HydrophobicContact CE1-CG2 3.5Å; Y111-T118 VanDerWaalsContact CE1-CG2 3.5Å; Y111-T118 HydrophobicContact CE2-CG2 3.78Å; Y111-T118 HydrophobicContact CG-CG2 4.12Å; Y111-E122 HydrophobicContact CE1-CG 4.01Å; Y111-E122 WeakPolarHBondContact CE1-OE1 3.32Å; Y111-E122 PolarHBondContact OH-OE1 3.28Å; Y111-Y165 AromaticContact CE2-CE2 3.98Å; Y111-Y165 HydrophobicContact CE2-CE2 3.98Å
112I97.3Very high98Very high10 Ų1026.6 Ų26.65%0.05114%0.144CC..Hα-helixtrans-86.4-18.2172.156.4150.5000112.4Y11 L18 L90 L91 A105 S109Y11-I112 HydrophobicContact CD1-CD1 4.01Å; Y11-I112 HydrophobicContact CD2-CD1 3.3Å; Y11-I112 HydrophobicContact CD2-CG1 4.49Å; Y11-I112 HydrophobicContact CE1-CD1 4.4Å; Y11-I112 HydrophobicContact CE1-CG2 4.23Å; Y11-I112 HydrophobicContact CE2-CD1 3.74Å; Y11-I112 HydrophobicContact CE2-CG2 4.35Å; Y11-I112 HydrophobicContact CG-CD1 3.42Å; Y11-I112 VanDerWaalsContact CG-CD1 3.42Å; Y11-I112 HydrophobicContact CG-CG1 4.37Å; L18-I112 HydrophobicContact CD1-CD1 3.38Å; L18-I112 HydrophobicContact CD2-CD1 4.19Å; L18-I112 HydrophobicContact CG-CD1 4.44Å; L90-I112 HydrophobicContact CD2-CG2 3.89Å; L91-I112 HydrophobicContact CD2-CB 3.95Å; L91-I112 HydrophobicContact CD2-CD1 4.2Å; L91-I112 HydrophobicContact CD2-CG2 4.15Å; A105-I112 HydrophobicContact CB-CB 4.43Å; A105-I112 HydrophobicContact CB-CG1 4.41Å; A105-I112 HydrophobicContact CB-CG2 3.51Å; S109-I112 WeakPolarHBondContact O-CG1 3.26Å; S109-I112 PolarHBondContact O-N 3.5Å
113L96.6Very high98.1Very high72 Ų7229.2 Ų29.238%0.37716%0.16SC..Hα-helixtrans-88.1-12.5178.4-62.9171.5000112.5L16 L18 S109 R110 D115L16-L113 HydrophobicContact CD1-CD1 4.31Å; L16-L113 HydrophobicContact CD1-CD2 4.02Å; L16-L113 HydrophobicContact CD2-CD2 4.1Å; L18-L113 HydrophobicContact CD2-CD2 4.37Å; S109-L113 VanDerWaalsContact O-CG 3.31Å; S109-L113 WeakPolarHBondContact O-CG 3.18Å; S109-L113 PolarHBondContact O-N 3.26Å; S109-L113 VanDerWaalsContact O-N 3.07Å; R110-L113 PolarHBondContact O-N 3.06Å; L113-D115 VanDerWaalsContact C-N 3.34Å
114G96.6Very high98.1Very high16 Ų1633 Ų3317%0.16518%0.18CC..THydrogen-bonded Turntrans61.543.5-174.500000111.8R110 N116R110-G114 PolarHBondContact O-N 3.03Å; G114-N116 PolarHBondContact O-N 2.85Å
115D98.3Very high98.1Very high47 Ų4731.7 Ų31.725%0.25118%0.176SC..  trans-53.3135.9179.4168.263.1000111.4R110 L113 F117 T118 V119R110-D115 HydrophobicContact CB-CB 3.74Å; R110-D115 HydrophobicContact CG-CB 4.06Å; R110-D115 PolarHBondContact O-N 3.08Å; R110-D115 VanDerWaalsContact O-N 3.08Å; L113-D115 VanDerWaalsContact C-N 3.34Å; D115-F117 VanDerWaalsContact C-N 3.32Å; D115-F117 PolarHBondContact O-N 3.17Å; D115-F117 WeakPolarHBondContact OD2-CB 3.41Å; D115-F117 PolarHBondContact OD2-N 2.9Å; D115-T118 PolarHBondContact O-N 2.94Å; D115-T118 VanDerWaalsContact O-N 3.12Å; D115-T118 PolarHBondContact OD2-N 3.44Å; D115-T118 PolarHBondContact OD2-OG1 2.99Å; D115-V119 WeakPolarHBondContact O-CG2 3.41Å; D115-V119 PolarHBondContact O-N 3.36Å
116N98.3Very high98.1Very high137 Ų13732 Ų3273%0.73318%0.179SC*.Hα-helixtrans-56.2-45.6-173.4-77.5-44.1000112.4G114 C120G114-N116 PolarHBondContact O-N 2.85Å; N116-C120 WeakPolarHBondContact O-CB 3.49Å; N116-C120 PolarHBondContact O-N 3.39Å; N116-C120 PolarHBondContact O-SG 3.49Å
117F98.4Very high98.2Very high53 Ų5334 Ų3423%0.23220%0.197CC..Hα-helixtrans-66.8-45.9-179.8170.1-96.8000110.4D115 V119 C120 M121 L164 T168D115-F117 VanDerWaalsContact C-N 3.32Å; D115-F117 PolarHBondContact O-N 3.17Å; D115-F117 WeakPolarHBondContact OD2-CB 3.41Å; D115-F117 PolarHBondContact OD2-N 2.9Å; F117-V119 PolarHBondContact O-N 2.96Å; F117-C120 PolarHBondContact O-N 3.43Å; F117-M121 HydrophobicContact CE1-CB 4.15Å; F117-M121 HydrophobicContact CE1-CG 4.45Å; F117-M121 HydrophobicContact CE1-SD 3.7Å; F117-M121 HydrophobicContact CE2-CB 4.3Å; F117-M121 HydrophobicContact CZ-CB 3.94Å; F117-M121 HydrophobicContact CZ-CG 4.09Å; F117-M121 HydrophobicContact CZ-SD 3.65Å; F117-M121 VanDerWaalsContact O-CB 3.28Å; F117-M121 WeakPolarHBondContact O-CB 3.4Å; F117-M121 PolarHBondContact O-N 3.46Å; F117-L164 HydrophobicContact CE1-CB 4.34Å; F117-L164 HydrophobicContact CE2-CB 3.82Å; F117-L164 HydrophobicContact CE2-CD1 3.97Å; F117-L164 HydrophobicContact CZ-CB 3.41Å; F117-L164 VanDerWaalsContact CZ-CB 3.41Å; F117-L164 HydrophobicContact CZ-CD1 4.31Å; F117-T168 HydrophobicContact CD1-CG2 4Å; F117-T168 HydrophobicContact CD2-CG2 4.43Å; F117-T168 HydrophobicContact CE1-CG2 4.34Å; F117-T168 HydrophobicContact CG-CG2 4.06Å
118T98.4Very high98.2Very high0 Ų037.9 Ų37.90%022%0.216CC..Hα-helixtrans-58.2-50.4179.8-52.50000110.8F83 Y111 D115 C120 M121 E122F83-T118 HydrophobicContact CE1-CG2 4.13Å; F83-T118 HydrophobicContact CZ-CG2 4.13Å; Y111-T118 HydrophobicContact CD1-CG2 3.81Å; Y111-T118 HydrophobicContact CD2-CG2 4.1Å; Y111-T118 HydrophobicContact CE1-CG2 3.5Å; Y111-T118 VanDerWaalsContact CE1-CG2 3.5Å; Y111-T118 HydrophobicContact CE2-CG2 3.78Å; Y111-T118 HydrophobicContact CG-CG2 4.12Å; D115-T118 PolarHBondContact O-N 2.94Å; D115-T118 VanDerWaalsContact O-N 3.12Å; D115-T118 PolarHBondContact OD2-N 3.44Å; D115-T118 PolarHBondContact OD2-OG1 2.99Å; T118-C120 PolarHBondContact O-N 2.77Å; T118-M121 PolarHBondContact O-N 3.44Å; T118-E122 HydrophobicContact CG2-CG 4.3Å; T118-E122 WeakPolarHBondContact O-CB 3.36Å; T118-E122 WeakPolarHBondContact O-CG 3.47Å; T118-E122 PolarHBondContact O-N 3.32Å
119V98.7Very high98.2Very high24 Ų2439.7 Ų39.715%0.14522%0.223CC..Hα-helixtrans-60.3-45.2177.2174.50000111.8F83 Y87 D115 F117 T123F83-V119 HydrophobicContact CE1-CG2 4.18Å; F83-V119 HydrophobicContact CZ-CG2 3.88Å; Y87-V119 HydrophobicContact CD1-CG2 4.31Å; Y87-V119 HydrophobicContact CD2-CG2 4.21Å; Y87-V119 HydrophobicContact CE1-CG1 4.14Å; Y87-V119 HydrophobicContact CE1-CG2 4.37Å; Y87-V119 HydrophobicContact CE2-CG2 4.28Å; Y87-V119 HydrophobicContact CG-CG2 4.25Å; D115-V119 WeakPolarHBondContact O-CG2 3.41Å; D115-V119 PolarHBondContact O-N 3.36Å; F117-V119 PolarHBondContact O-N 2.96Å; V119-T123 WeakPolarHBondContact O-CB 3.49Å; V119-T123 PolarHBondContact O-N 3.37Å; V119-T123 PolarHBondContact O-OG1 3.13Å
120C98.8Very high98.3Very high79 Ų7939.7 Ų39.753%0.53422%0.223SC..Hα-helixtrans-65.3-44.4178.4-73.30000113.1N116 F117 T118 T123 I124N116-C120 WeakPolarHBondContact O-CB 3.49Å; N116-C120 PolarHBondContact O-N 3.39Å; N116-C120 PolarHBondContact O-SG 3.49Å; F117-C120 PolarHBondContact O-N 3.43Å; T118-C120 PolarHBondContact O-N 2.77Å; C120-T123 PolarHBondContact O-N 2.95Å; C120-I124 PolarHBondContact O-N 3.37Å; C120-I124 VanDerWaalsContact O-N 3.16Å
121M98.7Very high98.3Very high21 Ų2142.3 Ų42.310%0.10324%0.24CC..Hα-helixtrans-62.1-48.8178.9-177.2-170.37500110.5F117 T118 T123 I124 T125 Y165F117-M121 HydrophobicContact CE1-CB 4.15Å; F117-M121 HydrophobicContact CE1-CG 4.45Å; F117-M121 HydrophobicContact CE1-SD 3.7Å; F117-M121 HydrophobicContact CE2-CB 4.3Å; F117-M121 HydrophobicContact CZ-CB 3.94Å; F117-M121 HydrophobicContact CZ-CG 4.09Å; F117-M121 HydrophobicContact CZ-SD 3.65Å; F117-M121 VanDerWaalsContact O-CB 3.28Å; F117-M121 WeakPolarHBondContact O-CB 3.4Å; F117-M121 PolarHBondContact O-N 3.46Å; T118-M121 PolarHBondContact O-N 3.44Å; M121-T123 VanDerWaalsContact C-N 3.26Å; M121-T123 PolarHBondContact O-N 3Å; M121-I124 WeakPolarHBondContact O-CB 3.41Å; M121-I124 PolarHBondContact O-N 3.08Å; M121-I124 VanDerWaalsContact O-N 3.11Å; M121-T125 HydrophobicContact CG-CG2 4.4Å; M121-T125 VanDerWaalsContact O-CG2 3.26Å; M121-T125 WeakPolarHBondContact O-CG2 3.41Å; M121-T125 PolarHBondContact O-N 2.84Å; M121-T125 PolarHBondContact O-OG1 3.33Å; M121-Y165 HydrophobicContact CE-CD2 4.19Å
122E98.5Very high98.3Very high7 Ų743.9 Ų43.93%0.03325%0.249CC..Hα-helixtrans-66.2-29.7-179.5-64.4-67.4-178.500112.2E80 F83 I84 Y111 T118 T125 A126E80-E122 WeakPolarHBondContact CB-OE2 3.38Å; E80-E122 WeakPolarHBondContact CG-OE2 3.3Å; E80-E122 VanDerWaalsContact OE2-OE2 3.12Å; F83-E122 HydrophobicContact CD1-CB 3.73Å; F83-E122 HydrophobicContact CD1-CG 3.79Å; F83-E122 HydrophobicContact CE1-CB 3.9Å; F83-E122 HydrophobicContact CE1-CG 3.77Å; I84-E122 HydrophobicContact CG2-CB 3.81Å; Y111-E122 HydrophobicContact CE1-CG 4.01Å; Y111-E122 WeakPolarHBondContact CE1-OE1 3.32Å; Y111-E122 PolarHBondContact OH-OE1 3.28Å; T118-E122 HydrophobicContact CG2-CG 4.3Å; T118-E122 WeakPolarHBondContact O-CB 3.36Å; T118-E122 WeakPolarHBondContact O-CG 3.47Å; T118-E122 PolarHBondContact O-N 3.32Å; E122-T125 WeakPolarHBondContact CA-OG1 3.39Å; E122-T125 PolarHBondContact O-N 2.93Å; E122-T125 PolarHBondContact O-OG1 3.42Å; E122-T125 PolarHBondContact OE2-OG1 2.84Å; E122-A126 WeakPolarHBondContact O-CB 3.45Å; E122-A126 PolarHBondContact O-N 3.18Å
123T98.7Very high98.4Very high55 Ų5543.4 Ų43.434%0.33725%0.246SC..Hα-helixtrans-65.4-44172.4-610000110.9V119 C120 M121 C127V119-T123 WeakPolarHBondContact O-CB 3.49Å; V119-T123 PolarHBondContact O-N 3.37Å; V119-T123 PolarHBondContact O-OG1 3.13Å; C120-T123 PolarHBondContact O-N 2.95Å; M121-T123 VanDerWaalsContact C-N 3.26Å; M121-T123 PolarHBondContact O-N 3Å; T123-C127 VanDerWaalsContact O-CB 3.23Å; T123-C127 WeakPolarHBondContact O-CB 3.34Å; T123-C127 PolarHBondContact O-N 3.31Å; T123-C127 PolarHBondContact O-SG 3.22Å
124I98.7Very high98.5Very high85 Ų8543.3 Ų43.344%0.43625%0.246SC..Hα-helixtrans-64.2-44.2177.1-71.3171.3000110.4C120 M121 L128 W129C120-I124 PolarHBondContact O-N 3.37Å; C120-I124 VanDerWaalsContact O-N 3.16Å; M121-I124 WeakPolarHBondContact O-CB 3.41Å; M121-I124 PolarHBondContact O-N 3.08Å; M121-I124 VanDerWaalsContact O-N 3.11Å; I124-L128 HydrophobicContact CG2-CD1 4.23Å; I124-L128 WeakPolarHBondContact O-CA 3.38Å; I124-L128 VanDerWaalsContact O-CB 3.27Å; I124-L128 WeakPolarHBondContact O-CB 3.38Å; I124-L128 PolarHBondContact O-N 3.11Å; I124-W129 HydrophobicContact CG2-CZ2 4Å
125T98.2Very high98.6Very high11 Ų1148.3 Ų48.37%0.06726%0.26CS..Iπ-helixtrans-65-45.9-179.361.20000111.4E80 M121 E122 W129 G130E80-T125 WeakPolarHBondContact OE2-CB 3.34Å; E80-T125 PolarHBondContact OE2-OG1 3.25Å; M121-T125 HydrophobicContact CG-CG2 4.4Å; M121-T125 VanDerWaalsContact O-CG2 3.26Å; M121-T125 WeakPolarHBondContact O-CG2 3.41Å; M121-T125 PolarHBondContact O-N 2.84Å; M121-T125 PolarHBondContact O-OG1 3.33Å; E122-T125 WeakPolarHBondContact CA-OG1 3.39Å; E122-T125 PolarHBondContact O-N 2.93Å; E122-T125 PolarHBondContact O-OG1 3.42Å; E122-T125 PolarHBondContact OE2-OG1 2.84Å; T125-W129 CarbonylContact O-C 3.42Å; T125-W129 WeakPolarHBondContact O-CA 3.22Å; T125-W129 WeakPolarHBondContact O-CB 3.28Å; T125-W129 PolarHBondContact O-N 2.82Å; T125-G130 PolarHBondContact O-N 3.24Å
126A98.4Very high98.6Very high7 Ų746.1 Ų46.16%0.05825%0.248CC..Iπ-helixtrans-64.1-46.7177.200000112.3H76 I84 E122 P131H76-A126 VanDerWaalsContact O-CA 3.31Å; H76-A126 WeakPolarHBondContact O-CA 3.49Å; H76-A126 VanDerWaalsContact O-CB 3.28Å; H76-A126 WeakPolarHBondContact O-CB 3.46Å; I84-A126 HydrophobicContact CD1-CB 4.38Å; E122-A126 WeakPolarHBondContact O-CB 3.45Å; E122-A126 PolarHBondContact O-N 3.18Å; A126-P131 VanDerWaalsContact O-CD 3.27Å; A126-P131 WeakPolarHBondContact O-CD 3.12Å
127C98.5Very high98.6Very high81 Ų8140.3 Ų40.355%0.54722%0.218SC..Iπ-helixtrans-77.6-27.4-176.3-67.30000114T123 P131T123-C127 VanDerWaalsContact O-CB 3.23Å; T123-C127 WeakPolarHBondContact O-CB 3.34Å; T123-C127 PolarHBondContact O-N 3.31Å; T123-C127 PolarHBondContact O-SG 3.22Å; C127-P131 WeakPolarHBondContact O-CG 3.49Å
128L98.6Very high98.6Very high86 Ų8642.4 Ų42.445%0.4523%0.23SC..Iπ-helixtrans-116.2-59.3-175.5-59.6-179.4000112.5I124 G130 P131 L132I124-L128 HydrophobicContact CG2-CD1 4.23Å; I124-L128 WeakPolarHBondContact O-CA 3.38Å; I124-L128 VanDerWaalsContact O-CB 3.27Å; I124-L128 WeakPolarHBondContact O-CB 3.38Å; I124-L128 PolarHBondContact O-N 3.11Å; L128-G130 VanDerWaalsContact C-N 3.31Å; L128-G130 PolarHBondContact O-N 2.78Å; L128-P131 WeakPolarHBondContact O-CD 3.46Å; L128-L132 WeakPolarHBondContact O-CB 3.37Å; L128-L132 WeakPolarHBondContact O-CG 3.14Å; L128-L132 PolarHBondContact O-N 3.13Å
129W98.6Very high98.6Very high37 Ų3742.5 Ų42.514%0.1423%0.231CC..Iπ-helixtrans-67.3-32.8-173.6-49.3149.3000112.6I124 T125 L132 S133 V153 V154I124-W129 HydrophobicContact CG2-CZ2 4Å; T125-W129 CarbonylContact O-C 3.42Å; T125-W129 WeakPolarHBondContact O-CA 3.22Å; T125-W129 WeakPolarHBondContact O-CB 3.28Å; T125-W129 PolarHBondContact O-N 2.82Å; W129-L132 HydrophobicContact CE3-CD1 4.12Å; W129-L132 HydrophobicContact CZ3-CD1 4.08Å; W129-S133 WeakPolarHBondContact O-CB 3.34Å; W129-S133 PolarHBondContact O-N 3.41Å; W129-S133 PolarHBondContact O-OG 3.22Å; W129-V153 HydrophobicContact CZ3-CG1 4.09Å; W129-V154 HydrophobicContact CB-CG1 4.45Å; W129-V154 HydrophobicContact CE3-CG2 4.39Å
130G98.6Very high98.6Very high0 Ų041.5 Ų41.50%023%0.225CC..Hα-helixtrans-58.6-65.1172.100000113.4H76 T125 L128 L132 S133 L134H76-G130 VanDerWaalsContact CB-CA 3.5Å; T125-G130 PolarHBondContact O-N 3.24Å; L128-G130 VanDerWaalsContact C-N 3.31Å; L128-G130 PolarHBondContact O-N 2.78Å; G130-L132 VanDerWaalsContact C-N 3.34Å; G130-L132 PolarHBondContact O-N 3.48Å; G130-S133 PolarHBondContact O-N 3.03Å; G130-L134 PolarHBondContact O-N 2.95Å
131P98.8Very high98.6Very high57 Ų5738.8 Ų38.837%0.3721%0.205SC..Hα-helixtrans-58.2-42.9177.8-26.735.2000113.2L77 A126 C127 L128 S133 L134 W135L77-P131 HydrophobicContact CD2-CG 3.9Å; A126-P131 VanDerWaalsContact O-CD 3.27Å; A126-P131 WeakPolarHBondContact O-CD 3.12Å; C127-P131 WeakPolarHBondContact O-CG 3.49Å; L128-P131 WeakPolarHBondContact O-CD 3.46Å; P131-S133 VanDerWaalsContact C-N 3.35Å; P131-S133 PolarHBondContact O-N 2.94Å; P131-L134 PolarHBondContact O-N 3.1Å; P131-W135 PolarHBondContact O-N 2.59Å
132L98.8Very high98.5Very high36 Ų3646 Ų4619%0.18823%0.231CC..Hα-helixtrans-67.8-34.2-179.1-66.8-179.8000111.9L128 W129 G130 W135 V136 L150 V154L128-L132 WeakPolarHBondContact O-CB 3.37Å; L128-L132 WeakPolarHBondContact O-CG 3.14Å; L128-L132 PolarHBondContact O-N 3.13Å; W129-L132 HydrophobicContact CE3-CD1 4.12Å; W129-L132 HydrophobicContact CZ3-CD1 4.08Å; G130-L132 VanDerWaalsContact C-N 3.34Å; G130-L132 PolarHBondContact O-N 3.48Å; L132-W135 HydrophobicContact CD2-CE3 3.79Å; L132-W135 HydrophobicContact CD2-CZ3 4.31Å; L132-W135 CarbonylContact O-C 3.46Å; L132-W135 PolarHBondContact O-N 2.76Å; L132-V136 VanDerWaalsContact O-CG2 3.32Å; L132-V136 WeakPolarHBondContact O-CG2 3.34Å; L132-V136 PolarHBondContact O-N 3.33Å; L132-L150 HydrophobicContact CD2-CD2 4.14Å; L132-V154 HydrophobicContact CB-CG2 3.4Å; L132-V154 VanDerWaalsContact CB-CG2 3.4Å; L132-V154 HydrophobicContact CD1-CG2 4.28Å; L132-V154 HydrophobicContact CG-CG2 4.49Å
133S98.8Very high98.5Very high0 Ų048.4 Ų48.40%024%0.242CC..Hα-helixtrans-62.6-43.2174.2-670000111.8F69 W129 G130 P131 W135 V136 V137 V154F69-S133 WeakPolarHBondContact O-CB 3.15Å; W129-S133 WeakPolarHBondContact O-CB 3.34Å; W129-S133 PolarHBondContact O-N 3.41Å; W129-S133 PolarHBondContact O-OG 3.22Å; G130-S133 PolarHBondContact O-N 3.03Å; P131-S133 VanDerWaalsContact C-N 3.35Å; P131-S133 PolarHBondContact O-N 2.94Å; S133-W135 VanDerWaalsContact C-N 3.31Å; S133-W135 PolarHBondContact O-N 2.7Å; S133-V136 WeakPolarHBondContact O-CB 3.02Å; S133-V136 PolarHBondContact O-N 3.22Å; S133-V137 PolarHBondContact O-N 3.42Å; S133-V154 WeakPolarHBondContact OG-CG1 3.39Å
134L98.6Very high98.4Very high70 Ų7049.6 Ų49.637%0.36624%0.243SC..Hα-helixtrans-65.6-37.3174-62.1-174.2000111.5L77 G130 P131 V136 V137 I138L77-L134 HydrophobicContact CD1-CD1 3.55Å; L77-L134 HydrophobicContact CD1-CG 4.28Å; G130-L134 PolarHBondContact O-N 2.95Å; P131-L134 PolarHBondContact O-N 3.1Å; L134-V136 VanDerWaalsContact C-N 3.34Å; L134-V136 PolarHBondContact O-N 2.89Å; L134-V137 WeakPolarHBondContact O-CB 3.39Å; L134-V137 PolarHBondContact O-N 3.41Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 2.96Å; L134-I138 VanDerWaalsContact O-N 3.08Å
135W98.8Very high98.4Very high122 Ų12250.3 Ų50.346%0.46225%0.254SS..Hα-helixtrans-66-36.3174.8-164.36.6000112.2P131 L132 S133 V137 I138 A139 L150P131-W135 PolarHBondContact O-N 2.59Å; L132-W135 HydrophobicContact CD2-CE3 3.79Å; L132-W135 HydrophobicContact CD2-CZ3 4.31Å; L132-W135 CarbonylContact O-C 3.46Å; L132-W135 PolarHBondContact O-N 2.76Å; S133-W135 VanDerWaalsContact C-N 3.31Å; S133-W135 PolarHBondContact O-N 2.7Å; W135-V137 VanDerWaalsContact C-N 3.31Å; W135-V137 PolarHBondContact O-N 3.49Å; W135-I138 PolarHBondContact O-N 2.8Å; W135-A139 WeakPolarHBondContact O-CB 3.09Å; W135-A139 PolarHBondContact O-N 3.43Å; W135-L150 HydrophobicContact CB-CD1 4.44Å; W135-L150 HydrophobicContact CD2-CD1 3.88Å; W135-L150 HydrophobicContact CE3-CD1 4.33Å; W135-L150 HydrophobicContact CE3-CD2 4.26Å; W135-L150 HydrophobicContact CG-CD1 3.91Å
136V98.8Very high98.4Very high0 Ų053.3 Ų53.30%027%0.269CS..Hα-helixtrans-55.3-48.7171.4170.60000110F69 L132 S133 L134 I138 A139 F140 L150 Q151 V154F69-V136 HydrophobicContact CB-CG1 4.48Å; F69-V136 HydrophobicContact CD1-CB 4.22Å; F69-V136 HydrophobicContact CD1-CG1 4.16Å; F69-V136 HydrophobicContact CD1-CG2 4.45Å; F69-V136 HydrophobicContact CD2-CB 4.43Å; F69-V136 HydrophobicContact CD2-CG1 3.55Å; F69-V136 HydrophobicContact CE1-CG1 4.29Å; F69-V136 HydrophobicContact CE1-CG2 4.33Å; F69-V136 HydrophobicContact CE2-CG1 3.71Å; F69-V136 HydrophobicContact CG-CB 4.19Å; F69-V136 HydrophobicContact CG-CG1 3.81Å; F69-V136 HydrophobicContact CZ-CG1 4.09Å; L132-V136 VanDerWaalsContact O-CG2 3.32Å; L132-V136 WeakPolarHBondContact O-CG2 3.34Å; L132-V136 PolarHBondContact O-N 3.33Å; S133-V136 WeakPolarHBondContact O-CB 3.02Å; S133-V136 PolarHBondContact O-N 3.22Å; L134-V136 VanDerWaalsContact C-N 3.34Å; L134-V136 PolarHBondContact O-N 2.89Å; V136-I138 PolarHBondContact O-N 3.06Å; V136-A139 PolarHBondContact O-N 3.32Å; V136-F140 HydrophobicContact CG1-CD2 3.69Å; V136-F140 HydrophobicContact CG1-CE2 3.83Å; V136-F140 WeakPolarHBondContact O-CD2 3.33Å; V136-F140 PolarHBondContact O-N 2.87Å; V136-L150 HydrophobicContact CG2-CB 3.53Å; V136-Q151 HydrophobicContact CG1-CB 4.35Å; V136-V154 HydrophobicContact CG2-CG2 4.35Å
137V98.7Very high98.4Very high16 Ų1655.3 Ų55.310%0.09728%0.275CS..Hα-helixtrans-55.9-53.6177.5178.20000110.8T46 L66 F69 A70 S133 L134 W135 A139 F140 L141T46-V137 HydrophobicContact CG2-CG1 4.35Å; L66-V137 HydrophobicContact CB-CG1 4.47Å; L66-V137 WeakPolarHBondContact O-CG2 3.48Å; F69-V137 HydrophobicContact CB-CG2 3.72Å; A70-V137 HydrophobicContact CB-CG2 4.38Å; S133-V137 PolarHBondContact O-N 3.42Å; L134-V137 WeakPolarHBondContact O-CB 3.39Å; L134-V137 PolarHBondContact O-N 3.41Å; W135-V137 VanDerWaalsContact C-N 3.31Å; W135-V137 PolarHBondContact O-N 3.49Å; V137-A139 PolarHBondContact O-N 3.18Å; V137-F140 PolarHBondContact O-N 3.38Å; V137-L141 HydrophobicContact CG1-CD1 4.28Å; V137-L141 WeakPolarHBondContact O-CG 3.13Å; V137-L141 PolarHBondContact O-N 2.85Å; V137-L141 VanDerWaalsContact O-N 3.07Å
138I98.4Very high98.4Very high97 Ų9752.3 Ų52.350%0.49725%0.253SS..Hα-helixtrans-61-44.6-179-64.3165.7000111.2L134 W135 V136 F140 L141 R142L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 2.96Å; L134-I138 VanDerWaalsContact O-N 3.08Å; W135-I138 PolarHBondContact O-N 2.8Å; V136-I138 PolarHBondContact O-N 3.06Å; I138-F140 VanDerWaalsContact C-N 3.33Å; I138-F140 PolarHBondContact O-N 3.43Å; I138-L141 PolarHBondContact O-N 3.48Å; I138-R142 WeakPolarHBondContact O-CG 3.44Å; I138-R142 PolarHBondContact O-N 3Å
139A98.4Very high98.5Very high2 Ų251.1 Ų51.12%0.01725%0.249CC..Hα-helixtrans-62.2-38.9-179.400000111.8W135 V136 V137 R142 Q143 H144 R147 L150W135-A139 WeakPolarHBondContact O-CB 3.09Å; W135-A139 PolarHBondContact O-N 3.43Å; V136-A139 PolarHBondContact O-N 3.32Å; V137-A139 PolarHBondContact O-N 3.18Å; A139-R142 PolarHBondContact O-N 3.12Å; A139-Q143 PolarHBondContact O-N 2.95Å; A139-Q143 VanDerWaalsContact O-N 3.12Å; A139-H144 HydrophobicContact CB-CB 3.97Å; A139-H144 PolarHBondContact O-N 3.37Å; A139-R147 HydrophobicContact CB-CB 3.83Å; A139-L150 HydrophobicContact CB-CD1 4.13Å
140F98.5Very high98.5Very high3 Ų350.2 Ų50.21%0.01325%0.247CC..Hα-helixtrans-69.2-41.9175.1-92.6-76.8000112.9R62 L66 V136 V137 I138 R142 Q143 R147 F148 Q151R62-F140 VanDerWaalsContact CD-CE1 3.42Å; R62-F140 HydrophobicContact CG-CD1 4.14Å; R62-F140 HydrophobicContact CG-CE1 4.38Å; R62-F140 VanDerWaalsContact NE-CE1 3.32Å; L66-F140 HydrophobicContact CD1-CB 4.04Å; L66-F140 HydrophobicContact CD2-CB 3.54Å; L66-F140 HydrophobicContact CD2-CD2 3.86Å; L66-F140 HydrophobicContact CD2-CG 3.78Å; L66-F140 HydrophobicContact CG-CB 4.42Å; V136-F140 HydrophobicContact CG1-CD2 3.69Å; V136-F140 HydrophobicContact CG1-CE2 3.83Å; V136-F140 WeakPolarHBondContact O-CD2 3.33Å; V136-F140 PolarHBondContact O-N 2.87Å; V137-F140 PolarHBondContact O-N 3.38Å; I138-F140 VanDerWaalsContact C-N 3.33Å; I138-F140 PolarHBondContact O-N 3.43Å; F140-R142 PolarHBondContact O-N 3.27Å; F140-Q143 PolarHBondContact O-N 2.56Å; F140-Q143 PolarHBondContact O-NE2 2.87Å; F140-R147 HydrophobicContact CD1-CB 4.24Å; F140-R147 HydrophobicContact CD1-CG 4.13Å; F140-R147 HydrophobicContact CD2-CB 3.78Å; F140-R147 HydrophobicContact CD2-CG 4.47Å; F140-R147 HydrophobicContact CE1-CB 4.28Å; F140-R147 HydrophobicContact CE1-CG 3.93Å; F140-R147 HydrophobicContact CE2-CB 3.83Å; F140-R147 HydrophobicContact CE2-CG 4.28Å; F140-R147 WeakPolarHBondContact CE2-O 3.43Å; F140-R147 HydrophobicContact CG-CB 3.99Å; F140-R147 HydrophobicContact CG-CG 4.39Å; F140-R147 HydrophobicContact CZ-CB 4.09Å; F140-R147 HydrophobicContact CZ-CG 4.01Å; F140-F148 HydrophobicContact CE1-CD1 4.37Å; F140-F148 AromaticContact CE1-CE1 3.86Å; F140-F148 HydrophobicContact CE1-CE1 3.86Å; F140-F148 HydrophobicContact CE1-CE2 4.37Å; F140-F148 AromaticContact CE1-CZ 3.83Å; F140-F148 HydrophobicContact CE1-CZ 3.83Å; F140-F148 AromaticContact CZ-CD1 3.77Å; F140-F148 HydrophobicContact CZ-CD1 3.77Å; F140-F148 AromaticContact CZ-CE1 3.63Å; F140-F148 HydrophobicContact CZ-CE1 3.63Å; F140-F148 HydrophobicContact CZ-CG 4.36Å; F140-F148 HydrophobicContact CZ-CZ 4.07Å; F140-Q151 HydrophobicContact CE2-CB 4.23Å
141L98.2Very high98.5Very high22 Ų2250.2 Ų50.212%0.11525%0.247CC..Hα-helixtrans-59.5-33.5175.6-65.7177.8000111.7A54 V55 L58 L66 V137 I138A54-L141 WeakPolarHBondContact CA-O 3.38Å; A54-L141 HydrophobicContact CB-CD2 4.02Å; V55-L141 PolarHBondContact N-O 2.75Å; L58-L141 HydrophobicContact CD1-CD2 4.41Å; L66-L141 HydrophobicContact CD1-CD2 3.87Å; L66-L141 HydrophobicContact CD1-CG 4.26Å; V137-L141 HydrophobicContact CG1-CD1 4.28Å; V137-L141 WeakPolarHBondContact O-CG 3.13Å; V137-L141 PolarHBondContact O-N 2.85Å; V137-L141 VanDerWaalsContact O-N 3.07Å; I138-L141 PolarHBondContact O-N 3.48Å
142R97.9Very high98.5Very high172 Ų17249.5 Ų49.565%0.64924%0.24SC*.THydrogen-bonded Turntrans-964.9-178.5-58.9-58.9-175.41560.7114.9I138 A139 F140 H144I138-R142 WeakPolarHBondContact O-CG 3.44Å; I138-R142 PolarHBondContact O-N 3Å; A139-R142 PolarHBondContact O-N 3.12Å; F140-R142 PolarHBondContact O-N 3.27Å; R142-H144 PolarHBondContact O-N 2.63Å
143Q96.9Very high98.5Very high58 Ų5851.1 Ų51.127%0.27125%0.251SS..THydrogen-bonded Turntrans50.535.6-172.3-75.1-59.5-46.500114.1V56 A139 F140 R147V56-Q143 HydrophobicContact CB-CG 4.16Å; V56-Q143 HydrophobicContact CG1-CG 3.83Å; V56-Q143 VanDerWaalsContact CG2-CD 3.41Å; V56-Q143 HydrophobicContact CG2-CG 3.31Å; V56-Q143 VanDerWaalsContact CG2-NE2 3.3Å; A139-Q143 PolarHBondContact O-N 2.95Å; A139-Q143 VanDerWaalsContact O-N 3.12Å; F140-Q143 PolarHBondContact O-N 2.56Å; F140-Q143 PolarHBondContact O-NE2 2.87Å; Q143-R147 VanDerWaalsContact OE1-NH2 3.12Å
144H98.3Very high98.5Very high79 Ų7951.1 Ų51.137%0.36625%0.251SS..  trans-66.8137.4-178.9-166-92.5000110.7A139 R142 L146 R147A139-H144 HydrophobicContact CB-CB 3.97Å; A139-H144 PolarHBondContact O-N 3.37Å; R142-H144 PolarHBondContact O-N 2.63Å; H144-L146 WeakPolarHBondContact ND1-CB 3.23Å; H144-L146 PolarHBondContact ND1-N 3.32Å; H144-L146 PolarHBondContact O-N 3.27Å; H144-L146 VanDerWaalsContact O-N 3.1Å; H144-R147 WeakPolarHBondContact O-CB 3.2Å; H144-R147 WeakPolarHBondContact O-CD 3.27Å; H144-R147 WeakPolarHBondContact O-CG 3.44Å; H144-R147 PolarHBondContact O-N 3.38Å
145P98Very high98.5Very high100 Ų10047.8 Ų47.865%0.64923%0.233SC*.THydrogen-bonded Turntrans-55.3-34-177.2-28.135.4000113.8R147P145-R147 VanDerWaalsContact C-N 3.28Å; P145-R147 PolarHBondContact O-N 2.92Å
146L98.4Very high98.5Very high75 Ų7545.4 Ų45.439%0.39323%0.232SC..THydrogen-bonded Turntrans-72.1-11.4-179.5-60.8179.1000114.8H144 F148 V149 L150H144-L146 WeakPolarHBondContact ND1-CB 3.23Å; H144-L146 PolarHBondContact ND1-N 3.32Å; H144-L146 PolarHBondContact O-N 3.27Å; H144-L146 VanDerWaalsContact O-N 3.1Å; L146-F148 VanDerWaalsContact C-N 3.28Å; L146-F148 PolarHBondContact O-N 3.47Å; L146-F148 VanDerWaalsContact O-N 3.12Å; L146-V149 WeakPolarHBondContact O-CA 3.34Å; L146-V149 WeakPolarHBondContact O-CB 3.47Å; L146-V149 PolarHBondContact O-N 3.4Å; L146-L150 HydrophobicContact CB-CD1 4.23Å; L146-L150 HydrophobicContact CB-CG 4.24Å; L146-L150 WeakPolarHBondContact O-CG 3.28Å; L146-L150 PolarHBondContact O-N 3.49Å
147R98.6Very high98.5Very high49 Ų4945.8 Ų45.819%0.18524%0.236CC..Hα-helixtrans-52-40.1-173.165.4-162165.5-15.59.1114.5A139 F140 Q143 H144 P145 Q151A139-R147 HydrophobicContact CB-CB 3.83Å; F140-R147 HydrophobicContact CD1-CB 4.24Å; F140-R147 HydrophobicContact CD1-CG 4.13Å; F140-R147 HydrophobicContact CD2-CB 3.78Å; F140-R147 HydrophobicContact CD2-CG 4.47Å; F140-R147 HydrophobicContact CE1-CB 4.28Å; F140-R147 HydrophobicContact CE1-CG 3.93Å; F140-R147 HydrophobicContact CE2-CB 3.83Å; F140-R147 HydrophobicContact CE2-CG 4.28Å; F140-R147 WeakPolarHBondContact CE2-O 3.43Å; F140-R147 HydrophobicContact CG-CB 3.99Å; F140-R147 HydrophobicContact CG-CG 4.39Å; F140-R147 HydrophobicContact CZ-CB 4.09Å; F140-R147 HydrophobicContact CZ-CG 4.01Å; Q143-R147 VanDerWaalsContact OE1-NH2 3.12Å; H144-R147 WeakPolarHBondContact O-CB 3.2Å; H144-R147 WeakPolarHBondContact O-CD 3.27Å; H144-R147 WeakPolarHBondContact O-CG 3.44Å; H144-R147 PolarHBondContact O-N 3.38Å; P145-R147 VanDerWaalsContact C-N 3.28Å; P145-R147 PolarHBondContact O-N 2.92Å; R147-Q151 WeakPolarHBondContact O-CB 3.42Å; R147-Q151 PolarHBondContact O-N 2.86Å
148F98.6Very high98.5Very high17 Ų1745.4 Ų45.48%0.07523%0.233CC..Hα-helixtrans-79.8-30178.1-74.4-64.2000112.9F140 L146 L152 A207 H210 L211F140-F148 HydrophobicContact CE1-CD1 4.37Å; F140-F148 AromaticContact CE1-CE1 3.86Å; F140-F148 HydrophobicContact CE1-CE1 3.86Å; F140-F148 HydrophobicContact CE1-CE2 4.37Å; F140-F148 AromaticContact CE1-CZ 3.83Å; F140-F148 HydrophobicContact CE1-CZ 3.83Å; F140-F148 AromaticContact CZ-CD1 3.77Å; F140-F148 HydrophobicContact CZ-CD1 3.77Å; F140-F148 AromaticContact CZ-CE1 3.63Å; F140-F148 HydrophobicContact CZ-CE1 3.63Å; F140-F148 HydrophobicContact CZ-CG 4.36Å; F140-F148 HydrophobicContact CZ-CZ 4.07Å; L146-F148 VanDerWaalsContact C-N 3.28Å; L146-F148 PolarHBondContact O-N 3.47Å; L146-F148 VanDerWaalsContact O-N 3.12Å; F148-L152 VanDerWaalsContact O-CB 3.27Å; F148-L152 WeakPolarHBondContact O-CB 3.42Å; F148-L152 PolarHBondContact O-N 2.94Å; F148-A207 HydrophobicContact CB-CB 4.48Å; F148-A207 HydrophobicContact CD1-CB 4.23Å; F148-H210 HydrophobicContact CD1-CB 4.06Å; F148-H210 HydrophobicContact CD2-CB 3.93Å; F148-H210 HydrophobicContact CE1-CB 3.86Å; F148-H210 AromaticContact CE1-CD2 3.85Å; F148-H210 AromaticContact CE1-CG 3.69Å; F148-H210 HydrophobicContact CE2-CB 3.78Å; F148-H210 AromaticContact CE2-CD2 3.69Å; F148-H210 AromaticContact CE2-CG 3.95Å; F148-H210 HydrophobicContact CG-CB 4.1Å; F148-H210 HydrophobicContact CZ-CB 3.75Å; F148-H210 AromaticContact CZ-CD2 3.19Å; F148-H210 WeakPolarHBondContact CZ-CD2 3.47Å; F148-H210 AromaticContact CZ-CG 3.48Å; F148-H210 VanDerWaalsContact CZ-CG 3.48Å; F148-H210 AromaticContact CZ-NE2 3.85Å; F148-L211 HydrophobicContact CB-CD1 4.25Å; F148-L211 HydrophobicContact CB-CD2 3.82Å; F148-L211 HydrophobicContact CB-CG 3.86Å
149V98.8Very high98.5Very high62 Ų6242.9 Ų42.938%0.37622%0.22SC..Hα-helixtrans-67.7-46.4173.3178.80000109.7L146 L152 V153 L211L146-V149 WeakPolarHBondContact O-CA 3.34Å; L146-V149 WeakPolarHBondContact O-CB 3.47Å; L146-V149 PolarHBondContact O-N 3.4Å; V149-L152 PolarHBondContact O-N 3.29Å; V149-V153 HydrophobicContact CG1-CG2 4.37Å; V149-V153 WeakPolarHBondContact O-CB 3.38Å; V149-V153 VanDerWaalsContact O-CG2 3.3Å; V149-V153 WeakPolarHBondContact O-CG2 3.44Å; V149-V153 PolarHBondContact O-N 3.25Å; V149-L211 HydrophobicContact CG2-CD2 4.09Å
150L98.8Very high98.5Very high17 Ų1750.1 Ų50.19%0.08925%0.248CC..Hα-helixtrans-61.9-46.6176.3-67.4173.3000111.5L132 W135 V136 A139 L146 L152 V153 V154L132-L150 HydrophobicContact CD2-CD2 4.14Å; W135-L150 HydrophobicContact CB-CD1 4.44Å; W135-L150 HydrophobicContact CD2-CD1 3.88Å; W135-L150 HydrophobicContact CE3-CD1 4.33Å; W135-L150 HydrophobicContact CE3-CD2 4.26Å; W135-L150 HydrophobicContact CG-CD1 3.91Å; V136-L150 HydrophobicContact CG2-CB 3.53Å; A139-L150 HydrophobicContact CB-CD1 4.13Å; L146-L150 HydrophobicContact CB-CD1 4.23Å; L146-L150 HydrophobicContact CB-CG 4.24Å; L146-L150 WeakPolarHBondContact O-CG 3.28Å; L146-L150 PolarHBondContact O-N 3.49Å; L150-L152 VanDerWaalsContact C-N 3.31Å; L150-L152 PolarHBondContact O-N 3.28Å; L150-V153 PolarHBondContact O-N 3.03Å; L150-V154 WeakPolarHBondContact O-CB 3.24Å; L150-V154 WeakPolarHBondContact O-CG2 3.48Å; L150-V154 PolarHBondContact O-N 2.72Å
151Q98.9Very high98.6Very high0 Ų050.4 Ų50.40%025%0.252CS..Hα-helixtrans-55.4-48.3174.3174.1175.5-5800110.9F69 V136 F140 R147 S155 L203 D206 A207F69-Q151 HydrophobicContact CE2-CB 4.43Å; F69-Q151 HydrophobicContact CE2-CG 3.9Å; F69-Q151 HydrophobicContact CZ-CB 4.25Å; F69-Q151 HydrophobicContact CZ-CG 3.8Å; V136-Q151 HydrophobicContact CG1-CB 4.35Å; F140-Q151 HydrophobicContact CE2-CB 4.23Å; R147-Q151 WeakPolarHBondContact O-CB 3.42Å; R147-Q151 PolarHBondContact O-N 2.86Å; Q151-S155 WeakPolarHBondContact O-CB 3.2Å; Q151-S155 PolarHBondContact O-N 3.36Å; Q151-S155 PolarHBondContact O-OG 2.99Å; Q151-L203 HydrophobicContact CG-CB 4.16Å; Q151-L203 PolarHBondContact NE2-O 3.43Å; Q151-D206 PolarHBondContact NE2-OD2 2.81Å; Q151-A207 HydrophobicContact CG-CB 4.31Å
152L98.9Very high98.6Very high43 Ų4350 Ų5023%0.22525%0.25CC..Hα-helixtrans-60.3-50179.2-177.965.5000111.7F148 V149 L150 S155 V156 V204 A207 V208 L211F148-L152 VanDerWaalsContact O-CB 3.27Å; F148-L152 WeakPolarHBondContact O-CB 3.42Å; F148-L152 PolarHBondContact O-N 2.94Å; V149-L152 PolarHBondContact O-N 3.29Å; L150-L152 VanDerWaalsContact C-N 3.31Å; L150-L152 PolarHBondContact O-N 3.28Å; L152-S155 PolarHBondContact O-N 3.39Å; L152-V156 HydrophobicContact CD1-CG2 4.14Å; L152-V156 HydrophobicContact CG-CG2 4.49Å; L152-V156 WeakPolarHBondContact O-CB 3.29Å; L152-V156 VanDerWaalsContact O-CG2 3.26Å; L152-V156 WeakPolarHBondContact O-CG2 3.38Å; L152-V156 PolarHBondContact O-N 2.95Å; L152-V204 HydrophobicContact CD1-CB 4.24Å; L152-V204 HydrophobicContact CD1-CG1 3.79Å; L152-V204 HydrophobicContact CD1-CG2 4.2Å; L152-A207 HydrophobicContact CB-CB 3.97Å; L152-A207 HydrophobicContact CD1-CB 4.38Å; L152-V208 HydrophobicContact CD1-CG2 3.91Å; L152-L211 HydrophobicContact CD2-CD1 4.06Å
153V98.9Very high98.6Very high69 Ų6944.6 Ų44.642%0.41824%0.236SC..Hα-helixtrans-61.7-49.3-177.61680000111.3W129 V149 L150 V156 G157W129-V153 HydrophobicContact CZ3-CG1 4.09Å; V149-V153 HydrophobicContact CG1-CG2 4.37Å; V149-V153 WeakPolarHBondContact O-CB 3.38Å; V149-V153 VanDerWaalsContact O-CG2 3.3Å; V149-V153 WeakPolarHBondContact O-CG2 3.44Å; V149-V153 PolarHBondContact O-N 3.25Å; L150-V153 PolarHBondContact O-N 3.03Å; V153-V156 PolarHBondContact O-N 3.11Å; V153-G157 PolarHBondContact O-N 2.92Å
154V98.9Very high98.7Very high0 Ų044.2 Ų44.20%024%0.236CC..Hα-helixtrans-63.1-46.7179.3175.20000110.5F69 W129 L132 S133 V136 L150 V156 G157 Q158F69-V154 HydrophobicContact CD1-CG1 4.42Å; F69-V154 HydrophobicContact CE1-CB 4.16Å; F69-V154 HydrophobicContact CE1-CG1 3.82Å; W129-V154 HydrophobicContact CB-CG1 4.45Å; W129-V154 HydrophobicContact CE3-CG2 4.39Å; L132-V154 HydrophobicContact CB-CG2 3.4Å; L132-V154 VanDerWaalsContact CB-CG2 3.4Å; L132-V154 HydrophobicContact CD1-CG2 4.28Å; L132-V154 HydrophobicContact CG-CG2 4.49Å; S133-V154 WeakPolarHBondContact OG-CG1 3.39Å; V136-V154 HydrophobicContact CG2-CG2 4.35Å; L150-V154 WeakPolarHBondContact O-CB 3.24Å; L150-V154 WeakPolarHBondContact O-CG2 3.48Å; L150-V154 PolarHBondContact O-N 2.72Å; V154-V156 PolarHBondContact O-N 3.16Å; V154-G157 PolarHBondContact O-N 3.48Å; V154-Q158 HydrophobicContact CG1-CG 4.37Å; V154-Q158 WeakPolarHBondContact O-CG 3.32Å; V154-Q158 PolarHBondContact O-N 2.87Å
155S98.9Very high98.7Very high0 Ų040.5 Ų40.50%022%0.218CC..Hα-helixtrans-65.9-38.3-178.4-65.50000112.8Q151 L152 I159Q151-S155 WeakPolarHBondContact O-CB 3.2Å; Q151-S155 PolarHBondContact O-N 3.36Å; Q151-S155 PolarHBondContact O-OG 2.99Å; L152-S155 PolarHBondContact O-N 3.39Å; S155-I159 WeakPolarHBondContact O-CD1 3.22Å; S155-I159 VanDerWaalsContact O-CG1 3.24Å; S155-I159 WeakPolarHBondContact O-CG1 3.3Å; S155-I159 PolarHBondContact O-N 3.07Å; S155-I159 VanDerWaalsContact O-N 3.1Å
156V98.9Very high98.8Very high73 Ų7337.7 Ų37.744%0.44220%0.196SC..Hα-helixtrans-65.5-42.2172.91700000111.1L152 V153 V154 I159 Y160 V204L152-V156 HydrophobicContact CD1-CG2 4.14Å; L152-V156 HydrophobicContact CG-CG2 4.49Å; L152-V156 WeakPolarHBondContact O-CB 3.29Å; L152-V156 VanDerWaalsContact O-CG2 3.26Å; L152-V156 WeakPolarHBondContact O-CG2 3.38Å; L152-V156 PolarHBondContact O-N 2.95Å; V153-V156 PolarHBondContact O-N 3.11Å; V154-V156 PolarHBondContact O-N 3.16Å; V156-I159 PolarHBondContact O-N 2.97Å; V156-Y160 WeakPolarHBondContact O-CB 3.36Å; V156-Y160 PolarHBondContact O-N 3.13Å; V156-V204 HydrophobicContact CG2-CG2 3.8Å
157G98.6Very high98.8Very high8 Ų838.3 Ų38.38%0.08220%0.199CC..Hα-helixtrans-60.2-44177.100000112.9V153 V154 Y160 G161V153-G157 PolarHBondContact O-N 2.92Å; V154-G157 PolarHBondContact O-N 3.48Å; G157-Y160 PolarHBondContact O-N 3.36Å; G157-G161 PolarHBondContact O-N 2.94Å
158Q98.8Very high98.8Very high8 Ų837.5 Ų37.54%0.03720%0.2CC..Hα-helixtrans-60.1-50.7174.9-73.5171.3-21.300111.5H76 V154 Y160 G161 D162 P200H76-Q158 PolarHBondContact NE2-NE2 2.92Å; V154-Q158 HydrophobicContact CG1-CG 4.37Å; V154-Q158 WeakPolarHBondContact O-CG 3.32Å; V154-Q158 PolarHBondContact O-N 2.87Å; Q158-Y160 VanDerWaalsContact C-N 3.31Å; Q158-Y160 PolarHBondContact O-N 3.19Å; Q158-G161 PolarHBondContact O-N 3.31Å; Q158-D162 VanDerWaalsContact O-CB 3.29Å; Q158-D162 WeakPolarHBondContact O-CB 3.48Å; Q158-D162 PolarHBondContact O-N 3.18Å; Q158-P200 HydrophobicContact CB-CB 4.4Å; Q158-P200 HydrophobicContact CB-CG 4.2Å; Q158-P200 VanDerWaalsContact OE1-CG 3.24Å
159I98.9Very high98.7Very high43 Ų4336.9 Ų36.922%0.22120%0.197CC..Hα-helixtrans-60-44.1177.9-65.4162.5000110.7S155 V156 D162 V163 L197 P200 V204S155-I159 WeakPolarHBondContact O-CD1 3.22Å; S155-I159 VanDerWaalsContact O-CG1 3.24Å; S155-I159 WeakPolarHBondContact O-CG1 3.3Å; S155-I159 PolarHBondContact O-N 3.07Å; S155-I159 VanDerWaalsContact O-N 3.1Å; V156-I159 PolarHBondContact O-N 2.97Å; I159-D162 PolarHBondContact O-N 3.27Å; I159-V163 HydrophobicContact CG2-CG2 4.13Å; I159-V163 WeakPolarHBondContact O-CB 3.3Å; I159-V163 VanDerWaalsContact O-CG2 3.22Å; I159-V163 WeakPolarHBondContact O-CG2 3.25Å; I159-V163 PolarHBondContact O-N 3.1Å; I159-L197 HydrophobicContact CG2-CD2 4.13Å; I159-P200 HydrophobicContact CD1-CB 4.11Å; I159-P200 HydrophobicContact CG1-CB 3.88Å; I159-V204 HydrophobicContact CD1-CG2 3.98Å
160Y98.8Very high98.7Very high154 Ų15439.3 Ų39.360%0.60420%0.204SC*.Hα-helixtrans-65-46.2-177.5178.3-126.2000112.1V156 G157 Q158 D162 L164V156-Y160 WeakPolarHBondContact O-CB 3.36Å; V156-Y160 PolarHBondContact O-N 3.13Å; G157-Y160 PolarHBondContact O-N 3.36Å; Q158-Y160 VanDerWaalsContact C-N 3.31Å; Q158-Y160 PolarHBondContact O-N 3.19Å; Y160-D162 VanDerWaalsContact C-N 3.34Å; Y160-D162 PolarHBondContact O-N 3.17Å; Y160-L164 HydrophobicContact CD1-CD1 4.49Å; Y160-L164 HydrophobicContact CD2-CD1 4.35Å; Y160-L164 HydrophobicContact CD2-CG 4.33Å; Y160-L164 HydrophobicContact CE1-CD1 3.93Å; Y160-L164 HydrophobicContact CE2-CD1 3.77Å; Y160-L164 HydrophobicContact CE2-CD2 4.33Å; Y160-L164 HydrophobicContact CE2-CG 3.94Å; Y160-L164 WeakPolarHBondContact O-CG 3.27Å; Y160-L164 PolarHBondContact O-N 2.74Å; Y160-L164 VanDerWaalsContact O-N 3.08Å
161G98.6Very high98.7Very high10 Ų1048 Ų4810%0.10324%0.236CC..Hα-helixtrans-58.5-47.6175.100000111.6G157 Q158 L164 Y165G157-G161 PolarHBondContact O-N 2.94Å; Q158-G161 PolarHBondContact O-N 3.31Å; G161-L164 CarbonylContact O-C 3.51Å; G161-L164 WeakPolarHBondContact O-CB 3.41Å; G161-L164 PolarHBondContact O-N 3.31Å; G161-L164 VanDerWaalsContact O-N 3.16Å; G161-Y165 PolarHBondContact O-N 3.27Å
162D98.6Very high98.6Very high12 Ų1250.9 Ų50.96%0.06425%0.251CS..Hα-helixtrans-71.7-35.6-175.4-163.723.1000113.1Q158 I159 Y160 L164 Y165 F166 L197Q158-D162 VanDerWaalsContact O-CB 3.29Å; Q158-D162 WeakPolarHBondContact O-CB 3.48Å; Q158-D162 PolarHBondContact O-N 3.18Å; I159-D162 PolarHBondContact O-N 3.27Å; Y160-D162 VanDerWaalsContact C-N 3.34Å; Y160-D162 PolarHBondContact O-N 3.17Å; D162-L164 VanDerWaalsContact C-N 3.32Å; D162-L164 PolarHBondContact O-N 3.35Å; D162-Y165 WeakPolarHBondContact O-CB 3.31Å; D162-Y165 PolarHBondContact O-N 2.7Å; D162-F166 WeakPolarHBondContact O-CD2 3.25Å; D162-F166 PolarHBondContact O-N 2.82Å; D162-L197 HydrophobicContact CB-CD2 3.87Å; D162-L197 HydrophobicContact CB-CG 4.47Å; D162-L197 WeakPolarHBondContact OD2-CG 3.25Å
163V98.8Very high98.6Very high59 Ų5951.4 Ų51.436%0.35827%0.267SS..Hα-helixtrans-60.3-44168.9167.40000110.7I159 F166 L167 L197I159-V163 HydrophobicContact CG2-CG2 4.13Å; I159-V163 WeakPolarHBondContact O-CB 3.3Å; I159-V163 VanDerWaalsContact O-CG2 3.22Å; I159-V163 WeakPolarHBondContact O-CG2 3.25Å; I159-V163 PolarHBondContact O-N 3.1Å; V163-F166 PolarHBondContact O-N 2.92Å; V163-L167 HydrophobicContact CG1-CD1 3.75Å; V163-L167 HydrophobicContact CG1-CG 4.29Å; V163-L167 WeakPolarHBondContact O-CB 3.36Å; V163-L167 VanDerWaalsContact O-CG 3.24Å; V163-L167 WeakPolarHBondContact O-CG 3.27Å; V163-L167 PolarHBondContact O-N 3.42Å; V163-L197 HydrophobicContact CG2-CD2 3.7Å
164L98.8Very high98.5Very high50 Ų5050.6 Ų50.626%0.26226%0.258SS..Hα-helixtrans-64.9-40.4176-73.1179.9000111.6F117 Y160 G161 D162 F166 L167 T168F117-L164 HydrophobicContact CE1-CB 4.34Å; F117-L164 HydrophobicContact CE2-CB 3.82Å; F117-L164 HydrophobicContact CE2-CD1 3.97Å; F117-L164 HydrophobicContact CZ-CB 3.41Å; F117-L164 VanDerWaalsContact CZ-CB 3.41Å; F117-L164 HydrophobicContact CZ-CD1 4.31Å; Y160-L164 HydrophobicContact CD1-CD1 4.49Å; Y160-L164 HydrophobicContact CD2-CD1 4.35Å; Y160-L164 HydrophobicContact CD2-CG 4.33Å; Y160-L164 HydrophobicContact CE1-CD1 3.93Å; Y160-L164 HydrophobicContact CE2-CD1 3.77Å; Y160-L164 HydrophobicContact CE2-CD2 4.33Å; Y160-L164 HydrophobicContact CE2-CG 3.94Å; Y160-L164 WeakPolarHBondContact O-CG 3.27Å; Y160-L164 PolarHBondContact O-N 2.74Å; Y160-L164 VanDerWaalsContact O-N 3.08Å; G161-L164 CarbonylContact O-C 3.51Å; G161-L164 WeakPolarHBondContact O-CB 3.41Å; G161-L164 PolarHBondContact O-N 3.31Å; G161-L164 VanDerWaalsContact O-N 3.16Å; D162-L164 VanDerWaalsContact C-N 3.32Å; D162-L164 PolarHBondContact O-N 3.35Å; L164-F166 PolarHBondContact O-N 3.43Å; L164-L167 PolarHBondContact O-N 2.98Å; L164-T168 WeakPolarHBondContact O-CG2 3.43Å; L164-T168 PolarHBondContact O-N 2.95Å; L164-T168 PolarHBondContact O-OG1 2.99Å
165Y98.7Very high98.5Very high1 Ų154.9 Ų54.90%0.00428%0.278CS..Hα-helixtrans-56.6-46.2175.8172.9-101.7000112.8Y104 D108 Y111 M121 G161 D162 T168 E169 F189 N193Y104-Y165 PolarHBondContact OH-OH 3.23Å; D108-Y165 WeakPolarHBondContact OD2-CE2 3.44Å; D108-Y165 PolarHBondContact OD2-OH 3.43Å; Y111-Y165 AromaticContact CE2-CE2 3.98Å; Y111-Y165 HydrophobicContact CE2-CE2 3.98Å; M121-Y165 HydrophobicContact CE-CD2 4.19Å; G161-Y165 PolarHBondContact O-N 3.27Å; D162-Y165 WeakPolarHBondContact O-CB 3.31Å; D162-Y165 PolarHBondContact O-N 2.7Å; Y165-T168 PolarHBondContact O-OG1 3.43Å; Y165-E169 PolarHBondContact O-N 3.33Å; Y165-F189 HydrophobicContact CD1-CE2 4.33Å; Y165-F189 AromaticContact CE1-CD2 3.82Å; Y165-F189 HydrophobicContact CE1-CD2 3.82Å; Y165-F189 AromaticContact CE1-CE2 3.45Å; Y165-F189 HydrophobicContact CE1-CE2 3.45Å; Y165-F189 VanDerWaalsContact CE1-CE2 3.45Å; Y165-F189 HydrophobicContact CE1-CZ 4.18Å; Y165-F189 AromaticContact CZ-CD2 3.86Å; Y165-F189 AromaticContact CZ-CE2 3.63Å; Y165-F189 VanDerWaalsContact OH-CD2 3.26Å; Y165-F189 WeakPolarHBondContact OH-CD2 3.28Å; Y165-F189 WeakPolarHBondContact OH-CE2 3.01Å; Y165-N193 HydrophobicContact CE1-CB 4.48Å; Y165-N193 WeakPolarHBondContact CE1-ND2 3.35Å
166F98.7Very high98.4Very high42 Ų4256 Ų5618%0.18428%0.283CS..Hα-helixtrans-67-42.9173.9-78.5-62.9000112.6D162 V163 L164 E169 H170 F189 N193 L197D162-F166 WeakPolarHBondContact O-CD2 3.25Å; D162-F166 PolarHBondContact O-N 2.82Å; V163-F166 PolarHBondContact O-N 2.92Å; L164-F166 PolarHBondContact O-N 3.43Å; F166-E169 PolarHBondContact O-N 3.49Å; F166-H170 WeakPolarHBondContact O-CB 3.31Å; F166-H170 PolarHBondContact O-N 2.86Å; F166-F189 HydrophobicContact CD1-CD1 4.43Å; F166-F189 AromaticContact CD1-CE1 3.54Å; F166-F189 HydrophobicContact CD1-CE1 3.54Å; F166-F189 AromaticContact CD1-CZ 3.64Å; F166-F189 HydrophobicContact CD1-CZ 3.64Å; F166-F189 HydrophobicContact CE1-CD1 4.01Å; F166-F189 AromaticContact CE1-CE1 3.56Å; F166-F189 HydrophobicContact CE1-CE1 3.56Å; F166-F189 AromaticContact CE1-CZ 3.96Å; F166-F189 HydrophobicContact CE1-CZ 3.96Å; F166-F189 WeakPolarHBondContact CE1-O 3.23Å; F166-N193 HydrophobicContact CE1-CB 4.41Å; F166-N193 HydrophobicContact CE2-CB 3.82Å; F166-N193 HydrophobicContact CZ-CB 3.51Å; F166-L197 HydrophobicContact CD2-CD1 4.09Å; F166-L197 HydrophobicContact CE2-CD1 3.85Å; F166-L197 HydrophobicContact CE2-CG 4.42Å
167L98.7Very high98.3Very high87 Ų8752.7 Ų52.746%0.45526%0.264SS..Hα-helixtrans-67.5-38.2-177.5-75.7175.4000112.5V163 L164 R171V163-L167 HydrophobicContact CG1-CD1 3.75Å; V163-L167 HydrophobicContact CG1-CG 4.29Å; V163-L167 WeakPolarHBondContact O-CB 3.36Å; V163-L167 VanDerWaalsContact O-CG 3.24Å; V163-L167 WeakPolarHBondContact O-CG 3.27Å; V163-L167 PolarHBondContact O-N 3.42Å; L164-L167 PolarHBondContact O-N 2.98Å; L167-R171 WeakPolarHBondContact O-CB 3.28Å; L167-R171 VanDerWaalsContact O-CG 3.28Å; L167-R171 WeakPolarHBondContact O-CG 3.38Å; L167-R171 PolarHBondContact O-N 3.46Å
168T98.6Very high98.2Very high33 Ų3357.2 Ų57.220%0.20228%0.283CS..Hα-helixtrans-63.9-48176.5510000110.4R110 F117 L164 Y165 H170 R171 D172R110-T168 PolarHBondContact NH1-OG1 3.3Å; F117-T168 HydrophobicContact CD1-CG2 4Å; F117-T168 HydrophobicContact CD2-CG2 4.43Å; F117-T168 HydrophobicContact CE1-CG2 4.34Å; F117-T168 HydrophobicContact CG-CG2 4.06Å; L164-T168 WeakPolarHBondContact O-CG2 3.43Å; L164-T168 PolarHBondContact O-N 2.95Å; L164-T168 PolarHBondContact O-OG1 2.99Å; Y165-T168 PolarHBondContact O-OG1 3.43Å; T168-H170 PolarHBondContact O-N 3.04Å; T168-R171 PolarHBondContact O-N 2.6Å; T168-D172 WeakPolarHBondContact O-CB 3.19Å; T168-D172 PolarHBondContact O-N 3.2Å
169E98.3Very high98.1Very high4 Ų462 Ų622%0.01931%0.309CS..Hα-helixtrans-67.1-37.8179-168.653.6-156.900112.7R110 Y165 F166 R171 D172 G173 F174 Q175 H176 F189R110-E169 WeakPolarHBondContact CD-OE2 3.18Å; R110-E169 IonicContact CZ-OE2 2.95Å; R110-E169 IonicContact NE-OE2 2.7Å; R110-E169 PolarHBondContact NE-OE2 2.9Å; R110-E169 IonicContact NH1-OE2 3.1Å; R110-E169 PolarHBondContact NH1-OE2 2.89Å; R110-E169 IonicContact NH2-OE2 2.8Å; Y165-E169 PolarHBondContact O-N 3.33Å; F166-E169 PolarHBondContact O-N 3.49Å; E169-R171 VanDerWaalsContact C-N 3.33Å; E169-R171 PolarHBondContact O-N 2.92Å; E169-D172 CarbonylContact O-C 3.59Å; E169-D172 PolarHBondContact O-N 3.03Å; E169-G173 PolarHBondContact O-N 3.04Å; E169-G173 VanDerWaalsContact O-N 3.15Å; E169-F174 HydrophobicContact CG-CD1 3.78Å; E169-F174 HydrophobicContact CG-CE1 4.37Å; E169-F174 PolarHBondContact O-N 3.08Å; E169-F174 WeakPolarHBondContact OE1-CA 3.25Å; E169-Q175 PolarHBondContact OE1-N 3.01Å; E169-H176 WeakPolarHBondContact OE1-CB 3.44Å; E169-H176 IonicContact OE1-CG 3.97Å; E169-H176 PolarHBondContact OE1-N 2.9Å; E169-H176 IonicContact OE1-ND1 2.82Å; E169-H176 PolarHBondContact OE1-ND1 3.48Å; E169-H176 IonicContact OE2-CE1 3.21Å; E169-H176 IonicContact OE2-CG 3.9Å; E169-H176 IonicContact OE2-ND1 2.69Å; E169-H176 PolarHBondContact OE2-ND1 2.99Å; E169-F189 HydrophobicContact CB-CE2 4Å; E169-F189 HydrophobicContact CB-CZ 3.76Å; E169-F189 HydrophobicContact CG-CE2 3.82Å; E169-F189 HydrophobicContact CG-CZ 3.74Å
170H98.3Very high98Very high112 Ų11261.7 Ų61.752%0.51932%0.316SS..Hα-helixtrans-61.1-43.8174.8175.256000111.6F166 T168 D172 G173 F174F166-H170 WeakPolarHBondContact O-CB 3.31Å; F166-H170 PolarHBondContact O-N 2.86Å; T168-H170 PolarHBondContact O-N 3.04Å; H170-D172 VanDerWaalsContact C-N 3.27Å; H170-D172 PolarHBondContact O-N 3.11Å; H170-G173 PolarHBondContact O-N 3.19Å; H170-F174 HydrophobicContact CB-CE2 4.45Å; H170-F174 HydrophobicContact CB-CZ 4.01Å; H170-F174 AromaticContact ND1-CE2 3.56Å; H170-F174 AromaticContact ND1-CZ 3.8Å
171R98.4Very high97.9Very high201 Ų20156.8 Ų56.876%0.75830%0.298SS*.Hα-helixtrans-67.6-29.6177-75.5-171.672.6-94.5-5.9112.8L167 T168 E169 G173L167-R171 WeakPolarHBondContact O-CB 3.28Å; L167-R171 VanDerWaalsContact O-CG 3.28Å; L167-R171 WeakPolarHBondContact O-CG 3.38Å; L167-R171 PolarHBondContact O-N 3.46Å; T168-R171 PolarHBondContact O-N 2.6Å; E169-R171 VanDerWaalsContact C-N 3.33Å; E169-R171 PolarHBondContact O-N 2.92Å; R171-G173 PolarHBondContact O-N 3.38Å
172D97.8Very high97.9Very high60 Ų6061 Ų6132%0.32132%0.324SS..THydrogen-bonded Turntrans-78.83.2172.5-75.9-13.2000112.9T168 E169 H170 F174 Q175 H176T168-D172 WeakPolarHBondContact O-CB 3.19Å; T168-D172 PolarHBondContact O-N 3.2Å; E169-D172 CarbonylContact O-C 3.59Å; E169-D172 PolarHBondContact O-N 3.03Å; H170-D172 VanDerWaalsContact C-N 3.27Å; H170-D172 PolarHBondContact O-N 3.11Å; D172-F174 VanDerWaalsContact C-N 3.33Å; D172-F174 PolarHBondContact O-N 3.5Å; D172-Q175 HydrophobicContact CB-CG 4.19Å; D172-Q175 WeakPolarHBondContact O-CB 3.29Å; D172-Q175 WeakPolarHBondContact O-CG 3.41Å; D172-Q175 PolarHBondContact O-N 3.14Å; D172-H176 IonicContact OD2-CE1 3.18Å; D172-H176 PolarHBondContact OD2-CE1 2.91Å
173G97.9Very high97.8Very high54 Ų5464 Ų6456%0.55734%0.34SS*.THydrogen-bonded Turntrans72.424.1174.500000113.9E169 H170 R171 Q175E169-G173 PolarHBondContact O-N 3.04Å; E169-G173 VanDerWaalsContact O-N 3.15Å; H170-G173 PolarHBondContact O-N 3.19Å; R171-G173 PolarHBondContact O-N 3.38Å; G173-Q175 VanDerWaalsContact C-N 3.25Å; G173-Q175 PolarHBondContact O-N 3.1Å
174F97.7Very high97.8Very high52 Ų5263.7 Ų63.723%0.22833%0.333CS..THydrogen-bonded Turntrans56.337.9-174.7-57.2-76.7000113.3E169 H170 D172 H176 L179 F185 F189E169-F174 HydrophobicContact CG-CD1 3.78Å; E169-F174 HydrophobicContact CG-CE1 4.37Å; E169-F174 PolarHBondContact O-N 3.08Å; E169-F174 WeakPolarHBondContact OE1-CA 3.25Å; H170-F174 HydrophobicContact CB-CE2 4.45Å; H170-F174 HydrophobicContact CB-CZ 4.01Å; H170-F174 AromaticContact ND1-CE2 3.56Å; H170-F174 AromaticContact ND1-CZ 3.8Å; D172-F174 VanDerWaalsContact C-N 3.33Å; D172-F174 PolarHBondContact O-N 3.5Å; F174-H176 VanDerWaalsContact C-N 3.28Å; F174-H176 PolarHBondContact O-N 2.94Å; F174-L179 HydrophobicContact CB-CD1 3.77Å; F174-L179 HydrophobicContact CD1-CD1 4.48Å; F174-L179 HydrophobicContact CD2-CD1 3.98Å; F174-L179 HydrophobicContact CG-CD1 3.83Å; F174-F185 AromaticContact CD1-CE2 3.78Å; F174-F185 HydrophobicContact CD1-CE2 3.78Å; F174-F185 HydrophobicContact CD1-CZ 4.37Å; F174-F185 HydrophobicContact CE1-CE2 4.1Å; F174-F185 HydrophobicContact CE1-CZ 4.36Å; F174-F185 HydrophobicContact CG-CE2 4.36Å; F174-F189 HydrophobicContact CD1-CE1 4.24Å; F174-F189 HydrophobicContact CD1-CZ 4.46Å; F174-F189 AromaticContact CE1-CE1 3.85Å; F174-F189 HydrophobicContact CE1-CE1 3.85Å; F174-F189 HydrophobicContact CE1-CZ 4.22Å
175Q97Very high97.7Very high89 Ų8962.3 Ų62.342%0.41633%0.325SS..THydrogen-bonded Turntrans-75.4-13.6-175.470.1-178.5-39.800113.9P13 E169 D172 G173P13-Q175 VanDerWaalsContact CD-O 3.3Å; P13-Q175 WeakPolarHBondContact CD-O 2.88Å; E169-Q175 PolarHBondContact OE1-N 3.01Å; D172-Q175 HydrophobicContact CB-CG 4.19Å; D172-Q175 WeakPolarHBondContact O-CB 3.29Å; D172-Q175 WeakPolarHBondContact O-CG 3.41Å; D172-Q175 PolarHBondContact O-N 3.14Å; G173-Q175 VanDerWaalsContact C-N 3.25Å; G173-Q175 PolarHBondContact O-N 3.1Å
176H98.1Very high97.7Very high23 Ų2369.2 Ų69.211%0.10635%0.351CS..THydrogen-bonded Turntrans-101.213.8-172.7-53.6107.8000113.5W12 D108 S109 R110 E169 D172 F174W12-H176 CarbonylContact O-C 3.18Å; D108-H176 CarbonylContact C-O 3.6Å; D108-H176 WeakPolarHBondContact CA-O 3.13Å; S109-H176 PolarHBondContact N-O 2.91Å; S109-H176 WeakPolarHBondContact OG-CB 3.5Å; S109-H176 PolarHBondContact OG-O 2.87Å; R110-H176 HydrophobicContact CG-CB 3.8Å; R110-H176 VanDerWaalsContact CG-CG 3.46Å; E169-H176 WeakPolarHBondContact OE1-CB 3.44Å; E169-H176 IonicContact OE1-CG 3.97Å; E169-H176 PolarHBondContact OE1-N 2.9Å; E169-H176 IonicContact OE1-ND1 2.82Å; E169-H176 PolarHBondContact OE1-ND1 3.48Å; E169-H176 IonicContact OE2-CE1 3.21Å; E169-H176 IonicContact OE2-CG 3.9Å; E169-H176 IonicContact OE2-ND1 2.69Å; E169-H176 PolarHBondContact OE2-ND1 2.99Å; D172-H176 IonicContact OD2-CE1 3.18Å; D172-H176 PolarHBondContact OD2-CE1 2.91Å; F174-H176 VanDerWaalsContact C-N 3.28Å; F174-H176 PolarHBondContact O-N 2.94Å
177G95.8Very high97.7Very high5 Ų571.2 Ų71.25%0.05236%0.359CS..SBendtrans-157.2157.5175.400000110.7L179G177-L179 PolarHBondContact O-N 3.16Å
178Q96.4Very high97.6Very high103 Ų10367.9 Ų67.948%0.48134%0.341SS..  trans-70.7100.1175.2-173.5-177.57.100109.9G180 H181 F185Q178-G180 PolarHBondContact O-N 3.23Å; Q178-H181 HydrophobicContact CB-CB 4.15Å; Q178-H181 HydrophobicContact CG-CB 4.24Å; Q178-H181 VanDerWaalsContact O-CB 3.28Å; Q178-H181 WeakPolarHBondContact O-CB 3.45Å; Q178-H181 PolarHBondContact O-N 3.42Å; Q178-H181 VanDerWaalsContact O-N 3.13Å; Q178-H181 PolarHBondContact OE1-CD2 2.95Å; Q178-H181 VanDerWaalsContact OE1-CD2 3.23Å; Q178-F185 WeakPolarHBondContact O-CB 3.32Å
179L96.6Very high97.6Very high108 Ų10866.5 Ų66.557%0.56533%0.332SS*.THydrogen-bonded Turntrans-53.1131-178.9-173.464.9000111.8F174 G177 H181 F185F174-L179 HydrophobicContact CB-CD1 3.77Å; F174-L179 HydrophobicContact CD1-CD1 4.48Å; F174-L179 HydrophobicContact CD2-CD1 3.98Å; F174-L179 HydrophobicContact CG-CD1 3.83Å; G177-L179 PolarHBondContact O-N 3.16Å; L179-H181 VanDerWaalsContact C-N 3.28Å; L179-H181 PolarHBondContact O-N 2.87Å; L179-F185 HydrophobicContact CD1-CD1 4.45Å; L179-F185 HydrophobicContact CD1-CD2 4.14Å; L179-F185 HydrophobicContact CD1-CE1 3.94Å; L179-F185 HydrophobicContact CD1-CE2 3.61Å; L179-F185 HydrophobicContact CD1-CZ 3.49Å; L179-F185 VanDerWaalsContact CD1-CZ 3.49Å
180G97.2Very high97.6Very high37 Ų3768.3 Ų68.338%0.38134%0.343SS..THydrogen-bonded Turntrans80-4.117800000115.7Q178 F185Q178-G180 PolarHBondContact O-N 3.23Å; G180-F185 VanDerWaalsContact N-CD1 3.33Å
181H97.9Very high97.6Very high50 Ų5067.9 Ų67.923%0.23134%0.34CS..  trans-61.6126.1177.1-172.3-74.9000111.2Q178 L179 L183 Y184 F185 W186Q178-H181 HydrophobicContact CB-CB 4.15Å; Q178-H181 HydrophobicContact CG-CB 4.24Å; Q178-H181 VanDerWaalsContact O-CB 3.28Å; Q178-H181 WeakPolarHBondContact O-CB 3.45Å; Q178-H181 PolarHBondContact O-N 3.42Å; Q178-H181 VanDerWaalsContact O-N 3.13Å; Q178-H181 PolarHBondContact OE1-CD2 2.95Å; Q178-H181 VanDerWaalsContact OE1-CD2 3.23Å; L179-H181 VanDerWaalsContact C-N 3.28Å; L179-H181 PolarHBondContact O-N 2.87Å; H181-L183 PolarHBondContact ND1-N 3.27Å; H181-L183 VanDerWaalsContact ND1-N 3.19Å; H181-L183 PolarHBondContact O-N 2.86Å; H181-Y184 AromaticContact CE1-CD2 3.5Å; H181-Y184 VanDerWaalsContact CE1-CD2 3.5Å; H181-Y184 WeakPolarHBondContact CE1-CD2 3.32Å; H181-Y184 AromaticContact CE1-CE2 3.86Å; H181-Y184 AromaticContact CG-CD2 3.95Å; H181-Y184 AromaticContact ND1-CD2 3.57Å; H181-Y184 AromaticContact ND1-CG 3.85Å; H181-Y184 PolarHBondContact ND1-N 3.37Å; H181-Y184 VanDerWaalsContact ND1-N 3.16Å; H181-Y184 AromaticContact NE2-CD2 3.85Å; H181-F185 HydrophobicContact CB-CB 4.4Å; H181-F185 WeakPolarHBondContact O-CA 3.35Å; H181-F185 WeakPolarHBondContact O-CB 3.48Å; H181-F185 PolarHBondContact O-N 3.21Å; H181-W186 PolarHBondContact O-N 3.5Å; H181-W186 VanDerWaalsContact O-N 3.07Å
182P98.1Very high97.6Very high100 Ų10061.1 Ų61.165%0.64932%0.318SS*.Iπ-helixtrans-57.9-41.7-172.9-27.434.8000114.8W186 F187P182-W186 WeakPolarHBondContact O-CB 3.43Å; P182-F187 PolarHBondContact O-N 3.32Å; P182-F187 VanDerWaalsContact O-N 3.17Å
183L97.3Very high97.6Very high73 Ų7359.2 Ų59.238%0.38231%0.308SS..Iπ-helixtrans-81.9-63.6179.4-173.965.5000111.6H181 F187 Y188H181-L183 PolarHBondContact ND1-N 3.27Å; H181-L183 VanDerWaalsContact ND1-N 3.19Å; H181-L183 PolarHBondContact O-N 2.86Å; L183-F187 HydrophobicContact CD1-CB 4.36Å; L183-F187 HydrophobicContact CD1-CD1 3.84Å; L183-F187 HydrophobicContact CD1-CG 4.43Å; L183-F187 CarbonylContact O-C 3.55Å; L183-F187 WeakPolarHBondContact O-CA 3.49Å; L183-F187 VanDerWaalsContact O-CB 3.24Å; L183-F187 WeakPolarHBondContact O-CB 3.39Å; L183-F187 PolarHBondContact O-N 3.09Å; L183-F187 VanDerWaalsContact O-N 3.1Å; L183-Y188 HydrophobicContact CD1-CE1 4.26Å; L183-Y188 PolarHBondContact O-N 2.82Å
184Y97.1Very high97.6Very high54 Ų5458.2 Ų58.221%0.21229%0.294CS..Iπ-helixtrans-67.2-43.4-173-59.7-39.9000114.9K106 G107 H181 Y188 F189K106-Y184 HydrophobicContact CB-CD1 3.8Å; K106-Y184 HydrophobicContact CB-CD2 4.39Å; K106-Y184 HydrophobicContact CB-CE1 3.73Å; K106-Y184 HydrophobicContact CB-CE2 4.31Å; K106-Y184 HydrophobicContact CB-CG 4.15Å; K106-Y184 HydrophobicContact CD-CE1 3.89Å; K106-Y184 HydrophobicContact CG-CE1 4.49Å; G107-Y184 WeakPolarHBondContact CA-O 3.32Å; H181-Y184 AromaticContact CE1-CD2 3.5Å; H181-Y184 VanDerWaalsContact CE1-CD2 3.5Å; H181-Y184 WeakPolarHBondContact CE1-CD2 3.32Å; H181-Y184 AromaticContact CE1-CE2 3.86Å; H181-Y184 AromaticContact CG-CD2 3.95Å; H181-Y184 AromaticContact ND1-CD2 3.57Å; H181-Y184 AromaticContact ND1-CG 3.85Å; H181-Y184 PolarHBondContact ND1-N 3.37Å; H181-Y184 VanDerWaalsContact ND1-N 3.16Å; H181-Y184 AromaticContact NE2-CD2 3.85Å; Y184-Y188 AromaticContact CD1-CD2 3.87Å; Y184-Y188 HydrophobicContact CD1-CD2 3.87Å; Y184-Y188 AromaticContact CD1-CE2 3.84Å; Y184-Y188 HydrophobicContact CD1-CE2 3.84Å; Y184-Y188 HydrophobicContact CE1-CD2 4.5Å; Y184-Y188 HydrophobicContact CE1-CE2 4.01Å; Y184-Y188 WeakPolarHBondContact O-CB 3.47Å; Y184-F189 PolarHBondContact O-N 3.35Å
185F98Very high97.6Very high21 Ų2158.2 Ų58.29%0.09230%0.296CS..Iπ-helixtrans-85-57.6178.5-178.7-105.7000111.5F174 Q178 L179 G180 H181 F189 V190F174-F185 AromaticContact CD1-CE2 3.78Å; F174-F185 HydrophobicContact CD1-CE2 3.78Å; F174-F185 HydrophobicContact CD1-CZ 4.37Å; F174-F185 HydrophobicContact CE1-CE2 4.1Å; F174-F185 HydrophobicContact CE1-CZ 4.36Å; F174-F185 HydrophobicContact CG-CE2 4.36Å; Q178-F185 WeakPolarHBondContact O-CB 3.32Å; L179-F185 HydrophobicContact CD1-CD1 4.45Å; L179-F185 HydrophobicContact CD1-CD2 4.14Å; L179-F185 HydrophobicContact CD1-CE1 3.94Å; L179-F185 HydrophobicContact CD1-CE2 3.61Å; L179-F185 HydrophobicContact CD1-CZ 3.49Å; L179-F185 VanDerWaalsContact CD1-CZ 3.49Å; G180-F185 VanDerWaalsContact N-CD1 3.33Å; H181-F185 HydrophobicContact CB-CB 4.4Å; H181-F185 WeakPolarHBondContact O-CA 3.35Å; H181-F185 WeakPolarHBondContact O-CB 3.48Å; H181-F185 PolarHBondContact O-N 3.21Å; F185-F189 HydrophobicContact CD2-CB 4.46Å; F185-F189 HydrophobicContact CD2-CD1 4.05Å; F185-F189 HydrophobicContact CD2-CG 4.47Å; F185-F189 AromaticContact CE2-CD1 3.78Å; F185-F189 HydrophobicContact CE2-CD1 3.78Å; F185-F189 HydrophobicContact CE2-CE1 4.16Å; F185-F189 VanDerWaalsContact O-CB 3.3Å; F185-F189 WeakPolarHBondContact O-CB 3.39Å; F185-F189 PolarHBondContact O-N 3.49Å; F185-V190 HydrophobicContact CD1-CG2 4.49Å; F185-V190 HydrophobicContact CE1-CG2 4.12Å; F185-V190 HydrophobicContact CE2-CG2 4.49Å; F185-V190 HydrophobicContact CZ-CG2 4.12Å; F185-V190 PolarHBondContact O-N 2.93Å
186W98.5Very high97.7Very high146 Ų14655.7 Ų55.755%0.55328%0.283SS*.Iπ-helixtrans-73.7-40.7-172.9-72.7111.3000113.8H181 P182 V190 F191H181-W186 PolarHBondContact O-N 3.5Å; H181-W186 VanDerWaalsContact O-N 3.07Å; P182-W186 WeakPolarHBondContact O-CB 3.43Å; W186-V190 HydrophobicContact CE3-CB 4.09Å; W186-V190 HydrophobicContact CE3-CG1 4.17Å; W186-V190 HydrophobicContact CE3-CG2 3.93Å; W186-V190 HydrophobicContact CZ3-CG1 4.27Å; W186-V190 HydrophobicContact CZ3-CG2 4.2Å; W186-V190 WeakPolarHBondContact O-CB 3.31Å; W186-F191 WeakPolarHBondContact O-CB 3.29Å; W186-F191 PolarHBondContact O-N 3.48Å
187F98.1Very high97.7Very high83 Ų8357 Ų5736%0.36429%0.29SS..Iπ-helixtrans-84.5-55.8-178.7-179.4-107.6000112.4P182 L183 F191 M192P182-F187 PolarHBondContact O-N 3.32Å; P182-F187 VanDerWaalsContact O-N 3.17Å; L183-F187 HydrophobicContact CD1-CB 4.36Å; L183-F187 HydrophobicContact CD1-CD1 3.84Å; L183-F187 HydrophobicContact CD1-CG 4.43Å; L183-F187 CarbonylContact O-C 3.55Å; L183-F187 WeakPolarHBondContact O-CA 3.49Å; L183-F187 VanDerWaalsContact O-CB 3.24Å; L183-F187 WeakPolarHBondContact O-CB 3.39Å; L183-F187 PolarHBondContact O-N 3.09Å; L183-F187 VanDerWaalsContact O-N 3.1Å; F187-F191 HydrophobicContact CD2-CB 4.37Å; F187-F191 AromaticContact CD2-CD1 3.54Å; F187-F191 HydrophobicContact CD2-CD1 3.54Å; F187-F191 HydrophobicContact CD2-CE1 4.19Å; F187-F191 HydrophobicContact CD2-CG 4.21Å; F187-F191 AromaticContact CE2-CD1 3.44Å; F187-F191 HydrophobicContact CE2-CD1 3.44Å; F187-F191 VanDerWaalsContact CE2-CD1 3.44Å; F187-F191 AromaticContact CE2-CE1 3.66Å; F187-F191 HydrophobicContact CE2-CE1 3.66Å; F187-F191 HydrophobicContact CE2-CG 4.48Å; F187-F191 HydrophobicContact CZ-CD1 4.45Å; F187-F191 WeakPolarHBondContact O-CB 3.21Å; F187-F191 PolarHBondContact O-N 2.72Å; F187-M192 HydrophobicContact CE2-SD 4.44Å; F187-M192 HydrophobicContact CZ-SD 4.07Å; F187-M192 WeakPolarHBondContact O-CG 3.22Å; F187-M192 PolarHBondContact O-N 2.97Å
188Y97.5Very high97.8Very high17 Ų1761.1 Ų61.17%0.06731%0.314CS..Iπ-helixtrans-70.8-57.6-179-67.6-5.3000112.1E103 Y104 L183 Y184 M192 N193E103-Y188 HydrophobicContact CG-CE2 4.02Å; E103-Y188 PolarHBondContact OE1-OH 3.13Å; Y104-Y188 HydrophobicContact CD2-CD2 4.45Å; Y104-Y188 HydrophobicContact CD2-CG 4.44Å; L183-Y188 HydrophobicContact CD1-CE1 4.26Å; L183-Y188 PolarHBondContact O-N 2.82Å; Y184-Y188 AromaticContact CD1-CD2 3.87Å; Y184-Y188 HydrophobicContact CD1-CD2 3.87Å; Y184-Y188 AromaticContact CD1-CE2 3.84Å; Y184-Y188 HydrophobicContact CD1-CE2 3.84Å; Y184-Y188 HydrophobicContact CE1-CD2 4.5Å; Y184-Y188 HydrophobicContact CE1-CE2 4.01Å; Y184-Y188 WeakPolarHBondContact O-CB 3.47Å; Y188-M192 WeakPolarHBondContact O-CB 3.31Å; Y188-N193 PolarHBondContact O-ND2 3.35Å
189F98.3Very high97.9Very high5 Ų559.6 Ų59.62%0.02231%0.309CS..Iπ-helixtrans-73.4-46.8-173.8-179.8-91.4000113D108 Y165 F166 E169 F174 Y184 F185 N193D108-F189 HydrophobicContact CB-CD2 4.38Å; Y165-F189 HydrophobicContact CD1-CE2 4.33Å; Y165-F189 AromaticContact CE1-CD2 3.82Å; Y165-F189 HydrophobicContact CE1-CD2 3.82Å; Y165-F189 AromaticContact CE1-CE2 3.45Å; Y165-F189 HydrophobicContact CE1-CE2 3.45Å; Y165-F189 VanDerWaalsContact CE1-CE2 3.45Å; Y165-F189 HydrophobicContact CE1-CZ 4.18Å; Y165-F189 AromaticContact CZ-CD2 3.86Å; Y165-F189 AromaticContact CZ-CE2 3.63Å; Y165-F189 VanDerWaalsContact OH-CD2 3.26Å; Y165-F189 WeakPolarHBondContact OH-CD2 3.28Å; Y165-F189 WeakPolarHBondContact OH-CE2 3.01Å; F166-F189 HydrophobicContact CD1-CD1 4.43Å; F166-F189 AromaticContact CD1-CE1 3.54Å; F166-F189 HydrophobicContact CD1-CE1 3.54Å; F166-F189 AromaticContact CD1-CZ 3.64Å; F166-F189 HydrophobicContact CD1-CZ 3.64Å; F166-F189 HydrophobicContact CE1-CD1 4.01Å; F166-F189 AromaticContact CE1-CE1 3.56Å; F166-F189 HydrophobicContact CE1-CE1 3.56Å; F166-F189 AromaticContact CE1-CZ 3.96Å; F166-F189 HydrophobicContact CE1-CZ 3.96Å; F166-F189 WeakPolarHBondContact CE1-O 3.23Å; E169-F189 HydrophobicContact CB-CE2 4Å; E169-F189 HydrophobicContact CB-CZ 3.76Å; E169-F189 HydrophobicContact CG-CE2 3.82Å; E169-F189 HydrophobicContact CG-CZ 3.74Å; F174-F189 HydrophobicContact CD1-CE1 4.24Å; F174-F189 HydrophobicContact CD1-CZ 4.46Å; F174-F189 AromaticContact CE1-CE1 3.85Å; F174-F189 HydrophobicContact CE1-CE1 3.85Å; F174-F189 HydrophobicContact CE1-CZ 4.22Å; Y184-F189 PolarHBondContact O-N 3.35Å; F185-F189 HydrophobicContact CD2-CB 4.46Å; F185-F189 HydrophobicContact CD2-CD1 4.05Å; F185-F189 HydrophobicContact CD2-CG 4.47Å; F185-F189 AromaticContact CE2-CD1 3.78Å; F185-F189 HydrophobicContact CE2-CD1 3.78Å; F185-F189 HydrophobicContact CE2-CE1 4.16Å; F185-F189 VanDerWaalsContact O-CB 3.3Å; F185-F189 WeakPolarHBondContact O-CB 3.39Å; F185-F189 PolarHBondContact O-N 3.49Å; F189-N193 WeakPolarHBondContact O-CB 3.34Å; F189-N193 PolarHBondContact O-ND2 3.29Å
190V98.4Very high98Very high41 Ų4154.4 Ų54.425%0.24828%0.282CS..Iπ-helixtrans-85.8-59.4-176.2-179.50000112.5F185 W186 A194F185-V190 HydrophobicContact CD1-CG2 4.49Å; F185-V190 HydrophobicContact CE1-CG2 4.12Å; F185-V190 HydrophobicContact CE2-CG2 4.49Å; F185-V190 HydrophobicContact CZ-CG2 4.12Å; F185-V190 PolarHBondContact O-N 2.93Å; W186-V190 HydrophobicContact CE3-CB 4.09Å; W186-V190 HydrophobicContact CE3-CG1 4.17Å; W186-V190 HydrophobicContact CE3-CG2 3.93Å; W186-V190 HydrophobicContact CZ3-CG1 4.27Å; W186-V190 HydrophobicContact CZ3-CG2 4.2Å; W186-V190 WeakPolarHBondContact O-CB 3.31Å; V190-A194 WeakPolarHBondContact O-CB 3.17Å; V190-A194 PolarHBondContact O-N 2.96Å
191F98.5Very high98.1Very high103 Ų10353.7 Ų53.745%0.45228%0.275SS..Iπ-helixtrans-68-49.3-169.3169.3-98000113.1W186 F187 A194 L195W186-F191 WeakPolarHBondContact O-CB 3.29Å; W186-F191 PolarHBondContact O-N 3.48Å; F187-F191 HydrophobicContact CD2-CB 4.37Å; F187-F191 AromaticContact CD2-CD1 3.54Å; F187-F191 HydrophobicContact CD2-CD1 3.54Å; F187-F191 HydrophobicContact CD2-CE1 4.19Å; F187-F191 HydrophobicContact CD2-CG 4.21Å; F187-F191 AromaticContact CE2-CD1 3.44Å; F187-F191 HydrophobicContact CE2-CD1 3.44Å; F187-F191 VanDerWaalsContact CE2-CD1 3.44Å; F187-F191 AromaticContact CE2-CE1 3.66Å; F187-F191 HydrophobicContact CE2-CE1 3.66Å; F187-F191 HydrophobicContact CE2-CG 4.48Å; F187-F191 HydrophobicContact CZ-CD1 4.45Å; F187-F191 WeakPolarHBondContact O-CB 3.21Å; F187-F191 PolarHBondContact O-N 2.72Å; F191-A194 PolarHBondContact O-N 3.3Å; F191-L195 HydrophobicContact CE1-CD1 4.29Å; F191-L195 HydrophobicContact CE2-CD2 4.47Å; F191-L195 HydrophobicContact CZ-CD1 4.42Å; F191-L195 HydrophobicContact CZ-CD2 4.37Å; F191-L195 PolarHBondContact O-N 3.04Å
192M97.1Very high98.1Very high60 Ų6055.6 Ų55.630%0.29629%0.289SS..Iπ-helixtrans-60.4-50.3-178.2-68.8-66.4-67.900110.3F187 Y188 A194 L195 W196F187-M192 HydrophobicContact CE2-SD 4.44Å; F187-M192 HydrophobicContact CZ-SD 4.07Å; F187-M192 WeakPolarHBondContact O-CG 3.22Å; F187-M192 PolarHBondContact O-N 2.97Å; Y188-M192 WeakPolarHBondContact O-CB 3.31Å; M192-A194 PolarHBondContact O-N 2.74Å; M192-L195 VanDerWaalsContact O-CB 3.27Å; M192-L195 WeakPolarHBondContact O-CB 3.26Å; M192-L195 PolarHBondContact O-N 3.07Å; M192-L195 VanDerWaalsContact O-N 3.15Å; M192-W196 WeakPolarHBondContact O-CZ3 3.47Å
193N98.3Very high98.1Very high20 Ų2051.7 Ų51.711%0.10726%0.263CS..Hα-helixtrans-64.1-39.9178.6-65.5-53.7000112.2Y104 Y165 F166 Y188 F189 L195 W196 L197Y104-N193 PolarHBondContact OH-ND2 3.46Å; Y104-N193 PolarHBondContact OH-OD1 3.26Å; Y165-N193 HydrophobicContact CE1-CB 4.48Å; Y165-N193 WeakPolarHBondContact CE1-ND2 3.35Å; F166-N193 HydrophobicContact CE1-CB 4.41Å; F166-N193 HydrophobicContact CE2-CB 3.82Å; F166-N193 HydrophobicContact CZ-CB 3.51Å; Y188-N193 PolarHBondContact O-ND2 3.35Å; F189-N193 WeakPolarHBondContact O-CB 3.34Å; F189-N193 PolarHBondContact O-ND2 3.29Å; N193-L195 PolarHBondContact O-N 2.98Å; N193-W196 WeakPolarHBondContact O-CA 3.32Å; N193-W196 WeakPolarHBondContact O-CB 3.33Å; N193-W196 PolarHBondContact O-N 3.08Å; N193-L197 PolarHBondContact O-N 2.8Å
194A97.9Very high98.2Very high32 Ų3249.5 Ų49.526%0.26425%0.253SS..Hα-helixtrans-55.7-22.9175.400000114.3V190 F191 M192 W196 L197 V198V190-A194 WeakPolarHBondContact O-CB 3.17Å; V190-A194 PolarHBondContact O-N 2.96Å; F191-A194 PolarHBondContact O-N 3.3Å; M192-A194 PolarHBondContact O-N 2.74Å; A194-W196 VanDerWaalsContact C-N 3.35Å; A194-L197 PolarHBondContact O-N 2.97Å; A194-V198 WeakPolarHBondContact O-CG2 3.43Å; A194-V198 PolarHBondContact O-N 3.19Å
195L98.1Very high98.3Very high53 Ų5352.1 Ų52.128%0.27727%0.27SS..Hα-helixtrans-63.9-38170.7-59.8174.9000112.4F191 M192 N193 L197 V198 L199 P200F191-L195 HydrophobicContact CE1-CD1 4.29Å; F191-L195 HydrophobicContact CE2-CD2 4.47Å; F191-L195 HydrophobicContact CZ-CD1 4.42Å; F191-L195 HydrophobicContact CZ-CD2 4.37Å; F191-L195 PolarHBondContact O-N 3.04Å; M192-L195 VanDerWaalsContact O-CB 3.27Å; M192-L195 WeakPolarHBondContact O-CB 3.26Å; M192-L195 PolarHBondContact O-N 3.07Å; M192-L195 VanDerWaalsContact O-N 3.15Å; N193-L195 PolarHBondContact O-N 2.98Å; L195-L197 VanDerWaalsContact C-N 3.29Å; L195-L197 PolarHBondContact O-N 3.26Å; L195-V198 PolarHBondContact O-N 2.78Å; L195-L199 HydrophobicContact CB-CD1 4.39Å; L195-L199 WeakPolarHBondContact O-CB 3.46Å; L195-L199 PolarHBondContact O-N 3.15Å; L195-P200 VanDerWaalsContact O-CD 3.23Å; L195-P200 WeakPolarHBondContact O-CD 3.43Å
196W97.9Very high98.3Very high36 Ų3653 Ų5314%0.13628%0.275CS..Hα-helixtrans-74.4-13.3174.9-82.5-101.8000113.6W68 I75 H76 M192 N193 A194 P200W68-W196 HydrophobicContact CH2-CD2 4.18Å; I75-W196 HydrophobicContact CD1-CH2 3.81Å; I75-W196 HydrophobicContact CD1-CZ2 3.59Å; I75-W196 HydrophobicContact CG2-CZ2 4.29Å; H76-W196 AromaticContact CE1-NE1 3.67Å; M192-W196 WeakPolarHBondContact O-CZ3 3.47Å; N193-W196 WeakPolarHBondContact O-CA 3.32Å; N193-W196 WeakPolarHBondContact O-CB 3.33Å; N193-W196 PolarHBondContact O-N 3.08Å; A194-W196 VanDerWaalsContact C-N 3.35Å; W196-P200 VanDerWaalsContact O-CD 3.27Å; W196-P200 WeakPolarHBondContact O-CD 3.4Å; W196-P200 WeakPolarHBondContact O-CG 3.35Å
197L98.1Very high98.3Very high49 Ų4946 Ų4626%0.25725%0.249SC..Hα-helixtrans-83.7-52.6163.5-64.7-178.4000112I159 D162 V163 F166 N193 A194 L195 G201I159-L197 HydrophobicContact CG2-CD2 4.13Å; D162-L197 HydrophobicContact CB-CD2 3.87Å; D162-L197 HydrophobicContact CB-CG 4.47Å; D162-L197 WeakPolarHBondContact OD2-CG 3.25Å; V163-L197 HydrophobicContact CG2-CD2 3.7Å; F166-L197 HydrophobicContact CD2-CD1 4.09Å; F166-L197 HydrophobicContact CE2-CD1 3.85Å; F166-L197 HydrophobicContact CE2-CG 4.42Å; N193-L197 PolarHBondContact O-N 2.8Å; A194-L197 PolarHBondContact O-N 2.97Å; L195-L197 VanDerWaalsContact C-N 3.29Å; L195-L197 PolarHBondContact O-N 3.26Å; L197-G201 PolarHBondContact O-N 3.02Å
198V98.5Very high98.4Very high93 Ų9345 Ų4556%0.56425%0.249SC*.Hα-helixtrans-76.4-49.6-166.4175.40000111.9A194 L195 G201 V202A194-V198 WeakPolarHBondContact O-CG2 3.43Å; A194-V198 PolarHBondContact O-N 3.19Å; L195-V198 PolarHBondContact O-N 2.78Å; V198-G201 PolarHBondContact O-N 3.13Å; V198-V202 WeakPolarHBondContact O-CG2 3.24Å; V198-V202 PolarHBondContact O-N 3.02Å
199L98.5Very high98.4Very high70 Ų7051 Ų5137%0.36628%0.276SS..Hα-helixtrans-67.4-47.5-175.4-58176.4000111.2W68 L195 G201 V202 L203W68-L199 HydrophobicContact CD2-CD1 4.14Å; W68-L199 HydrophobicContact CE3-CD1 3.68Å; W68-L199 HydrophobicContact CH2-CB 4.44Å; W68-L199 HydrophobicContact CH2-CD1 3.8Å; W68-L199 HydrophobicContact CZ2-CB 4.11Å; W68-L199 HydrophobicContact CZ2-CD1 4.23Å; W68-L199 HydrophobicContact CZ3-CD1 3.5Å; L195-L199 HydrophobicContact CB-CD1 4.39Å; L195-L199 WeakPolarHBondContact O-CB 3.46Å; L195-L199 PolarHBondContact O-N 3.15Å; L199-G201 VanDerWaalsContact C-N 3.27Å; L199-G201 PolarHBondContact O-N 3.47Å; L199-V202 PolarHBondContact O-N 3.12Å; L199-L203 WeakPolarHBondContact O-CG 3.42Å; L199-L203 PolarHBondContact O-N 3.2Å; L199-L203 VanDerWaalsContact O-N 3.11Å
200P98.4Very high98.4Very high0 Ų054.7 Ų54.70%029%0.293CS..Hα-helixtrans-59-36.6170.2-30.243.2000112.9W68 Q158 I159 L195 W196 V202 L203 V204W68-P200 HydrophobicContact CZ2-CG 4.12Å; Q158-P200 HydrophobicContact CB-CB 4.4Å; Q158-P200 HydrophobicContact CB-CG 4.2Å; Q158-P200 VanDerWaalsContact OE1-CG 3.24Å; I159-P200 HydrophobicContact CD1-CB 4.11Å; I159-P200 HydrophobicContact CG1-CB 3.88Å; L195-P200 VanDerWaalsContact O-CD 3.23Å; L195-P200 WeakPolarHBondContact O-CD 3.43Å; W196-P200 VanDerWaalsContact O-CD 3.27Å; W196-P200 WeakPolarHBondContact O-CD 3.4Å; W196-P200 WeakPolarHBondContact O-CG 3.35Å; P200-V202 VanDerWaalsContact C-N 3.35Å; P200-V202 PolarHBondContact O-N 3.17Å; P200-L203 CarbonylContact O-C 3.52Å; P200-L203 WeakPolarHBondContact O-CA 3.39Å; P200-L203 WeakPolarHBondContact O-CB 3.39Å; P200-L203 PolarHBondContact O-N 3.47Å; P200-V204 WeakPolarHBondContact O-CG2 3.37Å; P200-V204 PolarHBondContact O-N 3.48Å
201G98.7Very high98.4Very high22 Ų2255.3 Ų55.323%0.22730%0.295CS..Hα-helixtrans-59-42.9175.900000113L197 V198 L199 L203 V204 L205L197-G201 PolarHBondContact O-N 3.02Å; V198-G201 PolarHBondContact O-N 3.13Å; L199-G201 VanDerWaalsContact C-N 3.27Å; L199-G201 PolarHBondContact O-N 3.47Å; G201-L203 VanDerWaalsContact C-N 3.33Å; G201-L203 PolarHBondContact O-N 2.8Å; G201-V204 PolarHBondContact O-N 3.13Å; G201-L205 WeakPolarHBondContact O-CG 3.39Å; G201-L205 PolarHBondContact O-N 3.06Å; G201-L205 VanDerWaalsContact O-N 3.17Å
202V98.8Very high98.4Very high89 Ų8954 Ų5454%0.53930%0.295SS..Hα-helixtrans-63.5-40.3173.1175.40000111.2V198 L199 P200 L205 D206V198-V202 WeakPolarHBondContact O-CG2 3.24Å; V198-V202 PolarHBondContact O-N 3.02Å; L199-V202 PolarHBondContact O-N 3.12Å; P200-V202 VanDerWaalsContact C-N 3.35Å; P200-V202 PolarHBondContact O-N 3.17Å; V202-L205 PolarHBondContact O-N 2.95Å; V202-D206 WeakPolarHBondContact O-CB 3.4Å; V202-D206 PolarHBondContact O-N 3.4Å
203L98.8Very high98.5Very high18 Ų1857.1 Ų57.19%0.09431%0.309CS..Hα-helixtrans-69.4-31.4178.7-65.2170.8000113.1F69 Q151 L199 P200 G201 A207F69-L203 HydrophobicContact CE2-CD1 3.72Å; F69-L203 HydrophobicContact CZ-CD1 3.87Å; Q151-L203 HydrophobicContact CG-CB 4.16Å; Q151-L203 PolarHBondContact NE2-O 3.43Å; L199-L203 WeakPolarHBondContact O-CG 3.42Å; L199-L203 PolarHBondContact O-N 3.2Å; L199-L203 VanDerWaalsContact O-N 3.11Å; P200-L203 CarbonylContact O-C 3.52Å; P200-L203 WeakPolarHBondContact O-CA 3.39Å; P200-L203 WeakPolarHBondContact O-CB 3.39Å; P200-L203 PolarHBondContact O-N 3.47Å; G201-L203 VanDerWaalsContact C-N 3.33Å; G201-L203 PolarHBondContact O-N 2.8Å; L203-A207 WeakPolarHBondContact O-CB 3.48Å; L203-A207 PolarHBondContact O-N 2.88Å
204V98.9Very high98.5Very high28 Ų2858.7 Ų58.717%0.1733%0.325CS..Hα-helixtrans-61.6-52.2169.9166.70000109.6L152 V156 I159 P200 G201 D206 A207 V208L152-V204 HydrophobicContact CD1-CB 4.24Å; L152-V204 HydrophobicContact CD1-CG1 3.79Å; L152-V204 HydrophobicContact CD1-CG2 4.2Å; V156-V204 HydrophobicContact CG2-CG2 3.8Å; I159-V204 HydrophobicContact CD1-CG2 3.98Å; P200-V204 WeakPolarHBondContact O-CG2 3.37Å; P200-V204 PolarHBondContact O-N 3.48Å; G201-V204 PolarHBondContact O-N 3.13Å; V204-D206 VanDerWaalsContact C-N 3.28Å; V204-D206 PolarHBondContact O-N 3.22Å; V204-A207 PolarHBondContact O-N 3.48Å; V204-V208 HydrophobicContact CG1-CG2 4.31Å; V204-V208 WeakPolarHBondContact O-CB 3.48Å; V204-V208 VanDerWaalsContact O-CG2 3.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.4Å; V204-V208 PolarHBondContact O-N 2.69Å
205L98.8Very high98.5Very high109 Ų10962 Ų6257%0.57133%0.334SS*.Hα-helixtrans-59.7-40.4179.2-67.1175000111.9G201 V202 K209G201-L205 WeakPolarHBondContact O-CG 3.39Å; G201-L205 PolarHBondContact O-N 3.06Å; G201-L205 VanDerWaalsContact O-N 3.17Å; V202-L205 PolarHBondContact O-N 2.95Å; L205-K209 WeakPolarHBondContact O-CB 3.37Å; L205-K209 VanDerWaalsContact O-CG 3.24Å; L205-K209 WeakPolarHBondContact O-CG 3.18Å; L205-K209 PolarHBondContact O-N 3.29Å; L205-K209 VanDerWaalsContact O-N 3.07Å
206D98.8Very high98.5Very high39 Ų3962.8 Ų62.821%0.20934%0.344CS..Hα-helixtrans-62.3-48.717517268.6000112.4R62 Q151 V202 V204 K209 H210R62-D206 IonicContact CZ-OD2 3.73Å; R62-D206 IonicContact NH1-OD2 3.31Å; R62-D206 PolarHBondContact NH1-OD2 2.95Å; R62-D206 VanDerWaalsContact NH2-CG 3.31Å; R62-D206 IonicContact NH2-OD1 3.75Å; R62-D206 PolarHBondContact NH2-OD1 2.67Å; R62-D206 IonicContact NH2-OD2 3.86Å; R62-D206 PolarHBondContact NH2-OD2 3.37Å; Q151-D206 PolarHBondContact NE2-OD2 2.81Å; V202-D206 WeakPolarHBondContact O-CB 3.4Å; V202-D206 PolarHBondContact O-N 3.4Å; V204-D206 VanDerWaalsContact C-N 3.28Å; V204-D206 PolarHBondContact O-N 3.22Å; D206-K209 PolarHBondContact O-N 3.45Å; D206-H210 PolarHBondContact O-N 2.93Å; D206-H210 PolarHBondContact O-ND1 2.87Å; D206-H210 IonicContact OD1-CE1 3.16Å; D206-H210 PolarHBondContact OD1-CE1 3.31Å; D206-H210 IonicContact OD1-ND1 3.49Å; D206-H210 PolarHBondContact OD1-ND1 2.97Å
207A98.8Very high98.4Very high0 Ų066.7 Ų66.70%037%0.366CS..Hα-helixtrans-63.2-45.517900000111.7F148 Q151 L152 L203 V204 K209 H210 L211F148-A207 HydrophobicContact CB-CB 4.48Å; F148-A207 HydrophobicContact CD1-CB 4.23Å; Q151-A207 HydrophobicContact CG-CB 4.31Å; L152-A207 HydrophobicContact CB-CB 3.97Å; L152-A207 HydrophobicContact CD1-CB 4.38Å; L203-A207 WeakPolarHBondContact O-CB 3.48Å; L203-A207 PolarHBondContact O-N 2.88Å; V204-A207 PolarHBondContact O-N 3.48Å; A207-K209 VanDerWaalsContact C-N 3.35Å; A207-K209 PolarHBondContact O-N 3.31Å; A207-H210 PolarHBondContact O-N 3.43Å; A207-L211 WeakPolarHBondContact O-CB 3.27Å; A207-L211 VanDerWaalsContact O-CG 3.27Å; A207-L211 WeakPolarHBondContact O-CG 3.41Å; A207-L211 PolarHBondContact O-N 3.01Å
208V98.8Very high98.3Very high61 Ų6169.6 Ų69.637%0.3738%0.381SS..Hα-helixtrans-58.8-45.9177.8170.20000110.8L152 V204 H210 L211 T212L152-V208 HydrophobicContact CD1-CG2 3.91Å; V204-V208 HydrophobicContact CG1-CG2 4.31Å; V204-V208 WeakPolarHBondContact O-CB 3.48Å; V204-V208 VanDerWaalsContact O-CG2 3.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.4Å; V204-V208 PolarHBondContact O-N 2.69Å; V208-H210 VanDerWaalsContact C-N 3.33Å; V208-H210 PolarHBondContact O-N 3.21Å; V208-L211 PolarHBondContact O-N 3.28Å; V208-T212 HydrophobicContact CG1-CG2 4.07Å; V208-T212 WeakPolarHBondContact O-CB 2.98Å; V208-T212 VanDerWaalsContact O-CG2 3.24Å; V208-T212 WeakPolarHBondContact O-CG2 3.31Å; V208-T212 PolarHBondContact O-N 3.41Å; V208-T212 PolarHBondContact O-OG1 3.34Å
209K98.7Very high98.1Very high144 Ų14469.1 Ų69.163%0.62638%0.375SS*.Hα-helixtrans-57.8-44.3176.9-76.3171.6-177178.20112.3L205 D206 A207 T212 H213L205-K209 WeakPolarHBondContact O-CB 3.37Å; L205-K209 VanDerWaalsContact O-CG 3.24Å; L205-K209 WeakPolarHBondContact O-CG 3.18Å; L205-K209 PolarHBondContact O-N 3.29Å; L205-K209 VanDerWaalsContact O-N 3.07Å; D206-K209 PolarHBondContact O-N 3.45Å; A207-K209 VanDerWaalsContact C-N 3.35Å; A207-K209 PolarHBondContact O-N 3.31Å; K209-T212 PolarHBondContact O-OG1 3.43Å; K209-T212 VanDerWaalsContact O-OG1 3.07Å; K209-H213 VanDerWaalsContact O-CB 3.27Å; K209-H213 WeakPolarHBondContact O-CB 3.09Å; K209-H213 PolarHBondContact O-N 2.67Å
210H98.5Very high97.8Very high81 Ų8168 Ų6838%0.37538%0.376SS..Hα-helixtrans-71.4-41.4-178.7-73.767.5000112.4F148 D206 A207 V208 A214F148-H210 HydrophobicContact CD1-CB 4.06Å; F148-H210 HydrophobicContact CD2-CB 3.93Å; F148-H210 HydrophobicContact CE1-CB 3.86Å; F148-H210 AromaticContact CE1-CD2 3.85Å; F148-H210 AromaticContact CE1-CG 3.69Å; F148-H210 HydrophobicContact CE2-CB 3.78Å; F148-H210 AromaticContact CE2-CD2 3.69Å; F148-H210 AromaticContact CE2-CG 3.95Å; F148-H210 HydrophobicContact CG-CB 4.1Å; F148-H210 HydrophobicContact CZ-CB 3.75Å; F148-H210 AromaticContact CZ-CD2 3.19Å; F148-H210 WeakPolarHBondContact CZ-CD2 3.47Å; F148-H210 AromaticContact CZ-CG 3.48Å; F148-H210 VanDerWaalsContact CZ-CG 3.48Å; F148-H210 AromaticContact CZ-NE2 3.85Å; D206-H210 PolarHBondContact O-N 2.93Å; D206-H210 PolarHBondContact O-ND1 2.87Å; D206-H210 IonicContact OD1-CE1 3.16Å; D206-H210 PolarHBondContact OD1-CE1 3.31Å; D206-H210 IonicContact OD1-ND1 3.49Å; D206-H210 PolarHBondContact OD1-ND1 2.97Å; A207-H210 PolarHBondContact O-N 3.43Å; V208-H210 VanDerWaalsContact C-N 3.33Å; V208-H210 PolarHBondContact O-N 3.21Å; H210-A214 WeakPolarHBondContact O-CB 3.46Å; H210-A214 PolarHBondContact O-N 2.85Å
211L98.6Very high97.4Very high55 Ų5575.6 Ų75.629%0.28841%0.409SS..Hα-helixtrans-66.2-45178.3-69.7170.3000111.6F148 V149 L152 A207 V208 A214 Q215F148-L211 HydrophobicContact CB-CD1 4.25Å; F148-L211 HydrophobicContact CB-CD2 3.82Å; F148-L211 HydrophobicContact CB-CG 3.86Å; V149-L211 HydrophobicContact CG2-CD2 4.09Å; L152-L211 HydrophobicContact CD2-CD1 4.06Å; A207-L211 WeakPolarHBondContact O-CB 3.27Å; A207-L211 VanDerWaalsContact O-CG 3.27Å; A207-L211 WeakPolarHBondContact O-CG 3.41Å; A207-L211 PolarHBondContact O-N 3.01Å; V208-L211 PolarHBondContact O-N 3.28Å; L211-A214 PolarHBondContact O-N 3.5Å; L211-Q215 PolarHBondContact O-N 2.97Å
212T98.5Very high96.8Very high76 Ų7677.1 Ų77.147%0.46642%0.42SS..Hα-helixtrans-65.8-39.5177.9520000112.4V208 K209 Q215 S216V208-T212 HydrophobicContact CG1-CG2 4.07Å; V208-T212 WeakPolarHBondContact O-CB 2.98Å; V208-T212 VanDerWaalsContact O-CG2 3.24Å; V208-T212 WeakPolarHBondContact O-CG2 3.31Å; V208-T212 PolarHBondContact O-N 3.41Å; V208-T212 PolarHBondContact O-OG1 3.34Å; K209-T212 PolarHBondContact O-OG1 3.43Å; K209-T212 VanDerWaalsContact O-OG1 3.07Å; T212-Q215 PolarHBondContact O-N 2.95Å; T212-S216 WeakPolarHBondContact O-CB 3.48Å; T212-S216 PolarHBondContact O-N 3.02Å; T212-S216 PolarHBondContact O-OG 3.05Å
213H98.3Very high96.1Very high125 Ų12577.5 Ų77.558%0.57942%0.422SS*.Hα-helixtrans-61.6-44.7173177.6-99.1000111.7K209 Q215 S216 M217K209-H213 VanDerWaalsContact O-CB 3.27Å; K209-H213 WeakPolarHBondContact O-CB 3.09Å; K209-H213 PolarHBondContact O-N 2.67Å; H213-Q215 VanDerWaalsContact C-N 3.34Å; H213-Q215 PolarHBondContact O-N 2.93Å; H213-S216 PolarHBondContact O-N 3.38Å; H213-M217 WeakPolarHBondContact O-CG 3.19Å; H213-M217 PolarHBondContact O-N 3.39Å
214A97.5Very high95.3Very high53 Ų5384 Ų8444%0.43845%0.45SS..Hα-helixtrans-60.9-42.4176.700000112.2H210 L211 M217 L218H210-A214 WeakPolarHBondContact O-CB 3.46Å; H210-A214 PolarHBondContact O-N 2.85Å; L211-A214 PolarHBondContact O-N 3.5Å; A214-M217 PolarHBondContact O-N 2.49Å; A214-L218 PolarHBondContact O-N 3.3Å
215Q98Very high94.3Very high100 Ų10085.1 Ų85.147%0.46746%0.462SS..Hα-helixtrans-63.7-45.3176.7-174.457.849.100111.9L211 T212 H213 M217 L218 D219L211-Q215 PolarHBondContact O-N 2.97Å; T212-Q215 PolarHBondContact O-N 2.95Å; H213-Q215 VanDerWaalsContact C-N 3.34Å; H213-Q215 PolarHBondContact O-N 2.93Å; Q215-M217 PolarHBondContact O-N 2.76Å; Q215-L218 WeakPolarHBondContact O-CB 3.35Å; Q215-L218 PolarHBondContact O-N 3.02Å; Q215-D219 PolarHBondContact NE2-OD1 2.98Å; Q215-D219 PolarHBondContact O-N 3.2Å; Q215-D219 VanDerWaalsContact O-N 3.11Å
216S97.6Very high93Very high70 Ų7087.4 Ų87.449%0.4947%0.468SS..Hα-helixtrans-58.1-35.9179.8-58.50000112.6T212 H213 D219 A220T212-S216 WeakPolarHBondContact O-CB 3.48Å; T212-S216 PolarHBondContact O-N 3.02Å; T212-S216 PolarHBondContact O-OG 3.05Å; H213-S216 PolarHBondContact O-N 3.38Å; S216-D219 PolarHBondContact O-N 3.18Å; S216-A220 WeakPolarHBondContact O-CB 3.47Å; S216-A220 PolarHBondContact O-N 3.23Å
217M96.9Very high91.7Very high119 Ų11989.7 Ų89.759%0.58649%0.487SS*.Hα-helixtrans-66.2-35.3176.4-70.9-62.4-65.600112.9H213 A214 Q215 K221H213-M217 WeakPolarHBondContact O-CG 3.19Å; H213-M217 PolarHBondContact O-N 3.39Å; A214-M217 PolarHBondContact O-N 2.49Å; Q215-M217 PolarHBondContact O-N 2.76Å; M217-K221 WeakPolarHBondContact O-CB 3.23Å; M217-K221 PolarHBondContact O-N 3.12Å
218L94.9Very high90.2Very high110 Ų11098.5 Ų98.558%0.57653%0.525SS*.Hα-helixtrans-68.8-45175.3-69.3172.7000111A214 Q215 A220 K221 A222A214-L218 PolarHBondContact O-N 3.3Å; Q215-L218 WeakPolarHBondContact O-CB 3.35Å; Q215-L218 PolarHBondContact O-N 3.02Å; L218-A220 PolarHBondContact O-N 2.77Å; L218-K221 PolarHBondContact O-N 2.95Å; L218-A222 PolarHBondContact O-N 3.09Å
219D94.6Very high88.5Confident83 Ų83104.5 Ų104.544%0.44455%0.546SS..Hα-helixtrans-64.3-41-179.2-60.4-24.6000111.5Q215 S216 K221 A222 T223Q215-D219 PolarHBondContact NE2-OD1 2.98Å; Q215-D219 PolarHBondContact O-N 3.2Å; Q215-D219 VanDerWaalsContact O-N 3.11Å; S216-D219 PolarHBondContact O-N 3.18Å; D219-K221 PolarHBondContact O-N 2.81Å; D219-A222 PolarHBondContact O-N 3.09Å; D219-T223 PolarHBondContact O-N 2.91Å; D219-T223 PolarHBondContact O-OG1 3.16Å
220A93.4Very high86.4Confident47 Ų47107 Ų10739%0.38857%0.567SS.*Hα-helixtrans-63.5-39.1175.100000112.4S216 L218 T223 K224S216-A220 WeakPolarHBondContact O-CB 3.47Å; S216-A220 PolarHBondContact O-N 3.23Å; L218-A220 PolarHBondContact O-N 2.77Å; A220-T223 PolarHBondContact O-N 3.33Å; A220-K224 WeakPolarHBondContact O-CG 3.5Å; A220-K224 PolarHBondContact O-N 3.32Å
221K89.8Confident85.8Confident158 Ų158108.4 Ų108.469%0.68758%0.576SS**Hα-helixtrans-65.9-41.9177.1-173.6178.3178.3-178.10111.5M217 L218 D219 T223 K224 A225M217-K221 WeakPolarHBondContact O-CB 3.23Å; M217-K221 PolarHBondContact O-N 3.12Å; L218-K221 PolarHBondContact O-N 2.95Å; D219-K221 PolarHBondContact O-N 2.81Å; K221-T223 VanDerWaalsContact C-N 3.34Å; K221-T223 PolarHBondContact O-N 2.69Å; K221-K224 PolarHBondContact O-N 2.98Å; K221-A225 WeakPolarHBondContact O-CB 3.19Å; K221-A225 PolarHBondContact O-N 3.38Å
222A86.4Confident85.1Confident55 Ų55111.2 Ų111.246%0.45559%0.591SS.*Hα-helixtrans-62.3-41.4176.400000111.9L218 D219 A225 K226L218-A222 PolarHBondContact O-N 3.09Å; D219-A222 PolarHBondContact O-N 3.09Å; A222-A225 PolarHBondContact O-N 2.96Å; A222-K226 PolarHBondContact O-N 3.11Å; A222-K226 VanDerWaalsContact O-N 3.11Å
223T83.8Confident84.4Confident96 Ų96113.1 Ų113.159%0.58960%0.598SS**Hα-helixtrans-64-46.4177.8-54.60000111.7D219 A220 K221 A225 K226 S227D219-T223 PolarHBondContact O-N 2.91Å; D219-T223 PolarHBondContact O-OG1 3.16Å; A220-T223 PolarHBondContact O-N 3.33Å; K221-T223 VanDerWaalsContact C-N 3.34Å; K221-T223 PolarHBondContact O-N 2.69Å; T223-A225 VanDerWaalsContact C-N 3.33Å; T223-A225 PolarHBondContact O-N 2.75Å; T223-K226 PolarHBondContact O-N 3.3Å; T223-S227 PolarHBondContact O-N 3Å; T223-S227 VanDerWaalsContact O-N 3.09Å
224K81.4Confident83.6Confident154 Ų154112.4 Ų112.467%0.6760%0.6SS**Hα-helixtrans-63.1-36.5176-73-179.8-179-1800112.8A220 K221 S227 K228A220-K224 WeakPolarHBondContact O-CG 3.5Å; A220-K224 PolarHBondContact O-N 3.32Å; K221-K224 PolarHBondContact O-N 2.98Å; K224-S227 PolarHBondContact O-N 2.87Å; K224-K228 PolarHBondContact O-N 3.46Å
225A78.4Confident82.7Confident53 Ų53116.1 Ų116.144%0.43861%0.61SS.*Hα-helixtrans-67.2-37.3177.700000112.5K221 A222 T223K221-A225 WeakPolarHBondContact O-CB 3.19Å; K221-A225 PolarHBondContact O-N 3.38Å; A222-A225 PolarHBondContact O-N 2.96Å; T223-A225 VanDerWaalsContact C-N 3.33Å; T223-A225 PolarHBondContact O-N 2.75Å
226K71.5Confident81.7Confident156 Ų156117.2 Ų117.268%0.67862%0.619SS**Hα-helixtrans-65.9-43.7173-76.3179.6175.9179.50111.9A222 T223 K228 K229 N230A222-K226 PolarHBondContact O-N 3.11Å; A222-K226 VanDerWaalsContact O-N 3.11Å; T223-K226 PolarHBondContact O-N 3.3Å; K226-K228 PolarHBondContact O-N 2.88Å; K226-K229 PolarHBondContact O-N 3.02Å; K226-K229 VanDerWaalsContact O-N 3.1Å; K226-N230 PolarHBondContact O-N 3.08Å
227S71.8Confident80.6Confident88 Ų88120.6 Ų120.662%0.61563%0.628SS**Hα-helixtrans-64-21.8178.7-1770000114.5T223 K224T223-S227 PolarHBondContact O-N 3Å; T223-S227 VanDerWaalsContact O-N 3.09Å; K224-S227 PolarHBondContact O-N 2.87Å
228K67.3Low79.3Confident184 Ų184120.7 Ų120.780%0.863%0.632SS**THydrogen-bonded Turntrans-85.8-12.5175.6-76.2-172.1176.6-171.60114K224 K226K224-K228 PolarHBondContact O-N 3.46Å; K226-K228 PolarHBondContact O-N 2.88Å
229K63.1Low78Confident187 Ų187121.6 Ų121.681%0.81364%0.636SS**THydrogen-bonded Turntrans-97.5-14.7-179.4-75-172.4175.8-172.40113.2K226K226-K229 PolarHBondContact O-N 3.02Å; K226-K229 VanDerWaalsContact O-N 3.1Å
230N54.4Low76.5Confident198 Ų198125.1 Ų125.1100%1.05965%0.654SS**  trans-97.40171.3-64.9-3000109.3K226K226-N230 PolarHBondContact O-N 3.08Å

Retrieved 230 of 230 residues in 195.1 ms (Link to these results)

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