A0A096N649_PAPAN Loading...

G protein-coupled receptor 84

AlphaFold DB , UniProt , Accession A0A096N649, Species PAPAN (Papio anubis, Olive baboon), Gene GPR84, Length 396 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
1M31.1Very low57.2Low243 Ų243117.8 Ų117.8100%1.19761%0.607SS**  097.10-108.1173.4176.200108.3K3M1-K3 PolarHBondContact O-N 2.85Å
2W29.7Very low60.2Low239 Ų239120.7 Ų120.791%0.90561%0.606SS**  trans-81.2114.7172.2-77.380.4000107.9T4W2-T4 PolarHBondContact O-N 3.37Å
3K31.7Very low62.6Low192 Ų192116 Ų11684%0.83558%0.581SS**  trans-61.3125.8177.7-80.6178175.3176.40109.5M1 S5M1-K3 PolarHBondContact O-N 2.85Å; K3-S5 PolarHBondContact O-N 3.47Å
4T45.8Very low64.8Low110 Ų110119.1 Ų119.168%0.67559%0.593SS**THydrogen-bonded Turntrans-67.524.4176.233.30000114.5W2W2-T4 PolarHBondContact O-N 3.37Å
5S39Very low66.6Low89 Ų89114.1 Ų114.162%0.62257%0.574SS**THydrogen-bonded Turntrans-95.3-11.6-164.5-61.90000115.7K3K3-S5 PolarHBondContact O-N 3.47Å
6D44.4Very low68.2Low156 Ų156106.9 Ų106.983%0.83454%0.538SS*.  trans-127.341.4177.1-62-44.4000112.5N8D6-N8 PolarHBondContact O-N 3.43Å
7A57.9Low69.7Low56 Ų56104 Ų10446%0.46352%0.524SS..  trans-70.892.1161.600000107.1F9A7-F9 VanDerWaalsContact C-N 3.33Å; A7-F9 HydrophobicContact CB-CE1 4.37Å; A7-F9 HydrophobicContact CB-CE2 4.09Å; A7-F9 HydrophobicContact CB-CZ 3.91Å; A7-F9 WeakPolarHBondContact O-CD2 3.47Å; A7-F9 WeakPolarHBondContact O-CE2 3.49Å; A7-F9 PolarHBondContact O-N 3.08Å
8N75.3Confident71Confident130 Ų130101.8 Ų101.870%0.69553%0.531SS*.  trans-62.197176.4-163-5.5000108.1D6 S10D6-N8 PolarHBondContact O-N 3.43Å; N8-S10 PolarHBondContact O-N 3.39Å; N8-S10 WeakPolarHBondContact OD1-CB 3.49Å
9F89.8Confident72.3Confident43 Ų4397.6 Ų97.619%0.18951%0.508CS..  trans-71.613-178.9-72.9-66.6000112.9A7 H85 W86 A90 C93 L161A7-F9 VanDerWaalsContact C-N 3.33Å; A7-F9 HydrophobicContact CB-CE1 4.37Å; A7-F9 HydrophobicContact CB-CE2 4.09Å; A7-F9 HydrophobicContact CB-CZ 3.91Å; A7-F9 WeakPolarHBondContact O-CD2 3.47Å; A7-F9 WeakPolarHBondContact O-CE2 3.49Å; A7-F9 PolarHBondContact O-N 3.08Å; F9-H85 VanDerWaalsContact C-CE1 3.46Å; F9-H85 VanDerWaalsContact C-ND1 3.26Å; F9-H85 VanDerWaalsContact CB-CE1 3.47Å; F9-H85 WeakPolarHBondContact CB-CE1 3.47Å; F9-H85 CarbonylContact O-C 3.52Å; F9-H85 VanDerWaalsContact O-CA 3.25Å; F9-H85 WeakPolarHBondContact O-CA 3.39Å; F9-H85 PolarHBondContact O-ND1 3.01Å; F9-H85 VanDerWaalsContact O-ND1 3.09Å; F9-W86 HydrophobicContact CB-CB 4.11Å; F9-W86 HydrophobicContact CD1-CB 3.96Å; F9-W86 AromaticContact CD1-CD1 3.78Å; F9-W86 HydrophobicContact CD1-CG 4.16Å; F9-W86 HydrophobicContact CG-CB 4.39Å; F9-W86 PolarHBondContact O-N 3.01Å; F9-A90 HydrophobicContact CZ-CB 3.75Å; F9-C93 HydrophobicContact CE1-CB 4.46Å; F9-L161 HydrophobicContact CB-CD2 4.41Å; F9-L161 HydrophobicContact CD1-CB 4.34Å; F9-L161 WeakPolarHBondContact O-CD2 3.27Å
10S92.4Very high73.4Confident37 Ų3795.8 Ų95.826%0.25949%0.494SS..BIsolated β-bridgetrans-86136.3174.4-175.20000111.3N8 Y12 H85N8-S10 PolarHBondContact O-N 3.39Å; N8-S10 WeakPolarHBondContact OD1-CB 3.49Å; S10-Y12 WeakPolarHBondContact OG-CB 3.43Å; S10-Y12 PolarHBondContact OG-N 3.31Å; S10-H85 PolarHBondContact N-ND1 3.31Å
11C92.4Very high74.4Confident1 Ų197.6 Ų97.61%0.00750%0.495CS..  trans-110.914.2168.181.60000112H13 L84 P163 C166C11-H13 PolarHBondContact O-N 3.34Å; C11-L84 PolarHBondContact N-O 3.07Å; C11-L84 VanDerWaalsContact SG-C 3.51Å; C11-L84 WeakPolarHBondContact SG-CA 3.32Å; C11-L84 PolarHBondContact SG-O 3.32Å; C11-P163 HydrophobicContact CB-CB 4.5Å; C11-C166 HydrophobicContact CB-CB 3.63Å; C11-C166 WeakPolarHBondContact CB-SG 3.31Å; C11-C166 WeakPolarHBondContact SG-CB 3.48Å; C11-C166 CovalentContact SG-SG 2.03Å; C11-C166 PolarHBondContact SG-SG 3.31Å
12Y92.8Very high77.5Confident152 Ų15290 Ų9060%0.59646%0.463SS*.  trans-58.5124.8-177.4-177.8-91.4000111.8S10 L17 L84S10-Y12 WeakPolarHBondContact OG-CB 3.43Å; S10-Y12 PolarHBondContact OG-N 3.31Å; Y12-L17 HydrophobicContact CE2-CD2 4.3Å; Y12-L84 HydrophobicContact CD2-CD1 3.7Å; Y12-L84 HydrophobicContact CE2-CD1 4.3Å
13H91.9Very high80.6Confident60 Ų6078.6 Ų78.628%0.27842%0.42SS..  trans-162.4148.2172.9-172.8-88.1000107.9C11 S15 V16 L17 R349C11-H13 PolarHBondContact O-N 3.34Å; H13-S15 VanDerWaalsContact C-N 3.3Å; H13-S15 PolarHBondContact CE1-OG 3.13Å; H13-S15 PolarHBondContact ND1-N 3.41Å; H13-S15 PolarHBondContact ND1-OG 2.93Å; H13-S15 PolarHBondContact O-N 2.95Å; H13-V16 HydrophobicContact CB-CB 4.39Å; H13-V16 HydrophobicContact CB-CG2 3.93Å; H13-V16 WeakPolarHBondContact O-CA 3.46Å; H13-V16 PolarHBondContact O-N 3.34Å; H13-L17 PolarHBondContact O-N 3.2Å; H13-R349 PolarHBondContact CD2-NH1 2.88Å; H13-R349 PolarHBondContact CD2-NH2 3.24Å; H13-R349 PolarHBondContact NE2-NE 3.27Å
14E92.8Very high83.7Confident160 Ų16070.5 Ų70.575%0.74839%0.386SS*.Hα-helixtrans-52.8-46.1-176.7-171.3179.6179.900112.7V16 L17 G18E14-V16 VanDerWaalsContact C-N 3.33Å; E14-V16 PolarHBondContact O-N 3.42Å; E14-L17 WeakPolarHBondContact O-CB 3.1Å; E14-L17 PolarHBondContact O-N 3.04Å; E14-G18 PolarHBondContact O-N 2.94Å
15S92.4Very high86.1Confident43 Ų4368.7 Ų68.730%0.30138%0.378SS..Hα-helixtrans-62.4-35.2175.8-37.60000114.1H13 Y19H13-S15 VanDerWaalsContact C-N 3.3Å; H13-S15 PolarHBondContact CE1-OG 3.13Å; H13-S15 PolarHBondContact ND1-N 3.41Å; H13-S15 PolarHBondContact ND1-OG 2.93Å; H13-S15 PolarHBondContact O-N 2.95Å; S15-Y19 VanDerWaalsContact O-CB 3.3Å; S15-Y19 WeakPolarHBondContact O-CB 3.46Å; S15-Y19 PolarHBondContact O-N 3.16Å; S15-Y19 VanDerWaalsContact O-N 3.16Å
16V91.3Very high88.8Confident0 Ų068.5 Ų68.50%036%0.364CS..Hα-helixtrans-75-39.9179.2-174.80000109.4H13 E14 G18 Y19 R20 Y81 L84 C166 M353H13-V16 HydrophobicContact CB-CB 4.39Å; H13-V16 HydrophobicContact CB-CG2 3.93Å; H13-V16 WeakPolarHBondContact O-CA 3.46Å; H13-V16 PolarHBondContact O-N 3.34Å; E14-V16 VanDerWaalsContact C-N 3.33Å; E14-V16 PolarHBondContact O-N 3.42Å; V16-G18 PolarHBondContact O-N 2.84Å; V16-Y19 PolarHBondContact O-N 3.45Å; V16-R20 WeakPolarHBondContact O-CB 3.28Å; V16-R20 PolarHBondContact O-N 3.03Å; V16-Y81 HydrophobicContact CG1-CD1 4.37Å; V16-Y81 HydrophobicContact CG1-CE1 4.26Å; V16-L84 HydrophobicContact CB-CD2 4.38Å; V16-L84 HydrophobicContact CG1-CD2 3.57Å; V16-C166 HydrophobicContact CG1-CB 4.26Å; V16-M353 HydrophobicContact CB-SD 4.3Å; V16-M353 HydrophobicContact CG1-SD 4.18Å; V16-M353 HydrophobicContact CG2-CE 4.28Å; V16-M353 HydrophobicContact CG2-SD 3.85Å
17L93.9Very high91.3Very high57 Ų5761.1 Ų61.130%0.29832%0.324SS..Hα-helixtrans-58.1-46.2174.8-178.467.5000111.3Y12 H13 E14 R20 L84Y12-L17 HydrophobicContact CE2-CD2 4.3Å; H13-L17 PolarHBondContact O-N 3.2Å; E14-L17 WeakPolarHBondContact O-CB 3.1Å; E14-L17 PolarHBondContact O-N 3.04Å; L17-R20 VanDerWaalsContact O-CG 3.29Å; L17-R20 WeakPolarHBondContact O-CG 3.49Å; L17-L84 HydrophobicContact CB-CD1 4.39Å; L17-L84 HydrophobicContact CD1-CD1 3.74Å
18G93.8Very high93.1Very high64 Ų6461.6 Ų61.666%0.6632%0.321SS*.Hα-helixtrans-66.7-34.7176.500000113.6E14 V16E14-G18 PolarHBondContact O-N 2.94Å; V16-G18 PolarHBondContact O-N 2.84Å
19Y94.4Very high94.1Very high23 Ų2358.9 Ų58.99%0.0931%0.309CS..Hα-helixtrans-85.8-14.8-178-174.7-108.4000114.1S15 V16 Y21 V22 A23 Y81 V350 M353 L354 N357S15-Y19 VanDerWaalsContact O-CB 3.3Å; S15-Y19 WeakPolarHBondContact O-CB 3.46Å; S15-Y19 PolarHBondContact O-N 3.16Å; S15-Y19 VanDerWaalsContact O-N 3.16Å; V16-Y19 PolarHBondContact O-N 3.45Å; Y19-Y21 VanDerWaalsContact C-N 3.34Å; Y19-Y21 PolarHBondContact O-N 3.38Å; Y19-V22 HydrophobicContact CD2-CB 4.03Å; Y19-V22 HydrophobicContact CD2-CG1 4.26Å; Y19-V22 HydrophobicContact CE2-CB 3.92Å; Y19-V22 HydrophobicContact CE2-CG1 3.67Å; Y19-V22 WeakPolarHBondContact O-CB 3.28Å; Y19-V22 PolarHBondContact O-N 3.45Å; Y19-A23 HydrophobicContact CD1-CB 3.94Å; Y19-A23 HydrophobicContact CE1-CB 3.66Å; Y19-A23 PolarHBondContact O-N 3.09Å; Y19-Y81 HydrophobicContact CD1-CE1 4.24Å; Y19-V350 HydrophobicContact CD2-CG1 4.3Å; Y19-M353 HydrophobicContact CD1-CB 3.88Å; Y19-M353 HydrophobicContact CD1-CE 3.72Å; Y19-M353 HydrophobicContact CD1-CG 4.37Å; Y19-M353 HydrophobicContact CD1-SD 3.63Å; Y19-M353 HydrophobicContact CE1-CB 3.64Å; Y19-M353 HydrophobicContact CE1-SD 4.33Å; Y19-M353 HydrophobicContact CG-CE 3.88Å; Y19-M353 HydrophobicContact CG-SD 4.37Å; Y19-L354 HydrophobicContact CE2-CD2 3.83Å; Y19-L354 HydrophobicContact CE2-CG 4.22Å; Y19-L354 WeakPolarHBondContact OH-CD2 3.45Å; Y19-N357 VanDerWaalsContact CE1-ND2 3.27Å; Y19-N357 WeakPolarHBondContact CE1-ND2 3.38Å; Y19-N357 PolarHBondContact OH-ND2 2.98Å
20R94.8Very high94.3Very high61 Ų6156.9 Ų56.923%0.2330%0.3CS..Hα-helixtrans-54.4-43.6-168.576.9-174.3176.3-179.7-4.6113.9V16 L17 V22 A23 V24 L84V16-R20 WeakPolarHBondContact O-CB 3.28Å; V16-R20 PolarHBondContact O-N 3.03Å; L17-R20 VanDerWaalsContact O-CG 3.29Å; L17-R20 WeakPolarHBondContact O-CG 3.49Å; R20-V22 VanDerWaalsContact C-N 3.33Å; R20-V22 PolarHBondContact O-N 3.26Å; R20-A23 PolarHBondContact O-N 3.39Å; R20-V24 WeakPolarHBondContact O-CB 3.33Å; R20-V24 VanDerWaalsContact O-CG2 3.23Å; R20-V24 WeakPolarHBondContact O-CG2 3.34Å; R20-V24 PolarHBondContact O-N 3.48Å; R20-L84 HydrophobicContact CB-CD2 4.38Å
21Y95.3Very high94.5Very high133 Ų13355.8 Ų55.852%0.52229%0.293SS..Hα-helixtrans-73.1-29.8-176.2-67.4-63.3000112.1Y19 S25Y19-Y21 VanDerWaalsContact C-N 3.34Å; Y19-Y21 PolarHBondContact O-N 3.38Å; Y21-S25 WeakPolarHBondContact O-CB 3.41Å; Y21-S25 PolarHBondContact O-N 2.62Å; Y21-S25 PolarHBondContact O-OG 2.83Å
22V95.8Very high94.6Very high84 Ų8459.7 Ų59.751%0.50932%0.317SS..Hα-helixtrans-66.4-48.6171.9179.40000109.5Y19 R20 S25 W26Y19-V22 HydrophobicContact CD2-CB 4.03Å; Y19-V22 HydrophobicContact CD2-CG1 4.26Å; Y19-V22 HydrophobicContact CE2-CB 3.92Å; Y19-V22 HydrophobicContact CE2-CG1 3.67Å; Y19-V22 WeakPolarHBondContact O-CB 3.28Å; Y19-V22 PolarHBondContact O-N 3.45Å; R20-V22 VanDerWaalsContact C-N 3.33Å; R20-V22 PolarHBondContact O-N 3.26Å; V22-S25 PolarHBondContact O-N 2.96Å; V22-W26 VanDerWaalsContact O-CB 3.27Å; V22-W26 WeakPolarHBondContact O-CB 3.48Å; V22-W26 PolarHBondContact O-N 3.07Å
23A95.1Very high94.7Very high0 Ų055.3 Ų55.30%031%0.306CS..Hα-helixtrans-60.4-47.3176.400000112.2Y19 R20 W26 G27 Y81 W360Y19-A23 HydrophobicContact CD1-CB 3.94Å; Y19-A23 HydrophobicContact CE1-CB 3.66Å; Y19-A23 PolarHBondContact O-N 3.09Å; R20-A23 PolarHBondContact O-N 3.39Å; A23-W26 PolarHBondContact O-N 3.25Å; A23-G27 PolarHBondContact O-N 3.23Å; A23-Y81 HydrophobicContact CB-CD1 3.55Å; A23-Y81 HydrophobicContact CB-CD2 4.01Å; A23-Y81 HydrophobicContact CB-CE1 3.66Å; A23-Y81 HydrophobicContact CB-CE2 4.11Å; A23-Y81 HydrophobicContact CB-CG 3.73Å; A23-W360 WeakPolarHBondContact O-CZ3 3.25Å
24V96.4Very high94.9Very high21 Ų2152.5 Ų52.513%0.12729%0.293CS..Hα-helixtrans-61.1-50.4178.4165.20000110.8R20 W26 G27 V28 V78 L82R20-V24 WeakPolarHBondContact O-CB 3.33Å; R20-V24 VanDerWaalsContact O-CG2 3.23Å; R20-V24 WeakPolarHBondContact O-CG2 3.34Å; R20-V24 PolarHBondContact O-N 3.48Å; V24-W26 VanDerWaalsContact C-N 3.35Å; V24-W26 PolarHBondContact O-N 3.33Å; V24-G27 PolarHBondContact O-N 2.97Å; V24-V28 HydrophobicContact CG1-CG2 4.44Å; V24-V28 VanDerWaalsContact O-CG2 3.3Å; V24-V28 WeakPolarHBondContact O-CG2 3.19Å; V24-V28 PolarHBondContact O-N 3.32Å; V24-V78 HydrophobicContact CB-CG1 4.46Å; V24-V78 HydrophobicContact CG1-CG1 4Å; V24-V78 HydrophobicContact CG2-CG1 4.31Å; V24-L82 HydrophobicContact CG2-CB 4.19Å; V24-L82 HydrophobicContact CG2-CD1 4.47Å
25S96.6Very high95Very high72 Ų7246.7 Ų46.750%0.50327%0.269SS..Hα-helixtrans-60.5-47-179-57.40000111.1Y21 V22 G27 V28 V29Y21-S25 WeakPolarHBondContact O-CB 3.41Å; Y21-S25 PolarHBondContact O-N 2.62Å; Y21-S25 PolarHBondContact O-OG 2.83Å; V22-S25 PolarHBondContact O-N 2.96Å; S25-G27 VanDerWaalsContact C-N 3.34Å; S25-G27 PolarHBondContact O-N 3.31Å; S25-V28 PolarHBondContact O-N 2.83Å; S25-V29 WeakPolarHBondContact O-CG2 3.24Å; S25-V29 PolarHBondContact O-N 3.1Å
26W95.6Very high95.2Very high86 Ų8649.2 Ų49.233%0.32628%0.282SS..Hα-helixtrans-61.3-44.2175.8179.9-123.7000112.3V22 A23 V24 V28 V29 V30 N357 W360 L361V22-W26 VanDerWaalsContact O-CB 3.27Å; V22-W26 WeakPolarHBondContact O-CB 3.48Å; V22-W26 PolarHBondContact O-N 3.07Å; A23-W26 PolarHBondContact O-N 3.25Å; V24-W26 VanDerWaalsContact C-N 3.35Å; V24-W26 PolarHBondContact O-N 3.33Å; W26-V28 VanDerWaalsContact C-N 3.35Å; W26-V28 PolarHBondContact O-N 3.23Å; W26-V29 HydrophobicContact CE3-CB 4.45Å; W26-V29 HydrophobicContact CE3-CG1 4.45Å; W26-V29 HydrophobicContact CZ3-CG1 4.28Å; W26-V29 PolarHBondContact O-N 3.21Å; W26-V30 HydrophobicContact CD2-CG2 4.14Å; W26-V30 HydrophobicContact CH2-CG2 4.45Å; W26-V30 HydrophobicContact CZ2-CG2 4Å; W26-V30 WeakPolarHBondContact O-CG2 3.34Å; W26-V30 PolarHBondContact O-N 2.93Å; W26-N357 PolarHBondContact NE1-O 3.17Å; W26-N357 VanDerWaalsContact NE1-O 3.12Å; W26-W360 AromaticContact CD1-CE3 3.56Å; W26-L361 HydrophobicContact CH2-CD2 3.43Å; W26-L361 VanDerWaalsContact CH2-CD2 3.43Å; W26-L361 HydrophobicContact CH2-CG 4.25Å; W26-L361 HydrophobicContact CZ2-CD1 4.19Å; W26-L361 HydrophobicContact CZ2-CD2 3.25Å; W26-L361 HydrophobicContact CZ2-CG 3.59Å
27G95.8Very high95.4Very high0 Ų049.8 Ų49.80%029%0.288CS..Hα-helixtrans-65.3-38-178.400000113A23 V24 S25 V30 A31 Q74A23-G27 PolarHBondContact O-N 3.23Å; V24-G27 PolarHBondContact O-N 2.97Å; S25-G27 VanDerWaalsContact C-N 3.34Å; S25-G27 PolarHBondContact O-N 3.31Å; G27-V30 PolarHBondContact O-N 3.37Å; G27-A31 WeakPolarHBondContact O-CB 3.35Å; G27-A31 PolarHBondContact O-N 2.97Å; G27-Q74 WeakPolarHBondContact O-CG 3.5Å; G27-Q74 PolarHBondContact O-NE2 3.03Å
28V96.6Very high95.4Very high67 Ų6747.1 Ų47.141%0.40627%0.274SS..Hα-helixtrans-64.8-44.6172.9170.70000110.9V24 S25 W26 V30 A31 V32 V78V24-V28 HydrophobicContact CG1-CG2 4.44Å; V24-V28 VanDerWaalsContact O-CG2 3.3Å; V24-V28 WeakPolarHBondContact O-CG2 3.19Å; V24-V28 PolarHBondContact O-N 3.32Å; S25-V28 PolarHBondContact O-N 2.83Å; W26-V28 VanDerWaalsContact C-N 3.35Å; W26-V28 PolarHBondContact O-N 3.23Å; V28-V30 VanDerWaalsContact C-N 3.34Å; V28-V30 PolarHBondContact O-N 3.36Å; V28-A31 PolarHBondContact O-N 2.69Å; V28-V32 HydrophobicContact CG1-CG2 4.27Å; V28-V32 WeakPolarHBondContact O-CB 3.31Å; V28-V32 WeakPolarHBondContact O-CG2 3.43Å; V28-V32 PolarHBondContact O-N 3.18Å; V28-V78 HydrophobicContact CG2-CG1 4.03Å; V28-V78 HydrophobicContact CG2-CG2 4.44Å
29V95.7Very high95.5Very high73 Ų7347 Ų4744%0.44226%0.26SS..Hα-helixtrans-57.7-48175.9169.30000110.6S25 W26 T33S25-V29 WeakPolarHBondContact O-CG2 3.24Å; S25-V29 PolarHBondContact O-N 3.1Å; W26-V29 HydrophobicContact CE3-CB 4.45Å; W26-V29 HydrophobicContact CE3-CG1 4.45Å; W26-V29 HydrophobicContact CZ3-CG1 4.28Å; W26-V29 PolarHBondContact O-N 3.21Å; V29-T33 HydrophobicContact CG1-CG2 4.24Å; V29-T33 VanDerWaalsContact O-CB 3.31Å; V29-T33 WeakPolarHBondContact O-CB 3.36Å; V29-T33 VanDerWaalsContact O-CG2 3.27Å; V29-T33 WeakPolarHBondContact O-CG2 3.49Å; V29-T33 PolarHBondContact O-N 3.47Å; V29-T33 PolarHBondContact O-OG1 2.85Å
30V94.6Very high95.5Very high0 Ų047.2 Ų47.20%026%0.263CS..Hα-helixtrans-61.7-45.1177.1170.70000111.5W26 G27 V28 T33 G34 Q74 W360 C364W26-V30 HydrophobicContact CD2-CG2 4.14Å; W26-V30 HydrophobicContact CH2-CG2 4.45Å; W26-V30 HydrophobicContact CZ2-CG2 4Å; W26-V30 WeakPolarHBondContact O-CG2 3.34Å; W26-V30 PolarHBondContact O-N 2.93Å; G27-V30 PolarHBondContact O-N 3.37Å; V28-V30 VanDerWaalsContact C-N 3.34Å; V28-V30 PolarHBondContact O-N 3.36Å; V30-T33 PolarHBondContact O-OG1 3.29Å; V30-G34 WeakPolarHBondContact O-CA 3.48Å; V30-G34 PolarHBondContact O-N 2.98Å; V30-Q74 HydrophobicContact CG1-CG 4.38Å; V30-W360 HydrophobicContact CG1-CB 4.16Å; V30-W360 VanDerWaalsContact CG1-O 3.22Å; V30-W360 WeakPolarHBondContact CG1-O 3.43Å; V30-W360 HydrophobicContact CG2-CB 4.23Å; V30-C364 HydrophobicContact CG1-CB 4.38Å
31A96Very high95.4Very high14 Ų1444.3 Ų44.312%0.11625%0.252CS..Hα-helixtrans-61.4-47.6-179.500000111.7G27 V28 T35 Q74G27-A31 WeakPolarHBondContact O-CB 3.35Å; G27-A31 PolarHBondContact O-N 2.97Å; V28-A31 PolarHBondContact O-N 2.69Å; A31-T35 WeakPolarHBondContact O-CB 3.41Å; A31-T35 PolarHBondContact O-N 3.07Å; A31-T35 PolarHBondContact O-OG1 3.24Å; A31-Q74 HydrophobicContact CB-CB 4.29Å; A31-Q74 HydrophobicContact CB-CG 3.82Å
32V95.9Very high95.3Very high83 Ų8340.5 Ų40.550%0.50324%0.24SC..Hα-helixtrans-68.1-52.6-179.1173.60000110.7V28 G34 T35 V36V28-V32 HydrophobicContact CG1-CG2 4.27Å; V28-V32 WeakPolarHBondContact O-CB 3.31Å; V28-V32 WeakPolarHBondContact O-CG2 3.43Å; V28-V32 PolarHBondContact O-N 3.18Å; V32-G34 PolarHBondContact O-N 3.2Å; V32-T35 PolarHBondContact O-N 3.3Å; V32-V36 HydrophobicContact CG1-CG2 4.37Å; V32-V36 WeakPolarHBondContact O-CB 3.31Å; V32-V36 VanDerWaalsContact O-CG2 3.27Å; V32-V36 WeakPolarHBondContact O-CG2 3.39Å; V32-V36 PolarHBondContact O-N 3.27Å
33T94.6Very high95.1Very high61 Ų6139 Ų3937%0.37423%0.229SC..Hα-helixtrans-63.7-42.5-177.955.80000111.8V29 V30 G37 C364V29-T33 HydrophobicContact CG1-CG2 4.24Å; V29-T33 VanDerWaalsContact O-CB 3.31Å; V29-T33 WeakPolarHBondContact O-CB 3.36Å; V29-T33 VanDerWaalsContact O-CG2 3.27Å; V29-T33 WeakPolarHBondContact O-CG2 3.49Å; V29-T33 PolarHBondContact O-N 3.47Å; V29-T33 PolarHBondContact O-OG1 2.85Å; V30-T33 PolarHBondContact O-OG1 3.29Å; T33-G37 WeakPolarHBondContact O-CA 3.33Å; T33-G37 PolarHBondContact O-N 3.42Å; T33-C364 WeakPolarHBondContact OG1-CB 3.43Å
34G94.9Very high94.9Very high0 Ų039 Ų390%023%0.229CC..Hα-helixtrans-66.5-45.3177.100000112.4V30 V32 N38V30-G34 WeakPolarHBondContact O-CA 3.48Å; V30-G34 PolarHBondContact O-N 2.98Å; V32-G34 PolarHBondContact O-N 3.2Å; G34-N38 VanDerWaalsContact O-CB 3.25Å; G34-N38 WeakPolarHBondContact O-CB 3.31Å; G34-N38 PolarHBondContact O-N 2.97Å; G34-N38 PolarHBondContact O-ND2 2.8Å
35T96.1Very high94.7Very high39 Ų3938.7 Ų38.724%0.23923%0.227CC..Hα-helixtrans-63.7-53.1178.1-58.90000111.1A31 V32 G37 N38 V39 T71A31-T35 WeakPolarHBondContact O-CB 3.41Å; A31-T35 PolarHBondContact O-N 3.07Å; A31-T35 PolarHBondContact O-OG1 3.24Å; V32-T35 PolarHBondContact O-N 3.3Å; T35-G37 PolarHBondContact O-N 3.02Å; T35-N38 PolarHBondContact O-N 3.44Å; T35-V39 HydrophobicContact CG2-CG2 4.34Å; T35-V39 WeakPolarHBondContact O-CB 3.23Å; T35-V39 VanDerWaalsContact O-CG2 3.24Å; T35-V39 WeakPolarHBondContact O-CG2 3.47Å; T35-V39 PolarHBondContact O-N 3.07Å; T35-T71 HydrophobicContact CG2-CG2 3.67Å
36V95.6Very high94.3Very high95 Ų9538 Ų3858%0.57622%0.22SC*.Hα-helixtrans-60.8-46.6-179173.40000110.9V32 L40V32-V36 HydrophobicContact CG1-CG2 4.37Å; V32-V36 WeakPolarHBondContact O-CB 3.31Å; V32-V36 VanDerWaalsContact O-CG2 3.27Å; V32-V36 WeakPolarHBondContact O-CG2 3.39Å; V32-V36 PolarHBondContact O-N 3.27Å; V36-L40 VanDerWaalsContact O-CB 3.31Å; V36-L40 WeakPolarHBondContact O-CB 3.38Å; V36-L40 PolarHBondContact O-N 3Å
37G94.8Very high93.9Very high13 Ų1334.7 Ų34.713%0.13421%0.208CC..Hα-helixtrans-63.6-45.9-179.200000112.9T33 T35 L40 T41 P367T33-G37 WeakPolarHBondContact O-CA 3.33Å; T33-G37 PolarHBondContact O-N 3.42Å; T35-G37 PolarHBondContact O-N 3.02Å; G37-L40 PolarHBondContact O-N 3.19Å; G37-T41 PolarHBondContact O-N 3.02Å; G37-T41 PolarHBondContact O-OG1 3.43Å; G37-P367 VanDerWaalsContact C-CB 3.47Å
38N95.5Very high93.4Very high0 Ų037.6 Ų37.60%022%0.222CC..Hα-helixtrans-73.5-35.4-178.9-72.5-65000112.1G34 T35 T41 L42 D66 L67 G363 P367G34-N38 VanDerWaalsContact O-CB 3.25Å; G34-N38 WeakPolarHBondContact O-CB 3.31Å; G34-N38 PolarHBondContact O-N 2.97Å; G34-N38 PolarHBondContact O-ND2 2.8Å; T35-N38 PolarHBondContact O-N 3.44Å; N38-T41 WeakPolarHBondContact O-CB 3.41Å; N38-T41 PolarHBondContact O-N 3.39Å; N38-L42 WeakPolarHBondContact O-CB 3.39Å; N38-L42 PolarHBondContact O-N 3.37Å; N38-D66 WeakPolarHBondContact ND2-CB 3.32Å; N38-L67 HydrophobicContact CB-CD1 4.45Å; N38-L67 HydrophobicContact CB-CD2 3.69Å; N38-L67 HydrophobicContact CB-CG 3.69Å; N38-G363 PolarHBondContact ND2-O 3.39Å; N38-P367 HydrophobicContact CB-CG 4.27Å; N38-P367 VanDerWaalsContact CG-CG 3.47Å; N38-P367 VanDerWaalsContact OD1-CG 3.22Å; N38-P367 WeakPolarHBondContact OD1-CG 3.35Å
39V95.5Very high92.7Very high61 Ų6142.7 Ų42.737%0.3723%0.234SC..Hα-helixtrans-60.5-46.5170.31690000110.4T35 T41 L42 L43 L67T35-V39 HydrophobicContact CG2-CG2 4.34Å; T35-V39 WeakPolarHBondContact O-CB 3.23Å; T35-V39 VanDerWaalsContact O-CG2 3.24Å; T35-V39 WeakPolarHBondContact O-CG2 3.47Å; T35-V39 PolarHBondContact O-N 3.07Å; V39-T41 VanDerWaalsContact C-N 3.28Å; V39-T41 PolarHBondContact O-N 3.37Å; V39-L42 PolarHBondContact O-N 2.87Å; V39-L43 HydrophobicContact CG1-CD1 3.86Å; V39-L43 HydrophobicContact CG1-CG 4.22Å; V39-L43 WeakPolarHBondContact O-CB 3.18Å; V39-L43 VanDerWaalsContact O-CG 3.31Å; V39-L43 WeakPolarHBondContact O-CG 3.47Å; V39-L43 PolarHBondContact O-N 3.28Å; V39-L67 HydrophobicContact CG2-CD2 3.77Å
40L93.5Very high92.1Very high28 Ų2847.6 Ų47.615%0.14725%0.249CC..Hα-helixtrans-60.5-40.1176.7-17962000111.7V36 G37 L43 A44 Y381 V384 L385V36-L40 VanDerWaalsContact O-CB 3.31Å; V36-L40 WeakPolarHBondContact O-CB 3.38Å; V36-L40 PolarHBondContact O-N 3Å; G37-L40 PolarHBondContact O-N 3.19Å; L40-L43 PolarHBondContact O-N 2.94Å; L40-A44 VanDerWaalsContact O-CB 3.27Å; L40-A44 WeakPolarHBondContact O-CB 3.43Å; L40-A44 PolarHBondContact O-N 3.24Å; L40-Y381 HydrophobicContact CD1-CD1 4.46Å; L40-Y381 HydrophobicContact CD2-CD1 4.21Å; L40-Y381 HydrophobicContact CD2-CD2 3.98Å; L40-Y381 HydrophobicContact CD2-CG 3.79Å; L40-Y381 HydrophobicContact CG-CD1 3.85Å; L40-Y381 HydrophobicContact CG-CD2 4.46Å; L40-Y381 HydrophobicContact CG-CE1 4.32Å; L40-Y381 HydrophobicContact CG-CG 3.95Å; L40-V384 HydrophobicContact CD1-CB 3.94Å; L40-V384 HydrophobicContact CD1-CG1 3.71Å; L40-L385 HydrophobicContact CD1-CD2 4.43Å; L40-L385 HydrophobicContact CD1-CG 4.29Å; L40-L385 HydrophobicContact CD2-CD1 4.39Å
41T93.3Very high91.5Very high0 Ų047.8 Ų47.80%025%0.25CS..Hα-helixtrans-61.7-47.7176.1-51.60000111.2G37 N38 V39 A44 L45 I59 T63 Y370 F377 Y381G37-T41 PolarHBondContact O-N 3.02Å; G37-T41 PolarHBondContact O-OG1 3.43Å; N38-T41 WeakPolarHBondContact O-CB 3.41Å; N38-T41 PolarHBondContact O-N 3.39Å; V39-T41 VanDerWaalsContact C-N 3.28Å; V39-T41 PolarHBondContact O-N 3.37Å; T41-A44 PolarHBondContact O-N 3.34Å; T41-L45 WeakPolarHBondContact O-CG 3.47Å; T41-L45 PolarHBondContact O-N 3.5Å; T41-L45 VanDerWaalsContact O-N 3.07Å; T41-I59 HydrophobicContact CG2-CG2 4.25Å; T41-T63 HydrophobicContact CG2-CG2 3.44Å; T41-T63 VanDerWaalsContact CG2-CG2 3.44Å; T41-Y370 HydrophobicContact CG2-CD2 3.91Å; T41-Y370 HydrophobicContact CG2-CE2 4.15Å; T41-F377 HydrophobicContact CG2-CD1 4.22Å; T41-F377 HydrophobicContact CG2-CE1 3.84Å; T41-Y381 WeakPolarHBondContact CB-OH 3.37Å; T41-Y381 WeakPolarHBondContact CG2-OH 3.2Å; T41-Y381 PolarHBondContact OG1-OH 2.96Å
42L93.9Very high90.9Very high53 Ų5353.4 Ų53.428%0.27727%0.268SS..Hα-helixtrans-63.4-45.9178.5-172.663.5000111.5N38 V39 A44 L45 V46 L64 L67N38-L42 WeakPolarHBondContact O-CB 3.39Å; N38-L42 PolarHBondContact O-N 3.37Å; V39-L42 PolarHBondContact O-N 2.87Å; L42-A44 VanDerWaalsContact C-N 3.33Å; L42-A44 PolarHBondContact O-N 2.91Å; L42-L45 WeakPolarHBondContact O-CB 3.47Å; L42-L45 PolarHBondContact O-N 3.46Å; L42-V46 WeakPolarHBondContact O-CG2 3.44Å; L42-V46 PolarHBondContact O-N 3.05Å; L42-L64 HydrophobicContact CD2-CD2 4.46Å; L42-L67 HydrophobicContact CD2-CD1 4.12Å
43L91.7Very high90.4Very high52 Ų5252.3 Ų52.327%0.27226%0.262SS..Hα-helixtrans-60.2-41.6175.5-73.3176.1000112V39 L40 L45 V46 I47 V384 F392V39-L43 HydrophobicContact CG1-CD1 3.86Å; V39-L43 HydrophobicContact CG1-CG 4.22Å; V39-L43 WeakPolarHBondContact O-CB 3.18Å; V39-L43 VanDerWaalsContact O-CG 3.31Å; V39-L43 WeakPolarHBondContact O-CG 3.47Å; V39-L43 PolarHBondContact O-N 3.28Å; L40-L43 PolarHBondContact O-N 2.94Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-L45 PolarHBondContact O-N 3.42Å; L43-V46 PolarHBondContact O-N 3.42Å; L43-I47 HydrophobicContact CB-CD1 4.31Å; L43-I47 WeakPolarHBondContact O-CB 3.15Å; L43-I47 WeakPolarHBondContact O-CD1 3.48Å; L43-I47 VanDerWaalsContact O-CG1 3.31Å; L43-I47 WeakPolarHBondContact O-CG1 3.07Å; L43-I47 PolarHBondContact O-N 2.95Å; L43-V384 HydrophobicContact CB-CG1 4.31Å; L43-V384 HydrophobicContact CD1-CG1 4.46Å; L43-F392 HydrophobicContact CD2-CE1 4.32Å; L43-F392 HydrophobicContact CD2-CZ 3.98Å
44A90.9Very high89.9Confident0 Ų055.2 Ų55.20%027%0.266CS..Hα-helixtrans-62.3-41177.300000112.3L40 T41 L42 Q48 A380 Y381 V384L40-A44 VanDerWaalsContact O-CB 3.27Å; L40-A44 WeakPolarHBondContact O-CB 3.43Å; L40-A44 PolarHBondContact O-N 3.24Å; T41-A44 PolarHBondContact O-N 3.34Å; L42-A44 VanDerWaalsContact C-N 3.33Å; L42-A44 PolarHBondContact O-N 2.91Å; A44-Q48 VanDerWaalsContact O-CB 3.23Å; A44-Q48 WeakPolarHBondContact O-CB 3.39Å; A44-Q48 PolarHBondContact O-N 3Å; A44-A380 HydrophobicContact CB-CB 3.89Å; A44-Y381 HydrophobicContact CB-CD1 3.68Å; A44-Y381 HydrophobicContact CB-CE1 3.71Å; A44-V384 HydrophobicContact CB-CG2 4.36Å
45L91Very high89.2Confident15 Ų1555.6 Ų55.68%0.07927%0.268CS..Hα-helixtrans-65.3-42.4174.8-70.6173.9000111.9T41 L42 L43 L51 R52 N56 I59 A60 F377T41-L45 WeakPolarHBondContact O-CG 3.47Å; T41-L45 PolarHBondContact O-N 3.5Å; T41-L45 VanDerWaalsContact O-N 3.07Å; L42-L45 WeakPolarHBondContact O-CB 3.47Å; L42-L45 PolarHBondContact O-N 3.46Å; L43-L45 VanDerWaalsContact C-N 3.34Å; L43-L45 PolarHBondContact O-N 3.42Å; L45-L51 HydrophobicContact CD2-CB 4.18Å; L45-R52 VanDerWaalsContact O-CG 3.28Å; L45-R52 WeakPolarHBondContact O-CG 3.48Å; L45-N56 HydrophobicContact CD2-CB 3.84Å; L45-I59 HydrophobicContact CD1-CG2 4.39Å; L45-A60 HydrophobicContact CD1-CB 3.89Å; L45-F377 HydrophobicContact CD2-CE1 3.78Å; L45-F377 HydrophobicContact CD2-CZ 3.69Å; L45-F377 HydrophobicContact CG-CE1 4.04Å; L45-F377 HydrophobicContact CG-CZ 4.39Å
46V89.3Confident88.8Confident59 Ų5954.1 Ų54.136%0.35826%0.258SS..Hα-helixtrans-68.3-48.4178.9172.80000110.5L42 L43 R52 L395L42-V46 WeakPolarHBondContact O-CG2 3.44Å; L42-V46 PolarHBondContact O-N 3.05Å; L43-V46 PolarHBondContact O-N 3.42Å; V46-R52 PolarHBondContact O-NE 3.49Å; V46-R52 PolarHBondContact O-NH2 3.48Å; V46-L395 HydrophobicContact CG1-CD1 4.23Å; V46-L395 HydrophobicContact CG1-CD2 4Å
47I86.4Confident88.6Confident15 Ų1553.6 Ų53.68%0.07725%0.252CS..Hα-helixtrans-73.6-42.2-173.2-68.8162000111.7L43 R49 V384 L395L43-I47 HydrophobicContact CB-CD1 4.31Å; L43-I47 WeakPolarHBondContact O-CB 3.15Å; L43-I47 WeakPolarHBondContact O-CD1 3.48Å; L43-I47 VanDerWaalsContact O-CG1 3.31Å; L43-I47 WeakPolarHBondContact O-CG1 3.07Å; L43-I47 PolarHBondContact O-N 2.95Å; I47-R49 PolarHBondContact O-N 3.35Å; I47-V384 HydrophobicContact CD1-CG1 4.33Å; I47-V384 HydrophobicContact CD1-CG2 3.85Å; I47-L395 HydrophobicContact CG1-CD1 4.23Å
48Q86.1Confident88.4Confident61 Ų6153 Ų5329%0.28525%0.245SC..  trans-91.1102.1-170.3-174.466.6-12.800111.8A44 K50 L51 R52 A380A44-Q48 VanDerWaalsContact O-CB 3.23Å; A44-Q48 WeakPolarHBondContact O-CB 3.39Å; A44-Q48 PolarHBondContact O-N 3Å; Q48-K50 HydrophobicContact CG-CB 4.18Å; Q48-K50 PolarHBondContact O-N 3.32Å; Q48-K50 VanDerWaalsContact O-N 3.1Å; Q48-L51 HydrophobicContact CB-CB 4.26Å; Q48-L51 HydrophobicContact CB-CD1 3.95Å; Q48-L51 HydrophobicContact CB-CG 4.31Å; Q48-L51 HydrophobicContact CG-CB 4.29Å; Q48-L51 HydrophobicContact CG-CD1 3.98Å; Q48-L51 HydrophobicContact CG-CG 4.02Å; Q48-L51 WeakPolarHBondContact O-CB 3.18Å; Q48-L51 PolarHBondContact O-N 2.91Å; Q48-R52 PolarHBondContact O-N 3.48Å; Q48-A380 HydrophobicContact CB-CB 4.43Å
49R82.4Confident88.2Confident174 Ų17453.1 Ų53.166%0.65725%0.246SC*.G310 helixtrans-54-34.3177.8-63.6-174.6-172.1172.22.2113.4I47 L51 R52 R394I47-R49 PolarHBondContact O-N 3.35Å; R49-L51 PolarHBondContact O-N 2.91Å; R49-R52 WeakPolarHBondContact O-CB 3.24Å; R49-R52 PolarHBondContact O-N 3.06Å; R49-R52 VanDerWaalsContact O-N 3.07Å; R49-R394 PolarHBondContact NH2-O 3.37Å
50K82.4Confident88Confident177 Ų17751.1 Ų51.177%0.7724%0.236SC*.G310 helixtrans-62.9-24.7176.4-61.9-172.8179.9-175.20113.7Q48Q48-K50 HydrophobicContact CG-CB 4.18Å; Q48-K50 PolarHBondContact O-N 3.32Å; Q48-K50 VanDerWaalsContact O-N 3.1Å
51L81.8Confident88.1Confident4 Ų450.2 Ų50.22%0.02123%0.232CC..G310 helixtrans-92.1-7.4176.9-75.9169.8000112.6L45 Q48 R49 T53 N56 Q376 F377 A380L45-L51 HydrophobicContact CD2-CB 4.18Å; Q48-L51 HydrophobicContact CB-CB 4.26Å; Q48-L51 HydrophobicContact CB-CD1 3.95Å; Q48-L51 HydrophobicContact CB-CG 4.31Å; Q48-L51 HydrophobicContact CG-CB 4.29Å; Q48-L51 HydrophobicContact CG-CD1 3.98Å; Q48-L51 HydrophobicContact CG-CG 4.02Å; Q48-L51 WeakPolarHBondContact O-CB 3.18Å; Q48-L51 PolarHBondContact O-N 2.91Å; R49-L51 PolarHBondContact O-N 2.91Å; L51-T53 PolarHBondContact O-N 3.34Å; L51-N56 WeakPolarHBondContact O-CB 3.23Å; L51-N56 PolarHBondContact O-ND2 3.16Å; L51-Q376 HydrophobicContact CD2-CB 3.97Å; L51-F377 HydrophobicContact CD2-CD2 4.05Å; L51-F377 HydrophobicContact CD2-CE2 3.95Å; L51-F377 HydrophobicContact CD2-CZ 4.38Å; L51-A380 HydrophobicContact CD1-CB 3.33Å
52R84.1Confident88.1Confident131 Ų13150.2 Ų50.249%0.49423%0.232SC..  trans-79.361.4178.5-62.3-175.7-168.8174.8-0.2111.2L45 V46 Q48 R49L45-R52 VanDerWaalsContact O-CG 3.28Å; L45-R52 WeakPolarHBondContact O-CG 3.48Å; V46-R52 PolarHBondContact O-NE 3.49Å; V46-R52 PolarHBondContact O-NH2 3.48Å; Q48-R52 PolarHBondContact O-N 3.48Å; R49-R52 WeakPolarHBondContact O-CB 3.24Å; R49-R52 PolarHBondContact O-N 3.06Å; R49-R52 VanDerWaalsContact O-N 3.07Å
53T85.7Confident88.1Confident61 Ų6147.7 Ų47.737%0.37422%0.218SC..  trans-97.6152.4174.970.20000110.1L51 F55 N56 L57L51-T53 PolarHBondContact O-N 3.34Å; T53-F55 PolarHBondContact O-N 3.47Å; T53-N56 PolarHBondContact O-N 3.05Å; T53-N56 WeakPolarHBondContact OG1-CB 3.34Å; T53-N56 PolarHBondContact OG1-N 3.29Å; T53-N56 PolarHBondContact OG1-ND2 2.93Å; T53-L57 PolarHBondContact O-N 2.8Å
54R83.2Confident88.2Confident122 Ų12249.3 Ų49.346%0.4623%0.227SC..THydrogen-bonded Turntrans-46.7-43.8171-81.1-169.8-157167.36.2112.6L57 F132 I137R54-L57 WeakPolarHBondContact O-CB 3.37Å; R54-L57 PolarHBondContact O-N 2.88Å; R54-F132 VanDerWaalsContact CD-O 3.27Å; R54-F132 WeakPolarHBondContact CD-O 3.38Å; R54-F132 PolarHBondContact NH1-O 3.47Å; R54-I137 HydrophobicContact CB-CD1 3.3Å; R54-I137 HydrophobicContact CG-CD1 3.77Å; R54-I137 VanDerWaalsContact O-CD1 3.24Å; R54-I137 WeakPolarHBondContact O-CD1 3.41Å
55F80.6Confident88.4Confident8 Ų849.3 Ų49.34%0.03523%0.227CC..THydrogen-bonded Turntrans-64-40.7177.4-178.5-91.7000113T53 L57 L58 I59 I114 R118T53-F55 PolarHBondContact O-N 3.47Å; F55-L57 PolarHBondContact O-N 2.72Å; F55-L58 WeakPolarHBondContact O-CB 3.37Å; F55-L58 PolarHBondContact O-N 2.85Å; F55-L58 VanDerWaalsContact O-N 3.15Å; F55-I59 HydrophobicContact CE1-CD1 4.33Å; F55-I114 HydrophobicContact CZ-CB 4.49Å; F55-I114 HydrophobicContact CZ-CG2 3.83Å; F55-R118 VanDerWaalsContact CE1-NE 3.32Å; F55-R118 HydrophobicContact CE2-CG 3.78Å; F55-R118 VanDerWaalsContact CZ-CD 3.46Å; F55-R118 HydrophobicContact CZ-CG 3.57Å; F55-R118 VanDerWaalsContact CZ-CZ 3.46Å
56N87.4Confident88.6Confident7 Ų748.8 Ų48.84%0.03722%0.224CC..Hα-helixtrans-72.9-10-178.7-67.9-15.3000113.3L45 L51 T53 L58 I59 A60L45-N56 HydrophobicContact CD2-CB 3.84Å; L51-N56 WeakPolarHBondContact O-CB 3.23Å; L51-N56 PolarHBondContact O-ND2 3.16Å; T53-N56 PolarHBondContact O-N 3.05Å; T53-N56 WeakPolarHBondContact OG1-CB 3.34Å; T53-N56 PolarHBondContact OG1-N 3.29Å; T53-N56 PolarHBondContact OG1-ND2 2.93Å; N56-L58 VanDerWaalsContact C-N 3.27Å; N56-L58 PolarHBondContact O-N 3.44Å; N56-I59 WeakPolarHBondContact O-CB 3.43Å; N56-I59 PolarHBondContact O-N 2.98Å; N56-A60 PolarHBondContact O-N 3.32Å
57L90.1Very high88.9Confident84 Ų8447 Ų4744%0.4421%0.213SC..Hα-helixtrans-67.2-28168.7-65.5175.4000112.5T53 R54 F55 I59 A60 N61 I137T53-L57 PolarHBondContact O-N 2.8Å; R54-L57 WeakPolarHBondContact O-CB 3.37Å; R54-L57 PolarHBondContact O-N 2.88Å; F55-L57 PolarHBondContact O-N 2.72Å; L57-I59 VanDerWaalsContact C-N 3.34Å; L57-A60 WeakPolarHBondContact O-CB 3.42Å; L57-A60 PolarHBondContact O-N 3Å; L57-N61 PolarHBondContact O-N 3.5Å; L57-I137 HydrophobicContact CB-CG2 4.11Å; L57-I137 HydrophobicContact CD1-CG2 3.88Å
58L91.1Very high89.3Confident0 Ų048.4 Ų48.40%022%0.22CC..Hα-helixtrans-66.8-39.3171.5-60.5176.7000111F55 N56 A60 N61 L62 T110 L113 I114 F132 L141F55-L58 WeakPolarHBondContact O-CB 3.37Å; F55-L58 PolarHBondContact O-N 2.85Å; F55-L58 VanDerWaalsContact O-N 3.15Å; N56-L58 VanDerWaalsContact C-N 3.27Å; N56-L58 PolarHBondContact O-N 3.44Å; L58-A60 VanDerWaalsContact C-N 3.31Å; L58-N61 WeakPolarHBondContact O-CB 3.4Å; L58-N61 PolarHBondContact O-N 3.15Å; L58-L62 PolarHBondContact O-N 3.26Å; L58-T110 HydrophobicContact CB-CG2 4.34Å; L58-T110 WeakPolarHBondContact O-CG2 2.89Å; L58-L113 HydrophobicContact CD1-CB 4.14Å; L58-L113 HydrophobicContact CD2-CB 4.24Å; L58-L113 HydrophobicContact CD2-CD1 4.37Å; L58-I114 HydrophobicContact CB-CD1 4.35Å; L58-I114 HydrophobicContact CB-CG1 3.72Å; L58-I114 HydrophobicContact CD1-CG1 4.05Å; L58-F132 HydrophobicContact CD1-CE1 3.85Å; L58-F132 HydrophobicContact CD1-CZ 4.43Å; L58-L141 HydrophobicContact CD2-CD2 3.75Å
59I90.8Very high89.7Confident3 Ų346.4 Ų46.42%0.01521%0.21CC..Hα-helixtrans-64.4-40.9174.2-60.6174.2000109.7T41 L45 F55 N56 L57 N61 L62 T63 I114 Y370 F377T41-I59 HydrophobicContact CG2-CG2 4.25Å; L45-I59 HydrophobicContact CD1-CG2 4.39Å; F55-I59 HydrophobicContact CE1-CD1 4.33Å; N56-I59 WeakPolarHBondContact O-CB 3.43Å; N56-I59 PolarHBondContact O-N 2.98Å; L57-I59 VanDerWaalsContact C-N 3.34Å; I59-N61 VanDerWaalsContact C-N 3.34Å; I59-N61 PolarHBondContact O-N 3.25Å; I59-L62 PolarHBondContact O-N 2.73Å; I59-T63 HydrophobicContact CG2-CG2 4.4Å; I59-T63 VanDerWaalsContact O-CG2 3.32Å; I59-T63 WeakPolarHBondContact O-CG2 3.37Å; I59-T63 PolarHBondContact O-N 3.46Å; I59-T63 PolarHBondContact O-OG1 3.42Å; I59-I114 HydrophobicContact CG1-CD1 4.34Å; I59-Y370 HydrophobicContact CG2-CD2 4.37Å; I59-Y370 HydrophobicContact CG2-CE2 3.55Å; I59-F377 HydrophobicContact CB-CZ 4.49Å; I59-F377 HydrophobicContact CD1-CE2 3.79Å; I59-F377 HydrophobicContact CD1-CZ 3.69Å; I59-F377 HydrophobicContact CG2-CE1 4.28Å; I59-F377 HydrophobicContact CG2-CZ 3.97Å
60A92.9Very high90.4Very high19 Ų1938.2 Ų38.216%0.15718%0.179CC..Hα-helixtrans-58.3-44.7173.700000111.9L45 N56 L57 L58 L62 T63 L64L45-A60 HydrophobicContact CD1-CB 3.89Å; N56-A60 PolarHBondContact O-N 3.32Å; L57-A60 WeakPolarHBondContact O-CB 3.42Å; L57-A60 PolarHBondContact O-N 3Å; L58-A60 VanDerWaalsContact C-N 3.31Å; A60-L62 VanDerWaalsContact C-N 3.35Å; A60-L62 PolarHBondContact O-N 3.25Å; A60-T63 WeakPolarHBondContact CA-OG1 3.34Å; A60-T63 PolarHBondContact O-N 3.03Å; A60-T63 PolarHBondContact O-OG1 3.21Å; A60-L64 WeakPolarHBondContact O-CG 3.31Å; A60-L64 PolarHBondContact O-N 3.03Å
61N94.8Very high91Very high10 Ų1033 Ų335%0.05316%0.162CC..Hα-helixtrans-60-43.9176.5-17060.1000112.6L57 L58 I59 T63 L64 A65 T110 L141 T144 W145L57-N61 PolarHBondContact O-N 3.5Å; L58-N61 WeakPolarHBondContact O-CB 3.4Å; L58-N61 PolarHBondContact O-N 3.15Å; I59-N61 VanDerWaalsContact C-N 3.34Å; I59-N61 PolarHBondContact O-N 3.25Å; N61-T63 PolarHBondContact O-N 3.33Å; N61-L64 PolarHBondContact O-N 3Å; N61-A65 PolarHBondContact O-N 2.85Å; N61-A65 VanDerWaalsContact O-N 3.11Å; N61-T110 HydrophobicContact CB-CG2 4.47Å; N61-T110 PolarHBondContact ND2-OG1 2.88Å; N61-L141 HydrophobicContact CB-CD2 3.5Å; N61-T144 PolarHBondContact ND2-OG1 2.91Å; N61-W145 PolarHBondContact OD1-NE1 2.92Å
62L92.5Very high91.5Very high0 Ų035.1 Ų35.10%018%0.175CC..Hα-helixtrans-60.3-46.1175.3-17362.3000111.1L58 I59 A60 L64 A65 D66 T110 L111 I114 N366 Y370L58-L62 PolarHBondContact O-N 3.26Å; I59-L62 PolarHBondContact O-N 2.73Å; A60-L62 VanDerWaalsContact C-N 3.35Å; A60-L62 PolarHBondContact O-N 3.25Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 2.66Å; L62-A65 PolarHBondContact O-N 3.47Å; L62-D66 VanDerWaalsContact O-CG 3.31Å; L62-D66 PolarHBondContact O-N 2.86Å; L62-T110 HydrophobicContact CB-CG2 3.94Å; L62-L111 HydrophobicContact CD2-CD2 4.02Å; L62-I114 HydrophobicContact CD2-CD1 4.35Å; L62-N366 HydrophobicContact CD2-CB 4.4Å; L62-Y370 WeakPolarHBondContact CD2-OH 3.21Å
63T94.1Very high92.1Very high0 Ų028.9 Ų28.90%015%0.152CC..Hα-helixtrans-63.4-31.8178.3590000113.1T41 I59 A60 N61 L67T41-T63 HydrophobicContact CG2-CG2 3.44Å; T41-T63 VanDerWaalsContact CG2-CG2 3.44Å; I59-T63 HydrophobicContact CG2-CG2 4.4Å; I59-T63 VanDerWaalsContact O-CG2 3.32Å; I59-T63 WeakPolarHBondContact O-CG2 3.37Å; I59-T63 PolarHBondContact O-N 3.46Å; I59-T63 PolarHBondContact O-OG1 3.42Å; A60-T63 WeakPolarHBondContact CA-OG1 3.34Å; A60-T63 PolarHBondContact O-N 3.03Å; A60-T63 PolarHBondContact O-OG1 3.21Å; N61-T63 PolarHBondContact O-N 3.33Å; T63-L67 WeakPolarHBondContact O-CB 3.2Å; T63-L67 WeakPolarHBondContact O-CG 3.31Å; T63-L67 PolarHBondContact O-N 3.49Å
64L94.7Very high92.5Very high86 Ų8626 Ų2645%0.4513%0.134SC..Hα-helixtrans-70.2-41.7176.1-71.9171.6000111.5L42 A60 N61 L62 L67 L68L42-L64 HydrophobicContact CD2-CD2 4.46Å; A60-L64 WeakPolarHBondContact O-CG 3.31Å; A60-L64 PolarHBondContact O-N 3.03Å; N61-L64 PolarHBondContact O-N 3Å; L62-L64 VanDerWaalsContact C-N 3.27Å; L62-L64 PolarHBondContact O-N 2.66Å; L64-L67 PolarHBondContact O-N 3.21Å; L64-L68 PolarHBondContact O-N 2.92Å
65A95.1Very high93.1Very high0 Ų023 Ų230%013%0.13CC..Hα-helixtrans-63.4-43.517400000111.5N61 L62 L68 Y69 V106 W145N61-A65 PolarHBondContact O-N 2.85Å; N61-A65 VanDerWaalsContact O-N 3.11Å; L62-A65 PolarHBondContact O-N 3.47Å; A65-L68 WeakPolarHBondContact O-CB 3.43Å; A65-L68 PolarHBondContact O-N 2.82Å; A65-Y69 PolarHBondContact O-N 2.78Å; A65-V106 HydrophobicContact CB-CG1 4.01Å; A65-W145 HydrophobicContact CB-CH2 4.25Å; A65-W145 HydrophobicContact CB-CZ2 4.18Å
66D94.9Very high93.9Very high4 Ų425.7 Ų25.72%0.02114%0.142CC..Hα-helixtrans-67.2-36.4177.8-66.6-17.4000111.9N38 L62 Y69 C70 N366N38-D66 WeakPolarHBondContact ND2-CB 3.32Å; L62-D66 VanDerWaalsContact O-CG 3.31Å; L62-D66 PolarHBondContact O-N 2.86Å; D66-Y69 PolarHBondContact O-N 2.87Å; D66-C70 WeakPolarHBondContact O-CB 3.49Å; D66-C70 PolarHBondContact O-N 3.24Å; D66-C70 PolarHBondContact O-SG 3.29Å; D66-C70 VanDerWaalsContact O-SG 3.38Å; D66-N366 PolarHBondContact OD2-ND2 2.98Å
67L95.7Very high94.2Very high22 Ų2225.5 Ų25.512%0.11514%0.141CC..Hα-helixtrans-64.3-45173.1-78.8170.7000111.7N38 V39 L42 T63 L64 Y69 C70 T71N38-L67 HydrophobicContact CB-CD1 4.45Å; N38-L67 HydrophobicContact CB-CD2 3.69Å; N38-L67 HydrophobicContact CB-CG 3.69Å; V39-L67 HydrophobicContact CG2-CD2 3.77Å; L42-L67 HydrophobicContact CD2-CD1 4.12Å; T63-L67 WeakPolarHBondContact O-CB 3.2Å; T63-L67 WeakPolarHBondContact O-CG 3.31Å; T63-L67 PolarHBondContact O-N 3.49Å; L64-L67 PolarHBondContact O-N 3.21Å; L67-Y69 PolarHBondContact O-N 3.35Å; L67-C70 PolarHBondContact O-N 3Å; L67-T71 HydrophobicContact CD2-CG2 4.3Å; L67-T71 VanDerWaalsContact O-CB 3.29Å; L67-T71 WeakPolarHBondContact O-CB 3.33Å; L67-T71 WeakPolarHBondContact O-CG2 3.43Å; L67-T71 PolarHBondContact O-N 3.49Å; L67-T71 PolarHBondContact O-OG1 2.91Å
68L95.1Very high94.5Very high43 Ų4322.4 Ų22.423%0.22513%0.126CC..Hα-helixtrans-55.2-45.1174.1172.763.3000110.6L64 A65 V72 L73 L99 W145L64-L68 PolarHBondContact O-N 2.92Å; A65-L68 WeakPolarHBondContact O-CB 3.43Å; A65-L68 PolarHBondContact O-N 2.82Å; L68-V72 HydrophobicContact CD1-CB 4.22Å; L68-V72 HydrophobicContact CD1-CG2 4.02Å; L68-V72 VanDerWaalsContact O-CB 3.3Å; L68-V72 WeakPolarHBondContact O-CB 3.21Å; L68-V72 PolarHBondContact O-N 2.76Å; L68-V72 VanDerWaalsContact O-N 3.1Å; L68-L73 PolarHBondContact O-N 3.23Å; L68-L99 HydrophobicContact CD2-CD2 4.39Å; L68-W145 HydrophobicContact CD2-CH2 4.14Å; L68-W145 HydrophobicContact CD2-CZ3 4.15Å
69Y95Very high94.8Very high20 Ų2024 Ų248%0.07813%0.134CC..Iπ-helixtrans-63-54.7176.9-176.6-92.7000112.4A65 D66 L67 T71 L73 Q74 L100 W360A65-Y69 PolarHBondContact O-N 2.78Å; D66-Y69 PolarHBondContact O-N 2.87Å; L67-Y69 PolarHBondContact O-N 3.35Å; Y69-T71 PolarHBondContact O-N 3.34Å; Y69-L73 HydrophobicContact CD2-CB 4.24Å; Y69-L73 HydrophobicContact CD2-CD1 3.89Å; Y69-L73 WeakPolarHBondContact O-CB 3.37Å; Y69-L73 PolarHBondContact O-N 3.3Å; Y69-L73 VanDerWaalsContact O-N 3.09Å; Y69-Q74 HydrophobicContact CE1-CB 4.45Å; Y69-Q74 WeakPolarHBondContact O-CB 3.31Å; Y69-Q74 PolarHBondContact O-N 2.95Å; Y69-Q74 PolarHBondContact OH-OE1 2.97Å; Y69-L100 HydrophobicContact CD2-CD1 4.21Å; Y69-L100 HydrophobicContact CE2-CD1 3.53Å; Y69-W360 WeakPolarHBondContact OH-CA 3.38Å
70C95.9Very high95Very high1 Ų123.9 Ų23.91%0.00713%0.133CC..Iπ-helixtrans-72.7-28.8-172.9-68.70000114.3D66 L67 P75 G363D66-C70 WeakPolarHBondContact O-CB 3.49Å; D66-C70 PolarHBondContact O-N 3.24Å; D66-C70 PolarHBondContact O-SG 3.29Å; D66-C70 VanDerWaalsContact O-SG 3.38Å; L67-C70 PolarHBondContact O-N 3Å; C70-P75 WeakPolarHBondContact O-CD 3.41Å; C70-G363 PolarHBondContact SG-O 2.88Å
71T94.9Very high95.1Very high67 Ų6723 Ų2341%0.41113%0.126SC..Iπ-helixtrans-95.9-29.1-176.563.10000113.5T35 L67 Y69 P75T35-T71 HydrophobicContact CG2-CG2 3.67Å; L67-T71 HydrophobicContact CD2-CG2 4.3Å; L67-T71 VanDerWaalsContact O-CB 3.29Å; L67-T71 WeakPolarHBondContact O-CB 3.33Å; L67-T71 WeakPolarHBondContact O-CG2 3.43Å; L67-T71 PolarHBondContact O-N 3.49Å; L67-T71 PolarHBondContact O-OG1 2.91Å; Y69-T71 PolarHBondContact O-N 3.34Å; T71-P75 WeakPolarHBondContact O-CG 3.41Å
72V93.4Very high95.1Very high49 Ų4926.1 Ų26.130%0.29714%0.142SC..Iπ-helixtrans-107.4-62.1-179-175.20000109.9L68 P75 F76L68-V72 HydrophobicContact CD1-CB 4.22Å; L68-V72 HydrophobicContact CD1-CG2 4.02Å; L68-V72 VanDerWaalsContact O-CB 3.3Å; L68-V72 WeakPolarHBondContact O-CB 3.21Å; L68-V72 PolarHBondContact O-N 2.76Å; L68-V72 VanDerWaalsContact O-N 3.1Å; V72-P75 WeakPolarHBondContact O-CD 3.5Å; V72-F76 HydrophobicContact CG1-CE2 4.49Å; V72-F76 WeakPolarHBondContact O-CD2 3.27Å
73L95.3Very high95.2Very high1 Ų130.1 Ų30.11%0.00516%0.161CC..Iπ-helixtrans-70.7-43.6-169.7-54.3179.9000112.2L68 Y69 F76 S77 F96 L99 L100L68-L73 PolarHBondContact O-N 3.23Å; Y69-L73 HydrophobicContact CD2-CB 4.24Å; Y69-L73 HydrophobicContact CD2-CD1 3.89Å; Y69-L73 WeakPolarHBondContact O-CB 3.37Å; Y69-L73 PolarHBondContact O-N 3.3Å; Y69-L73 VanDerWaalsContact O-N 3.09Å; L73-F76 PolarHBondContact O-N 2.8Å; L73-S77 PolarHBondContact O-N 3.47Å; L73-S77 PolarHBondContact O-OG 3.24Å; L73-F96 HydrophobicContact CB-CD2 4.45Å; L73-F96 HydrophobicContact CB-CE2 3.85Å; L73-F96 HydrophobicContact CB-CZ 4.25Å; L73-F96 HydrophobicContact CD2-CD2 3.68Å; L73-F96 HydrophobicContact CD2-CE2 3.95Å; L73-F96 HydrophobicContact CD2-CG 4.26Å; L73-F96 VanDerWaalsContact O-CE2 3.24Å; L73-F96 WeakPolarHBondContact O-CE2 3.24Å; L73-L99 HydrophobicContact CD1-CB 4.13Å; L73-L99 HydrophobicContact CD2-CB 3.94Å; L73-L99 HydrophobicContact CD2-CD1 4.36Å; L73-L100 HydrophobicContact CD1-CB 4.29Å
74Q95.7Very high95.2Very high0 Ų030.6 Ų30.60%016%0.164CC..Hα-helixtrans-65-42.5-173.8-169.164.71.300113.9G27 V30 A31 Y69 F76 S77 V78G27-Q74 WeakPolarHBondContact O-CG 3.5Å; G27-Q74 PolarHBondContact O-NE2 3.03Å; V30-Q74 HydrophobicContact CG1-CG 4.38Å; A31-Q74 HydrophobicContact CB-CB 4.29Å; A31-Q74 HydrophobicContact CB-CG 3.82Å; Y69-Q74 HydrophobicContact CE1-CB 4.45Å; Y69-Q74 WeakPolarHBondContact O-CB 3.31Å; Y69-Q74 PolarHBondContact O-N 2.95Å; Y69-Q74 PolarHBondContact OH-OE1 2.97Å; Q74-F76 VanDerWaalsContact C-N 3.33Å; Q74-F76 PolarHBondContact O-N 3.32Å; Q74-S77 WeakPolarHBondContact O-CB 3.36Å; Q74-S77 PolarHBondContact O-N 3.38Å; Q74-V78 WeakPolarHBondContact O-CG2 3.49Å; Q74-V78 PolarHBondContact O-N 2.87Å
75P95.8Very high95.2Very high58 Ų5830 Ų3038%0.37716%0.158SC..Hα-helixtrans-59.4-38.6174.1-28.837.9000113.9C70 T71 V72 V78 D79C70-P75 WeakPolarHBondContact O-CD 3.41Å; T71-P75 WeakPolarHBondContact O-CG 3.41Å; V72-P75 WeakPolarHBondContact O-CD 3.5Å; P75-V78 PolarHBondContact O-N 3.47Å; P75-D79 WeakPolarHBondContact O-CB 3.5Å; P75-D79 PolarHBondContact O-N 3.41Å
76F95.8Very high95.2Very high65 Ų6530.1 Ų30.129%0.28516%0.159SC..Hα-helixtrans-69.9-35.3176-75.1-70.8000112.5V72 L73 Q74 V78 D79 T80 W86 T88 F92 F96V72-F76 HydrophobicContact CG1-CE2 4.49Å; V72-F76 WeakPolarHBondContact O-CD2 3.27Å; L73-F76 PolarHBondContact O-N 2.8Å; Q74-F76 VanDerWaalsContact C-N 3.33Å; Q74-F76 PolarHBondContact O-N 3.32Å; F76-V78 VanDerWaalsContact C-N 3.34Å; F76-D79 PolarHBondContact O-N 2.97Å; F76-T80 WeakPolarHBondContact O-CB 3.44Å; F76-T80 PolarHBondContact O-N 3.49Å; F76-T80 PolarHBondContact O-OG1 3.33Å; F76-W86 HydrophobicContact CB-CH2 4.28Å; F76-W86 HydrophobicContact CB-CZ3 4.31Å; F76-T88 HydrophobicContact CD1-CG2 4.05Å; F76-T88 HydrophobicContact CE1-CG2 3.58Å; F76-T88 HydrophobicContact CZ-CG2 4.47Å; F76-F92 AromaticContact CD1-CE1 3.94Å; F76-F92 HydrophobicContact CD1-CE1 3.94Å; F76-F92 AromaticContact CD2-CE1 3.63Å; F76-F92 HydrophobicContact CD2-CE1 3.63Å; F76-F92 AromaticContact CD2-CZ 3.74Å; F76-F92 HydrophobicContact CD2-CZ 3.74Å; F76-F92 AromaticContact CE1-CE1 3.98Å; F76-F92 HydrophobicContact CE1-CE1 3.98Å; F76-F92 AromaticContact CE2-CE1 3.71Å; F76-F92 HydrophobicContact CE2-CE1 3.71Å; F76-F92 AromaticContact CE2-CZ 3.54Å; F76-F92 HydrophobicContact CE2-CZ 3.54Å; F76-F92 AromaticContact CG-CE1 3.79Å; F76-F92 HydrophobicContact CG-CE1 3.79Å; F76-F92 HydrophobicContact CG-CZ 4.37Å; F76-F92 AromaticContact CZ-CE1 3.88Å; F76-F92 HydrophobicContact CZ-CE1 3.88Å; F76-F92 AromaticContact CZ-CZ 3.97Å; F76-F92 HydrophobicContact CZ-CZ 3.97Å; F76-F96 HydrophobicContact CB-CD2 4.3Å; F76-F96 HydrophobicContact CB-CE2 4.01Å
77S95Very high95.1Very high3 Ų336.7 Ų36.72%0.02118%0.183CC..Hα-helixtrans-58.7-47.4170.1-640000111.2L73 Q74 T80 Y81 F96L73-S77 PolarHBondContact O-N 3.47Å; L73-S77 PolarHBondContact O-OG 3.24Å; Q74-S77 WeakPolarHBondContact O-CB 3.36Å; Q74-S77 PolarHBondContact O-N 3.38Å; S77-T80 PolarHBondContact O-N 3.46Å; S77-Y81 WeakPolarHBondContact O-CD2 3.49Å; S77-Y81 PolarHBondContact O-N 3.47Å; S77-Y81 VanDerWaalsContact O-N 3.11Å; S77-F96 WeakPolarHBondContact OG-CZ 3.5Å
78V96.2Very high94.9Very high20 Ų2038.5 Ų38.512%0.12120%0.195CC..Hα-helixtrans-61.1-45.2177.7170.80000111V24 V28 Q74 P75 F76 T80 Y81 L82V24-V78 HydrophobicContact CB-CG1 4.46Å; V24-V78 HydrophobicContact CG1-CG1 4Å; V24-V78 HydrophobicContact CG2-CG1 4.31Å; V28-V78 HydrophobicContact CG2-CG1 4.03Å; V28-V78 HydrophobicContact CG2-CG2 4.44Å; Q74-V78 WeakPolarHBondContact O-CG2 3.49Å; Q74-V78 PolarHBondContact O-N 2.87Å; P75-V78 PolarHBondContact O-N 3.47Å; F76-V78 VanDerWaalsContact C-N 3.34Å; V78-T80 VanDerWaalsContact C-N 3.3Å; V78-T80 PolarHBondContact O-N 3.44Å; V78-Y81 PolarHBondContact O-N 3.43Å; V78-L82 PolarHBondContact O-N 2.95Å
79D96.2Very high94.8Very high32 Ų3237.7 Ų37.717%0.17120%0.198CC..Hα-helixtrans-58.2-43.1178.3-17257.6000112.5P75 F76 L82 H83 R87P75-D79 WeakPolarHBondContact O-CB 3.5Å; P75-D79 PolarHBondContact O-N 3.41Å; F76-D79 PolarHBondContact O-N 2.97Å; D79-L82 PolarHBondContact O-N 3.5Å; D79-H83 PolarHBondContact O-N 2.84Å; D79-H83 PolarHBondContact O-ND1 3.39Å; D79-H83 IonicContact OD1-CE1 3.01Å; D79-H83 PolarHBondContact OD1-CE1 3.36Å; D79-H83 IonicContact OD1-ND1 3.8Å; D79-H83 PolarHBondContact OD1-ND1 2.99Å; D79-H83 IonicContact OD2-ND1 3.86Å; D79-R87 IonicContact OD1-CZ 3.96Å; D79-R87 IonicContact OD1-NE 2.96Å; D79-R87 IonicContact OD1-NH2 3.39Å; D79-R87 PolarHBondContact OD1-NH2 3.1Å; D79-R87 IonicContact OD2-CZ 3.1Å; D79-R87 IonicContact OD2-NE 3.03Å; D79-R87 PolarHBondContact OD2-NE 3.44Å; D79-R87 IonicContact OD2-NH2 3.02Å; D79-R87 PolarHBondContact OD2-NH2 3.08Å
80T95.4Very high94.6Very high1 Ų138.7 Ų38.71%0.00621%0.21CC..Hα-helixtrans-66.3-41.8-179.2-49.30000110.9F76 S77 V78 L82 L84 H85 W86 L161 C166F76-T80 WeakPolarHBondContact O-CB 3.44Å; F76-T80 PolarHBondContact O-N 3.49Å; F76-T80 PolarHBondContact O-OG1 3.33Å; S77-T80 PolarHBondContact O-N 3.46Å; V78-T80 VanDerWaalsContact C-N 3.3Å; V78-T80 PolarHBondContact O-N 3.44Å; T80-L82 VanDerWaalsContact C-N 3.35Å; T80-L84 WeakPolarHBondContact O-CA 3.46Å; T80-L84 PolarHBondContact O-N 2.87Å; T80-H85 PolarHBondContact O-N 3.48Å; T80-W86 HydrophobicContact CG2-CB 4.33Å; T80-W86 HydrophobicContact CG2-CE3 4.08Å; T80-L161 HydrophobicContact CG2-CD1 4.26Å; T80-C166 WeakPolarHBondContact CG2-O 3.21Å; T80-C166 PolarHBondContact O-SG 2.91Å
81Y95.1Very high94.5Very high0 Ų043.4 Ų43.40%024%0.238CC..Hα-helixtrans-65.3-36174.2-92.2-75.3000112.9V16 Y19 A23 S77 V78 L84 V165 C166 M353 W360V16-Y81 HydrophobicContact CG1-CD1 4.37Å; V16-Y81 HydrophobicContact CG1-CE1 4.26Å; Y19-Y81 HydrophobicContact CD1-CE1 4.24Å; A23-Y81 HydrophobicContact CB-CD1 3.55Å; A23-Y81 HydrophobicContact CB-CD2 4.01Å; A23-Y81 HydrophobicContact CB-CE1 3.66Å; A23-Y81 HydrophobicContact CB-CE2 4.11Å; A23-Y81 HydrophobicContact CB-CG 3.73Å; S77-Y81 WeakPolarHBondContact O-CD2 3.49Å; S77-Y81 PolarHBondContact O-N 3.47Å; S77-Y81 VanDerWaalsContact O-N 3.11Å; V78-Y81 PolarHBondContact O-N 3.43Å; Y81-L84 WeakPolarHBondContact O-CD2 3.34Å; Y81-V165 PolarHBondContact OH-O 2.89Å; Y81-V165 VanDerWaalsContact OH-O 3.09Å; Y81-C166 HydrophobicContact CD1-CB 4.12Å; Y81-C166 HydrophobicContact CD2-CB 4.5Å; Y81-C166 HydrophobicContact CE1-CB 3.88Å; Y81-C166 HydrophobicContact CE2-CB 4.27Å; Y81-C166 HydrophobicContact CG-CB 4.43Å; Y81-M353 HydrophobicContact CE1-SD 3.97Å; Y81-W360 AromaticContact CD2-CH2 3.98Å; Y81-W360 HydrophobicContact CD2-CH2 3.98Å; Y81-W360 HydrophobicContact CD2-CZ2 4.37Å; Y81-W360 AromaticContact CE2-CH2 3.77Å; Y81-W360 HydrophobicContact CE2-CH2 3.77Å; Y81-W360 AromaticContact CE2-CZ2 3.87Å; Y81-W360 HydrophobicContact CE2-CZ2 3.87Å
82L95.4Very high94.4Very high76 Ų7643.1 Ų43.140%0.39823%0.232SC..Hα-helixtrans-68.6-46.1-179.7-173.565.6000111.8V24 V78 D79 T80V24-L82 HydrophobicContact CG2-CB 4.19Å; V24-L82 HydrophobicContact CG2-CD1 4.47Å; V78-L82 PolarHBondContact O-N 2.95Å; D79-L82 PolarHBondContact O-N 3.5Å; T80-L82 VanDerWaalsContact C-N 3.35Å
83H94.6Very high94.5Very high84 Ų8440.9 Ų40.939%0.38922%0.218SC..Hα-helixtrans-89.8-7.6-177.7-63.789.2000113.5D79 H85 R87D79-H83 PolarHBondContact O-N 2.84Å; D79-H83 PolarHBondContact O-ND1 3.39Å; D79-H83 IonicContact OD1-CE1 3.01Å; D79-H83 PolarHBondContact OD1-CE1 3.36Å; D79-H83 IonicContact OD1-ND1 3.8Å; D79-H83 PolarHBondContact OD1-ND1 2.99Å; D79-H83 IonicContact OD2-ND1 3.86Å; H83-H85 PolarHBondContact O-N 3.32Å; H83-H85 VanDerWaalsContact O-N 3.13Å; H83-R87 PolarHBondContact CE1-NH1 3.03Å; H83-R87 PolarHBondContact CE1-NH2 3.07Å; H83-R87 PolarHBondContact NE2-NH1 2.93Å; H83-R87 VanDerWaalsContact NE2-NH1 3.19Å
84L94.3Very high94.5Very high11 Ų1143.9 Ų43.96%0.05823%0.229CC..THydrogen-bonded Turntrans53.726.8-172.2-56.7173.3000112.8C11 Y12 V16 L17 R20 T80 Y81C11-L84 PolarHBondContact N-O 3.07Å; C11-L84 VanDerWaalsContact SG-C 3.51Å; C11-L84 WeakPolarHBondContact SG-CA 3.32Å; C11-L84 PolarHBondContact SG-O 3.32Å; Y12-L84 HydrophobicContact CD2-CD1 3.7Å; Y12-L84 HydrophobicContact CE2-CD1 4.3Å; V16-L84 HydrophobicContact CB-CD2 4.38Å; V16-L84 HydrophobicContact CG1-CD2 3.57Å; L17-L84 HydrophobicContact CB-CD1 4.39Å; L17-L84 HydrophobicContact CD1-CD1 3.74Å; R20-L84 HydrophobicContact CB-CD2 4.38Å; T80-L84 WeakPolarHBondContact O-CA 3.46Å; T80-L84 PolarHBondContact O-N 2.87Å; Y81-L84 WeakPolarHBondContact O-CD2 3.34Å
85H94.1Very high94.6Very high73 Ų7345.1 Ų45.134%0.33824%0.24SC..BIsolated β-bridgetrans-155.7142.4-171.7-167.184.9000111.4F9 S10 T80 H83F9-H85 VanDerWaalsContact C-CE1 3.46Å; F9-H85 VanDerWaalsContact C-ND1 3.26Å; F9-H85 VanDerWaalsContact CB-CE1 3.47Å; F9-H85 WeakPolarHBondContact CB-CE1 3.47Å; F9-H85 CarbonylContact O-C 3.52Å; F9-H85 VanDerWaalsContact O-CA 3.25Å; F9-H85 WeakPolarHBondContact O-CA 3.39Å; F9-H85 PolarHBondContact O-ND1 3.01Å; F9-H85 VanDerWaalsContact O-ND1 3.09Å; S10-H85 PolarHBondContact N-ND1 3.31Å; T80-H85 PolarHBondContact O-N 3.48Å; H83-H85 PolarHBondContact O-N 3.32Å; H83-H85 VanDerWaalsContact O-N 3.13Å
86W94.9Very high94.6Very high3 Ų342.3 Ų42.31%0.01122%0.222CC..  trans-91109.2174.9-178.5-90.5000111.5F9 F76 T80 T88 G89 F92 C93 F96 L161 C168F9-W86 HydrophobicContact CB-CB 4.11Å; F9-W86 HydrophobicContact CD1-CB 3.96Å; F9-W86 AromaticContact CD1-CD1 3.78Å; F9-W86 HydrophobicContact CD1-CG 4.16Å; F9-W86 HydrophobicContact CG-CB 4.39Å; F9-W86 PolarHBondContact O-N 3.01Å; F76-W86 HydrophobicContact CB-CH2 4.28Å; F76-W86 HydrophobicContact CB-CZ3 4.31Å; T80-W86 HydrophobicContact CG2-CB 4.33Å; T80-W86 HydrophobicContact CG2-CE3 4.08Å; W86-T88 VanDerWaalsContact CZ2-OG1 3.25Å; W86-T88 WeakPolarHBondContact CZ2-OG1 3.43Å; W86-T88 PolarHBondContact NE1-OG1 3.25Å; W86-G89 PolarHBondContact NE1-O 3.15Å; W86-F92 HydrophobicContact CH2-CD1 4.03Å; W86-F92 HydrophobicContact CH2-CE1 4.14Å; W86-F92 AromaticContact CZ2-CD1 3.45Å; W86-F92 HydrophobicContact CZ2-CD1 3.45Å; W86-F92 VanDerWaalsContact CZ2-CD1 3.45Å; W86-F92 HydrophobicContact CZ2-CE1 4.03Å; W86-F92 HydrophobicContact CZ2-CG 4.39Å; W86-C93 HydrophobicContact CD2-CB 4.47Å; W86-C93 VanDerWaalsContact CZ2-CA 3.48Å; W86-C93 HydrophobicContact CZ2-CB 4.06Å; W86-F96 HydrophobicContact CH2-CB 3.78Å; W86-F96 HydrophobicContact CH2-CD1 4.29Å; W86-F96 AromaticContact CH2-CD2 3.57Å; W86-F96 HydrophobicContact CH2-CD2 3.57Å; W86-F96 HydrophobicContact CH2-CE2 4.19Å; W86-F96 AromaticContact CH2-CG 3.62Å; W86-F96 HydrophobicContact CH2-CG 3.62Å; W86-F96 HydrophobicContact CZ2-CB 4.1Å; W86-F96 HydrophobicContact CZ2-CG 4.42Å; W86-F96 HydrophobicContact CZ3-CD2 4.22Å; W86-F96 HydrophobicContact CZ3-CE2 4.42Å; W86-F96 HydrophobicContact CZ3-CG 4.33Å; W86-L161 HydrophobicContact CB-CD1 4.15Å; W86-L161 HydrophobicContact CB-CD2 4.05Å; W86-C168 VanDerWaalsContact CD2-SG 3.5Å; W86-C168 HydrophobicContact CH2-CB 4.5Å
87R93.6Very high94.6Very high142 Ų14239.2 Ų39.254%0.53621%0.208SC..  trans-92-16.7-167.3-59.5-172.7-65.9169.13.2115.6D79 H83D79-R87 IonicContact OD1-CZ 3.96Å; D79-R87 IonicContact OD1-NE 2.96Å; D79-R87 IonicContact OD1-NH2 3.39Å; D79-R87 PolarHBondContact OD1-NH2 3.1Å; D79-R87 IonicContact OD2-CZ 3.1Å; D79-R87 IonicContact OD2-NE 3.03Å; D79-R87 PolarHBondContact OD2-NE 3.44Å; D79-R87 IonicContact OD2-NH2 3.02Å; D79-R87 PolarHBondContact OD2-NH2 3.08Å; H83-R87 PolarHBondContact CE1-NH1 3.03Å; H83-R87 PolarHBondContact CE1-NH2 3.07Å; H83-R87 PolarHBondContact NE2-NH1 2.93Å; H83-R87 VanDerWaalsContact NE2-NH1 3.19Å
88T91.1Very high94.6Very high59 Ų5940.3 Ų40.336%0.36221%0.214SC..SBendtrans-91.53.6-169.442.60000114.1F76 W86 F92F76-T88 HydrophobicContact CD1-CG2 4.05Å; F76-T88 HydrophobicContact CE1-CG2 3.58Å; F76-T88 HydrophobicContact CZ-CG2 4.47Å; W86-T88 VanDerWaalsContact CZ2-OG1 3.25Å; W86-T88 WeakPolarHBondContact CZ2-OG1 3.43Å; W86-T88 PolarHBondContact NE1-OG1 3.25Å; T88-F92 HydrophobicContact CG2-CD1 4.12Å; T88-F92 HydrophobicContact CG2-CE1 4.49Å; T88-F92 VanDerWaalsContact OG1-CD1 3.27Å; T88-F92 WeakPolarHBondContact OG1-CD1 3.32Å
89G92Very high94.6Very high27 Ų2742.2 Ų42.228%0.27822%0.223SC..Hα-helixtrans84.2174.1173.900000115.4W86 C93W86-G89 PolarHBondContact NE1-O 3.15Å; G89-C93 PolarHBondContact O-N 3.11Å; G89-C93 VanDerWaalsContact O-N 3.11Å
90A91.3Very high94.5Very high40 Ų4042 Ų4233%0.33122%0.221SC..Hα-helixtrans-64.1-44.9-170.300000113.6F9 F92 C93 R94F9-A90 HydrophobicContact CZ-CB 3.75Å; A90-F92 PolarHBondContact O-N 2.84Å; A90-C93 WeakPolarHBondContact O-CB 3.29Å; A90-C93 PolarHBondContact O-N 3.4Å; A90-R94 WeakPolarHBondContact O-CG 3.41Å; A90-R94 PolarHBondContact O-N 3.42Å
91T93.5Very high94.4Very high100 Ų10042.2 Ų42.261%0.61322%0.222SC*.Hα-helixtrans-63.3-43.9-176.3-53.20000111.2R94 A95 W156T91-R94 PolarHBondContact O-N 3.25Å; T91-A95 PolarHBondContact O-N 3.07Å; T91-W156 HydrophobicContact CG2-CZ2 4.48Å
92F94.5Very high94.4Very high61 Ų6142.3 Ų42.327%0.26822%0.223SC..Hα-helixtrans-69.8-33.7177.2-167.4-107.8000111.8F76 W86 T88 A90 R94 A95 F96F76-F92 AromaticContact CD1-CE1 3.94Å; F76-F92 HydrophobicContact CD1-CE1 3.94Å; F76-F92 AromaticContact CD2-CE1 3.63Å; F76-F92 HydrophobicContact CD2-CE1 3.63Å; F76-F92 AromaticContact CD2-CZ 3.74Å; F76-F92 HydrophobicContact CD2-CZ 3.74Å; F76-F92 AromaticContact CE1-CE1 3.98Å; F76-F92 HydrophobicContact CE1-CE1 3.98Å; F76-F92 AromaticContact CE2-CE1 3.71Å; F76-F92 HydrophobicContact CE2-CE1 3.71Å; F76-F92 AromaticContact CE2-CZ 3.54Å; F76-F92 HydrophobicContact CE2-CZ 3.54Å; F76-F92 AromaticContact CG-CE1 3.79Å; F76-F92 HydrophobicContact CG-CE1 3.79Å; F76-F92 HydrophobicContact CG-CZ 4.37Å; F76-F92 AromaticContact CZ-CE1 3.88Å; F76-F92 HydrophobicContact CZ-CE1 3.88Å; F76-F92 AromaticContact CZ-CZ 3.97Å; F76-F92 HydrophobicContact CZ-CZ 3.97Å; W86-F92 HydrophobicContact CH2-CD1 4.03Å; W86-F92 HydrophobicContact CH2-CE1 4.14Å; W86-F92 AromaticContact CZ2-CD1 3.45Å; W86-F92 HydrophobicContact CZ2-CD1 3.45Å; W86-F92 VanDerWaalsContact CZ2-CD1 3.45Å; W86-F92 HydrophobicContact CZ2-CE1 4.03Å; W86-F92 HydrophobicContact CZ2-CG 4.39Å; T88-F92 HydrophobicContact CG2-CD1 4.12Å; T88-F92 HydrophobicContact CG2-CE1 4.49Å; T88-F92 VanDerWaalsContact OG1-CD1 3.27Å; T88-F92 WeakPolarHBondContact OG1-CD1 3.32Å; A90-F92 PolarHBondContact O-N 2.84Å; F92-R94 VanDerWaalsContact C-N 3.3Å; F92-R94 PolarHBondContact O-N 2.89Å; F92-A95 PolarHBondContact O-N 2.89Å; F92-F96 WeakPolarHBondContact O-CB 3.04Å; F92-F96 PolarHBondContact O-N 3.49Å
93C95.4Very high94.3Very high2 Ų238.9 Ų38.91%0.01421%0.205CC..Hα-helixtrans-58.6-42.5171.6-173.90000112.1F9 W86 G89 A90 F96 G97 L161 C168F9-C93 HydrophobicContact CE1-CB 4.46Å; W86-C93 HydrophobicContact CD2-CB 4.47Å; W86-C93 VanDerWaalsContact CZ2-CA 3.48Å; W86-C93 HydrophobicContact CZ2-CB 4.06Å; G89-C93 PolarHBondContact O-N 3.11Å; G89-C93 VanDerWaalsContact O-N 3.11Å; A90-C93 WeakPolarHBondContact O-CB 3.29Å; A90-C93 PolarHBondContact O-N 3.4Å; C93-F96 PolarHBondContact O-N 3.48Å; C93-G97 PolarHBondContact O-N 3.43Å; C93-L161 PolarHBondContact SG-N 3.24Å; C93-L161 VanDerWaalsContact SG-N 3.43Å; C93-C168 WeakPolarHBondContact CA-SG 3.45Å; C93-C168 HydrophobicContact CB-CB 4.07Å; C93-C168 WeakPolarHBondContact CB-SG 3.29Å; C93-C168 VanDerWaalsContact O-CB 3.31Å; C93-C168 WeakPolarHBondContact O-CB 3.32Å; C93-C168 WeakPolarHBondContact SG-CB 3.5Å; C93-C168 CovalentContact SG-SG 2.03Å; C93-C168 PolarHBondContact SG-SG 2.82Å
94R95.6Very high94.1Very high64 Ų6436.1 Ų36.124%0.24219%0.193CC..Hα-helixtrans-66.2-46.9176.4-65.3179.9179.2162.71.2112.3A90 T91 F92 F96 G97 L98 W156 Y159A90-R94 WeakPolarHBondContact O-CG 3.41Å; A90-R94 PolarHBondContact O-N 3.42Å; T91-R94 PolarHBondContact O-N 3.25Å; F92-R94 VanDerWaalsContact C-N 3.3Å; F92-R94 PolarHBondContact O-N 2.89Å; R94-F96 VanDerWaalsContact C-N 3.32Å; R94-F96 PolarHBondContact O-N 3.05Å; R94-G97 PolarHBondContact O-N 2.97Å; R94-L98 PolarHBondContact O-N 3.47Å; R94-W156 HydrophobicContact CB-CD2 4.23Å; R94-W156 HydrophobicContact CB-CE3 4.13Å; R94-W156 HydrophobicContact CB-CH2 3.86Å; R94-W156 HydrophobicContact CB-CZ2 3.95Å; R94-W156 HydrophobicContact CB-CZ3 3.96Å; R94-Y159 WeakPolarHBondContact CG-O 3.19Å
95A96.4Very high94Very high26 Ų2635.6 Ų35.622%0.21519%0.191CC..Hα-helixtrans-60.8-42.5176.300000111.6T91 F92 L98 L99 W156T91-A95 PolarHBondContact O-N 3.07Å; F92-A95 PolarHBondContact O-N 2.89Å; A95-L98 PolarHBondContact O-N 3.32Å; A95-L99 WeakPolarHBondContact O-CB 3.48Å; A95-L99 VanDerWaalsContact O-CG 3.25Å; A95-L99 WeakPolarHBondContact O-CG 3.36Å; A95-L99 PolarHBondContact O-N 3.23Å; A95-W156 HydrophobicContact CB-CH2 4.36Å; A95-W156 HydrophobicContact CB-CZ3 4.47Å
96F96.6Very high94Very high0 Ų032.1 Ų32.10%018%0.175CC..Hα-helixtrans-57.4-51.5175.1178.7-79.7000111.4L73 F76 S77 W86 F92 C93 R94 L98 L99 L100 T167 C168L73-F96 HydrophobicContact CB-CD2 4.45Å; L73-F96 HydrophobicContact CB-CE2 3.85Å; L73-F96 HydrophobicContact CB-CZ 4.25Å; L73-F96 HydrophobicContact CD2-CD2 3.68Å; L73-F96 HydrophobicContact CD2-CE2 3.95Å; L73-F96 HydrophobicContact CD2-CG 4.26Å; L73-F96 VanDerWaalsContact O-CE2 3.24Å; L73-F96 WeakPolarHBondContact O-CE2 3.24Å; F76-F96 HydrophobicContact CB-CD2 4.3Å; F76-F96 HydrophobicContact CB-CE2 4.01Å; S77-F96 WeakPolarHBondContact OG-CZ 3.5Å; W86-F96 HydrophobicContact CH2-CB 3.78Å; W86-F96 HydrophobicContact CH2-CD1 4.29Å; W86-F96 AromaticContact CH2-CD2 3.57Å; W86-F96 HydrophobicContact CH2-CD2 3.57Å; W86-F96 HydrophobicContact CH2-CE2 4.19Å; W86-F96 AromaticContact CH2-CG 3.62Å; W86-F96 HydrophobicContact CH2-CG 3.62Å; W86-F96 HydrophobicContact CZ2-CB 4.1Å; W86-F96 HydrophobicContact CZ2-CG 4.42Å; W86-F96 HydrophobicContact CZ3-CD2 4.22Å; W86-F96 HydrophobicContact CZ3-CE2 4.42Å; W86-F96 HydrophobicContact CZ3-CG 4.33Å; F92-F96 WeakPolarHBondContact O-CB 3.04Å; F92-F96 PolarHBondContact O-N 3.49Å; C93-F96 PolarHBondContact O-N 3.48Å; R94-F96 VanDerWaalsContact C-N 3.32Å; R94-F96 PolarHBondContact O-N 3.05Å; F96-L98 VanDerWaalsContact C-N 3.33Å; F96-L98 PolarHBondContact O-N 3.07Å; F96-L99 PolarHBondContact O-N 3.45Å; F96-L100 HydrophobicContact CE1-CB 4.5Å; F96-L100 HydrophobicContact CE1-CD2 4.18Å; F96-L100 VanDerWaalsContact O-CB 3.27Å; F96-L100 WeakPolarHBondContact O-CB 3.21Å; F96-L100 PolarHBondContact O-N 3.02Å; F96-T167 WeakPolarHBondContact CE1-OG1 3.28Å; F96-C168 HydrophobicContact CB-CB 4.36Å; F96-C168 HydrophobicContact CD1-CB 3.63Å; F96-C168 HydrophobicContact CE1-CB 4.35Å; F96-C168 HydrophobicContact CG-CB 4.28Å
97G94.9Very high93.8Very high0 Ų032.4 Ų32.40%018%0.177CC..Hα-helixtrans-60.1-43.5179.200000111.9C93 R94 L100 F101C93-G97 PolarHBondContact O-N 3.43Å; R94-G97 PolarHBondContact O-N 2.97Å; G97-L100 PolarHBondContact O-N 3.3Å; G97-F101 WeakPolarHBondContact O-CD2 3.24Å; G97-F101 PolarHBondContact O-N 3.25Å
98L95.9Very high93.6Very high26 Ų2625.9 Ų25.914%0.13615%0.153CC..Hα-helixtrans-59.5-52.2174.7174.658.9000111.8R94 A95 F96 L100 F101 A102 F152 A153 W156 Y159R94-L98 PolarHBondContact O-N 3.47Å; A95-L98 PolarHBondContact O-N 3.32Å; F96-L98 VanDerWaalsContact C-N 3.33Å; F96-L98 PolarHBondContact O-N 3.07Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 2.68Å; L98-F101 PolarHBondContact O-N 3.39Å; L98-A102 WeakPolarHBondContact O-CB 3.02Å; L98-A102 PolarHBondContact O-N 2.88Å; L98-F152 VanDerWaalsContact CD1-C 3.49Å; L98-F152 HydrophobicContact CD1-CB 3.72Å; L98-A153 HydrophobicContact CD1-CB 4.25Å; L98-W156 HydrophobicContact CD2-CE3 4.34Å; L98-W156 HydrophobicContact CD2-CZ3 4.3Å; L98-Y159 HydrophobicContact CB-CD2 4.49Å; L98-Y159 HydrophobicContact CB-CE2 3.9Å; L98-Y159 HydrophobicContact CD1-CE2 4.47Å
99L95.8Very high93.7Very high59 Ų5924.3 Ų24.331%0.30914%0.142SC..Hα-helixtrans-63.8-36.5-178.1-70.8174000112L68 L73 A95 F96 S103L68-L99 HydrophobicContact CD2-CD2 4.39Å; L73-L99 HydrophobicContact CD1-CB 4.13Å; L73-L99 HydrophobicContact CD2-CB 3.94Å; L73-L99 HydrophobicContact CD2-CD1 4.36Å; A95-L99 WeakPolarHBondContact O-CB 3.48Å; A95-L99 VanDerWaalsContact O-CG 3.25Å; A95-L99 WeakPolarHBondContact O-CG 3.36Å; A95-L99 PolarHBondContact O-N 3.23Å; F96-L99 PolarHBondContact O-N 3.45Å; L99-S103 WeakPolarHBondContact O-CB 3.29Å; L99-S103 PolarHBondContact O-N 3.24Å; L99-S103 PolarHBondContact O-OG 2.66Å
100L94.4Very high93.7Very high27 Ų2723 Ų2314%0.14113%0.129CC..Hα-helixtrans-56-53.1175.1173.163.1000111.2Y69 L73 F96 G97 L98 N104Y69-L100 HydrophobicContact CD2-CD1 4.21Å; Y69-L100 HydrophobicContact CE2-CD1 3.53Å; L73-L100 HydrophobicContact CD1-CB 4.29Å; F96-L100 HydrophobicContact CE1-CB 4.5Å; F96-L100 HydrophobicContact CE1-CD2 4.18Å; F96-L100 VanDerWaalsContact O-CB 3.27Å; F96-L100 WeakPolarHBondContact O-CB 3.21Å; F96-L100 PolarHBondContact O-N 3.02Å; G97-L100 PolarHBondContact O-N 3.3Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 2.68Å; L100-N104 WeakPolarHBondContact O-CB 3.38Å; L100-N104 PolarHBondContact O-N 3.34Å
101F93Very high93.4Very high6 Ų622.4 Ų22.43%0.02612%0.12CC..Hα-helixtrans-77.9-37-177.4-65.6-60.9000113.2G97 L98 N104 S105 F152 Y159 S169 F170 M183G97-F101 WeakPolarHBondContact O-CD2 3.24Å; G97-F101 PolarHBondContact O-N 3.25Å; L98-F101 PolarHBondContact O-N 3.39Å; F101-N104 PolarHBondContact O-N 3.22Å; F101-S105 WeakPolarHBondContact O-CB 3.46Å; F101-S105 PolarHBondContact O-N 3.05Å; F101-S105 PolarHBondContact O-OG 3.21Å; F101-F152 HydrophobicContact CB-CB 4.37Å; F101-F152 HydrophobicContact CB-CD1 3.48Å; F101-F152 VanDerWaalsContact CB-CD1 3.48Å; F101-F152 HydrophobicContact CB-CD2 4Å; F101-F152 HydrophobicContact CB-CE1 3.68Å; F101-F152 HydrophobicContact CB-CE2 4.22Å; F101-F152 HydrophobicContact CB-CG 3.67Å; F101-F152 HydrophobicContact CB-CZ 4.05Å; F101-F152 HydrophobicContact CG-CD1 4.16Å; F101-F152 HydrophobicContact CG-CE1 4.17Å; F101-Y159 AromaticContact CD2-CE1 3.83Å; F101-Y159 HydrophobicContact CD2-CE1 3.83Å; F101-Y159 HydrophobicContact CE2-CE1 4.09Å; F101-S169 WeakPolarHBondContact CE2-OG 3.38Å; F101-S169 VanDerWaalsContact CZ-OG 3.27Å; F101-S169 WeakPolarHBondContact CZ-OG 3.49Å; F101-F170 HydrophobicContact CD1-CE1 4.28Å; F101-F170 AromaticContact CD2-CD1 3.88Å; F101-F170 HydrophobicContact CD2-CD1 3.88Å; F101-F170 AromaticContact CD2-CE1 3.99Å; F101-F170 HydrophobicContact CD2-CE1 3.99Å; F101-F170 AromaticContact CE1-CE1 3.78Å; F101-F170 HydrophobicContact CE1-CE1 3.78Å; F101-F170 AromaticContact CE2-CD1 3.38Å; F101-F170 HydrophobicContact CE2-CD1 3.38Å; F101-F170 AromaticContact CE2-CE1 3.47Å; F101-F170 HydrophobicContact CE2-CE1 3.47Å; F101-F170 VanDerWaalsContact CE2-CE1 3.47Å; F101-F170 HydrophobicContact CE2-CG 4.45Å; F101-F170 HydrophobicContact CG-CE1 4.37Å; F101-F170 AromaticContact CZ-CD1 3.75Å; F101-F170 HydrophobicContact CZ-CD1 3.75Å; F101-F170 AromaticContact CZ-CE1 3.33Å; F101-F170 HydrophobicContact CZ-CE1 3.33Å; F101-F170 HydrophobicContact CZ-CZ 4.13Å; F101-M183 HydrophobicContact CD1-CE 3.09Å; F101-M183 HydrophobicContact CE1-CE 3.06Å; F101-M183 HydrophobicContact CG-CE 4.07Å; F101-M183 HydrophobicContact CZ-CE 4.02Å
102A94.6Very high93.2Very high3 Ų318.4 Ų18.43%0.02510%0.096CC..Hα-helixtrans-59.9-48.1173.600000110.8L98 N104 S105 V106 V149L98-A102 WeakPolarHBondContact O-CB 3.02Å; L98-A102 PolarHBondContact O-N 2.88Å; A102-N104 PolarHBondContact O-N 3.11Å; A102-S105 PolarHBondContact O-N 3.5Å; A102-S105 PolarHBondContact O-OG 2.92Å; A102-V106 VanDerWaalsContact O-CG2 3.32Å; A102-V106 WeakPolarHBondContact O-CG2 3.31Å; A102-V106 PolarHBondContact O-N 2.92Å; A102-V149 HydrophobicContact CB-CG2 4.27Å
103S93.3Very high93.1Very high3 Ų317.1 Ų17.12%0.0219%0.092CC..Hα-helixtrans-61.2-45.7178.4-55.30000111.5L99 S105 V106 S107L99-S103 WeakPolarHBondContact O-CB 3.29Å; L99-S103 PolarHBondContact O-N 3.24Å; L99-S103 PolarHBondContact O-OG 2.66Å; S103-S105 VanDerWaalsContact C-N 3.3Å; S103-S105 PolarHBondContact O-N 3.26Å; S103-V106 PolarHBondContact O-N 3.45Å; S103-S107 PolarHBondContact O-N 2.96Å; S103-S107 PolarHBondContact O-OG 3.32Å
104N90.3Very high92.7Very high26 Ų2617.7 Ų17.714%0.1399%0.094CC..Hα-helixtrans-60.2-40.8176.5-175.167.8000112.2L100 F101 A102 S107 I108 Y332L100-N104 WeakPolarHBondContact O-CB 3.38Å; L100-N104 PolarHBondContact O-N 3.34Å; F101-N104 PolarHBondContact O-N 3.22Å; A102-N104 PolarHBondContact O-N 3.11Å; N104-S107 PolarHBondContact O-N 3.33Å; N104-I108 WeakPolarHBondContact O-CG1 3.5Å; N104-I108 PolarHBondContact O-N 2.91Å; N104-Y332 VanDerWaalsContact ND2-CE2 3.34Å; N104-Y332 WeakPolarHBondContact ND2-CE2 3.38Å; N104-Y332 PolarHBondContact ND2-OH 2.8Å
105S92.8Very high92.1Very high1 Ų115.1 Ų15.11%0.0079%0.087CC..Hα-helixtrans-66.6-39.517776.30000112.9F101 A102 S103 S107 I108 L109 G148F101-S105 WeakPolarHBondContact O-CB 3.46Å; F101-S105 PolarHBondContact O-N 3.05Å; F101-S105 PolarHBondContact O-OG 3.21Å; A102-S105 PolarHBondContact O-N 3.5Å; A102-S105 PolarHBondContact O-OG 2.92Å; S103-S105 VanDerWaalsContact C-N 3.3Å; S103-S105 PolarHBondContact O-N 3.26Å; S105-S107 VanDerWaalsContact C-N 3.31Å; S105-S107 PolarHBondContact O-N 3.47Å; S105-I108 PolarHBondContact O-N 2.86Å; S105-L109 WeakPolarHBondContact O-CB 3.46Å; S105-L109 VanDerWaalsContact O-CG 3.29Å; S105-L109 WeakPolarHBondContact O-CG 3.18Å; S105-L109 PolarHBondContact O-N 2.66Å; S105-G148 WeakPolarHBondContact OG-CA 3.48Å
106V93.8Very high91.7Very high0 Ų016.5 Ų16.50%09%0.091CC..Hα-helixtrans-61.1-42.8174170.20000110A65 A102 S103 L109 T110 W145A65-V106 HydrophobicContact CB-CG1 4.01Å; A102-V106 VanDerWaalsContact O-CG2 3.32Å; A102-V106 WeakPolarHBondContact O-CG2 3.31Å; A102-V106 PolarHBondContact O-N 2.92Å; S103-V106 PolarHBondContact O-N 3.45Å; V106-L109 PolarHBondContact O-N 3.18Å; V106-T110 WeakPolarHBondContact O-CB 3.16Å; V106-T110 PolarHBondContact O-N 2.9Å; V106-T110 PolarHBondContact O-OG1 3.38Å; V106-W145 HydrophobicContact CG1-CD2 4.31Å; V106-W145 HydrophobicContact CG1-CZ2 4.17Å; V106-W145 HydrophobicContact CG2-CD2 3.88Å; V106-W145 HydrophobicContact CG2-CE3 3.97Å; V106-W145 HydrophobicContact CG2-CG 4.14Å; V106-W145 HydrophobicContact CG2-CZ3 4.5Å
107S90.8Very high91.2Very high9 Ų916.5 Ų16.56%0.0639%0.091CC..Hα-helixtrans-61.3-46.2176.4-60.90000111.7S103 N104 S105 T110 L111S103-S107 PolarHBondContact O-N 2.96Å; S103-S107 PolarHBondContact O-OG 3.32Å; N104-S107 PolarHBondContact O-N 3.33Å; S105-S107 VanDerWaalsContact C-N 3.31Å; S105-S107 PolarHBondContact O-N 3.47Å; S107-T110 PolarHBondContact O-N 3.22Å; S107-L111 WeakPolarHBondContact O-CB 3.27Å; S107-L111 VanDerWaalsContact O-CG 3.28Å; S107-L111 WeakPolarHBondContact O-CG 3.08Å; S107-L111 PolarHBondContact O-N 2.7Å
108I89.4Confident90.6Very high4 Ų418.5 Ų18.52%0.02110%0.098CC..Hα-helixtrans-59.2-53.7175.6-64.2167000111N104 S105 T110 L111 C112 Y186 F328N104-I108 WeakPolarHBondContact O-CG1 3.5Å; N104-I108 PolarHBondContact O-N 2.91Å; S105-I108 PolarHBondContact O-N 2.86Å; I108-T110 VanDerWaalsContact C-N 3.26Å; I108-T110 PolarHBondContact O-N 2.83Å; I108-L111 WeakPolarHBondContact O-CB 3.29Å; I108-L111 PolarHBondContact O-N 3.5Å; I108-L111 VanDerWaalsContact O-N 3.13Å; I108-C112 PolarHBondContact O-N 3.38Å; I108-C112 PolarHBondContact O-SG 2.83Å; I108-Y186 HydrophobicContact CD1-CD1 4.4Å; I108-F328 HydrophobicContact CD1-CE1 4.08Å; I108-F328 HydrophobicContact CD1-CZ 3.61Å; I108-F328 HydrophobicContact CG1-CE1 3.79Å; I108-F328 HydrophobicContact CG1-CE2 3.97Å; I108-F328 HydrophobicContact CG1-CZ 3.29Å
109L93.2Very high90Very high27 Ų2719.4 Ų19.414%0.14110%0.1CC..Hα-helixtrans-60.9-38-178.2-67.8173.1000111.5S105 V106 C112 L113 T144 V147 Y186 L189S105-L109 WeakPolarHBondContact O-CB 3.46Å; S105-L109 VanDerWaalsContact O-CG 3.29Å; S105-L109 WeakPolarHBondContact O-CG 3.18Å; S105-L109 PolarHBondContact O-N 2.66Å; V106-L109 PolarHBondContact O-N 3.18Å; L109-C112 WeakPolarHBondContact O-CB 3.37Å; L109-C112 PolarHBondContact O-N 3.44Å; L109-L113 WeakPolarHBondContact O-CG 3.4Å; L109-L113 PolarHBondContact O-N 3.48Å; L109-T144 HydrophobicContact CB-CG2 3.71Å; L109-V147 HydrophobicContact CD1-CB 4.04Å; L109-V147 HydrophobicContact CD1-CG1 3.88Å; L109-Y186 HydrophobicContact CD1-CE1 4.19Å; L109-Y186 HydrophobicContact CD2-CE1 4.3Å; L109-Y186 HydrophobicContact CG-CE1 4.14Å; L109-L189 HydrophobicContact CD2-CD2 3.7Å
110T91.9Very high89.6Confident0 Ų017.4 Ų17.40%09%0.09CC..Hα-helixtrans-67.1-41.1176.4-57.20000111.3L58 N61 L62 V106 S107 I108 C112 L113 I114L58-T110 HydrophobicContact CB-CG2 4.34Å; L58-T110 WeakPolarHBondContact O-CG2 2.89Å; N61-T110 HydrophobicContact CB-CG2 4.47Å; N61-T110 PolarHBondContact ND2-OG1 2.88Å; L62-T110 HydrophobicContact CB-CG2 3.94Å; V106-T110 WeakPolarHBondContact O-CB 3.16Å; V106-T110 PolarHBondContact O-N 2.9Å; V106-T110 PolarHBondContact O-OG1 3.38Å; S107-T110 PolarHBondContact O-N 3.22Å; I108-T110 VanDerWaalsContact C-N 3.26Å; I108-T110 PolarHBondContact O-N 2.83Å; T110-C112 VanDerWaalsContact C-N 3.34Å; T110-C112 PolarHBondContact O-N 3.2Å; T110-L113 PolarHBondContact O-N 2.99Å; T110-I114 HydrophobicContact CG2-CD1 4.04Å; T110-I114 HydrophobicContact CG2-CG1 4.42Å; T110-I114 WeakPolarHBondContact O-CB 3.13Å; T110-I114 VanDerWaalsContact O-CG1 3.24Å; T110-I114 WeakPolarHBondContact O-CG1 3.32Å; T110-I114 PolarHBondContact O-N 3.13Å
111L86.1Confident89.1Confident26 Ų2619.3 Ų19.314%0.13610%0.1CC..Hα-helixtrans-62.2-40.6173.7-71.6172.4000111.9L62 S107 I108 L113 I114 A115 V324L62-L111 HydrophobicContact CD2-CD2 4.02Å; S107-L111 WeakPolarHBondContact O-CB 3.27Å; S107-L111 VanDerWaalsContact O-CG 3.28Å; S107-L111 WeakPolarHBondContact O-CG 3.08Å; S107-L111 PolarHBondContact O-N 2.7Å; I108-L111 WeakPolarHBondContact O-CB 3.29Å; I108-L111 PolarHBondContact O-N 3.5Å; I108-L111 VanDerWaalsContact O-N 3.13Å; L111-L113 VanDerWaalsContact C-N 3.34Å; L111-L113 PolarHBondContact O-N 3.2Å; L111-I114 HydrophobicContact CD2-CD1 4.46Å; L111-I114 PolarHBondContact O-N 2.57Å; L111-A115 WeakPolarHBondContact O-CB 3.12Å; L111-A115 PolarHBondContact O-N 3.45Å; L111-V324 HydrophobicContact CD1-CG1 4.26Å; L111-V324 HydrophobicContact CD2-CG1 3.65Å
112C89.1Confident88.6Confident17 Ų1721.2 Ų21.212%0.11511%0.109CC..Hα-helixtrans-58.9-45.1172.5-61.60000111.4I108 L109 T110 A115 L116 S193I108-C112 PolarHBondContact O-N 3.38Å; I108-C112 PolarHBondContact O-SG 2.83Å; L109-C112 WeakPolarHBondContact O-CB 3.37Å; L109-C112 PolarHBondContact O-N 3.44Å; T110-C112 VanDerWaalsContact C-N 3.34Å; T110-C112 PolarHBondContact O-N 3.2Å; C112-A115 PolarHBondContact O-N 3.43Å; C112-L116 WeakPolarHBondContact O-CB 3.35Å; C112-L116 PolarHBondContact O-N 3.01Å; C112-S193 PolarHBondContact SG-OG 3.24Å
113L90.9Very high87.9Confident34 Ų3421.8 Ų21.818%0.17811%0.114CC..Hα-helixtrans-66.6-37.7177.7-71.9171.5000112.5L58 L109 T110 L111 G117 A140 T144L58-L113 HydrophobicContact CD1-CB 4.14Å; L58-L113 HydrophobicContact CD2-CB 4.24Å; L58-L113 HydrophobicContact CD2-CD1 4.37Å; L109-L113 WeakPolarHBondContact O-CG 3.4Å; L109-L113 PolarHBondContact O-N 3.48Å; T110-L113 PolarHBondContact O-N 2.99Å; L111-L113 VanDerWaalsContact C-N 3.34Å; L111-L113 PolarHBondContact O-N 3.2Å; L113-G117 PolarHBondContact O-N 2.98Å; L113-A140 HydrophobicContact CD1-CB 4.06Å; L113-A140 HydrophobicContact CD2-CB 4.49Å; L113-T144 HydrophobicContact CD1-CG2 3.53Å
114I87.4Confident87.6Confident13 Ų1325.4 Ų25.47%0.06713%0.131CC..Hα-helixtrans-61.5-47.5173.7-72.9169.2000109.4F55 L58 I59 L62 T110 L111 G117 R118F55-I114 HydrophobicContact CZ-CB 4.49Å; F55-I114 HydrophobicContact CZ-CG2 3.83Å; L58-I114 HydrophobicContact CB-CD1 4.35Å; L58-I114 HydrophobicContact CB-CG1 3.72Å; L58-I114 HydrophobicContact CD1-CG1 4.05Å; I59-I114 HydrophobicContact CG1-CD1 4.34Å; L62-I114 HydrophobicContact CD2-CD1 4.35Å; T110-I114 HydrophobicContact CG2-CD1 4.04Å; T110-I114 HydrophobicContact CG2-CG1 4.42Å; T110-I114 WeakPolarHBondContact O-CB 3.13Å; T110-I114 VanDerWaalsContact O-CG1 3.24Å; T110-I114 WeakPolarHBondContact O-CG1 3.32Å; T110-I114 PolarHBondContact O-N 3.13Å; L111-I114 HydrophobicContact CD2-CD1 4.46Å; L111-I114 PolarHBondContact O-N 2.57Å; I114-G117 PolarHBondContact O-N 3.07Å; I114-R118 WeakPolarHBondContact O-CG 3.43Å; I114-R118 PolarHBondContact O-N 3.49Å
115A83.8Confident87.4Confident11 Ų1128.4 Ų28.49%0.09115%0.152CC..Hα-helixtrans-63-46.8178.500000112L111 C112 G117 R118 Y119 F197L111-A115 WeakPolarHBondContact O-CB 3.12Å; L111-A115 PolarHBondContact O-N 3.45Å; C112-A115 PolarHBondContact O-N 3.43Å; A115-G117 PolarHBondContact O-N 3.14Å; A115-R118 PolarHBondContact O-N 2.99Å; A115-Y119 PolarHBondContact O-N 3.13Å; A115-F197 HydrophobicContact CB-CB 4.01Å; A115-F197 HydrophobicContact CB-CD2 3.58Å; A115-F197 HydrophobicContact CB-CE2 4.44Å; A115-F197 HydrophobicContact CB-CG 4.07Å
116L87.1Confident87.2Confident55 Ų5537.1 Ų37.129%0.28819%0.19SC..Hα-helixtrans-60.4-45.6174.8175.361.4000111.7C112 R118 Y119 L120 F197C112-L116 WeakPolarHBondContact O-CB 3.35Å; C112-L116 PolarHBondContact O-N 3.01Å; L116-R118 VanDerWaalsContact C-N 3.31Å; L116-R118 PolarHBondContact O-N 2.91Å; L116-Y119 PolarHBondContact O-N 3.32Å; L116-L120 HydrophobicContact CD1-CD1 4.04Å; L116-L120 HydrophobicContact CD1-CG 4.02Å; L116-L120 HydrophobicContact CG-CD1 4.15Å; L116-L120 HydrophobicContact CG-CG 4.47Å; L116-L120 WeakPolarHBondContact O-CG 3.3Å; L116-L120 PolarHBondContact O-N 3.01Å; L116-F197 HydrophobicContact CB-CE1 4.31Å; L116-F197 HydrophobicContact CB-CE2 3.99Å; L116-F197 HydrophobicContact CB-CZ 3.78Å; L116-F197 HydrophobicContact CD1-CE1 3.74Å; L116-F197 HydrophobicContact CD1-CZ 3.67Å; L116-F197 HydrophobicContact CG-CZ 4.28Å
117G86.6Confident87Confident0 Ų041.2 Ų41.20%021%0.211CC..Hα-helixtrans-60.7-40178.600000112.4L113 I114 A115 L121 F128 F132L113-G117 PolarHBondContact O-N 2.98Å; I114-G117 PolarHBondContact O-N 3.07Å; A115-G117 PolarHBondContact O-N 3.14Å; G117-L121 WeakPolarHBondContact O-CB 3.49Å; G117-L121 PolarHBondContact O-N 3.21Å; G117-F128 WeakPolarHBondContact O-CE2 3.11Å; G117-F132 VanDerWaalsContact CA-CE2 3.42Å
118R81.9Confident86.9Confident42 Ų4242.1 Ų42.116%0.15821%0.214CC..Hα-helixtrans-66-46.3173.6-72.2-58.1-168.7-164.9-3.4112F55 I114 A115 L116 L120 L121 I122 I201F55-R118 VanDerWaalsContact CE1-NE 3.32Å; F55-R118 HydrophobicContact CE2-CG 3.78Å; F55-R118 VanDerWaalsContact CZ-CD 3.46Å; F55-R118 HydrophobicContact CZ-CG 3.57Å; F55-R118 VanDerWaalsContact CZ-CZ 3.46Å; I114-R118 WeakPolarHBondContact O-CG 3.43Å; I114-R118 PolarHBondContact O-N 3.49Å; A115-R118 PolarHBondContact O-N 2.99Å; L116-R118 VanDerWaalsContact C-N 3.31Å; L116-R118 PolarHBondContact O-N 2.91Å; R118-L120 PolarHBondContact O-N 3.3Å; R118-L121 PolarHBondContact O-N 2.94Å; R118-I122 WeakPolarHBondContact O-CG1 3.23Å; R118-I122 PolarHBondContact O-N 3.28Å; R118-I122 VanDerWaalsContact O-N 3.07Å; R118-I201 HydrophobicContact CB-CD1 4.33Å
119Y83.3Confident86.8Confident45 Ų4544.9 Ų44.918%0.17623%0.232CC..Hα-helixtrans-58.1-48.3177.6171.6-110.1000111.3A115 L116 L121 I122 A123 H124 F197 L200 I201A115-Y119 PolarHBondContact O-N 3.13Å; L116-Y119 PolarHBondContact O-N 3.32Å; Y119-L121 VanDerWaalsContact C-N 3.34Å; Y119-L121 PolarHBondContact O-N 3.05Å; Y119-I122 PolarHBondContact O-N 2.91Å; Y119-A123 HydrophobicContact CD2-CB 3.89Å; Y119-A123 HydrophobicContact CE2-CB 3.43Å; Y119-A123 VanDerWaalsContact CE2-CB 3.43Å; Y119-A123 VanDerWaalsContact O-CB 3.31Å; Y119-A123 WeakPolarHBondContact O-CB 3.36Å; Y119-A123 PolarHBondContact O-N 3.18Å; Y119-H124 AromaticContact CE1-CD2 3.98Å; Y119-H124 PolarHBondContact OH-NE2 3.37Å; Y119-F197 HydrophobicContact CD1-CD1 4.11Å; Y119-F197 HydrophobicContact CD1-CE1 4.06Å; Y119-F197 AromaticContact CG-CD1 3.94Å; Y119-F197 HydrophobicContact CG-CD1 3.94Å; Y119-F197 HydrophobicContact CG-CE1 4.35Å; Y119-L200 HydrophobicContact CD2-CB 3.84Å; Y119-L200 HydrophobicContact CD2-CD1 4.42Å; Y119-L200 HydrophobicContact CE1-CD1 4.36Å; Y119-L200 HydrophobicContact CE2-CB 3.63Å; Y119-L200 HydrophobicContact CE2-CD1 4.06Å; Y119-L200 HydrophobicContact CE2-CG 4.36Å; Y119-I201 HydrophobicContact CD2-CG1 4.32Å
120L86.9Confident86.6Confident17 Ų1751.2 Ų51.29%0.08926%0.258CS..Hα-helixtrans-63.3-38.4178.2-71179.5000112.5L116 R118 I122 H124 F128 V131 F132L116-L120 HydrophobicContact CD1-CD1 4.04Å; L116-L120 HydrophobicContact CD1-CG 4.02Å; L116-L120 HydrophobicContact CG-CD1 4.15Å; L116-L120 HydrophobicContact CG-CG 4.47Å; L116-L120 WeakPolarHBondContact O-CG 3.3Å; L116-L120 PolarHBondContact O-N 3.01Å; R118-L120 PolarHBondContact O-N 3.3Å; L120-I122 VanDerWaalsContact C-N 3.32Å; L120-I122 PolarHBondContact O-N 3.3Å; L120-H124 HydrophobicContact CD2-CB 4.21Å; L120-H124 CarbonylContact O-C 2.92Å; L120-H124 VanDerWaalsContact O-CA 3.31Å; L120-H124 WeakPolarHBondContact O-CA 3.36Å; L120-H124 PolarHBondContact O-N 3.19Å; L120-F128 HydrophobicContact CB-CB 4.42Å; L120-F128 HydrophobicContact CB-CD2 4.13Å; L120-V131 HydrophobicContact CD1-CB 4.22Å; L120-V131 HydrophobicContact CD1-CG1 4.09Å; L120-V131 HydrophobicContact CD1-CG2 4.29Å; L120-F132 HydrophobicContact CD1-CD2 4.4Å; L120-F132 HydrophobicContact CD1-CE2 4.04Å
121L84.8Confident86.4Confident67 Ų6754.7 Ų54.735%0.35128%0.279SS..Hα-helixtrans-62.7-38.6176.9-173.669.5000112.3G117 R118 Y119 F128G117-L121 WeakPolarHBondContact O-CB 3.49Å; G117-L121 PolarHBondContact O-N 3.21Å; R118-L121 PolarHBondContact O-N 2.94Å; Y119-L121 VanDerWaalsContact C-N 3.34Å; Y119-L121 PolarHBondContact O-N 3.05Å; L121-F128 HydrophobicContact CB-CD2 3.93Å; L121-F128 HydrophobicContact CB-CE2 4.11Å; L121-F128 HydrophobicContact CB-CG 4.43Å; L121-F128 HydrophobicContact CD1-CD1 3.93Å; L121-F128 HydrophobicContact CD1-CD2 4.24Å; L121-F128 HydrophobicContact CD1-CE1 4.01Å; L121-F128 HydrophobicContact CD1-CE2 4.31Å; L121-F128 HydrophobicContact CD1-CG 4.05Å; L121-F128 HydrophobicContact CD1-CZ 4.2Å
122I81.8Confident86.6Confident45 Ų4553.7 Ų53.723%0.23127%0.274CS..Hα-helixtrans-86.7-46.8-175.5-63.5168000111.7R118 Y119 L120 I201 Q204 F314R118-I122 WeakPolarHBondContact O-CG1 3.23Å; R118-I122 PolarHBondContact O-N 3.28Å; R118-I122 VanDerWaalsContact O-N 3.07Å; Y119-I122 PolarHBondContact O-N 2.91Å; L120-I122 VanDerWaalsContact C-N 3.32Å; L120-I122 PolarHBondContact O-N 3.3Å; I122-I201 HydrophobicContact CD1-CG2 4.14Å; I122-Q204 HydrophobicContact CG2-CG 4.14Å; I122-F314 HydrophobicContact CD1-CD1 4.38Å; I122-F314 HydrophobicContact CG1-CD1 4.48Å; I122-F314 HydrophobicContact CG1-CE1 4.48Å
123A81.7Confident86.7Confident16 Ų1654.8 Ų54.813%0.13228%0.282CS..Hα-helixtrans-89.6-31.7-173.200000113.2Y119 Q204Y119-A123 HydrophobicContact CD2-CB 3.89Å; Y119-A123 HydrophobicContact CE2-CB 3.43Å; Y119-A123 VanDerWaalsContact CE2-CB 3.43Å; Y119-A123 VanDerWaalsContact O-CB 3.31Å; Y119-A123 WeakPolarHBondContact O-CB 3.36Å; Y119-A123 PolarHBondContact O-N 3.18Å; A123-Q204 HydrophobicContact CB-CG 4.06Å
124H85.4Confident86.6Confident78 Ų7856.3 Ų56.336%0.36130%0.299SS..  trans-138.363.9-171.4-62.5-63.1000113.2Y119 L120 K126 L127 F128Y119-H124 AromaticContact CE1-CD2 3.98Å; Y119-H124 PolarHBondContact OH-NE2 3.37Å; L120-H124 HydrophobicContact CD2-CB 4.21Å; L120-H124 CarbonylContact O-C 2.92Å; L120-H124 VanDerWaalsContact O-CA 3.31Å; L120-H124 WeakPolarHBondContact O-CA 3.36Å; L120-H124 PolarHBondContact O-N 3.19Å; H124-K126 PolarHBondContact O-N 3.17Å; H124-L127 HydrophobicContact CB-CB 4.15Å; H124-L127 HydrophobicContact CB-CD1 4.01Å; H124-L127 HydrophobicContact CB-CG 4.48Å; H124-L127 PolarHBondContact O-N 3.4Å; H124-F128 PolarHBondContact O-N 3.24Å
125P86.8Confident86.8Confident89 Ų8964.5 Ų64.558%0.57833%0.334SS*.THydrogen-bonded Turntrans-60.2-24.9-172.923.6-34.8000114.2P129P125-P129 WeakPolarHBondContact O-CD 3.31Å
126K89Confident87.3Confident185 Ų18564.9 Ų64.980%0.80434%0.34SS*.THydrogen-bonded Turntrans-73.9-29.3175.6-63.3-176.3-179.3-179.60113.4H124H124-K126 PolarHBondContact O-N 3.17Å
127L88.2Confident87.6Confident85 Ų8562.4 Ų62.445%0.44533%0.327SS..THydrogen-bonded Turntrans-86.5-31.6-179.8-73.4168.6000111.9H124 K130 V131H124-L127 HydrophobicContact CB-CB 4.15Å; H124-L127 HydrophobicContact CB-CD1 4.01Å; H124-L127 HydrophobicContact CB-CG 4.48Å; H124-L127 PolarHBondContact O-N 3.4Å; L127-K130 WeakPolarHBondContact O-CB 3.3Å; L127-K130 PolarHBondContact O-N 2.9Å; L127-V131 PolarHBondContact O-N 2.81Å
128F88.8Confident87.9Confident28 Ų2866.8 Ų66.812%0.12335%0.353CS..Hα-helixtrans-48.2-52.1179.1-178.6-93.7000114.4G117 L120 L121 H124 K130 V131 F132G117-F128 WeakPolarHBondContact O-CE2 3.11Å; L120-F128 HydrophobicContact CB-CB 4.42Å; L120-F128 HydrophobicContact CB-CD2 4.13Å; L121-F128 HydrophobicContact CB-CD2 3.93Å; L121-F128 HydrophobicContact CB-CE2 4.11Å; L121-F128 HydrophobicContact CB-CG 4.43Å; L121-F128 HydrophobicContact CD1-CD1 3.93Å; L121-F128 HydrophobicContact CD1-CD2 4.24Å; L121-F128 HydrophobicContact CD1-CE1 4.01Å; L121-F128 HydrophobicContact CD1-CE2 4.31Å; L121-F128 HydrophobicContact CD1-CG 4.05Å; L121-F128 HydrophobicContact CD1-CZ 4.2Å; H124-F128 PolarHBondContact O-N 3.24Å; F128-K130 VanDerWaalsContact C-N 3.26Å; F128-K130 PolarHBondContact O-N 3.06Å; F128-V131 PolarHBondContact O-N 3.09Å; F128-F132 AromaticContact CD2-CD2 3.92Å; F128-F132 HydrophobicContact CD2-CD2 3.92Å; F128-F132 HydrophobicContact CE1-CB 4.47Å; F128-F132 HydrophobicContact CE2-CB 4.2Å; F128-F132 AromaticContact CE2-CD2 3.81Å; F128-F132 HydrophobicContact CE2-CD2 3.81Å; F128-F132 HydrophobicContact CE2-CG 4.11Å; F128-F132 HydrophobicContact CZ-CB 4.15Å; F128-F132 HydrophobicContact CZ-CG 4.46Å; F128-F132 WeakPolarHBondContact O-CA 3.23Å; F128-F132 WeakPolarHBondContact O-CB 3.24Å; F128-F132 PolarHBondContact O-N 3.41Å
129P88.1Confident88.6Confident62 Ų6270.7 Ų70.740%0.40338%0.377SS..Hα-helixtrans-70.5-20.7-178.228.2-36000113.8P125 S133P125-P129 WeakPolarHBondContact O-CD 3.31Å; P129-S133 WeakPolarHBondContact O-CA 3.2Å; P129-S133 PolarHBondContact O-N 3.43Å
130K89.4Confident89.1Confident161 Ų16169.2 Ų69.270%0.737%0.374SS*.Hα-helixtrans-76.7-48.6175.5-62.9-174.1178.6-174.60110.8L127 F128L127-K130 WeakPolarHBondContact O-CB 3.3Å; L127-K130 PolarHBondContact O-N 2.9Å; F128-K130 VanDerWaalsContact C-N 3.26Å; F128-K130 PolarHBondContact O-N 3.06Å
131V87.9Confident89.5Confident73 Ų7370.2 Ų70.244%0.44238%0.379SS..Hα-helixtrans-71.1-54.7179.51780000110.9L120 L127 F128 S133L120-V131 HydrophobicContact CD1-CB 4.22Å; L120-V131 HydrophobicContact CD1-CG1 4.09Å; L120-V131 HydrophobicContact CD1-CG2 4.29Å; L127-V131 PolarHBondContact O-N 2.81Å; F128-V131 PolarHBondContact O-N 3.09Å; V131-S133 PolarHBondContact O-N 3.42Å; V131-S133 VanDerWaalsContact O-N 3.13Å
132F88.9Confident90.1Very high5 Ų570.8 Ų70.82%0.02239%0.385CS..THydrogen-bonded Turntrans-89.649.2175.5-69.8-84.4000111.1R54 L58 G117 L120 F128 I137R54-F132 VanDerWaalsContact CD-O 3.27Å; R54-F132 WeakPolarHBondContact CD-O 3.38Å; R54-F132 PolarHBondContact NH1-O 3.47Å; L58-F132 HydrophobicContact CD1-CE1 3.85Å; L58-F132 HydrophobicContact CD1-CZ 4.43Å; G117-F132 VanDerWaalsContact CA-CE2 3.42Å; L120-F132 HydrophobicContact CD1-CD2 4.4Å; L120-F132 HydrophobicContact CD1-CE2 4.04Å; F128-F132 AromaticContact CD2-CD2 3.92Å; F128-F132 HydrophobicContact CD2-CD2 3.92Å; F128-F132 HydrophobicContact CE1-CB 4.47Å; F128-F132 HydrophobicContact CE2-CB 4.2Å; F128-F132 AromaticContact CE2-CD2 3.81Å; F128-F132 HydrophobicContact CE2-CD2 3.81Å; F128-F132 HydrophobicContact CE2-CG 4.11Å; F128-F132 HydrophobicContact CZ-CB 4.15Å; F128-F132 HydrophobicContact CZ-CG 4.46Å; F128-F132 WeakPolarHBondContact O-CA 3.23Å; F128-F132 WeakPolarHBondContact O-CB 3.24Å; F128-F132 PolarHBondContact O-N 3.41Å; F132-I137 HydrophobicContact CB-CD1 4.15Å; F132-I137 HydrophobicContact CB-CG1 4.25Å; F132-I137 HydrophobicContact CD1-CD1 4.19Å; F132-I137 HydrophobicContact CD1-CG1 3.71Å; F132-I137 HydrophobicContact CG-CG1 4.48Å
133S91.9Very high90.8Very high39 Ų3970.9 Ų70.927%0.27339%0.39SS..SBendtrans-69.2170.4166.268.90000110.4P129 V131 K135 G136 I137P129-S133 WeakPolarHBondContact O-CA 3.2Å; P129-S133 PolarHBondContact O-N 3.43Å; V131-S133 PolarHBondContact O-N 3.42Å; V131-S133 VanDerWaalsContact O-N 3.13Å; S133-K135 VanDerWaalsContact C-N 3.34Å; S133-K135 PolarHBondContact O-N 2.89Å; S133-G136 PolarHBondContact O-N 3.38Å; S133-G136 PolarHBondContact OG-N 3Å; S133-G136 VanDerWaalsContact OG-N 3.08Å; S133-I137 PolarHBondContact O-N 3.42Å
134A89.1Confident91.5Very high67 Ų6770.2 Ų70.255%0.55438%0.384SS*.Hα-helixtrans-58.2-46.6178.200000111.8V138A134-V138 WeakPolarHBondContact O-CG2 3.29Å; A134-V138 PolarHBondContact O-N 3.45Å
135K92.4Very high92Very high184 Ų18470.3 Ų70.380%0.838%0.381SS*.Hα-helixtrans-66.2-42175.2-62.3-176.6-178.7-179.20111.6S133 I137 V138 L139S133-K135 VanDerWaalsContact C-N 3.34Å; S133-K135 PolarHBondContact O-N 2.89Å; K135-I137 VanDerWaalsContact C-N 3.34Å; K135-I137 PolarHBondContact O-N 2.82Å; K135-V138 PolarHBondContact O-N 3.44Å; K135-L139 WeakPolarHBondContact O-CB 3.2Å; K135-L139 PolarHBondContact O-N 3.16Å
136G93.1Very high92.6Very high20 Ų2070.3 Ų70.321%0.20638%0.38CS..Hα-helixtrans-60.4-39.9179.500000113.2S133 A140S133-G136 PolarHBondContact O-N 3.38Å; S133-G136 PolarHBondContact OG-N 3Å; S133-G136 VanDerWaalsContact OG-N 3.08Å; G136-A140 VanDerWaalsContact O-CB 3.31Å; G136-A140 WeakPolarHBondContact O-CB 3.34Å; G136-A140 PolarHBondContact O-N 2.82Å
137I93.6Very high92.9Very high3 Ų364.7 Ų64.72%0.01536%0.36CS..Hα-helixtrans-66.9-48.2175.3-81163.7000111.9R54 L57 F132 S133 K135 L139 A140 L141R54-I137 HydrophobicContact CB-CD1 3.3Å; R54-I137 HydrophobicContact CG-CD1 3.77Å; R54-I137 VanDerWaalsContact O-CD1 3.24Å; R54-I137 WeakPolarHBondContact O-CD1 3.41Å; L57-I137 HydrophobicContact CB-CG2 4.11Å; L57-I137 HydrophobicContact CD1-CG2 3.88Å; F132-I137 HydrophobicContact CB-CD1 4.15Å; F132-I137 HydrophobicContact CB-CG1 4.25Å; F132-I137 HydrophobicContact CD1-CD1 4.19Å; F132-I137 HydrophobicContact CD1-CG1 3.71Å; F132-I137 HydrophobicContact CG-CG1 4.48Å; S133-I137 PolarHBondContact O-N 3.42Å; K135-I137 VanDerWaalsContact C-N 3.34Å; K135-I137 PolarHBondContact O-N 2.82Å; I137-L139 PolarHBondContact O-N 2.93Å; I137-A140 WeakPolarHBondContact O-CB 3.36Å; I137-A140 PolarHBondContact O-N 3.49Å; I137-L141 HydrophobicContact CG2-CD1 4.26Å; I137-L141 HydrophobicContact CG2-CG 4.2Å; I137-L141 WeakPolarHBondContact O-CG 3.24Å; I137-L141 PolarHBondContact O-N 3.05Å
138V94.1Very high93.3Very high92 Ų9260.6 Ų60.656%0.55834%0.339SS*.Hα-helixtrans-57.4-44.7178.61740000110.1A134 K135 A140 L141 V142A134-V138 WeakPolarHBondContact O-CG2 3.29Å; A134-V138 PolarHBondContact O-N 3.45Å; K135-V138 PolarHBondContact O-N 3.44Å; V138-A140 PolarHBondContact O-N 2.84Å; V138-L141 PolarHBondContact O-N 3.43Å; V138-V142 HydrophobicContact CG1-CG2 4.41Å; V138-V142 WeakPolarHBondContact O-CG2 3.35Å; V138-V142 PolarHBondContact O-N 2.83Å
139L95.2Very high93.6Very high123 Ų12362.3 Ų62.364%0.64435%0.352SS*.Hα-helixtrans-60.8-43.3175.3-177.362.3000112.1K135 I137 S143K135-L139 WeakPolarHBondContact O-CB 3.2Å; K135-L139 PolarHBondContact O-N 3.16Å; I137-L139 PolarHBondContact O-N 2.93Å; L139-S143 WeakPolarHBondContact O-CB 3.2Å; L139-S143 PolarHBondContact O-N 3.31Å; L139-S143 PolarHBondContact O-OG 3.33Å
140A94.5Very high94Very high14 Ų1462.3 Ų62.312%0.11636%0.357CS..Hα-helixtrans-64.1-39.2177.700000112.5L113 G136 I137 V138 S143 T144L113-A140 HydrophobicContact CD1-CB 4.06Å; L113-A140 HydrophobicContact CD2-CB 4.49Å; G136-A140 VanDerWaalsContact O-CB 3.31Å; G136-A140 WeakPolarHBondContact O-CB 3.34Å; G136-A140 PolarHBondContact O-N 2.82Å; I137-A140 WeakPolarHBondContact O-CB 3.36Å; I137-A140 PolarHBondContact O-N 3.49Å; V138-A140 PolarHBondContact O-N 2.84Å; A140-S143 PolarHBondContact O-OG 3.39Å; A140-T144 WeakPolarHBondContact O-CG2 3.29Å; A140-T144 PolarHBondContact O-N 2.81Å
141L95.5Very high94.2Very high38 Ų3855.9 Ų55.920%0.19933%0.332CS..Hα-helixtrans-65.2-54.3176-63.9-170000110.4L58 N61 I137 V138 S143 T144L58-L141 HydrophobicContact CD2-CD2 3.75Å; N61-L141 HydrophobicContact CB-CD2 3.5Å; I137-L141 HydrophobicContact CG2-CD1 4.26Å; I137-L141 HydrophobicContact CG2-CG 4.2Å; I137-L141 WeakPolarHBondContact O-CG 3.24Å; I137-L141 PolarHBondContact O-N 3.05Å; V138-L141 PolarHBondContact O-N 3.43Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 3.37Å; L141-T144 PolarHBondContact O-N 3.49Å; L141-T144 PolarHBondContact O-OG1 2.9Å
142V96.3Very high94.6Very high80 Ų8052.6 Ų52.649%0.48531%0.312SS..Hα-helixtrans-59.6-40.5-179.7173.40000111V138 T144 W145 V146V138-V142 HydrophobicContact CG1-CG2 4.41Å; V138-V142 WeakPolarHBondContact O-CG2 3.35Å; V138-V142 PolarHBondContact O-N 2.83Å; V142-T144 VanDerWaalsContact C-N 3.31Å; V142-T144 PolarHBondContact O-N 3.24Å; V142-W145 PolarHBondContact O-N 3.22Å; V142-V146 HydrophobicContact CG1-CG2 3.87Å; V142-V146 WeakPolarHBondContact O-CG2 3.31Å; V142-V146 PolarHBondContact O-N 3.03Å
143S96.5Very high94.8Very high47 Ų4754 Ų5433%0.32932%0.324SS..Hα-helixtrans-63.3-35.4-179.772.20000112.6L139 A140 L141 W145 V146 V147L139-S143 WeakPolarHBondContact O-CB 3.2Å; L139-S143 PolarHBondContact O-N 3.31Å; L139-S143 PolarHBondContact O-OG 3.33Å; A140-S143 PolarHBondContact O-OG 3.39Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 3.37Å; S143-W145 VanDerWaalsContact C-N 3.34Å; S143-W145 PolarHBondContact O-N 3.17Å; S143-V146 PolarHBondContact O-N 3.22Å; S143-V147 VanDerWaalsContact O-CB 3.24Å; S143-V147 WeakPolarHBondContact O-CB 3.26Å; S143-V147 WeakPolarHBondContact O-CG2 3.3Å; S143-V147 PolarHBondContact O-N 2.85Å
144T96.7Very high94.9Very high2 Ų256 Ų561%0.01234%0.337CS..Hα-helixtrans-59.6-44.5175.861.30000112.3N61 L109 L113 A140 L141 V142 G148N61-T144 PolarHBondContact ND2-OG1 2.91Å; L109-T144 HydrophobicContact CB-CG2 3.71Å; L113-T144 HydrophobicContact CD1-CG2 3.53Å; A140-T144 WeakPolarHBondContact O-CG2 3.29Å; A140-T144 PolarHBondContact O-N 2.81Å; L141-T144 PolarHBondContact O-N 3.49Å; L141-T144 PolarHBondContact O-OG1 2.9Å; V142-T144 VanDerWaalsContact C-N 3.31Å; V142-T144 PolarHBondContact O-N 3.24Å; T144-G148 PolarHBondContact O-N 2.91Å
145W97.1Very high95.1Very high80 Ų8053.4 Ų53.430%0.30331%0.313SS..Hα-helixtrans-70.3-46.3178.6-69.891.5000112.1N61 A65 L68 V106 V142 S143 V147 G148 V149N61-W145 PolarHBondContact OD1-NE1 2.92Å; A65-W145 HydrophobicContact CB-CH2 4.25Å; A65-W145 HydrophobicContact CB-CZ2 4.18Å; L68-W145 HydrophobicContact CD2-CH2 4.14Å; L68-W145 HydrophobicContact CD2-CZ3 4.15Å; V106-W145 HydrophobicContact CG1-CD2 4.31Å; V106-W145 HydrophobicContact CG1-CZ2 4.17Å; V106-W145 HydrophobicContact CG2-CD2 3.88Å; V106-W145 HydrophobicContact CG2-CE3 3.97Å; V106-W145 HydrophobicContact CG2-CG 4.14Å; V106-W145 HydrophobicContact CG2-CZ3 4.5Å; V142-W145 PolarHBondContact O-N 3.22Å; S143-W145 VanDerWaalsContact C-N 3.34Å; S143-W145 PolarHBondContact O-N 3.17Å; W145-V147 PolarHBondContact O-N 2.95Å; W145-G148 PolarHBondContact O-N 2.94Å; W145-V149 WeakPolarHBondContact O-CB 3.39Å; W145-V149 WeakPolarHBondContact O-CG2 3.44Å; W145-V149 PolarHBondContact O-N 2.95Å
146V97.4Very high95.1Very high89 Ų8949.4 Ų49.454%0.53929%0.293SS..Hα-helixtrans-60.6-47.7179.31710000110.5V142 S143 A150V142-V146 HydrophobicContact CG1-CG2 3.87Å; V142-V146 WeakPolarHBondContact O-CG2 3.31Å; V142-V146 PolarHBondContact O-N 3.03Å; S143-V146 PolarHBondContact O-N 3.22Å; V146-A150 WeakPolarHBondContact O-CB 3.25Å; V146-A150 PolarHBondContact O-N 3.43Å
147V96.5Very high95Very high66 Ų6652.8 Ų52.840%0.431%0.312SS..Hα-helixtrans-64.9-41.9179172.30000111.2L109 S143 W145 S151L109-V147 HydrophobicContact CD1-CB 4.04Å; L109-V147 HydrophobicContact CD1-CG1 3.88Å; S143-V147 VanDerWaalsContact O-CB 3.24Å; S143-V147 WeakPolarHBondContact O-CB 3.26Å; S143-V147 WeakPolarHBondContact O-CG2 3.3Å; S143-V147 PolarHBondContact O-N 2.85Å; W145-V147 PolarHBondContact O-N 2.95Å; V147-S151 VanDerWaalsContact O-CB 3.23Å; V147-S151 WeakPolarHBondContact O-CB 3.45Å; V147-S151 PolarHBondContact O-N 2.92Å; V147-S151 PolarHBondContact O-OG 3.35Å
148G95.4Very high94.9Very high0 Ų054.1 Ų54.10%032%0.318CS..Hα-helixtrans-61.4-53.4176.800000112.4S105 T144 W145 A150 S151 F152S105-G148 WeakPolarHBondContact OG-CA 3.48Å; T144-G148 PolarHBondContact O-N 2.91Å; W145-G148 PolarHBondContact O-N 2.94Å; G148-A150 PolarHBondContact O-N 3.44Å; G148-S151 PolarHBondContact O-N 3.38Å; G148-F152 VanDerWaalsContact O-CD2 3.27Å; G148-F152 WeakPolarHBondContact O-CD2 3.38Å; G148-F152 PolarHBondContact O-N 2.95Å
149V96Very high94.9Very high64 Ų6449.9 Ų49.939%0.38829%0.292SS..Hα-helixtrans-63.2-44.5177.81750000111A102 W145 S151 F152 A153A102-V149 HydrophobicContact CB-CG2 4.27Å; W145-V149 WeakPolarHBondContact O-CB 3.39Å; W145-V149 WeakPolarHBondContact O-CG2 3.44Å; W145-V149 PolarHBondContact O-N 2.95Å; V149-S151 PolarHBondContact O-N 3.25Å; V149-F152 PolarHBondContact O-N 3.1Å; V149-A153 HydrophobicContact CG1-CB 4.09Å; V149-A153 WeakPolarHBondContact O-CA 3.22Å; V149-A153 WeakPolarHBondContact O-CB 3.27Å; V149-A153 PolarHBondContact O-N 2.6Å
150A96.3Very high94.8Very high62 Ų6247.2 Ų47.251%0.51228%0.278SS..Hα-helixtrans-61.6-31.4179.700000112.9V146 G148 P154V146-A150 WeakPolarHBondContact O-CB 3.25Å; V146-A150 PolarHBondContact O-N 3.43Å; G148-A150 PolarHBondContact O-N 3.44Å; A150-P154 WeakPolarHBondContact O-CD 3.47Å; A150-P154 WeakPolarHBondContact O-CG 3.17Å
151S94.6Very high94.7Very high25 Ų2547.2 Ų47.218%0.17528%0.276CS..Hα-helixtrans-75.3-35.5178.9-67.50000112.7V147 G148 V149 Y178 L182 Y186V147-S151 VanDerWaalsContact O-CB 3.23Å; V147-S151 WeakPolarHBondContact O-CB 3.45Å; V147-S151 PolarHBondContact O-N 2.92Å; V147-S151 PolarHBondContact O-OG 3.35Å; G148-S151 PolarHBondContact O-N 3.38Å; V149-S151 PolarHBondContact O-N 3.25Å; S151-Y178 PolarHBondContact O-OH 2.92Å; S151-L182 VanDerWaalsContact O-CD2 3.29Å; S151-L182 WeakPolarHBondContact O-CD2 3.48Å; S151-Y186 WeakPolarHBondContact CB-OH 3.32Å; S151-Y186 PolarHBondContact OG-OH 2.84Å
152F94.8Very high94.5Very high4 Ų446 Ų462%0.01827%0.27CS..Hα-helixtrans-105.1-23.7-173.4-69.8-73.2000114.3L98 F101 G148 V149 P154 L155 Y159 L182 M183 Y186L98-F152 VanDerWaalsContact CD1-C 3.49Å; L98-F152 HydrophobicContact CD1-CB 3.72Å; F101-F152 HydrophobicContact CB-CB 4.37Å; F101-F152 HydrophobicContact CB-CD1 3.48Å; F101-F152 VanDerWaalsContact CB-CD1 3.48Å; F101-F152 HydrophobicContact CB-CD2 4Å; F101-F152 HydrophobicContact CB-CE1 3.68Å; F101-F152 HydrophobicContact CB-CE2 4.22Å; F101-F152 HydrophobicContact CB-CG 3.67Å; F101-F152 HydrophobicContact CB-CZ 4.05Å; F101-F152 HydrophobicContact CG-CD1 4.16Å; F101-F152 HydrophobicContact CG-CE1 4.17Å; G148-F152 VanDerWaalsContact O-CD2 3.27Å; G148-F152 WeakPolarHBondContact O-CD2 3.38Å; G148-F152 PolarHBondContact O-N 2.95Å; V149-F152 PolarHBondContact O-N 3.1Å; F152-P154 VanDerWaalsContact C-CD 3.46Å; F152-L155 HydrophobicContact CD1-CD1 4.05Å; F152-L155 VanDerWaalsContact O-CB 3.31Å; F152-L155 WeakPolarHBondContact O-CB 3.45Å; F152-L155 PolarHBondContact O-N 3.01Å; F152-Y159 PolarHBondContact O-OH 3.41Å; F152-Y159 VanDerWaalsContact O-OH 3.14Å; F152-L182 HydrophobicContact CD1-CD2 3.91Å; F152-L182 HydrophobicContact CE1-CD2 3.59Å; F152-L182 HydrophobicContact CE1-CG 4.24Å; F152-L182 HydrophobicContact CZ-CD2 3.94Å; F152-L182 HydrophobicContact CZ-CG 4.22Å; F152-M183 HydrophobicContact CE1-CE 4.37Å; F152-Y186 HydrophobicContact CE2-CD2 4.2Å; F152-Y186 AromaticContact CE2-CE2 3.74Å; F152-Y186 HydrophobicContact CE2-CE2 3.74Å; F152-Y186 HydrophobicContact CZ-CD2 4.05Å; F152-Y186 AromaticContact CZ-CE2 3.99Å; F152-Y186 HydrophobicContact CZ-CE2 3.99Å
153A94.6Very high94.2Very high35 Ų3544.7 Ų44.729%0.28926%0.263SS..G310 helixtrans-59.6-37178.700000114.4L98 V149 L155 W156L98-A153 HydrophobicContact CD1-CB 4.25Å; V149-A153 HydrophobicContact CG1-CB 4.09Å; V149-A153 WeakPolarHBondContact O-CA 3.22Å; V149-A153 WeakPolarHBondContact O-CB 3.27Å; V149-A153 PolarHBondContact O-N 2.6Å; A153-L155 PolarHBondContact O-N 3.47Å; A153-W156 WeakPolarHBondContact O-CB 3.25Å; A153-W156 PolarHBondContact O-N 2.77Å
154P93.9Very high93.7Very high82 Ų8243.4 Ų43.453%0.53225%0.254SS..G310 helixtrans-58.5-18175-26.536.5000114A150 F152 W156A150-P154 WeakPolarHBondContact O-CD 3.47Å; A150-P154 WeakPolarHBondContact O-CG 3.17Å; F152-P154 VanDerWaalsContact C-CD 3.46Å; P154-W156 VanDerWaalsContact C-N 3.26Å; P154-W156 PolarHBondContact O-N 3.46Å
155L92Very high93.4Very high12 Ų1243.6 Ų43.66%0.06326%0.255CS..G310 helixtrans-84.86.3178.1-54172.3000113.6F152 A153 P157 I158 Y159 Y178 T179F152-L155 HydrophobicContact CD1-CD1 4.05Å; F152-L155 VanDerWaalsContact O-CB 3.31Å; F152-L155 WeakPolarHBondContact O-CB 3.45Å; F152-L155 PolarHBondContact O-N 3.01Å; A153-L155 PolarHBondContact O-N 3.47Å; L155-P157 VanDerWaalsContact O-N 3.17Å; L155-I158 HydrophobicContact CB-CD1 4.03Å; L155-I158 HydrophobicContact CB-CG1 3.84Å; L155-I158 HydrophobicContact CD2-CD1 3.58Å; L155-I158 HydrophobicContact CD2-CG1 4.24Å; L155-I158 HydrophobicContact CG-CD1 4.3Å; L155-I158 WeakPolarHBondContact O-CG1 3.39Å; L155-I158 PolarHBondContact O-N 3.1Å; L155-Y159 HydrophobicContact CB-CE2 3.9Å; L155-Y159 VanDerWaalsContact O-CD2 3.29Å; L155-Y159 WeakPolarHBondContact O-CD2 3.27Å; L155-Y159 PolarHBondContact O-N 3.36Å; L155-Y178 HydrophobicContact CD1-CD1 4.46Å; L155-Y178 HydrophobicContact CD1-CE1 4.19Å; L155-Y178 HydrophobicContact CD2-CD1 3.44Å; L155-Y178 VanDerWaalsContact CD2-CD1 3.44Å; L155-Y178 HydrophobicContact CD2-CE1 3.53Å; L155-Y178 HydrophobicContact CG-CD1 4.36Å; L155-Y178 HydrophobicContact CG-CE1 4.04Å; L155-T179 HydrophobicContact CD1-CG2 3.85Å; L155-T179 HydrophobicContact CD2-CG2 3.97Å
156W93.3Very high93.2Very high100 Ų10039.8 Ų39.838%0.37924%0.24SC..G310 helixtrans-41.5-49.7177.2-172.3-101.9000115.7T91 R94 A95 L98 A153 P154 I158T91-W156 HydrophobicContact CG2-CZ2 4.48Å; R94-W156 HydrophobicContact CB-CD2 4.23Å; R94-W156 HydrophobicContact CB-CE3 4.13Å; R94-W156 HydrophobicContact CB-CH2 3.86Å; R94-W156 HydrophobicContact CB-CZ2 3.95Å; R94-W156 HydrophobicContact CB-CZ3 3.96Å; A95-W156 HydrophobicContact CB-CH2 4.36Å; A95-W156 HydrophobicContact CB-CZ3 4.47Å; L98-W156 HydrophobicContact CD2-CE3 4.34Å; L98-W156 HydrophobicContact CD2-CZ3 4.3Å; A153-W156 WeakPolarHBondContact O-CB 3.25Å; A153-W156 PolarHBondContact O-N 2.77Å; P154-W156 VanDerWaalsContact C-N 3.26Å; P154-W156 PolarHBondContact O-N 3.46Å; W156-I158 VanDerWaalsContact C-N 3.25Å; W156-I158 PolarHBondContact O-N 3.41Å
157P91.7Very high93Very high91 Ų9136.2 Ų36.259%0.59122%0.219SC*.G310 helixtrans-72.2-17.4-175.528.8-35.6000113.9L155L155-P157 VanDerWaalsContact O-N 3.17Å
158I91.4Very high92.8Very high30 Ų3033 Ų3315%0.15420%0.199CC..G310 helixtrans-102.2-0.4-176.565.3164.2000113.3L155 W156 I160 F170 D171 R174 T179L155-I158 HydrophobicContact CB-CD1 4.03Å; L155-I158 HydrophobicContact CB-CG1 3.84Å; L155-I158 HydrophobicContact CD2-CD1 3.58Å; L155-I158 HydrophobicContact CD2-CG1 4.24Å; L155-I158 HydrophobicContact CG-CD1 4.3Å; L155-I158 WeakPolarHBondContact O-CG1 3.39Å; L155-I158 PolarHBondContact O-N 3.1Å; W156-I158 VanDerWaalsContact C-N 3.25Å; W156-I158 PolarHBondContact O-N 3.41Å; I158-I160 PolarHBondContact O-N 3.32Å; I158-F170 HydrophobicContact CD1-CB 3.9Å; I158-F170 HydrophobicContact CG1-CB 4.15Å; I158-F170 CarbonylContact O-C 3.57Å; I158-F170 WeakPolarHBondContact O-CA 3.33Å; I158-D171 HydrophobicContact CB-CB 4.39Å; I158-D171 PolarHBondContact O-N 2.87Å; I158-R174 HydrophobicContact CG2-CB 4.45Å; I158-T179 HydrophobicContact CD1-CG2 3.96Å
159Y93.1Very high92.7Very high3 Ų333.6 Ų33.61%0.01220%0.203CC..EExtended strand (participates in β ladder)trans-72.9119.8171.1-70.4-61.9000110.9R94 L98 F101 F152 L155 S169 F170R94-Y159 WeakPolarHBondContact CG-O 3.19Å; L98-Y159 HydrophobicContact CB-CD2 4.49Å; L98-Y159 HydrophobicContact CB-CE2 3.9Å; L98-Y159 HydrophobicContact CD1-CE2 4.47Å; F101-Y159 AromaticContact CD2-CE1 3.83Å; F101-Y159 HydrophobicContact CD2-CE1 3.83Å; F101-Y159 HydrophobicContact CE2-CE1 4.09Å; F152-Y159 PolarHBondContact O-OH 3.41Å; F152-Y159 VanDerWaalsContact O-OH 3.14Å; L155-Y159 HydrophobicContact CB-CE2 3.9Å; L155-Y159 VanDerWaalsContact O-CD2 3.29Å; L155-Y159 WeakPolarHBondContact O-CD2 3.27Å; L155-Y159 PolarHBondContact O-N 3.36Å; Y159-S169 WeakPolarHBondContact CA-O 3.08Å; Y159-F170 HydrophobicContact CD1-CB 4.19Å; Y159-F170 HydrophobicContact CE1-CB 4.15Å; Y159-F170 HydrophobicContact CE1-CD1 4.33Å
160I92.3Very high92.4Very high67 Ų6730.7 Ų30.734%0.34419%0.185SC..EExtended strand (participates in β ladder)trans-141.1163.2-177.560.9169.8000110I158 V162 C168 S169 D171I158-I160 PolarHBondContact O-N 3.32Å; I160-V162 HydrophobicContact CG1-CG2 4.47Å; I160-V162 PolarHBondContact O-N 3.04Å; I160-C168 WeakPolarHBondContact O-CA 3.39Å; I160-S169 PolarHBondContact N-O 3.34Å; I160-S169 PolarHBondContact O-N 2.92Å; I160-D171 HydrophobicContact CD1-CB 3.74Å; I160-D171 HydrophobicContact CG1-CB 4.11Å
161L92.8Very high91.9Very high15 Ų1528.9 Ų28.98%0.07917%0.167CC..EExtended strand (participates in β ladder)trans-67125.5166-178.468.9000108.2F9 T80 W86 C93 P163F9-L161 HydrophobicContact CB-CD2 4.41Å; F9-L161 HydrophobicContact CD1-CB 4.34Å; F9-L161 WeakPolarHBondContact O-CD2 3.27Å; T80-L161 HydrophobicContact CG2-CD1 4.26Å; W86-L161 HydrophobicContact CB-CD1 4.15Å; W86-L161 HydrophobicContact CB-CD2 4.05Å; C93-L161 PolarHBondContact SG-N 3.24Å; C93-L161 VanDerWaalsContact SG-N 3.43Å; L161-P163 WeakPolarHBondContact O-CD 3.18Å
162V91.2Very high91Very high11 Ų1129 Ų297%0.06716%0.164CC..EExtended strand (participates in β ladder)trans-98.2104.2174.8-178.60000108.4I160 V164 V165 C166 T167I160-V162 HydrophobicContact CG1-CG2 4.47Å; I160-V162 PolarHBondContact O-N 3.04Å; V162-V164 HydrophobicContact CG1-CB 4.44Å; V162-V164 PolarHBondContact O-N 2.87Å; V162-V164 VanDerWaalsContact O-N 3.16Å; V162-V165 HydrophobicContact CB-CG2 3.81Å; V162-V165 HydrophobicContact CG1-CG2 3.74Å; V162-V165 PolarHBondContact O-N 3.36Å; V162-V165 VanDerWaalsContact O-N 3.16Å; V162-C166 PolarHBondContact O-N 3.38Å; V162-T167 PolarHBondContact N-O 3.34Å
163P89.8Confident90.2Very high53 Ų5335.5 Ų35.534%0.34420%0.197SC..G310 helixtrans-62.4-29.7-170.7-25.736.7000113.7C11 L161 V165 C166C11-P163 HydrophobicContact CB-CB 4.5Å; L161-P163 WeakPolarHBondContact O-CD 3.18Å; P163-V165 PolarHBondContact O-N 2.84Å; P163-C166 PolarHBondContact O-N 2.79Å
164V87.6Confident89.4Confident21 Ų2142.8 Ų42.813%0.12722%0.217CC..G310 helixtrans-62.2-31.6-179.2178.20000112.5V162 V345 R349 H352 M353V162-V164 HydrophobicContact CG1-CB 4.44Å; V162-V164 PolarHBondContact O-N 2.87Å; V162-V164 VanDerWaalsContact O-N 3.16Å; V164-V345 HydrophobicContact CG1-CG1 4.29Å; V164-V345 HydrophobicContact CG2-CG1 4.21Å; V164-R349 HydrophobicContact CG1-CB 4.44Å; V164-R349 HydrophobicContact CG1-CG 4.29Å; V164-H352 HydrophobicContact CG1-CB 3.78Å; V164-M353 WeakPolarHBondContact O-CG 3.37Å
165V89.5Confident88.6Confident5 Ų539.1 Ų39.13%0.0320%0.195CC..G310 helixtrans-117.68.8-179.1-68.20000112.6Y81 V162 P163 T167 H352 A356Y81-V165 PolarHBondContact OH-O 2.89Å; Y81-V165 VanDerWaalsContact OH-O 3.09Å; V162-V165 HydrophobicContact CB-CG2 3.81Å; V162-V165 HydrophobicContact CG1-CG2 3.74Å; V162-V165 PolarHBondContact O-N 3.36Å; V162-V165 VanDerWaalsContact O-N 3.16Å; P163-V165 PolarHBondContact O-N 2.84Å; V165-T167 HydrophobicContact CB-CG2 4.19Å; V165-T167 HydrophobicContact CG2-CG2 3.66Å; V165-T167 PolarHBondContact O-N 2.73Å; V165-H352 HydrophobicContact CG1-CB 3.96Å; V165-A356 HydrophobicContact CB-CB 4.27Å; V165-A356 HydrophobicContact CG1-CB 3.97Å
166C91.9Very high87.9Confident0 Ų041.2 Ų41.20%020%0.202CC..THydrogen-bonded Turntrans42.541.5-179.2-160.40000114.4C11 V16 T80 Y81 V162 P163C11-C166 HydrophobicContact CB-CB 3.63Å; C11-C166 WeakPolarHBondContact CB-SG 3.31Å; C11-C166 WeakPolarHBondContact SG-CB 3.48Å; C11-C166 CovalentContact SG-SG 2.03Å; C11-C166 PolarHBondContact SG-SG 3.31Å; V16-C166 HydrophobicContact CG1-CB 4.26Å; T80-C166 WeakPolarHBondContact CG2-O 3.21Å; T80-C166 PolarHBondContact O-SG 2.91Å; Y81-C166 HydrophobicContact CD1-CB 4.12Å; Y81-C166 HydrophobicContact CD2-CB 4.5Å; Y81-C166 HydrophobicContact CE1-CB 3.88Å; Y81-C166 HydrophobicContact CE2-CB 4.27Å; Y81-C166 HydrophobicContact CG-CB 4.43Å; V162-C166 PolarHBondContact O-N 3.38Å; P163-C166 PolarHBondContact O-N 2.79Å
167T93.3Very high87.5Confident14 Ų1441 Ų419%0.08621%0.213CC..EExtended strand (participates in β ladder)trans-146.6156.1-179.7-168.60000111.3F96 V162 V165F96-T167 WeakPolarHBondContact CE1-OG1 3.28Å; V162-T167 PolarHBondContact N-O 3.34Å; V165-T167 HydrophobicContact CB-CG2 4.19Å; V165-T167 HydrophobicContact CG2-CG2 3.66Å; V165-T167 PolarHBondContact O-N 2.73Å
168C93.8Very high87.3Confident0 Ų041.9 Ų41.90%021%0.205CC..EExtended strand (participates in β ladder)trans-79.4122.2178-730000110.7W86 C93 F96 I160W86-C168 VanDerWaalsContact CD2-SG 3.5Å; W86-C168 HydrophobicContact CH2-CB 4.5Å; C93-C168 WeakPolarHBondContact CA-SG 3.45Å; C93-C168 HydrophobicContact CB-CB 4.07Å; C93-C168 WeakPolarHBondContact CB-SG 3.29Å; C93-C168 VanDerWaalsContact O-CB 3.31Å; C93-C168 WeakPolarHBondContact O-CB 3.32Å; C93-C168 WeakPolarHBondContact SG-CB 3.5Å; C93-C168 CovalentContact SG-SG 2.03Å; C93-C168 PolarHBondContact SG-SG 2.82Å; F96-C168 HydrophobicContact CB-CB 4.36Å; F96-C168 HydrophobicContact CD1-CB 3.63Å; F96-C168 HydrophobicContact CE1-CB 4.35Å; F96-C168 HydrophobicContact CG-CB 4.28Å; I160-C168 WeakPolarHBondContact O-CA 3.39Å
169S92.3Very high87.1Confident11 Ų1140.5 Ų40.58%0.07720%0.198CC..EExtended strand (participates in β ladder)trans-152.7176-175.4-1770000110.1F101 Y159 I160F101-S169 WeakPolarHBondContact CE2-OG 3.38Å; F101-S169 VanDerWaalsContact CZ-OG 3.27Å; F101-S169 WeakPolarHBondContact CZ-OG 3.49Å; Y159-S169 WeakPolarHBondContact CA-O 3.08Å; I160-S169 PolarHBondContact N-O 3.34Å; I160-S169 PolarHBondContact O-N 2.92Å
170F90.2Very high86.8Confident3 Ų341.6 Ų41.61%0.01321%0.206CC..EExtended strand (participates in β ladder)trans-70.8147173.451-103.4000111F101 I158 Y159 R172 T179 M183F101-F170 HydrophobicContact CD1-CE1 4.28Å; F101-F170 AromaticContact CD2-CD1 3.88Å; F101-F170 HydrophobicContact CD2-CD1 3.88Å; F101-F170 AromaticContact CD2-CE1 3.99Å; F101-F170 HydrophobicContact CD2-CE1 3.99Å; F101-F170 AromaticContact CE1-CE1 3.78Å; F101-F170 HydrophobicContact CE1-CE1 3.78Å; F101-F170 AromaticContact CE2-CD1 3.38Å; F101-F170 HydrophobicContact CE2-CD1 3.38Å; F101-F170 AromaticContact CE2-CE1 3.47Å; F101-F170 HydrophobicContact CE2-CE1 3.47Å; F101-F170 VanDerWaalsContact CE2-CE1 3.47Å; F101-F170 HydrophobicContact CE2-CG 4.45Å; F101-F170 HydrophobicContact CG-CE1 4.37Å; F101-F170 AromaticContact CZ-CD1 3.75Å; F101-F170 HydrophobicContact CZ-CD1 3.75Å; F101-F170 AromaticContact CZ-CE1 3.33Å; F101-F170 HydrophobicContact CZ-CE1 3.33Å; F101-F170 HydrophobicContact CZ-CZ 4.13Å; I158-F170 HydrophobicContact CD1-CB 3.9Å; I158-F170 HydrophobicContact CG1-CB 4.15Å; I158-F170 CarbonylContact O-C 3.57Å; I158-F170 WeakPolarHBondContact O-CA 3.33Å; Y159-F170 HydrophobicContact CD1-CB 4.19Å; Y159-F170 HydrophobicContact CE1-CB 4.15Å; Y159-F170 HydrophobicContact CE1-CD1 4.33Å; F170-R172 PolarHBondContact O-N 3.03Å; F170-T179 HydrophobicContact CB-CG2 4.21Å; F170-T179 HydrophobicContact CD1-CG2 4.21Å; F170-T179 HydrophobicContact CD2-CG2 3.71Å; F170-T179 HydrophobicContact CE2-CG2 4.1Å; F170-T179 HydrophobicContact CG-CG2 3.78Å; F170-M183 HydrophobicContact CE1-CE 3.68Å; F170-M183 HydrophobicContact CZ-CE 3.93Å; F170-M183 HydrophobicContact CZ-CG 4.37Å
171D85.9Confident86.7Confident24 Ų2443.2 Ų43.213%0.12821%0.214CC..  trans-57.9123.5173.8-172.9-41.9000110.6I158 I160 I173 R174 G175I158-D171 HydrophobicContact CB-CB 4.39Å; I158-D171 PolarHBondContact O-N 2.87Å; I160-D171 HydrophobicContact CD1-CB 3.74Å; I160-D171 HydrophobicContact CG1-CB 4.11Å; D171-I173 VanDerWaalsContact C-N 3.26Å; D171-I173 PolarHBondContact O-N 3.34Å; D171-I173 PolarHBondContact OD1-N 2.99Å; D171-R174 HydrophobicContact CB-CB 4.13Å; D171-R174 PolarHBondContact OD1-N 3.29Å; D171-R174 WeakPolarHBondContact OD2-CD 3.45Å; D171-R174 WeakPolarHBondContact OD2-CG 3.28Å; D171-R174 IonicContact OD2-NE 3.18Å; D171-G175 PolarHBondContact O-N 3.03Å
172R76.1Confident86.6Confident27 Ų2743.4 Ų43.410%0.10222%0.215CC..THydrogen-bonded Turntrans-70.6-16.7-176.7-69.8-172.1178.8-171.41.6113.7F170 R176 H352F170-R172 PolarHBondContact O-N 3.03Å; R172-R176 WeakPolarHBondContact O-CD 3.09Å; R172-R176 WeakPolarHBondContact O-CG 3.37Å; R172-R176 PolarHBondContact O-NE 3.41Å; R172-H352 PolarHBondContact NH1-ND1 3.38Å
173I76.8Confident86.4Confident142 Ų14243 Ų4373%0.72821%0.212SC*.THydrogen-bonded Turntrans-102.9-51.4-178.6-58.9176.8000109.4D171 G175D171-I173 VanDerWaalsContact C-N 3.26Å; D171-I173 PolarHBondContact O-N 3.34Å; D171-I173 PolarHBondContact OD1-N 2.99Å; I173-G175 VanDerWaalsContact C-N 3.31Å; I173-G175 PolarHBondContact O-N 2.76Å
174R79.1Confident86.3Confident187 Ų18741.5 Ų41.571%0.70621%0.206SC*.THydrogen-bonded Turntrans-69.8-26.8-175.2-63.7-178.6179.4-170.8-0.1113.6I158 D171I158-R174 HydrophobicContact CG2-CB 4.45Å; D171-R174 HydrophobicContact CB-CB 4.13Å; D171-R174 PolarHBondContact OD1-N 3.29Å; D171-R174 WeakPolarHBondContact OD2-CD 3.45Å; D171-R174 WeakPolarHBondContact OD2-CG 3.28Å; D171-R174 IonicContact OD2-NE 3.18Å
175G75.9Confident86.5Confident6 Ų645.2 Ų45.26%0.06222%0.224CC..THydrogen-bonded Turntrans-91.3-8.8-177.600000115.7D171 I173 Y178 T179D171-G175 PolarHBondContact O-N 3.03Å; I173-G175 VanDerWaalsContact C-N 3.31Å; I173-G175 PolarHBondContact O-N 2.76Å; G175-Y178 PolarHBondContact O-N 3Å; G175-T179 PolarHBondContact O-N 2.85Å; G175-T179 PolarHBondContact O-OG1 3.35Å
176R79Confident86.5Confident55 Ų5545.6 Ų45.621%0.20823%0.225CC..THydrogen-bonded Turntrans-88.6114.8-178.9-71-171-173-164.58.8108.8R172 N339R172-R176 WeakPolarHBondContact O-CD 3.09Å; R172-R176 WeakPolarHBondContact O-CG 3.37Å; R172-R176 PolarHBondContact O-NE 3.41Å; R176-N339 PolarHBondContact NH1-O 2.78Å; R176-N339 PolarHBondContact NH2-O 3.29Å; R176-N339 PolarHBondContact NH2-OD1 3.08Å
177P84.3Confident86.2Confident95 Ų9547 Ų4762%0.61723%0.231SC*.THydrogen-bonded Turncis-106.3-16.739.735.2-35.7000116T179 T180 I181P177-T179 PolarHBondContact O-N 3.49Å; P177-T180 PolarHBondContact O-N 2.87Å; P177-I181 HydrophobicContact CB-CD1 4.09Å; P177-I181 WeakPolarHBondContact O-CG1 3.38Å; P177-I181 PolarHBondContact O-N 2.67Å
178Y86.6Confident85.9Confident110 Ų11050.1 Ų50.143%0.43125%0.251SS..Hα-helixtrans-56.1-48.5-169.9178.9-92.5000113.2S151 L155 G175 T180 I181 L182S151-Y178 PolarHBondContact O-OH 2.92Å; L155-Y178 HydrophobicContact CD1-CD1 4.46Å; L155-Y178 HydrophobicContact CD1-CE1 4.19Å; L155-Y178 HydrophobicContact CD2-CD1 3.44Å; L155-Y178 VanDerWaalsContact CD2-CD1 3.44Å; L155-Y178 HydrophobicContact CD2-CE1 3.53Å; L155-Y178 HydrophobicContact CG-CD1 4.36Å; L155-Y178 HydrophobicContact CG-CE1 4.04Å; G175-Y178 PolarHBondContact O-N 3Å; Y178-T180 VanDerWaalsContact C-N 3.33Å; Y178-T180 PolarHBondContact O-N 3.32Å; Y178-I181 PolarHBondContact O-N 2.86Å; Y178-L182 HydrophobicContact CE1-CD2 3.93Å; Y178-L182 WeakPolarHBondContact O-CB 3.37Å; Y178-L182 PolarHBondContact O-N 3.43Å
179T87.7Confident85.6Confident1 Ų153.8 Ų53.81%0.00627%0.27CS..Hα-helixtrans-65.4-36.9-177.257.50000112.4L155 I158 F170 G175 P177 M183L155-T179 HydrophobicContact CD1-CG2 3.85Å; L155-T179 HydrophobicContact CD2-CG2 3.97Å; I158-T179 HydrophobicContact CD1-CG2 3.96Å; F170-T179 HydrophobicContact CB-CG2 4.21Å; F170-T179 HydrophobicContact CD1-CG2 4.21Å; F170-T179 HydrophobicContact CD2-CG2 3.71Å; F170-T179 HydrophobicContact CE2-CG2 4.1Å; F170-T179 HydrophobicContact CG-CG2 3.78Å; G175-T179 PolarHBondContact O-N 2.85Å; G175-T179 PolarHBondContact O-OG1 3.35Å; P177-T179 PolarHBondContact O-N 3.49Å; T179-M183 VanDerWaalsContact O-CB 3.32Å; T179-M183 WeakPolarHBondContact O-CB 3.34Å; T179-M183 WeakPolarHBondContact O-CG 3.49Å; T179-M183 PolarHBondContact O-N 3.46Å
180T86.3Confident85.2Confident27 Ų2753.5 Ų53.517%0.16627%0.268CS..Hα-helixtrans-69.2-43.4176.8-59.20000111.6P177 Y178 M183 G184 I340P177-T180 PolarHBondContact O-N 2.87Å; Y178-T180 VanDerWaalsContact C-N 3.33Å; Y178-T180 PolarHBondContact O-N 3.32Å; T180-M183 PolarHBondContact O-N 3.02Å; T180-G184 PolarHBondContact O-N 3.41Å; T180-I340 HydrophobicContact CG2-CG1 3.74Å
181I89.8Confident84.8Confident101 Ų10156.2 Ų56.252%0.51828%0.282SS..Hα-helixtrans-62.2-48.1176.3-67.7168.6000110P177 Y178 M183 G184 I185P177-I181 HydrophobicContact CB-CD1 4.09Å; P177-I181 WeakPolarHBondContact O-CG1 3.38Å; P177-I181 PolarHBondContact O-N 2.67Å; Y178-I181 PolarHBondContact O-N 2.86Å; I181-M183 VanDerWaalsContact C-N 3.35Å; I181-M183 PolarHBondContact O-N 2.89Å; I181-G184 WeakPolarHBondContact O-CA 3.39Å; I181-G184 PolarHBondContact O-N 3.23Å; I181-G184 VanDerWaalsContact O-N 3.14Å; I181-I185 HydrophobicContact CG2-CD1 3.85Å; I181-I185 HydrophobicContact CG2-CG1 4.4Å; I181-I185 WeakPolarHBondContact O-CG1 3.33Å; I181-I185 PolarHBondContact O-N 3.34Å
182L90.9Very high84.6Confident18 Ų1857.7 Ų57.79%0.09430%0.295CS..Hα-helixtrans-59.2-46.3179.8-174.463.5000111.6S151 F152 Y178 G184 I185 Y186S151-L182 VanDerWaalsContact O-CD2 3.29Å; S151-L182 WeakPolarHBondContact O-CD2 3.48Å; F152-L182 HydrophobicContact CD1-CD2 3.91Å; F152-L182 HydrophobicContact CE1-CD2 3.59Å; F152-L182 HydrophobicContact CE1-CG 4.24Å; F152-L182 HydrophobicContact CZ-CD2 3.94Å; F152-L182 HydrophobicContact CZ-CG 4.22Å; Y178-L182 HydrophobicContact CE1-CD2 3.93Å; Y178-L182 WeakPolarHBondContact O-CB 3.37Å; Y178-L182 PolarHBondContact O-N 3.43Å; L182-G184 VanDerWaalsContact C-N 3.34Å; L182-G184 PolarHBondContact O-N 2.74Å; L182-I185 PolarHBondContact O-N 3.49Å; L182-Y186 HydrophobicContact CD1-CD2 4.11Å; L182-Y186 HydrophobicContact CD1-CE2 3.8Å; L182-Y186 HydrophobicContact CG-CD2 4.19Å; L182-Y186 HydrophobicContact CG-CE2 4.16Å; L182-Y186 WeakPolarHBondContact O-CD2 3.18Å; L182-Y186 PolarHBondContact O-N 3.31Å
183M88.2Confident84.7Confident3 Ų357 Ų572%0.01530%0.295CS..Hα-helixtrans-61.2-42174.5-76.9-65.8-165.300112.8F101 F152 F170 T179 T180 I181 Y186 F187 Y332 L336F101-M183 HydrophobicContact CD1-CE 3.09Å; F101-M183 HydrophobicContact CE1-CE 3.06Å; F101-M183 HydrophobicContact CG-CE 4.07Å; F101-M183 HydrophobicContact CZ-CE 4.02Å; F152-M183 HydrophobicContact CE1-CE 4.37Å; F170-M183 HydrophobicContact CE1-CE 3.68Å; F170-M183 HydrophobicContact CZ-CE 3.93Å; F170-M183 HydrophobicContact CZ-CG 4.37Å; T179-M183 VanDerWaalsContact O-CB 3.32Å; T179-M183 WeakPolarHBondContact O-CB 3.34Å; T179-M183 WeakPolarHBondContact O-CG 3.49Å; T179-M183 PolarHBondContact O-N 3.46Å; T180-M183 PolarHBondContact O-N 3.02Å; I181-M183 VanDerWaalsContact C-N 3.35Å; I181-M183 PolarHBondContact O-N 2.89Å; M183-Y186 PolarHBondContact O-N 2.99Å; M183-F187 VanDerWaalsContact O-CB 3.25Å; M183-F187 WeakPolarHBondContact O-CB 3.25Å; M183-F187 PolarHBondContact O-N 3.33Å; M183-Y332 HydrophobicContact SD-CE1 4.32Å; M183-L336 HydrophobicContact CB-CD1 3.95Å
184G88.3Confident84.4Confident21 Ų2151 Ų5122%0.21626%0.264CS..Hα-helixtrans-59.7-44.1174.300000112.2T180 I181 L182 F187 V188T180-G184 PolarHBondContact O-N 3.41Å; I181-G184 WeakPolarHBondContact O-CA 3.39Å; I181-G184 PolarHBondContact O-N 3.23Å; I181-G184 VanDerWaalsContact O-N 3.14Å; L182-G184 VanDerWaalsContact C-N 3.34Å; L182-G184 PolarHBondContact O-N 2.74Å; G184-F187 PolarHBondContact O-N 3.41Å; G184-V188 WeakPolarHBondContact O-CB 3.2Å; G184-V188 VanDerWaalsContact O-CG2 3.29Å; G184-V188 WeakPolarHBondContact O-CG2 3.43Å; G184-V188 PolarHBondContact O-N 3.41Å
185I90.8Very high84.1Confident99 Ų9943.7 Ų43.751%0.50825%0.247SC..Hα-helixtrans-61.1-50.2177.5-70.3167.1000110.8I181 L182 F187 V188 L189I181-I185 HydrophobicContact CG2-CD1 3.85Å; I181-I185 HydrophobicContact CG2-CG1 4.4Å; I181-I185 WeakPolarHBondContact O-CG1 3.33Å; I181-I185 PolarHBondContact O-N 3.34Å; L182-I185 PolarHBondContact O-N 3.49Å; I185-F187 VanDerWaalsContact C-N 3.29Å; I185-F187 PolarHBondContact O-N 3.28Å; I185-V188 PolarHBondContact O-N 3.05Å; I185-L189 WeakPolarHBondContact O-CB 3.5Å; I185-L189 PolarHBondContact O-N 3.3Å
186Y89.8Confident84.4Confident13 Ų1348 Ų485%0.05127%0.268CS..Hα-helixtrans-63.2-37.7178.8-87.2-76000112.5I108 L109 S151 F152 L182 M183 G190I108-Y186 HydrophobicContact CD1-CD1 4.4Å; L109-Y186 HydrophobicContact CD1-CE1 4.19Å; L109-Y186 HydrophobicContact CD2-CE1 4.3Å; L109-Y186 HydrophobicContact CG-CE1 4.14Å; S151-Y186 WeakPolarHBondContact CB-OH 3.32Å; S151-Y186 PolarHBondContact OG-OH 2.84Å; F152-Y186 HydrophobicContact CE2-CD2 4.2Å; F152-Y186 AromaticContact CE2-CE2 3.74Å; F152-Y186 HydrophobicContact CE2-CE2 3.74Å; F152-Y186 HydrophobicContact CZ-CD2 4.05Å; F152-Y186 AromaticContact CZ-CE2 3.99Å; F152-Y186 HydrophobicContact CZ-CE2 3.99Å; L182-Y186 HydrophobicContact CD1-CD2 4.11Å; L182-Y186 HydrophobicContact CD1-CE2 3.8Å; L182-Y186 HydrophobicContact CG-CD2 4.19Å; L182-Y186 HydrophobicContact CG-CE2 4.16Å; L182-Y186 WeakPolarHBondContact O-CD2 3.18Å; L182-Y186 PolarHBondContact O-N 3.31Å; M183-Y186 PolarHBondContact O-N 2.99Å; Y186-G190 PolarHBondContact O-N 3.19Å
187F85.3Confident84.2Confident29 Ų2947.1 Ų47.113%0.12727%0.266CS..Hα-helixtrans-65.9-49.4176.5-179.2-105.9000111.9M183 G184 I185 L189 G190 L191 Y332 V333 L336M183-F187 VanDerWaalsContact O-CB 3.25Å; M183-F187 WeakPolarHBondContact O-CB 3.25Å; M183-F187 PolarHBondContact O-N 3.33Å; G184-F187 PolarHBondContact O-N 3.41Å; I185-F187 VanDerWaalsContact C-N 3.29Å; I185-F187 PolarHBondContact O-N 3.28Å; F187-L189 VanDerWaalsContact C-N 3.34Å; F187-L189 PolarHBondContact O-N 3.48Å; F187-G190 PolarHBondContact O-N 3.36Å; F187-L191 HydrophobicContact CD1-CD1 3.95Å; F187-L191 HydrophobicContact CD1-CG 4.25Å; F187-L191 HydrophobicContact CD2-CG 4.48Å; F187-L191 HydrophobicContact CE1-CD1 3.22Å; F187-L191 HydrophobicContact CE1-CD2 4.49Å; F187-L191 HydrophobicContact CE1-CG 3.83Å; F187-L191 HydrophobicContact CE2-CD1 4.22Å; F187-L191 HydrophobicContact CE2-CD2 4.05Å; F187-L191 HydrophobicContact CE2-CG 4.05Å; F187-L191 HydrophobicContact CZ-CD1 3.36Å; F187-L191 HydrophobicContact CZ-CD2 3.87Å; F187-L191 HydrophobicContact CZ-CG 3.7Å; F187-L191 WeakPolarHBondContact O-CG 3.43Å; F187-L191 PolarHBondContact O-N 2.95Å; F187-Y332 HydrophobicContact CD2-CD1 4.41Å; F187-V333 HydrophobicContact CE2-CG2 3.68Å; F187-V333 HydrophobicContact CZ-CG2 3.38Å; F187-L336 HydrophobicContact CB-CD2 3.76Å; F187-L336 HydrophobicContact CD1-CD2 3.41Å; F187-L336 VanDerWaalsContact CD1-CD2 3.41Å; F187-L336 HydrophobicContact CD2-CD2 4.01Å; F187-L336 HydrophobicContact CE1-CD2 3.95Å; F187-L336 HydrophobicContact CE2-CD2 4.5Å; F187-L336 HydrophobicContact CG-CD2 3.44Å; F187-L336 VanDerWaalsContact CG-CD2 3.44Å; F187-L336 HydrophobicContact CZ-CD2 4.47Å
188V87.5Confident83.8Confident81 Ų8146.7 Ų46.749%0.49125%0.252SS..Hα-helixtrans-62.2-42.9176.4171.40000110.6G184 I185 G190 L191 S192G184-V188 WeakPolarHBondContact O-CB 3.2Å; G184-V188 VanDerWaalsContact O-CG2 3.29Å; G184-V188 WeakPolarHBondContact O-CG2 3.43Å; G184-V188 PolarHBondContact O-N 3.41Å; I185-V188 PolarHBondContact O-N 3.05Å; V188-G190 VanDerWaalsContact C-N 3.33Å; V188-G190 PolarHBondContact O-N 3.21Å; V188-L191 PolarHBondContact O-N 3.19Å; V188-S192 VanDerWaalsContact O-CB 3.23Å; V188-S192 WeakPolarHBondContact O-CB 3.43Å; V188-S192 PolarHBondContact O-N 3.36Å; V188-S192 PolarHBondContact O-OG 3.46Å; V188-S192 VanDerWaalsContact O-OG 3.05Å
189L87.9Confident83.4Confident77 Ų7744.9 Ų44.940%0.40326%0.255SS..Hα-helixtrans-58.1-46.6175.2179.564.9000111.4L109 I185 F187 S193L109-L189 HydrophobicContact CD2-CD2 3.7Å; I185-L189 WeakPolarHBondContact O-CB 3.5Å; I185-L189 PolarHBondContact O-N 3.3Å; F187-L189 VanDerWaalsContact C-N 3.34Å; F187-L189 PolarHBondContact O-N 3.48Å; L189-S193 WeakPolarHBondContact O-CB 3.29Å; L189-S193 PolarHBondContact O-N 2.91Å; L189-S193 PolarHBondContact O-OG 3.41Å
190G82.9Confident83.1Confident4 Ų447.4 Ų47.44%0.04127%0.268CS..Hα-helixtrans-58.7-49.9173.700000111.7Y186 F187 V188 S193 V194 F325Y186-G190 PolarHBondContact O-N 3.19Å; F187-G190 PolarHBondContact O-N 3.36Å; V188-G190 VanDerWaalsContact C-N 3.33Å; V188-G190 PolarHBondContact O-N 3.21Å; G190-S193 PolarHBondContact O-OG 3Å; G190-V194 PolarHBondContact O-N 3.38Å; G190-F325 WeakPolarHBondContact O-CE2 3.36Å
191L80.9Confident82.6Confident60 Ų6046.7 Ų46.731%0.31426%0.263SS..Hα-helixtrans-65.8-51.5-177.6-69.4-170.2000113.6F187 V188 V194 G195 F325 A329F187-L191 HydrophobicContact CD1-CD1 3.95Å; F187-L191 HydrophobicContact CD1-CG 4.25Å; F187-L191 HydrophobicContact CD2-CG 4.48Å; F187-L191 HydrophobicContact CE1-CD1 3.22Å; F187-L191 HydrophobicContact CE1-CD2 4.49Å; F187-L191 HydrophobicContact CE1-CG 3.83Å; F187-L191 HydrophobicContact CE2-CD1 4.22Å; F187-L191 HydrophobicContact CE2-CD2 4.05Å; F187-L191 HydrophobicContact CE2-CG 4.05Å; F187-L191 HydrophobicContact CZ-CD1 3.36Å; F187-L191 HydrophobicContact CZ-CD2 3.87Å; F187-L191 HydrophobicContact CZ-CG 3.7Å; F187-L191 WeakPolarHBondContact O-CG 3.43Å; F187-L191 PolarHBondContact O-N 2.95Å; V188-L191 PolarHBondContact O-N 3.19Å; L191-V194 PolarHBondContact O-N 2.98Å; L191-G195 PolarHBondContact O-N 3.43Å; L191-F325 HydrophobicContact CB-CZ 4.25Å; L191-F325 HydrophobicContact CD2-CE1 4.31Å; L191-F325 HydrophobicContact CD2-CE2 3.84Å; L191-F325 HydrophobicContact CD2-CZ 3.32Å; L191-F325 HydrophobicContact CG-CZ 4.31Å; L191-A329 HydrophobicContact CD2-CB 3.93Å
192S82.1Confident82Confident55 Ų5546.9 Ų46.939%0.38526%0.262SS..Hα-helixtrans-65.7-43.1-176.3-61.90000111.2V188 V194 G195 I196V188-S192 VanDerWaalsContact O-CB 3.23Å; V188-S192 WeakPolarHBondContact O-CB 3.43Å; V188-S192 PolarHBondContact O-N 3.36Å; V188-S192 PolarHBondContact O-OG 3.46Å; V188-S192 VanDerWaalsContact O-OG 3.05Å; S192-V194 PolarHBondContact O-N 3.33Å; S192-G195 PolarHBondContact O-N 2.93Å; S192-I196 WeakPolarHBondContact O-CB 3.27Å; S192-I196 WeakPolarHBondContact O-CD1 3.35Å; S192-I196 WeakPolarHBondContact O-CG1 3.15Å; S192-I196 PolarHBondContact O-N 3.42Å
193S78Confident81.5Confident14 Ų1453.7 Ų53.710%0.09829%0.286CS..Hα-helixtrans-58.2-48.3178.763.60000111.1C112 L189 G190 F197C112-S193 PolarHBondContact SG-OG 3.24Å; L189-S193 WeakPolarHBondContact O-CB 3.29Å; L189-S193 PolarHBondContact O-N 2.91Å; L189-S193 PolarHBondContact O-OG 3.41Å; G190-S193 PolarHBondContact O-OG 3Å; S193-F197 WeakPolarHBondContact O-CB 3.31Å; S193-F197 WeakPolarHBondContact O-CD2 3.4Å; S193-F197 WeakPolarHBondContact O-CG 3.42Å; S193-F197 PolarHBondContact O-N 3.27Å
194V70.3Confident81.1Confident14 Ų1456.3 Ų56.39%0.08530%0.298CS..Hα-helixtrans-72.4-42.3-177.7-179.90000112.1G190 L191 S192 I196 F197 Y198 F325G190-V194 PolarHBondContact O-N 3.38Å; L191-V194 PolarHBondContact O-N 2.98Å; S192-V194 PolarHBondContact O-N 3.33Å; V194-I196 VanDerWaalsContact C-N 3.34Å; V194-I196 PolarHBondContact O-N 3.3Å; V194-F197 PolarHBondContact O-N 3.26Å; V194-Y198 WeakPolarHBondContact O-CB 3.43Å; V194-Y198 PolarHBondContact O-N 3.33Å; V194-F325 HydrophobicContact CB-CB 4.25Å; V194-F325 HydrophobicContact CB-CD1 3.84Å; V194-F325 HydrophobicContact CB-CD2 3.61Å; V194-F325 HydrophobicContact CB-CE1 4.02Å; V194-F325 HydrophobicContact CB-CE2 3.8Å; V194-F325 HydrophobicContact CB-CG 3.6Å; V194-F325 HydrophobicContact CB-CZ 3.98Å; V194-F325 HydrophobicContact CG1-CB 3.73Å; V194-F325 HydrophobicContact CG1-CD1 3.44Å; V194-F325 VanDerWaalsContact CG1-CD1 3.44Å; V194-F325 HydrophobicContact CG1-CD2 4Å; V194-F325 HydrophobicContact CG1-CE1 3.99Å; V194-F325 HydrophobicContact CG1-CE2 4.48Å; V194-F325 HydrophobicContact CG1-CG 3.42Å; V194-F325 VanDerWaalsContact CG1-CG 3.42Å; V194-F325 HydrophobicContact CG1-CZ 4.45Å; V194-F325 HydrophobicContact CG2-CB 4.02Å; V194-F325 HydrophobicContact CG2-CD1 4.4Å; V194-F325 HydrophobicContact CG2-CD2 3.36Å; V194-F325 HydrophobicContact CG2-CE2 3.87Å; V194-F325 HydrophobicContact CG2-CG 3.65Å
195G74.5Confident80.6Confident35 Ų3558.5 Ų58.536%0.36131%0.307SS..Hα-helixtrans-58.9-45.7176.100000112.1L191 S192 C199L191-G195 PolarHBondContact O-N 3.43Å; S192-G195 PolarHBondContact O-N 2.93Å; G195-C199 VanDerWaalsContact O-CB 3.31Å; G195-C199 WeakPolarHBondContact O-CB 3.48Å; G195-C199 PolarHBondContact O-N 3.05Å; G195-C199 PolarHBondContact O-SG 3.24Å
196I81Confident80.2Confident97 Ų9759.6 Ų59.650%0.49731%0.308SS..Hα-helixtrans-66-53.1178.3-67.1166.7000110.1S192 V194 Y198 C199 L200S192-I196 WeakPolarHBondContact O-CB 3.27Å; S192-I196 WeakPolarHBondContact O-CD1 3.35Å; S192-I196 WeakPolarHBondContact O-CG1 3.15Å; S192-I196 PolarHBondContact O-N 3.42Å; V194-I196 VanDerWaalsContact C-N 3.34Å; V194-I196 PolarHBondContact O-N 3.3Å; I196-Y198 VanDerWaalsContact C-N 3.33Å; I196-Y198 PolarHBondContact O-N 2.96Å; I196-C199 PolarHBondContact O-N 3.38Å; I196-L200 HydrophobicContact CG2-CD1 3.63Å; I196-L200 HydrophobicContact CG2-CG 4.1Å; I196-L200 WeakPolarHBondContact O-CB 3.47Å; I196-L200 WeakPolarHBondContact O-CG 3.48Å; I196-L200 PolarHBondContact O-N 2.88Å
197F75.2Confident80Confident35 Ų3566.5 Ų66.515%0.15433%0.334CS..Hα-helixtrans-65.3-35.5-177.4-68.8-53.4000112.6A115 L116 Y119 S193 V194 L200 I201A115-F197 HydrophobicContact CB-CB 4.01Å; A115-F197 HydrophobicContact CB-CD2 3.58Å; A115-F197 HydrophobicContact CB-CE2 4.44Å; A115-F197 HydrophobicContact CB-CG 4.07Å; L116-F197 HydrophobicContact CB-CE1 4.31Å; L116-F197 HydrophobicContact CB-CE2 3.99Å; L116-F197 HydrophobicContact CB-CZ 3.78Å; L116-F197 HydrophobicContact CD1-CE1 3.74Å; L116-F197 HydrophobicContact CD1-CZ 3.67Å; L116-F197 HydrophobicContact CG-CZ 4.28Å; Y119-F197 HydrophobicContact CD1-CD1 4.11Å; Y119-F197 HydrophobicContact CD1-CE1 4.06Å; Y119-F197 AromaticContact CG-CD1 3.94Å; Y119-F197 HydrophobicContact CG-CD1 3.94Å; Y119-F197 HydrophobicContact CG-CE1 4.35Å; S193-F197 WeakPolarHBondContact O-CB 3.31Å; S193-F197 WeakPolarHBondContact O-CD2 3.4Å; S193-F197 WeakPolarHBondContact O-CG 3.42Å; S193-F197 PolarHBondContact O-N 3.27Å; V194-F197 PolarHBondContact O-N 3.26Å; F197-L200 HydrophobicContact CD1-CD1 4.28Å; F197-L200 PolarHBondContact O-N 2.93Å; F197-I201 VanDerWaalsContact O-CB 3.32Å; F197-I201 WeakPolarHBondContact O-CB 3.27Å; F197-I201 WeakPolarHBondContact O-CD1 3.13Å; F197-I201 WeakPolarHBondContact O-CG1 3.25Å; F197-I201 PolarHBondContact O-N 2.99Å
198Y75.1Confident79.8Confident87 Ų8767.8 Ų67.834%0.34135%0.351SS..Hα-helixtrans-62.2-50.5172.7177.8-98.3000111.3V194 I196 L200 I201 H202 T318 F322V194-Y198 WeakPolarHBondContact O-CB 3.43Å; V194-Y198 PolarHBondContact O-N 3.33Å; I196-Y198 VanDerWaalsContact C-N 3.33Å; I196-Y198 PolarHBondContact O-N 2.96Å; Y198-L200 VanDerWaalsContact C-N 3.29Å; Y198-L200 PolarHBondContact O-N 3.47Å; Y198-I201 PolarHBondContact O-N 3.06Å; Y198-H202 VanDerWaalsContact O-CB 3.3Å; Y198-H202 WeakPolarHBondContact O-CB 3.48Å; Y198-H202 PolarHBondContact O-N 3.4Å; Y198-T318 HydrophobicContact CD2-CG2 4.08Å; Y198-T318 HydrophobicContact CE2-CG2 4.27Å; Y198-F322 HydrophobicContact CD2-CB 4.17Å; Y198-F322 AromaticContact CD2-CD2 4Å; Y198-F322 HydrophobicContact CD2-CD2 4Å; Y198-F322 HydrophobicContact CD2-CG 4.35Å; Y198-F322 HydrophobicContact CE2-CB 4.28Å; Y198-F322 HydrophobicContact CE2-CD2 4.21Å; Y198-F322 HydrophobicContact CE2-CG 4.31Å; Y198-F322 HydrophobicContact CG-CD2 4.2Å
199C79.4Confident79.6Confident72 Ų7266.8 Ų66.849%0.48635%0.351SS..Hα-helixtrans-58.9-41.9176.9-75.90000111.8G195 I196 R203G195-C199 VanDerWaalsContact O-CB 3.31Å; G195-C199 WeakPolarHBondContact O-CB 3.48Å; G195-C199 PolarHBondContact O-N 3.05Å; G195-C199 PolarHBondContact O-SG 3.24Å; I196-C199 PolarHBondContact O-N 3.38Å; C199-R203 VanDerWaalsContact O-CB 3.24Å; C199-R203 WeakPolarHBondContact O-CB 3.24Å; C199-R203 VanDerWaalsContact O-CG 3.23Å; C199-R203 WeakPolarHBondContact O-CG 3.48Å; C199-R203 PolarHBondContact O-N 3.42Å
200L80.3Confident79.5Confident54 Ų5468 Ų6828%0.28335%0.354SS..Hα-helixtrans-67-45178.1-70.4177.2000112.1Y119 I196 F197 Y198 R203 Q204Y119-L200 HydrophobicContact CD2-CB 3.84Å; Y119-L200 HydrophobicContact CD2-CD1 4.42Å; Y119-L200 HydrophobicContact CE1-CD1 4.36Å; Y119-L200 HydrophobicContact CE2-CB 3.63Å; Y119-L200 HydrophobicContact CE2-CD1 4.06Å; Y119-L200 HydrophobicContact CE2-CG 4.36Å; I196-L200 HydrophobicContact CG2-CD1 3.63Å; I196-L200 HydrophobicContact CG2-CG 4.1Å; I196-L200 WeakPolarHBondContact O-CB 3.47Å; I196-L200 WeakPolarHBondContact O-CG 3.48Å; I196-L200 PolarHBondContact O-N 2.88Å; F197-L200 HydrophobicContact CD1-CD1 4.28Å; F197-L200 PolarHBondContact O-N 2.93Å; Y198-L200 VanDerWaalsContact C-N 3.29Å; Y198-L200 PolarHBondContact O-N 3.47Å; L200-R203 PolarHBondContact O-N 3.26Å; L200-Q204 VanDerWaalsContact O-CB 3.31Å; L200-Q204 WeakPolarHBondContact O-CB 3.41Å; L200-Q204 PolarHBondContact O-N 3.48Å
201I75.8Confident79.7Confident11 Ų1170.4 Ų70.46%0.05637%0.374CS..Hα-helixtrans-63.2-48176.8-69.5164.1000109.8R118 Y119 I122 F197 Y198 R203 Q204 V205 T318R118-I201 HydrophobicContact CB-CD1 4.33Å; Y119-I201 HydrophobicContact CD2-CG1 4.32Å; I122-I201 HydrophobicContact CD1-CG2 4.14Å; F197-I201 VanDerWaalsContact O-CB 3.32Å; F197-I201 WeakPolarHBondContact O-CB 3.27Å; F197-I201 WeakPolarHBondContact O-CD1 3.13Å; F197-I201 WeakPolarHBondContact O-CG1 3.25Å; F197-I201 PolarHBondContact O-N 2.99Å; Y198-I201 PolarHBondContact O-N 3.06Å; I201-R203 VanDerWaalsContact C-N 3.35Å; I201-R203 PolarHBondContact O-N 2.93Å; I201-Q204 PolarHBondContact O-N 3.34Å; I201-Q204 VanDerWaalsContact O-N 3.16Å; I201-V205 HydrophobicContact CG2-CG2 4.21Å; I201-V205 WeakPolarHBondContact O-CB 3.04Å; I201-V205 VanDerWaalsContact O-CG2 3.3Å; I201-V205 WeakPolarHBondContact O-CG2 3.43Å; I201-V205 PolarHBondContact O-N 3.01Å; I201-T318 HydrophobicContact CB-CG2 4.31Å; I201-T318 HydrophobicContact CD1-CG2 4.49Å; I201-T318 HydrophobicContact CG2-CG2 3.65Å
202H77.2Confident80Confident105 Ų10572.1 Ų72.149%0.48638%0.383SS..Hα-helixtrans-60.9-44.2178.8-177.4-93.8000111.6Y198 Q204 V205 K206Y198-H202 VanDerWaalsContact O-CB 3.3Å; Y198-H202 WeakPolarHBondContact O-CB 3.48Å; Y198-H202 PolarHBondContact O-N 3.4Å; H202-Q204 VanDerWaalsContact C-N 3.35Å; H202-Q204 PolarHBondContact O-N 3.48Å; H202-V205 PolarHBondContact O-N 3.4Å; H202-K206 WeakPolarHBondContact O-CB 3.32Å; H202-K206 PolarHBondContact O-N 3.44Å
203R81.1Confident80.2Confident161 Ų16174 Ų7461%0.60839%0.389SS*.Hα-helixtrans-59.5-44.4173.6-81.7177.4145-177-5.3111.9C199 L200 I201 K206 R207C199-R203 VanDerWaalsContact O-CB 3.24Å; C199-R203 WeakPolarHBondContact O-CB 3.24Å; C199-R203 VanDerWaalsContact O-CG 3.23Å; C199-R203 WeakPolarHBondContact O-CG 3.48Å; C199-R203 PolarHBondContact O-N 3.42Å; L200-R203 PolarHBondContact O-N 3.26Å; I201-R203 VanDerWaalsContact C-N 3.35Å; I201-R203 PolarHBondContact O-N 2.93Å; R203-K206 PolarHBondContact O-N 2.82Å; R203-R207 WeakPolarHBondContact O-CB 3.44Å; R203-R207 VanDerWaalsContact O-CG 3.31Å; R203-R207 WeakPolarHBondContact O-CG 3.37Å; R203-R207 PolarHBondContact O-N 3.21Å
204Q79.8Confident80.7Confident58 Ų5880 Ų8027%0.27142%0.415SS..Hα-helixtrans-66.1-43.9-179.9-174.562.713.600111.8I122 A123 L200 I201 H202 R207 A208I122-Q204 HydrophobicContact CG2-CG 4.14Å; A123-Q204 HydrophobicContact CB-CG 4.06Å; L200-Q204 VanDerWaalsContact O-CB 3.31Å; L200-Q204 WeakPolarHBondContact O-CB 3.41Å; L200-Q204 PolarHBondContact O-N 3.48Å; I201-Q204 PolarHBondContact O-N 3.34Å; I201-Q204 VanDerWaalsContact O-N 3.16Å; H202-Q204 VanDerWaalsContact C-N 3.35Å; H202-Q204 PolarHBondContact O-N 3.48Å; Q204-R207 PolarHBondContact O-N 3.04Å; Q204-A208 WeakPolarHBondContact O-CB 3.31Å; Q204-A208 PolarHBondContact O-N 3.33Å
205V78.9Confident81.6Confident67 Ų6786.1 Ų86.141%0.40644%0.438SS..Hα-helixtrans-62.5-43.8176.3171.90000110.5I201 H202 R207 A208 A209I201-V205 HydrophobicContact CG2-CG2 4.21Å; I201-V205 WeakPolarHBondContact O-CB 3.04Å; I201-V205 VanDerWaalsContact O-CG2 3.3Å; I201-V205 WeakPolarHBondContact O-CG2 3.43Å; I201-V205 PolarHBondContact O-N 3.01Å; H202-V205 PolarHBondContact O-N 3.4Å; V205-R207 PolarHBondContact O-N 2.91Å; V205-A208 PolarHBondContact O-N 3.22Å; V205-A209 WeakPolarHBondContact O-CB 3.38Å; V205-A209 PolarHBondContact O-N 2.85Å
206K82Confident82.3Confident122 Ų12290.2 Ų90.253%0.5345%0.446SS..Hα-helixtrans-61.1-45176.3-172.4173.5-178.7177.10111.7H202 R203 A209 Q210H202-K206 WeakPolarHBondContact O-CB 3.32Å; H202-K206 PolarHBondContact O-N 3.44Å; R203-K206 PolarHBondContact O-N 2.82Å; K206-A209 PolarHBondContact O-N 2.95Å; K206-Q210 VanDerWaalsContact O-CG 3.29Å; K206-Q210 WeakPolarHBondContact O-CG 3.02Å; K206-Q210 PolarHBondContact O-N 3.41Å
207R84Confident82.7Confident158 Ų15890.9 Ų90.960%0.59645%0.45SS*.Hα-helixtrans-61.5-44.7175.9-75175.5-179.8179.7-2112.2R203 Q204 V205 A209 Q210 A211R203-R207 WeakPolarHBondContact O-CB 3.44Å; R203-R207 VanDerWaalsContact O-CG 3.31Å; R203-R207 WeakPolarHBondContact O-CG 3.37Å; R203-R207 PolarHBondContact O-N 3.21Å; Q204-R207 PolarHBondContact O-N 3.04Å; V205-R207 PolarHBondContact O-N 2.91Å; R207-A209 PolarHBondContact O-N 2.69Å; R207-Q210 PolarHBondContact O-N 3.14Å; R207-A211 PolarHBondContact O-N 2.88Å
208A82.2Confident83.3Confident57 Ų5798.1 Ų98.147%0.47148%0.476SS..Hα-helixtrans-64.1-40178.400000112.2Q204 V205 A211 L212Q204-A208 WeakPolarHBondContact O-CB 3.31Å; Q204-A208 PolarHBondContact O-N 3.33Å; V205-A208 PolarHBondContact O-N 3.22Å; A208-A211 PolarHBondContact O-N 2.84Å; A208-L212 PolarHBondContact O-N 2.76Å; A208-L212 VanDerWaalsContact O-N 3.08Å
209A83.4Confident83.9Confident59 Ų5999 Ų9949%0.48848%0.483SS..Hα-helixtrans-64-44.3175.400000111.9V205 K206 R207 L212 D213V205-A209 WeakPolarHBondContact O-CB 3.38Å; V205-A209 PolarHBondContact O-N 2.85Å; K206-A209 PolarHBondContact O-N 2.95Å; R207-A209 PolarHBondContact O-N 2.69Å; A209-L212 PolarHBondContact O-N 2.94Å; A209-D213 PolarHBondContact O-N 2.92Å
210Q86.5Confident84.2Confident103 Ų10398.4 Ų98.448%0.48148%0.484SS..Hα-helixtrans-62-42.3176.5-73173.9-37.900112.3K206 R207 L212 D213 Q214K206-Q210 VanDerWaalsContact O-CG 3.29Å; K206-Q210 WeakPolarHBondContact O-CG 3.02Å; K206-Q210 PolarHBondContact O-N 3.41Å; R207-Q210 PolarHBondContact O-N 3.14Å; Q210-L212 VanDerWaalsContact C-N 3.35Å; Q210-L212 PolarHBondContact O-N 3.02Å; Q210-D213 PolarHBondContact O-N 3.46Å; Q210-Q214 WeakPolarHBondContact O-CG 3.4Å; Q210-Q214 PolarHBondContact O-N 2.89Å
211A85.8Confident84.2Confident55 Ų5598.5 Ų98.546%0.45549%0.488SS..Hα-helixtrans-64.4-38.4177.200000112.5R207 A208 Y215R207-A211 PolarHBondContact O-N 2.88Å; A208-A211 PolarHBondContact O-N 2.84Å; A211-Y215 WeakPolarHBondContact O-CB 3.42Å; A211-Y215 PolarHBondContact O-N 3.11Å
212L87.8Confident84.3Confident96 Ų96103.1 Ų103.150%0.50351%0.512SS..Hα-helixtrans-66.8-38.7176-175.765.9000111.9A208 A209 Q210 Y215 K216A208-L212 PolarHBondContact O-N 2.76Å; A208-L212 VanDerWaalsContact O-N 3.08Å; A209-L212 PolarHBondContact O-N 2.94Å; Q210-L212 VanDerWaalsContact C-N 3.35Å; Q210-L212 PolarHBondContact O-N 3.02Å; L212-Y215 PolarHBondContact O-N 3.06Å; L212-K216 WeakPolarHBondContact O-CG 3.5Å; L212-K216 PolarHBondContact O-N 3.48Å
213D87.1Confident84.1Confident95 Ų95104.6 Ų104.651%0.50852%0.519SS..Hα-helixtrans-65.8-44.8177.7-158.753.3000111.3A209 Q210 Y215 K216 L217A209-D213 PolarHBondContact O-N 2.92Å; Q210-D213 PolarHBondContact O-N 3.46Å; D213-Y215 VanDerWaalsContact C-N 3.33Å; D213-Y215 PolarHBondContact O-N 3.09Å; D213-K216 PolarHBondContact O-N 3.44Å; D213-L217 WeakPolarHBondContact O-CG 3.47Å; D213-L217 PolarHBondContact O-N 2.82Å
214Q88.2Confident83.6Confident140 Ų140100.3 Ų100.365%0.65451%0.514SS*.Hα-helixtrans-59.3-41.2172.7-73.5-179.5-13.600112.7Q210 L217 R218Q210-Q214 WeakPolarHBondContact O-CG 3.4Å; Q210-Q214 PolarHBondContact O-N 2.89Å; Q214-L217 PolarHBondContact O-N 3.27Å; Q214-R218 WeakPolarHBondContact O-CB 3.37Å; Q214-R218 PolarHBondContact O-N 3.36Å
215Y88.5Confident82.6Confident141 Ų141103.1 Ų103.155%0.55353%0.531SS*.Hα-helixtrans-61.9-44.3175.7176.2-98.4000111.9A211 L212 D213 R218 Q219A211-Y215 WeakPolarHBondContact O-CB 3.42Å; A211-Y215 PolarHBondContact O-N 3.11Å; L212-Y215 PolarHBondContact O-N 3.06Å; D213-Y215 VanDerWaalsContact C-N 3.33Å; D213-Y215 PolarHBondContact O-N 3.09Å; Y215-R218 PolarHBondContact O-N 2.92Å; Y215-Q219 VanDerWaalsContact CE1-OE1 3.29Å; Y215-Q219 WeakPolarHBondContact O-CB 3.38Å; Y215-Q219 PolarHBondContact O-N 2.92Å
216K89.9Confident81.6Confident122 Ų122107.6 Ų107.653%0.5355%0.547SS..Hα-helixtrans-63.5-43176.9-73.6176.6179.9179.10112.3L212 D213 R218 Q219 A220L212-K216 WeakPolarHBondContact O-CG 3.5Å; L212-K216 PolarHBondContact O-N 3.48Å; D213-K216 PolarHBondContact O-N 3.44Å; K216-R218 VanDerWaalsContact C-N 3.35Å; K216-Q219 PolarHBondContact O-N 3.31Å; K216-A220 WeakPolarHBondContact O-CB 3.36Å; K216-A220 PolarHBondContact O-N 2.03Å
217L89.6Confident80.4Confident111 Ų111106.6 Ų106.658%0.58155%0.551SS**Hα-helixtrans-61.5-43.6176.2-71170.4000111.2D213 Q214 Q219 A220 S221D213-L217 WeakPolarHBondContact O-CG 3.47Å; D213-L217 PolarHBondContact O-N 2.82Å; Q214-L217 PolarHBondContact O-N 3.27Å; L217-Q219 VanDerWaalsContact C-N 3.33Å; L217-Q219 PolarHBondContact O-N 3.22Å; L217-A220 PolarHBondContact O-N 3.43Å; L217-S221 PolarHBondContact O-N 3.06Å
218R87.8Confident78.9Confident186 Ų186102.9 Ų102.970%0.70255%0.554SS**Hα-helixtrans-66.1-34176.5-164.2174.4-171.5-179.12.3112.7Q214 Y215 K216 S221 I222Q214-R218 WeakPolarHBondContact O-CB 3.37Å; Q214-R218 PolarHBondContact O-N 3.36Å; Y215-R218 PolarHBondContact O-N 2.92Å; K216-R218 VanDerWaalsContact C-N 3.35Å; R218-S221 PolarHBondContact O-OG 2.85Å; R218-I222 WeakPolarHBondContact O-CD1 3.36Å; R218-I222 VanDerWaalsContact O-CG1 3.28Å; R218-I222 WeakPolarHBondContact O-CG1 3.44Å; R218-I222 PolarHBondContact O-N 3.5Å
219Q87.5Confident77.2Confident106 Ų106103.1 Ų103.150%0.49556%0.561SS.*Hα-helixtrans-74.1-38.1176.3-168.2166.219.500112Y215 K216 L217 I222 H223Y215-Q219 VanDerWaalsContact CE1-OE1 3.29Å; Y215-Q219 WeakPolarHBondContact O-CB 3.38Å; Y215-Q219 PolarHBondContact O-N 2.92Å; K216-Q219 PolarHBondContact O-N 3.31Å; L217-Q219 VanDerWaalsContact C-N 3.33Å; L217-Q219 PolarHBondContact O-N 3.22Å; Q219-I222 PolarHBondContact O-N 3.47Å; Q219-H223 PolarHBondContact O-N 3.03Å
220A84.4Confident75.5Confident60 Ų60105.4 Ų105.450%0.49657%0.57SS.*Hα-helixtrans-64-39174.400000111.9K216 L217 H223 S224K216-A220 WeakPolarHBondContact O-CB 3.36Å; K216-A220 PolarHBondContact O-N 2.03Å; L217-A220 PolarHBondContact O-N 3.43Å; A220-H223 PolarHBondContact O-N 3.27Å; A220-S224 WeakPolarHBondContact O-CB 3.41Å; A220-S224 PolarHBondContact O-N 3.34Å
221S81.8Confident73.4Confident55 Ų55108.1 Ų108.139%0.38559%0.587SS.*Hα-helixtrans-67.4-4017667.30000112.8L217 R218 H223 S224 N225L217-S221 PolarHBondContact O-N 3.06Å; R218-S221 PolarHBondContact O-OG 2.85Å; S221-H223 PolarHBondContact O-N 2.93Å; S221-S224 PolarHBondContact O-N 3.18Å; S221-N225 VanDerWaalsContact O-CG 3.3Å; S221-N225 PolarHBondContact O-N 3.22Å
222I77.4Confident71.1Confident109 Ų109115 Ų11556%0.55961%0.61SS**Hα-helixtrans-62.5-43174.5-68167000110.9R218 Q219 N225 H226R218-I222 WeakPolarHBondContact O-CD1 3.36Å; R218-I222 VanDerWaalsContact O-CG1 3.28Å; R218-I222 WeakPolarHBondContact O-CG1 3.44Å; R218-I222 PolarHBondContact O-N 3.5Å; Q219-I222 PolarHBondContact O-N 3.47Å; I222-N225 PolarHBondContact O-N 2.96Å; I222-H226 PolarHBondContact O-N 3.37Å; I222-H226 VanDerWaalsContact O-N 3.16Å
223H73.2Confident68.7Low135 Ų135115.1 Ų115.163%0.62563%0.625SS**Hα-helixtrans-66.7-39.7177.5-166.462.5000112.1Q219 A220 S221 N225 H226 V227Q219-H223 PolarHBondContact O-N 3.03Å; A220-H223 PolarHBondContact O-N 3.27Å; S221-H223 PolarHBondContact O-N 2.93Å; H223-N225 PolarHBondContact O-N 2.85Å; H223-H226 PolarHBondContact O-N 3.23Å; H223-V227 WeakPolarHBondContact O-CG2 3.42Å; H223-V227 PolarHBondContact O-N 2.93Å; H223-V227 VanDerWaalsContact O-N 3.16Å
224S70Confident66.3Low72 Ų72119.2 Ų119.250%0.50364%0.643SS.*Hα-helixtrans-62.3-40174.4-168.70000112.4A220 S221 H226 V227 A228A220-S224 WeakPolarHBondContact O-CB 3.41Å; A220-S224 PolarHBondContact O-N 3.34Å; S221-S224 PolarHBondContact O-N 3.18Å; S224-H226 VanDerWaalsContact C-N 3.3Å; S224-H226 PolarHBondContact O-N 3.5Å; S224-V227 PolarHBondContact O-N 3.37Å; S224-A228 WeakPolarHBondContact O-CB 3.42Å; S224-A228 PolarHBondContact O-N 3.5Å
225N58.8Low64.2Low117 Ų117117.9 Ų117.963%0.62665%0.647SS**Hα-helixtrans-69.4-27177.6-72.7-7.6000112.9S221 I222 H223 G229S221-N225 VanDerWaalsContact O-CG 3.3Å; S221-N225 PolarHBondContact O-N 3.22Å; I222-N225 PolarHBondContact O-N 2.96Å; H223-N225 PolarHBondContact O-N 2.85Å; N225-G229 PolarHBondContact O-N 2.91Å
226H57.8Low61.4Low161 Ų161114.7 Ų114.775%0.74566%0.657SS**Hα-helixtrans-77.4-29.6174.9-144.566.3000112.3I222 H223 S224I222-H226 PolarHBondContact O-N 3.37Å; I222-H226 VanDerWaalsContact O-N 3.16Å; H223-H226 PolarHBondContact O-N 3.23Å; S224-H226 VanDerWaalsContact C-N 3.3Å; S224-H226 PolarHBondContact O-N 3.5Å
227V56.3Low58.4Low101 Ų101120.4 Ų120.461%0.61268%0.675SS**Hα-helixtrans-82.6-29.2175.6177.10000112H223 S224 G229H223-V227 WeakPolarHBondContact O-CG2 3.42Å; H223-V227 PolarHBondContact O-N 2.93Å; H223-V227 VanDerWaalsContact O-N 3.16Å; S224-V227 PolarHBondContact O-N 3.37Å; V227-G229 VanDerWaalsContact C-N 3.28Å
228A52.5Low55.6Low80 Ų80124.6 Ų124.666%0.66169%0.689SS**THydrogen-bonded Turntrans-81.5-3.2174.100000113.8S224S224-A228 WeakPolarHBondContact O-CB 3.42Å; S224-A228 PolarHBondContact O-N 3.5Å
229G47.8Very low52.8Low61 Ų61124.3 Ų124.363%0.62970%0.696SS**THydrogen-bonded Turntrans-94.517.1-177.200000115.5N225 V227N225-G229 PolarHBondContact O-N 2.91Å; V227-G229 VanDerWaalsContact C-N 3.28Å
230T47.7Very low50.2Low108 Ų108126 Ų12666%0.66370%0.703SS**SBendtrans-124.281.6169.852.30000108.9
231D42.8Very low47.5Very low159 Ų159131.9 Ų131.985%0.8573%0.726SS**SBendtrans169.880.3147.1-85.2-21.1000106.9
232E35.9Very low45.1Very low201 Ų201135.2 Ų135.294%0.93974%0.739SS**  trans-164.5100.4140.2-82.3-132.914500107.6
233A38.9Very low42.9Very low98 Ų98134 Ų13481%0.8174%0.74SS**  trans-78.3130.4162.700000108.7
234M36.2Very low40.7Very low180 Ų180138.6 Ų138.689%0.88775%0.752SS**  trans-154.3147.7137.6-97.5-56.9-85.700110
235P44Very low38.8Very low113 Ų113143 Ų14373%0.73477%0.769SS**  trans-92.2150.3-153.337.1-35.7000112.6
236G29.8Very low37.4Very low74 Ų74141.8 Ų141.876%0.76378%0.776SS**  trans174.395.8169.100000114.4
237R27.2Very low36Very low242 Ų242140.1 Ų140.191%0.91378%0.782SS**  trans75.992.3155.3-119170-177166.5-0.3117.6Q239R237-Q239 PolarHBondContact O-N 3.17Å
238F30Very low34.6Very low199 Ų199138.9 Ų138.987%0.87379%0.79SS**  trans-61.3121.5151.8-131.3-103.9000108.6
239Q28.8Very low33.2Very low180 Ų180138.8 Ų138.884%0.84180%0.797SS**  trans-125.495.7150.7-162.1136.814.600108R237R237-Q239 PolarHBondContact O-N 3.17Å
240E33Very low32.8Very low141 Ų141141.6 Ų141.666%0.65980%0.804SS**  trans-30.7133.3161.3-156.9171.2-167.600113
241L28.2Very low31.7Very low184 Ų184141.4 Ų141.496%0.96381%0.807SS**  trans-147.4100.4141.4-131.892.9000108.6
242D30.9Very low30.9Very low125 Ų125142.8 Ų142.867%0.66881%0.808SS**  trans-86.5143.6179.9-144.5-5.3000110.4
243S31.9Very low30.3Very low83 Ų83136.3 Ų136.358%0.5880%0.796SS**  trans34.1132.5134.4-62.30000122.5
244R26.1Very low29.6Very low232 Ų232139.2 Ų139.288%0.87580%0.796SS**  97.5127.3129.7-77.9168.5-172.3-158.23.2121.7
245L29.8Very low29Very low163 Ų163135.6 Ų135.685%0.85379%0.789SS**  58.2114.5125.2-126.977.4000120.6
246A30.5Very low28.3Very low93 Ų93136 Ų13677%0.76979%0.794SS**  trans25.4137.5135.100000122.4
247S28.1Very low28.1Very low125 Ų125141.3 Ų141.387%0.87480%0.799SS**  trans108.5126137.51190000118
248G26.4Very low28Very low76 Ų76134.7 Ų134.778%0.78479%0.789SS**  trans103.2107.2146.500000116.1
249G23.2Very low27.9Very low78 Ų78130.9 Ų130.980%0.80478%0.782SS**  trans-73-152.9168.200000113.2
250P39.3Very low27.9Very low120 Ų120129.3 Ų129.378%0.77978%0.78SS**  cis-135.4-173.44.240.7-21.7000115.1
251S25.5Very low27.7Very low104 Ų104127 Ų12773%0.72779%0.785SS**  trans75.3140.3162.5-65.30000116.5
252E24.7Very low27.6Very low187 Ų187122.3 Ų122.387%0.87477%0.772SS**  cis-166.9154.714-122.7171.3-177.500107
253G23.9Very low27.3Very low66 Ų66123.3 Ų123.368%0.6878%0.783SS**  trans117.888.3149.100000119.8
254I24.7Very low26.9Very low158 Ų158124 Ų12481%0.8178%0.784SS**  84.3107.3128.7-61.1162.2000120.3
255S23.5Very low26.9Very low105 Ų105122.4 Ų122.473%0.73479%0.787SS**  trans60.1126.1142.472.80000119.5
256S29Very low26.6Very low120 Ų120120 Ų12084%0.83978%0.778SS**  -164.314758.630.20000112.7
257E25.4Very low26.3Very low186 Ų186122.6 Ų122.687%0.86978%0.779SS**  trans-62.6159.8-179.3-66.8168.7130.800113.6
258S25.8Very low26.1Very low103 Ų103125.7 Ų125.772%0.7278%0.779SS**  -176.8132.666.146.60000111.7
259V27.2Very low26Very low119 Ų119125.4 Ų125.472%0.72178%0.776SS**  82.8130.6104.8170.70000112.1
260N29.5Very low26Very low148 Ų148129.5 Ų129.579%0.79178%0.78SS**  cis-171.4173.514.4-101.7-4.3000105.7
261A28Very low25.3Very low92 Ų92128.1 Ų128.176%0.7677%0.773SS**  cis-167.4157.1-700000107.1
262A26.8Very low25.1Very low85 Ų85128.5 Ų128.570%0.70278%0.776SS**  trans-77.9165.417600000113.5
263T24.6Very low25.1Very low147 Ų147128.6 Ų128.690%0.90278%0.776SS**  trans-145.2120.1138.7-60.30000109.3
264T24.1Very low25.2Very low97 Ų97132 Ų13260%0.59578%0.783SS**  trans-85.6152.1174.4-48.70000109.8T266T264-T266 HydrophobicContact CG2-CG2 4.22Å
265Q24.7Very low25.1Very low199 Ų199127.8 Ų127.893%0.9378%0.779SS**  trans-156.3131.7131.9-108.9171.628.800111.4
266T23Very low25.2Very low111 Ų111129.1 Ų129.168%0.68178%0.778SS**  trans-97.9171.6-176.237.60000111.8T264T264-T266 HydrophobicContact CG2-CG2 4.22Å
267L24.6Very low25Very low148 Ų148130.6 Ų130.678%0.77577%0.772SS**  trans164.7106132.6-83.4162.7000107.9
268E25.3Very low25.1Very low190 Ų190127.9 Ų127.989%0.88876%0.762SS**  69.4138.289-71.9-172.5157.200113.9
269G24.2Very low25.1Very low70 Ų70130.5 Ų130.572%0.72277%0.768SS**  cis-162.7158.57.800000110.1
270D22.1Very low25Very low164 Ų164129.1 Ų129.188%0.87776%0.763SS**  56.5135.4107.6-127.317.9000115.5
271S24Very low24.9Very low91 Ų91131.6 Ų131.664%0.63677%0.767SS**  cis-173.3152.824.839.20000111.1
272S22.6Very low24.7Very low113 Ų113136.3 Ų136.379%0.7977%0.765SS**  trans49.9151138-53.70000127.8
273E24.8Very low24.6Very low188 Ų188136.4 Ų136.488%0.87977%0.766SS**  trans96.1142.1159.3-62.7-165.9160.100119.8
274V24.7Very low24.6Very low137 Ų137135.9 Ų135.983%0.8375%0.753SS**  cis-175.1148.6-26.8137.60000106.5
275G23.8Very low24.6Very low70 Ų70139.8 Ų139.872%0.72277%0.765SS**  trans86.9139.1160.400000116.8
276D24.2Very low24.6Very low133 Ų133139 Ų13971%0.71176%0.763SS**  cis-167144.110.8-134.5-12.9000108.9
277Q25.6Very low24.7Very low152 Ų152138.2 Ų138.271%0.7177%0.769SS**  trans47.6139.4138-75.5176.95100121
278I27.2Very low24.6Very low128 Ų128139.6 Ų139.666%0.65677%0.771SS**  cis-175.1137.424.7-97.8157.3000102.9
279N26.6Very low24.6Very low159 Ų159140.2 Ų140.285%0.8577%0.771SS**  -171.5146.476.8-141-12.1000112.7
280S24.4Very low24.5Very low89 Ų89141.9 Ų141.962%0.62277%0.772SS**  trans-93.4153.5-170.7171.80000113.1
281K27.7Very low25.2Very low200 Ų200139.6 Ų139.687%0.8777%0.765SS**  trans170.687.7136.2-90.8168.9-172.4-170.70107.7
282R24.5Very low25.5Very low191 Ų191141.2 Ų141.272%0.72177%0.774SS**  48.4101.485.9-162.9164.9-174.8166.62.2111.4E284R282-E284 IonicContact CZ-OE1 3.56Å; R282-E284 IonicContact NE-OE1 3.37Å; R282-E284 PolarHBondContact NE-OE1 2.98Å; R282-E284 IonicContact NH2-OE1 2.85Å; R282-E284 PolarHBondContact NH2-OE1 2.85Å; R282-E284 IonicContact NH2-OE2 3.79Å
283A24.3Very low25.6Very low87 Ų87145 Ų14572%0.71978%0.779SS**  65.9142.461.100000114.4
284E24.7Very low25.8Very low136 Ų136140.7 Ų140.764%0.63678%0.775SS**  trans99129.7-179.3-60.8162.5-164.100113.4R282R282-E284 IonicContact CZ-OE1 3.56Å; R282-E284 IonicContact NE-OE1 3.37Å; R282-E284 PolarHBondContact NE-OE1 2.98Å; R282-E284 IonicContact NH2-OE1 2.85Å; R282-E284 PolarHBondContact NH2-OE1 2.85Å; R282-E284 IonicContact NH2-OE2 3.79Å
285Q24.4Very low26.1Very low179 Ų179140 Ų14084%0.83678%0.777SS**  cis-165.5160.313.6-126.1166.34.400111.7
286M23.7Very low26.4Very low182 Ų182141.3 Ų141.390%0.89778%0.781SS**  trans-69.6172.5174.9-75.9161.358.100115
287A24.8Very low26.6Very low96 Ų96144.1 Ų144.179%0.79379%0.787SS**  trans104.6135162.100000113.5
288E23.7Very low26.7Very low177 Ų177141.9 Ų141.983%0.82779%0.794SS**  cis177.4138.65.4169.4-178.5176.400106
289K25.1Very low26.8Very low202 Ų202144 Ų14488%0.87880%0.801SS**  trans153117.4144.8-96.5176.9168.1171.30114.7
290S21.5Very low26.9Very low106 Ų106141.4 Ų141.474%0.74179%0.793SS**  trans-91.5177.9145.929.60000109.5
291P37Very low27.2Very low115 Ų115145.3 Ų145.375%0.74781%0.805SS**  cis-125.7-162.5-3136.3-15.3000110.4
292P30.2Very low27.4Very low125 Ų125145.1 Ų145.181%0.81281%0.805SS**  -141.5160.677.632.9-12.8000115.8
293E25.7Very low27.7Very low193 Ų193138.9 Ų138.990%0.90280%0.799SS**  trans-56.9135.9171.3-68165.2125.200113
294A28.2Very low28.1Very low97 Ų97139.4 Ų139.480%0.80280%0.804SS**  trans-144.2116.7154.500000109.8A296A294-A296 PolarHBondContact O-N 3.3Å
295S30.3Very low28.5Very low124 Ų124144.4 Ų144.487%0.86782%0.817SS**  trans-43.3118.6171.61800000112.9
296A29.8Very low29Very low97 Ų97147.3 Ų147.380%0.80282%0.82SS**  trans-133.999166.900000109.9A294A294-A296 PolarHBondContact O-N 3.3Å
297K28.5Very low29.4Very low191 Ų191142.7 Ų142.783%0.8381%0.811SS**  trans-25.1127.6170.5-68.5168.5176.6175.30114.3Q299K297-Q299 PolarHBondContact O-N 3.37Å
298A29.1Very low29.9Very low105 Ų105143.4 Ų143.487%0.86881%0.807SS**  trans-54.8108.5164.100000110
299Q27.8Very low30.7Very low173 Ų173138.2 Ų138.281%0.80879%0.785SS**  trans-77.3135.1167.9-76.6-174.1-14.500109.1K297 I301K297-Q299 PolarHBondContact O-N 3.37Å; Q299-I301 PolarHBondContact O-N 2.8Å
300P28.8Very low31.5Very low105 Ų105131.5 Ų131.568%0.68276%0.764SS**  trans-65.8130.8175.926.9-31.4000109K302P300-K302 PolarHBondContact O-N 3.04Å
301I31.7Very low32.5Very low171 Ų171131.5 Ų131.588%0.87776%0.764SS**  trans-60.987.6173.6-61.4173.9000108.2Q299 G303Q299-I301 PolarHBondContact O-N 2.8Å; I301-G303 PolarHBondContact O-N 2.92Å
302K32.4Very low32.9Very low196 Ų196128.2 Ų128.285%0.85274%0.743SS**  trans-78.4115.1167.7-82.1-176.7177.6177.50107.9P300P300-K302 PolarHBondContact O-N 3.04Å
303G30.2Very low34Very low59 Ų59125 Ų12561%0.60872%0.718SS**  trans112.277.6167.600000112.3I301 R305I301-G303 PolarHBondContact O-N 2.92Å; G303-R305 VanDerWaalsContact C-N 3.28Å; G303-R305 PolarHBondContact O-N 3.41Å
304A32.9Very low35.3Very low99 Ų99120.9 Ų120.982%0.81870%0.697SS**  trans-48.7107.3140.900000106.4R306A304-R306 PolarHBondContact O-N 3.49Å
305R31.8Very low36.7Very low240 Ų240118.1 Ų118.191%0.90668%0.678SS**  trans-48.3109.8165.6-97.6176171.9172.2-1.5105.4G303 A307G303-R305 VanDerWaalsContact C-N 3.28Å; G303-R305 PolarHBondContact O-N 3.41Å; R305-A307 PolarHBondContact O-N 3.13Å
306R35.6Very low38.3Very low241 Ų241119 Ų11991%0.90966%0.662SS**  trans-47.5113.9162.8-95176.9171165.1-2.6105.3A304 P308A304-R306 PolarHBondContact O-N 3.49Å; R306-P308 VanDerWaalsContact O-N 3.13Å
307A32.5Very low39.7Very low85 Ų85115.9 Ų115.970%0.70263%0.633SS**  trans-50.3124.316800000106.4R305 D309R305-A307 PolarHBondContact O-N 3.13Å; A307-D309 PolarHBondContact O-N 3.04Å
308P34.5Very low41.4Very low110 Ų110107.8 Ų107.871%0.71460%0.6SS**  trans-66.4124.2-171.125.4-31.4000109.1R306 S310R306-P308 VanDerWaalsContact O-N 3.13Å; P308-S310 PolarHBondContact O-N 3.42Å
309D41.8Very low43.2Very low69 Ų69108.3 Ų108.337%0.36958%0.584SS.*SBendtrans46.213.4136.1-156.728.5000119.2A307 S312 E313 R375A307-D309 PolarHBondContact O-N 3.04Å; D309-S312 PolarHBondContact O-OG 3.28Å; D309-S312 PolarHBondContact OD1-OG 2.84Å; D309-E313 WeakPolarHBondContact O-CB 3.47Å; D309-E313 WeakPolarHBondContact O-CG 3.43Å; D309-E313 PolarHBondContact O-N 3.05Å; D309-R375 IonicContact OD2-CZ 3.62Å; D309-R375 IonicContact OD2-NH1 2.8Å; D309-R375 PolarHBondContact OD2-NH1 3.28Å; D309-R375 IonicContact OD2-NH2 3.73Å
310S41.1Very low45.2Very low61 Ų61100.4 Ų100.443%0.42755%0.548SS..Hα-helixtrans-80.1-39.3-173.361.40000112.1P308 S312 E313 F314P308-S310 PolarHBondContact O-N 3.42Å; S310-S312 PolarHBondContact O-N 3.03Å; S310-E313 PolarHBondContact O-N 3.25Å; S310-F314 WeakPolarHBondContact O-CD2 3.25Å; S310-F314 PolarHBondContact O-N 2.96Å
311S41.8Very low47Very low105 Ų10596.9 Ų96.973%0.73453%0.525SS*.Hα-helixtrans-65.7-35.8178.959.20000112.8G315S311-G315 PolarHBondContact O-N 3.01Å
312S46.4Very low48.9Very low46 Ų4692.4 Ų92.432%0.32250%0.499SS..Hα-helixtrans-71.5-36.3172.235.80000112.6D309 S310 R316D309-S312 PolarHBondContact O-OG 3.28Å; D309-S312 PolarHBondContact OD1-OG 2.84Å; S310-S312 PolarHBondContact O-N 3.03Å; S312-R316 WeakPolarHBondContact O-CG 3.27Å; S312-R316 PolarHBondContact O-N 2.9Å
313E53.1Low50.8Low58 Ų5884.1 Ų84.127%0.27147%0.467SS..Hα-helixtrans-67.3-41174.7-84.3-166.7130.600112.8D309 S310 G315 R316 V317 R375D309-E313 WeakPolarHBondContact O-CB 3.47Å; D309-E313 WeakPolarHBondContact O-CG 3.43Å; D309-E313 PolarHBondContact O-N 3.05Å; S310-E313 PolarHBondContact O-N 3.25Å; E313-G315 PolarHBondContact O-N 3.36Å; E313-R316 PolarHBondContact O-N 3.34Å; E313-V317 WeakPolarHBondContact O-CG2 3.44Å; E313-V317 PolarHBondContact O-N 3.17Å; E313-V317 VanDerWaalsContact O-N 3.13Å; E313-R375 IonicContact OE1-CZ 2.99Å; E313-R375 IonicContact OE1-NE 2.86Å; E313-R375 PolarHBondContact OE1-NE 2.77Å; E313-R375 IonicContact OE1-NH2 2.66Å; E313-R375 PolarHBondContact OE1-NH2 2.81Å; E313-R375 IonicContact OE2-NH2 3.32Å; E313-R375 PolarHBondContact OE2-NH2 3.18Å
314F52.8Low52.8Low106 Ų10681.6 Ų81.647%0.46544%0.44SS..Hα-helixtrans-65-38.6177.7-79.5-69.6000112.9I122 S310 T318I122-F314 HydrophobicContact CD1-CD1 4.38Å; I122-F314 HydrophobicContact CG1-CD1 4.48Å; I122-F314 HydrophobicContact CG1-CE1 4.48Å; S310-F314 WeakPolarHBondContact O-CD2 3.25Å; S310-F314 PolarHBondContact O-N 2.96Å; F314-T318 PolarHBondContact O-N 3.33Å; F314-T318 PolarHBondContact O-OG1 3.39Å
315G57.3Low54.6Low39 Ų3978.1 Ų78.140%0.40241%0.406SS..Hα-helixtrans-62.2-45.917500000112.3S311 E313 V317 T318 Q319S311-G315 PolarHBondContact O-N 3.01Å; E313-G315 PolarHBondContact O-N 3.36Å; G315-V317 PolarHBondContact O-N 3.21Å; G315-T318 PolarHBondContact O-N 3.01Å; G315-Q319 WeakPolarHBondContact O-CB 3.33Å; G315-Q319 PolarHBondContact O-N 2.87Å
316R63.5Low56.7Low143 Ų14370.3 Ų70.354%0.5438%0.382SS..Hα-helixtrans-63.8-39.3179.7-74.9175169.4178-2.4113.3S312 E313 Q319 M320S312-R316 WeakPolarHBondContact O-CG 3.27Å; S312-R316 PolarHBondContact O-N 2.9Å; E313-R316 PolarHBondContact O-N 3.34Å; R316-Q319 PolarHBondContact O-N 2.91Å; R316-M320 PolarHBondContact O-N 2.7Å
317V59.3Low58.8Low31 Ų3161 Ų6119%0.18835%0.353CS..Hα-helixtrans-69.4-36.5177.9174.50000111.7E313 G315 M320 C321E313-V317 WeakPolarHBondContact O-CG2 3.44Å; E313-V317 PolarHBondContact O-N 3.17Å; E313-V317 VanDerWaalsContact O-N 3.13Å; G315-V317 PolarHBondContact O-N 3.21Å; V317-M320 WeakPolarHBondContact O-CB 3.33Å; V317-M320 PolarHBondContact O-N 2.99Å; V317-C321 PolarHBondContact O-N 3.38Å; V317-C321 PolarHBondContact O-SG 2.66Å
318T64.2Low61Low22 Ų2257.6 Ų57.614%0.13532%0.323CS..Hα-helixtrans-68-41.8174.5-52.90000110.9Y198 I201 F314 G315 M320 C321 F322Y198-T318 HydrophobicContact CD2-CG2 4.08Å; Y198-T318 HydrophobicContact CE2-CG2 4.27Å; I201-T318 HydrophobicContact CB-CG2 4.31Å; I201-T318 HydrophobicContact CD1-CG2 4.49Å; I201-T318 HydrophobicContact CG2-CG2 3.65Å; F314-T318 PolarHBondContact O-N 3.33Å; F314-T318 PolarHBondContact O-OG1 3.39Å; G315-T318 PolarHBondContact O-N 3.01Å; T318-M320 VanDerWaalsContact C-N 3.27Å; T318-M320 PolarHBondContact O-N 2.89Å; T318-C321 PolarHBondContact O-N 3.39Å; T318-F322 PolarHBondContact O-N 2.92Å
319Q67.8Low63Low116 Ų11652.9 Ų52.954%0.54229%0.293SS..Hα-helixtrans-61.6-35.5174.4-163.4-179.8-10.100111.8G315 R316 F322 A323 M373G315-Q319 WeakPolarHBondContact O-CB 3.33Å; G315-Q319 PolarHBondContact O-N 2.87Å; R316-Q319 PolarHBondContact O-N 2.91Å; Q319-F322 PolarHBondContact O-N 2.95Å; Q319-A323 WeakPolarHBondContact O-CB 3.41Å; Q319-A323 PolarHBondContact O-N 3.25Å; Q319-M373 VanDerWaalsContact C-CE 3.42Å; Q319-M373 HydrophobicContact CB-CE 3.95Å; Q319-M373 HydrophobicContact CG-CE 3.77Å; Q319-M373 WeakPolarHBondContact O-CE 3.5Å
320M69.3Low65Low7 Ų754.8 Ų54.83%0.03430%0.303CS..Hα-helixtrans-63.8-47.5173.8-176.3-174.177.400112.2R316 V317 T318 F322 A323 V324 Y370 M373 N374R316-M320 PolarHBondContact O-N 2.7Å; V317-M320 WeakPolarHBondContact O-CB 3.33Å; V317-M320 PolarHBondContact O-N 2.99Å; T318-M320 VanDerWaalsContact C-N 3.27Å; T318-M320 PolarHBondContact O-N 2.89Å; M320-F322 PolarHBondContact O-N 3.43Å; M320-A323 PolarHBondContact O-N 3.33Å; M320-V324 HydrophobicContact CG-CG2 4.45Å; M320-V324 VanDerWaalsContact O-CG2 3.28Å; M320-V324 WeakPolarHBondContact O-CG2 3.2Å; M320-V324 PolarHBondContact O-N 3.45Å; M320-Y370 HydrophobicContact CE-CD1 4.01Å; M320-Y370 HydrophobicContact CE-CE1 4.11Å; M320-Y370 HydrophobicContact SD-CD1 3.78Å; M320-Y370 HydrophobicContact SD-CE1 4.39Å; M320-M373 VanDerWaalsContact CA-CE 3.48Å; M320-M373 HydrophobicContact CB-CB 3.65Å; M320-M373 HydrophobicContact CB-CE 4.13Å; M320-M373 HydrophobicContact CB-CG 4.45Å; M320-M373 HydrophobicContact CB-SD 4.05Å; M320-M373 HydrophobicContact CG-CB 3.69Å; M320-M373 HydrophobicContact CG-CG 4.44Å; M320-M373 HydrophobicContact CG-SD 4.18Å; M320-M373 HydrophobicContact SD-CB 4.13Å; M320-N374 HydrophobicContact CE-CB 4.47Å; M320-N374 HydrophobicContact SD-CB 3.66Å
321C67.2Low67.1Low30 Ų3052 Ų5220%0.20328%0.283CS..Hα-helixtrans-61.6-38.1178.6-60.10000111.1V317 T318 F325V317-C321 PolarHBondContact O-N 3.38Å; V317-C321 PolarHBondContact O-SG 2.66Å; T318-C321 PolarHBondContact O-N 3.39Å; C321-F325 WeakPolarHBondContact O-CB 3.47Å; C321-F325 PolarHBondContact O-N 2.82Å
322F71.3Confident69.2Low78 Ų7847.4 Ų47.434%0.34225%0.25SC..Hα-helixtrans-65.4-44173.9-178.3-98.8000112.5Y198 T318 Q319 M320 F325 L326Y198-F322 HydrophobicContact CD2-CB 4.17Å; Y198-F322 AromaticContact CD2-CD2 4Å; Y198-F322 HydrophobicContact CD2-CD2 4Å; Y198-F322 HydrophobicContact CD2-CG 4.35Å; Y198-F322 HydrophobicContact CE2-CB 4.28Å; Y198-F322 HydrophobicContact CE2-CD2 4.21Å; Y198-F322 HydrophobicContact CE2-CG 4.31Å; Y198-F322 HydrophobicContact CG-CD2 4.2Å; T318-F322 PolarHBondContact O-N 2.92Å; Q319-F322 PolarHBondContact O-N 2.95Å; M320-F322 PolarHBondContact O-N 3.43Å; F322-F325 PolarHBondContact O-N 3.09Å; F322-L326 HydrophobicContact CE1-CD2 4.33Å; F322-L326 WeakPolarHBondContact O-CB 3.5Å; F322-L326 PolarHBondContact O-N 3.34Å
323A72.2Confident71.1Confident21 Ų2147.6 Ų47.617%0.17425%0.249CC..Hα-helixtrans-63.3-44.3178.500000112.4Q319 M320 F325 L326 C327 L369 M373Q319-A323 WeakPolarHBondContact O-CB 3.41Å; Q319-A323 PolarHBondContact O-N 3.25Å; M320-A323 PolarHBondContact O-N 3.33Å; A323-F325 PolarHBondContact O-N 2.93Å; A323-L326 PolarHBondContact O-N 2.9Å; A323-C327 PolarHBondContact O-N 3.2Å; A323-C327 PolarHBondContact O-SG 2.61Å; A323-C327 VanDerWaalsContact O-SG 3.33Å; A323-L369 HydrophobicContact CB-CD2 4.14Å; A323-M373 HydrophobicContact CB-CE 4.08Å; A323-M373 HydrophobicContact CB-SD 3.66Å
324V72.4Confident72.9Confident6 Ų647 Ų474%0.03625%0.25CS..Hα-helixtrans-53.9-47.2174.6173.60000110.6L111 M320 F328 N366 L369L111-V324 HydrophobicContact CD1-CG1 4.26Å; L111-V324 HydrophobicContact CD2-CG1 3.65Å; M320-V324 HydrophobicContact CG-CG2 4.45Å; M320-V324 VanDerWaalsContact O-CG2 3.28Å; M320-V324 WeakPolarHBondContact O-CG2 3.2Å; M320-V324 PolarHBondContact O-N 3.45Å; V324-F328 PolarHBondContact O-N 3.46Å; V324-N366 WeakPolarHBondContact CG1-OD1 3.11Å; V324-L369 HydrophobicContact CB-CD1 3.8Å; V324-L369 HydrophobicContact CG1-CD1 4.47Å; V324-L369 HydrophobicContact CG2-CB 3.9Å; V324-L369 HydrophobicContact CG2-CD1 3.33Å; V324-L369 HydrophobicContact CG2-CG 4.25Å
325F70.2Confident74.5Confident26 Ų2643 Ų4311%0.11423%0.233CC..Hα-helixtrans-72.5-38.4-178.3167.4-96.5000113.5G190 L191 V194 C321 F322 A323 C327 F328 A329G190-F325 WeakPolarHBondContact O-CE2 3.36Å; L191-F325 HydrophobicContact CB-CZ 4.25Å; L191-F325 HydrophobicContact CD2-CE1 4.31Å; L191-F325 HydrophobicContact CD2-CE2 3.84Å; L191-F325 HydrophobicContact CD2-CZ 3.32Å; L191-F325 HydrophobicContact CG-CZ 4.31Å; V194-F325 HydrophobicContact CB-CB 4.25Å; V194-F325 HydrophobicContact CB-CD1 3.84Å; V194-F325 HydrophobicContact CB-CD2 3.61Å; V194-F325 HydrophobicContact CB-CE1 4.02Å; V194-F325 HydrophobicContact CB-CE2 3.8Å; V194-F325 HydrophobicContact CB-CG 3.6Å; V194-F325 HydrophobicContact CB-CZ 3.98Å; V194-F325 HydrophobicContact CG1-CB 3.73Å; V194-F325 HydrophobicContact CG1-CD1 3.44Å; V194-F325 VanDerWaalsContact CG1-CD1 3.44Å; V194-F325 HydrophobicContact CG1-CD2 4Å; V194-F325 HydrophobicContact CG1-CE1 3.99Å; V194-F325 HydrophobicContact CG1-CE2 4.48Å; V194-F325 HydrophobicContact CG1-CG 3.42Å; V194-F325 VanDerWaalsContact CG1-CG 3.42Å; V194-F325 HydrophobicContact CG1-CZ 4.45Å; V194-F325 HydrophobicContact CG2-CB 4.02Å; V194-F325 HydrophobicContact CG2-CD1 4.4Å; V194-F325 HydrophobicContact CG2-CD2 3.36Å; V194-F325 HydrophobicContact CG2-CE2 3.87Å; V194-F325 HydrophobicContact CG2-CG 3.65Å; C321-F325 WeakPolarHBondContact O-CB 3.47Å; C321-F325 PolarHBondContact O-N 2.82Å; F322-F325 PolarHBondContact O-N 3.09Å; A323-F325 PolarHBondContact O-N 2.93Å; F325-C327 VanDerWaalsContact C-N 3.28Å; F325-C327 PolarHBondContact O-N 3.18Å; F325-F328 CarbonylContact O-C 3.59Å; F325-F328 WeakPolarHBondContact O-CB 3.45Å; F325-F328 PolarHBondContact O-N 3.13Å; F325-F328 VanDerWaalsContact O-N 3.13Å; F325-A329 HydrophobicContact CZ-CB 4.44Å; F325-A329 WeakPolarHBondContact O-CB 3.46Å; F325-A329 PolarHBondContact O-N 2.85Å
326L77.1Confident75.9Confident76 Ų7641.8 Ų41.840%0.39822%0.217SC..Hα-helixtrans-60.6-42.6175.7-17863.1000110.4F322 A323 F328 A329 L330F322-L326 HydrophobicContact CE1-CD2 4.33Å; F322-L326 WeakPolarHBondContact O-CB 3.5Å; F322-L326 PolarHBondContact O-N 3.34Å; A323-L326 PolarHBondContact O-N 2.9Å; L326-F328 VanDerWaalsContact C-N 3.34Å; L326-F328 PolarHBondContact O-N 3.33Å; L326-A329 PolarHBondContact O-N 3.31Å; L326-L330 HydrophobicContact CD1-CD1 4.04Å; L326-L330 HydrophobicContact CD1-CG 4.1Å; L326-L330 HydrophobicContact CG-CD1 3.85Å; L326-L330 HydrophobicContact CG-CG 4.33Å; L326-L330 WeakPolarHBondContact O-CB 3.44Å; L326-L330 WeakPolarHBondContact O-CG 3.48Å; L326-L330 PolarHBondContact O-N 3.04Å
327C79.8Confident77Confident46 Ų4639 Ų3931%0.31121%0.212SC..Hα-helixtrans-62.7-40.2173.6-66.60000112.3A323 F325 S331 I365A323-C327 PolarHBondContact O-N 3.2Å; A323-C327 PolarHBondContact O-SG 2.61Å; A323-C327 VanDerWaalsContact O-SG 3.33Å; F325-C327 VanDerWaalsContact C-N 3.28Å; F325-C327 PolarHBondContact O-N 3.18Å; C327-S331 WeakPolarHBondContact O-CB 3.36Å; C327-S331 PolarHBondContact O-N 3.07Å; C327-S331 VanDerWaalsContact O-N 3.07Å; C327-S331 PolarHBondContact O-OG 3.01Å; C327-I365 HydrophobicContact CB-CG1 3.87Å
328F77.7Confident78.3Confident13 Ų1338.9 Ų38.96%0.05721%0.21CC..Hα-helixtrans-62.9-46.8174.5-175.5-88.8000112I108 V324 F325 L326 S331 Y332 N362I108-F328 HydrophobicContact CD1-CE1 4.08Å; I108-F328 HydrophobicContact CD1-CZ 3.61Å; I108-F328 HydrophobicContact CG1-CE1 3.79Å; I108-F328 HydrophobicContact CG1-CE2 3.97Å; I108-F328 HydrophobicContact CG1-CZ 3.29Å; V324-F328 PolarHBondContact O-N 3.46Å; F325-F328 CarbonylContact O-C 3.59Å; F325-F328 WeakPolarHBondContact O-CB 3.45Å; F325-F328 PolarHBondContact O-N 3.13Å; F325-F328 VanDerWaalsContact O-N 3.13Å; L326-F328 VanDerWaalsContact C-N 3.34Å; L326-F328 PolarHBondContact O-N 3.33Å; F328-S331 PolarHBondContact O-N 3.23Å; F328-S331 PolarHBondContact O-OG 3.33Å; F328-Y332 HydrophobicContact CE1-CG 4.47Å; F328-Y332 HydrophobicContact CZ-CD2 4.26Å; F328-Y332 HydrophobicContact CZ-CG 4.34Å; F328-Y332 WeakPolarHBondContact O-CB 3.44Å; F328-Y332 PolarHBondContact O-N 3.24Å; F328-N362 HydrophobicContact CD2-CB 4.46Å; F328-N362 WeakPolarHBondContact CD2-ND2 3.35Å; F328-N362 WeakPolarHBondContact CD2-OD1 3.06Å; F328-N362 WeakPolarHBondContact CE2-ND2 3.4Å
329A77.9Confident79.2Confident11 Ų1138.1 Ų38.19%0.09121%0.205CC..Hα-helixtrans-64.7-48179.900000111.4L191 F325 L326 S331 Y332 V333L191-A329 HydrophobicContact CD2-CB 3.93Å; F325-A329 HydrophobicContact CZ-CB 4.44Å; F325-A329 WeakPolarHBondContact O-CB 3.46Å; F325-A329 PolarHBondContact O-N 2.85Å; L326-A329 PolarHBondContact O-N 3.31Å; A329-S331 PolarHBondContact O-N 2.79Å; A329-Y332 PolarHBondContact O-N 2.79Å; A329-V333 WeakPolarHBondContact O-CB 3.27Å; A329-V333 WeakPolarHBondContact O-CG2 3.15Å; A329-V333 PolarHBondContact O-N 2.84Å
330L82.8Confident79.9Confident110 Ų11036.4 Ų36.458%0.57620%0.199SC*.Hα-helixtrans-62.7-32.6179.8-70.2174.1000112.4L326 P334 L358L326-L330 HydrophobicContact CD1-CD1 4.04Å; L326-L330 HydrophobicContact CD1-CG 4.1Å; L326-L330 HydrophobicContact CG-CD1 3.85Å; L326-L330 HydrophobicContact CG-CG 4.33Å; L326-L330 WeakPolarHBondContact O-CB 3.44Å; L326-L330 WeakPolarHBondContact O-CG 3.48Å; L326-L330 PolarHBondContact O-N 3.04Å; L330-P334 VanDerWaalsContact O-CD 3.26Å; L330-P334 WeakPolarHBondContact O-CD 3.4Å; L330-L358 WeakPolarHBondContact O-CD2 3.49Å
331S85.3Confident80.7Confident2 Ų242.7 Ų42.71%0.01423%0.232CC..Hα-helixtrans-79.3-29.9177.659.60000114C327 F328 A329 L358 N362C327-S331 WeakPolarHBondContact O-CB 3.36Å; C327-S331 PolarHBondContact O-N 3.07Å; C327-S331 VanDerWaalsContact O-N 3.07Å; C327-S331 PolarHBondContact O-OG 3.01Å; F328-S331 PolarHBondContact O-N 3.23Å; F328-S331 PolarHBondContact O-OG 3.33Å; A329-S331 PolarHBondContact O-N 2.79Å; S331-L358 WeakPolarHBondContact CB-O 3.15Å; S331-N362 PolarHBondContact OG-OD1 2.83Å
332Y85.4Confident81.4Confident9 Ų942 Ų424%0.03523%0.226CC..Hα-helixtrans-96.2-29.3-174.1-141-99.6000114.3N104 M183 F187 F328 A329 F335 L336 T359N104-Y332 VanDerWaalsContact ND2-CE2 3.34Å; N104-Y332 WeakPolarHBondContact ND2-CE2 3.38Å; N104-Y332 PolarHBondContact ND2-OH 2.8Å; M183-Y332 HydrophobicContact SD-CE1 4.32Å; F187-Y332 HydrophobicContact CD2-CD1 4.41Å; F328-Y332 HydrophobicContact CE1-CG 4.47Å; F328-Y332 HydrophobicContact CZ-CD2 4.26Å; F328-Y332 HydrophobicContact CZ-CG 4.34Å; F328-Y332 WeakPolarHBondContact O-CB 3.44Å; F328-Y332 PolarHBondContact O-N 3.24Å; A329-Y332 PolarHBondContact O-N 2.79Å; Y332-F335 PolarHBondContact O-N 3.41Å; Y332-L336 PolarHBondContact O-N 3.24Å; Y332-T359 HydrophobicContact CD2-CG2 3.82Å; Y332-T359 HydrophobicContact CE2-CG2 4.07Å
333V87.1Confident81.5Confident50 Ų5041 Ų4130%0.30323%0.233SC..Hα-helixtrans-54.5-48.9179.7163.10000112.6F187 A329 F335 L336 L337F187-V333 HydrophobicContact CE2-CG2 3.68Å; F187-V333 HydrophobicContact CZ-CG2 3.38Å; A329-V333 WeakPolarHBondContact O-CB 3.27Å; A329-V333 WeakPolarHBondContact O-CG2 3.15Å; A329-V333 PolarHBondContact O-N 2.84Å; V333-F335 VanDerWaalsContact C-N 3.3Å; V333-F335 PolarHBondContact O-N 3.07Å; V333-L336 PolarHBondContact O-N 3.04Å; V333-L337 HydrophobicContact CG1-CD1 3.67Å; V333-L337 HydrophobicContact CG1-CG 4.13Å; V333-L337 WeakPolarHBondContact O-CB 3.31Å; V333-L337 WeakPolarHBondContact O-CG 3.49Å; V333-L337 PolarHBondContact O-N 3Å
334P90.1Very high81.6Confident45 Ų4550 Ų5029%0.29226%0.262SS..Hα-helixtrans-61-40.4-178.1-25.236.7000112.4L330 L338 A355 L358L330-P334 VanDerWaalsContact O-CD 3.26Å; L330-P334 WeakPolarHBondContact O-CD 3.4Å; P334-L338 WeakPolarHBondContact O-CG 3.22Å; P334-L338 PolarHBondContact O-N 3.34Å; P334-L338 VanDerWaalsContact O-N 3.1Å; P334-A355 HydrophobicContact CB-CB 4Å; P334-L358 HydrophobicContact CG-CD2 3.99Å
335F87.7Confident81.8Confident23 Ų2352.6 Ų52.610%0.10128%0.278CS..Hα-helixtrans-65.1-44.5178.1-180-100.4000111.7Y332 V333 L338 N339 A355 A356 T359Y332-F335 PolarHBondContact O-N 3.41Å; V333-F335 VanDerWaalsContact C-N 3.3Å; V333-F335 PolarHBondContact O-N 3.07Å; F335-L338 PolarHBondContact O-N 3.49Å; F335-N339 WeakPolarHBondContact O-CB 3.32Å; F335-N339 PolarHBondContact O-N 2.9Å; F335-A355 HydrophobicContact CB-CB 4.5Å; F335-A356 HydrophobicContact CD2-CB 4.12Å; F335-A356 HydrophobicContact CE2-CB 4.21Å; F335-T359 HydrophobicContact CB-CG2 3.85Å; F335-T359 HydrophobicContact CG-CG2 4.14Å
336L85.8Confident82.4Confident13 Ų1358.9 Ų58.97%0.06831%0.307CS..Hα-helixtrans-64.2-45178-176.265.4000111.7M183 F187 Y332 V333 L338 N339 I340M183-L336 HydrophobicContact CB-CD1 3.95Å; F187-L336 HydrophobicContact CB-CD2 3.76Å; F187-L336 HydrophobicContact CD1-CD2 3.41Å; F187-L336 VanDerWaalsContact CD1-CD2 3.41Å; F187-L336 HydrophobicContact CD2-CD2 4.01Å; F187-L336 HydrophobicContact CE1-CD2 3.95Å; F187-L336 HydrophobicContact CE2-CD2 4.5Å; F187-L336 HydrophobicContact CG-CD2 3.44Å; F187-L336 VanDerWaalsContact CG-CD2 3.44Å; F187-L336 HydrophobicContact CZ-CD2 4.47Å; Y332-L336 PolarHBondContact O-N 3.24Å; V333-L336 PolarHBondContact O-N 3.04Å; L336-L338 PolarHBondContact O-N 3.28Å; L336-N339 CarbonylContact O-C 3.48Å; L336-N339 WeakPolarHBondContact O-CA 3.22Å; L336-N339 PolarHBondContact O-N 2.91Å; L336-N339 VanDerWaalsContact O-N 3.07Å; L336-I340 HydrophobicContact CD1-CD1 4.04Å; L336-I340 HydrophobicContact CD1-CG1 4.43Å; L336-I340 HydrophobicContact CD2-CD1 4.42Å; L336-I340 HydrophobicContact CG-CD1 3.83Å; L336-I340 WeakPolarHBondContact O-CG1 3.31Å; L336-I340 PolarHBondContact O-N 2.96Å
337L86.4Confident82.8Confident85 Ų8556.6 Ų56.645%0.44530%0.299SS..Hα-helixtrans-60.2-44.5178.7-73.9176.2000111.7V333 N339 I340 L341V333-L337 HydrophobicContact CG1-CD1 3.67Å; V333-L337 HydrophobicContact CG1-CG 4.13Å; V333-L337 WeakPolarHBondContact O-CB 3.31Å; V333-L337 WeakPolarHBondContact O-CG 3.49Å; V333-L337 PolarHBondContact O-N 3Å; L337-N339 VanDerWaalsContact C-N 3.28Å; L337-N339 PolarHBondContact O-N 2.86Å; L337-I340 PolarHBondContact O-N 3.42Å; L337-I340 VanDerWaalsContact O-N 3.08Å; L337-L341 HydrophobicContact CB-CD1 4.46Å; L337-L341 HydrophobicContact CD2-CD1 4.16Å; L337-L341 WeakPolarHBondContact O-CB 2.99Å; L337-L341 PolarHBondContact O-N 2.64Å
338L86.6Confident83.2Confident28 Ų2858.7 Ų58.715%0.14731%0.312CS..Hα-helixtrans-65-34174.5-70.1173.3000112.1P334 F335 L336 I340 D342 A347 V351 A355P334-L338 WeakPolarHBondContact O-CG 3.22Å; P334-L338 PolarHBondContact O-N 3.34Å; P334-L338 VanDerWaalsContact O-N 3.1Å; F335-L338 PolarHBondContact O-N 3.49Å; L336-L338 PolarHBondContact O-N 3.28Å; L338-I340 VanDerWaalsContact C-N 3.25Å; L338-I340 PolarHBondContact O-N 3.25Å; L338-D342 HydrophobicContact CD2-CB 4.42Å; L338-D342 PolarHBondContact O-N 3.19Å; L338-A347 HydrophobicContact CD2-CB 4.36Å; L338-V351 HydrophobicContact CD1-CG1 3.96Å; L338-V351 HydrophobicContact CD2-CG1 4.21Å; L338-A355 HydrophobicContact CD1-CB 3.43Å; L338-A355 VanDerWaalsContact CD1-CB 3.43Å
339N83.1Confident83.8Confident5 Ų561.9 Ų61.93%0.02732%0.324CS..Hα-helixtrans-72.7-15.7174.5-165.551.1000113.3R176 F335 L336 L337R176-N339 PolarHBondContact NH1-O 2.78Å; R176-N339 PolarHBondContact NH2-O 3.29Å; R176-N339 PolarHBondContact NH2-OD1 3.08Å; F335-N339 WeakPolarHBondContact O-CB 3.32Å; F335-N339 PolarHBondContact O-N 2.9Å; L336-N339 CarbonylContact O-C 3.48Å; L336-N339 WeakPolarHBondContact O-CA 3.22Å; L336-N339 PolarHBondContact O-N 2.91Å; L336-N339 VanDerWaalsContact O-N 3.07Å; L337-N339 VanDerWaalsContact C-N 3.28Å; L337-N339 PolarHBondContact O-N 2.86Å
340I83Confident84.4Confident81 Ų8163.9 Ų63.942%0.41534%0.335SS..Hα-helixtrans-99.4-57.6177.1-66.4169.2000110.5T180 L336 L337 L338T180-I340 HydrophobicContact CG2-CG1 3.74Å; L336-I340 HydrophobicContact CD1-CD1 4.04Å; L336-I340 HydrophobicContact CD1-CG1 4.43Å; L336-I340 HydrophobicContact CD2-CD1 4.42Å; L336-I340 HydrophobicContact CG-CD1 3.83Å; L336-I340 WeakPolarHBondContact O-CG1 3.31Å; L336-I340 PolarHBondContact O-N 2.96Å; L337-I340 PolarHBondContact O-N 3.42Å; L337-I340 VanDerWaalsContact O-N 3.08Å; L338-I340 VanDerWaalsContact C-N 3.25Å; L338-I340 PolarHBondContact O-N 3.25Å
341L85.1Confident84.8Confident138 Ų13861.7 Ų61.772%0.72333%0.326SS*.Hα-helixtrans-78.3-33.5-169-59.4178000112.6L337 A343L337-L341 HydrophobicContact CB-CD1 4.46Å; L337-L341 HydrophobicContact CD2-CD1 4.16Å; L337-L341 WeakPolarHBondContact O-CB 2.99Å; L337-L341 PolarHBondContact O-N 2.64Å; L341-A343 PolarHBondContact O-N 3.02Å
342D83.2Confident85.1Confident15 Ų1561.6 Ų61.68%0.0833%0.326CS..  trans-10562.9-177.4-167.918.7000112.3L338 R344 V345 Q346 A347 H352L338-D342 HydrophobicContact CD2-CB 4.42Å; L338-D342 PolarHBondContact O-N 3.19Å; D342-R344 VanDerWaalsContact C-N 3.25Å; D342-R344 PolarHBondContact O-N 3Å; D342-V345 PolarHBondContact O-N 3.09Å; D342-V345 WeakPolarHBondContact OD1-CA 3.38Å; D342-V345 PolarHBondContact OD1-N 2.86Å; D342-V345 WeakPolarHBondContact OD2-CA 3.34Å; D342-Q346 PolarHBondContact OD1-N 3.49Å; D342-Q346 PolarHBondContact OD2-N 3.1Å; D342-A347 WeakPolarHBondContact OD2-CB 3.41Å; D342-A347 PolarHBondContact OD2-N 3.13Å; D342-H352 IonicContact OD2-CE1 2.64Å; D342-H352 PolarHBondContact OD2-CE1 3.33Å; D342-H352 IonicContact OD2-NE2 3.52Å; D342-H352 PolarHBondContact OD2-NE2 3.03Å
343A72.4Confident85.4Confident58 Ų5861.2 Ų61.248%0.47932%0.324SS..THydrogen-bonded Turntrans-67.6-25.6177.900000113.8L341L341-A343 PolarHBondContact O-N 3.02Å
344R75Confident85.7Confident211 Ų21163.1 Ų63.180%0.79633%0.332SS*.THydrogen-bonded Turntrans-96.93.3-179.1-63.3-169.9-174.2-146.13.9113.5D342 Q346D342-R344 VanDerWaalsContact C-N 3.25Å; D342-R344 PolarHBondContact O-N 3Å; R344-Q346 VanDerWaalsContact C-N 3.3Å; R344-Q346 HydrophobicContact CB-CG 4.06Å; R344-Q346 PolarHBondContact O-N 3.41Å
345V76Confident85.8Confident59 Ų5961.3 Ų61.336%0.35832%0.321SS..  trans54.547.5179.8-1630000111.2V164 D342V164-V345 HydrophobicContact CG1-CG1 4.29Å; V164-V345 HydrophobicContact CG2-CG1 4.21Å; D342-V345 PolarHBondContact O-N 3.09Å; D342-V345 WeakPolarHBondContact OD1-CA 3.38Å; D342-V345 PolarHBondContact OD1-N 2.86Å; D342-V345 WeakPolarHBondContact OD2-CA 3.34Å
346Q82.1Confident86Confident158 Ų15860.5 Ų60.574%0.73832%0.319SS*.  trans-81.8-24.8177.1-68.8-180-13.600111.9D342 R344D342-Q346 PolarHBondContact OD1-N 3.49Å; D342-Q346 PolarHBondContact OD2-N 3.1Å; R344-Q346 VanDerWaalsContact C-N 3.3Å; R344-Q346 HydrophobicContact CB-CG 4.06Å; R344-Q346 PolarHBondContact O-N 3.41Å
347A85.5Confident86.3Confident28 Ų2860 Ų6023%0.23132%0.316CS..SBendtrans-69.6152.3178.200000111.3L338 D342 R349L338-A347 HydrophobicContact CD2-CB 4.36Å; D342-A347 WeakPolarHBondContact OD2-CB 3.41Å; D342-A347 PolarHBondContact OD2-N 3.13Å; A347-R349 PolarHBondContact O-N 3.28Å
348P89.4Confident86.6Confident90 Ų9058.9 Ų58.958%0.58431%0.31SS*.  trans-56.6137.1175.9-23.332.4000111.6V350 V351P348-V350 PolarHBondContact O-N 2.99Å; P348-V350 VanDerWaalsContact O-N 3.08Å; P348-V351 HydrophobicContact CB-CG2 4.18Å; P348-V351 HydrophobicContact CG-CG2 4.32Å; P348-V351 WeakPolarHBondContact O-CB 3.39Å; P348-V351 PolarHBondContact O-N 3.29Å
349R89.4Confident86.7Confident80 Ų8058.6 Ų58.630%0.30231%0.309SS..Hα-helixtrans-53.3-35.9-178.5-64.3-171.4-178.6-152.53.3113.2H13 V164 A347 V351 H352 M353H13-R349 PolarHBondContact CD2-NH1 2.88Å; H13-R349 PolarHBondContact CD2-NH2 3.24Å; H13-R349 PolarHBondContact NE2-NE 3.27Å; V164-R349 HydrophobicContact CG1-CB 4.44Å; V164-R349 HydrophobicContact CG1-CG 4.29Å; A347-R349 PolarHBondContact O-N 3.28Å; R349-V351 PolarHBondContact O-N 3.11Å; R349-H352 WeakPolarHBondContact O-CB 3.26Å; R349-H352 PolarHBondContact O-N 2.84Å; R349-H352 VanDerWaalsContact O-N 3.14Å; R349-M353 WeakPolarHBondContact O-CG 3.13Å; R349-M353 PolarHBondContact O-N 3.45Å
350V90.5Very high87.2Confident53 Ų5358.9 Ų58.932%0.32131%0.31SS..Hα-helixtrans-58.3-36.4177.2-177.70000111.7Y19 P348 M353 L354Y19-V350 HydrophobicContact CD2-CG1 4.3Å; P348-V350 PolarHBondContact O-N 2.99Å; P348-V350 VanDerWaalsContact O-N 3.08Å; V350-M353 HydrophobicContact CB-CE 4.31Å; V350-M353 HydrophobicContact CG2-CE 3.96Å; V350-M353 PolarHBondContact O-N 3.44Å; V350-L354 HydrophobicContact CG1-CD1 3.92Å; V350-L354 HydrophobicContact CG1-CG 4.26Å; V350-L354 WeakPolarHBondContact O-CB 3.5Å; V350-L354 VanDerWaalsContact O-CG 3.3Å; V350-L354 WeakPolarHBondContact O-CG 3.33Å; V350-L354 PolarHBondContact O-N 2.79Å
351V92.4Very high87.4Confident64 Ų6457.1 Ų57.139%0.38830%0.301SS..Hα-helixtrans-66.2-42.3177.51800000110.8L338 P348 R349 L354 A355L338-V351 HydrophobicContact CD1-CG1 3.96Å; L338-V351 HydrophobicContact CD2-CG1 4.21Å; P348-V351 HydrophobicContact CB-CG2 4.18Å; P348-V351 HydrophobicContact CG-CG2 4.32Å; P348-V351 WeakPolarHBondContact O-CB 3.39Å; P348-V351 PolarHBondContact O-N 3.29Å; R349-V351 PolarHBondContact O-N 3.11Å; V351-L354 PolarHBondContact O-N 3.24Å; V351-A355 WeakPolarHBondContact O-CB 3.47Å; V351-A355 PolarHBondContact O-N 3.47Å
352H90.5Very high87.5Confident1 Ų151.2 Ų51.21%0.00527%0.27CS..Hα-helixtrans-63.9-41.1174-67.8-68.9000112.7V164 V165 R172 D342 R349 A356V164-H352 HydrophobicContact CG1-CB 3.78Å; V165-H352 HydrophobicContact CG1-CB 3.96Å; R172-H352 PolarHBondContact NH1-ND1 3.38Å; D342-H352 IonicContact OD2-CE1 2.64Å; D342-H352 PolarHBondContact OD2-CE1 3.33Å; D342-H352 IonicContact OD2-NE2 3.52Å; D342-H352 PolarHBondContact OD2-NE2 3.03Å; R349-H352 WeakPolarHBondContact O-CB 3.26Å; R349-H352 PolarHBondContact O-N 2.84Å; R349-H352 VanDerWaalsContact O-N 3.14Å; H352-A356 VanDerWaalsContact O-CB 3.31Å; H352-A356 WeakPolarHBondContact O-CB 3.46Å; H352-A356 PolarHBondContact O-N 3.43Å
353M92.9Very high87.6Confident0 Ų050.6 Ų50.60%027%0.268CS..Hα-helixtrans-65.3-45.3177-68.2-172.2-69.500111.4V16 Y19 Y81 V164 R349 V350 A355 A356 N357V16-M353 HydrophobicContact CB-SD 4.3Å; V16-M353 HydrophobicContact CG1-SD 4.18Å; V16-M353 HydrophobicContact CG2-CE 4.28Å; V16-M353 HydrophobicContact CG2-SD 3.85Å; Y19-M353 HydrophobicContact CD1-CB 3.88Å; Y19-M353 HydrophobicContact CD1-CE 3.72Å; Y19-M353 HydrophobicContact CD1-CG 4.37Å; Y19-M353 HydrophobicContact CD1-SD 3.63Å; Y19-M353 HydrophobicContact CE1-CB 3.64Å; Y19-M353 HydrophobicContact CE1-SD 4.33Å; Y19-M353 HydrophobicContact CG-CE 3.88Å; Y19-M353 HydrophobicContact CG-SD 4.37Å; Y81-M353 HydrophobicContact CE1-SD 3.97Å; V164-M353 WeakPolarHBondContact O-CG 3.37Å; R349-M353 WeakPolarHBondContact O-CG 3.13Å; R349-M353 PolarHBondContact O-N 3.45Å; V350-M353 HydrophobicContact CB-CE 4.31Å; V350-M353 HydrophobicContact CG2-CE 3.96Å; V350-M353 PolarHBondContact O-N 3.44Å; M353-A355 PolarHBondContact O-N 2.87Å; M353-A356 PolarHBondContact O-N 3.47Å; M353-N357 VanDerWaalsContact O-CB 3.27Å; M353-N357 WeakPolarHBondContact O-CB 3.03Å; M353-N357 PolarHBondContact O-N 3.19Å; M353-N357 PolarHBondContact O-OD1 3.5Å
354L92.9Very high88.4Confident91 Ų9148.2 Ų48.248%0.47625%0.248SC..Hα-helixtrans-60-47.9176.6-77.3168.2000111.6Y19 V350 V351 A356 N357 L358Y19-L354 HydrophobicContact CE2-CD2 3.83Å; Y19-L354 HydrophobicContact CE2-CG 4.22Å; Y19-L354 WeakPolarHBondContact OH-CD2 3.45Å; V350-L354 HydrophobicContact CG1-CD1 3.92Å; V350-L354 HydrophobicContact CG1-CG 4.26Å; V350-L354 WeakPolarHBondContact O-CB 3.5Å; V350-L354 VanDerWaalsContact O-CG 3.3Å; V350-L354 WeakPolarHBondContact O-CG 3.33Å; V350-L354 PolarHBondContact O-N 2.79Å; V351-L354 PolarHBondContact O-N 3.24Å; L354-A356 VanDerWaalsContact C-N 3.34Å; L354-A356 PolarHBondContact O-N 2.97Å; L354-N357 PolarHBondContact O-N 3.05Å; L354-L358 WeakPolarHBondContact O-CB 3.49Å; L354-L358 PolarHBondContact O-N 2.03Å
355A92.5Very high89Confident6 Ų639.7 Ų39.75%0.0522%0.218CC..Hα-helixtrans-62.6-40.9178.300000112.2P334 F335 L338 V351 M353P334-A355 HydrophobicContact CB-CB 4Å; F335-A355 HydrophobicContact CB-CB 4.5Å; L338-A355 HydrophobicContact CD1-CB 3.43Å; L338-A355 VanDerWaalsContact CD1-CB 3.43Å; V351-A355 WeakPolarHBondContact O-CB 3.47Å; V351-A355 PolarHBondContact O-N 3.47Å; M353-A355 PolarHBondContact O-N 2.87Å
356A91.3Very high89.5Confident7 Ų737.2 Ų37.26%0.05820%0.202CC..Hα-helixtrans-65-46.1175.200000111.6V165 F335 H352 M353 L354 L358 T359V165-A356 HydrophobicContact CB-CB 4.27Å; V165-A356 HydrophobicContact CG1-CB 3.97Å; F335-A356 HydrophobicContact CD2-CB 4.12Å; F335-A356 HydrophobicContact CE2-CB 4.21Å; H352-A356 VanDerWaalsContact O-CB 3.31Å; H352-A356 WeakPolarHBondContact O-CB 3.46Å; H352-A356 PolarHBondContact O-N 3.43Å; M353-A356 PolarHBondContact O-N 3.47Å; L354-A356 VanDerWaalsContact C-N 3.34Å; L354-A356 PolarHBondContact O-N 2.97Å; A356-L358 VanDerWaalsContact C-N 3.25Å; A356-L358 PolarHBondContact O-N 3.49Å; A356-T359 WeakPolarHBondContact O-CB 3.33Å; A356-T359 PolarHBondContact O-N 2.86Å; A356-T359 VanDerWaalsContact O-N 3.13Å; A356-T359 PolarHBondContact O-OG1 3.04Å
357N92.6Very high89.8Confident3 Ų329.9 Ų29.92%0.01617%0.168CC..Hα-helixtrans-69.1-23.9-178.9-70.45.2000113.2Y19 W26 M353 L354 T359 W360Y19-N357 VanDerWaalsContact CE1-ND2 3.27Å; Y19-N357 WeakPolarHBondContact CE1-ND2 3.38Å; Y19-N357 PolarHBondContact OH-ND2 2.98Å; W26-N357 PolarHBondContact NE1-O 3.17Å; W26-N357 VanDerWaalsContact NE1-O 3.12Å; M353-N357 VanDerWaalsContact O-CB 3.27Å; M353-N357 WeakPolarHBondContact O-CB 3.03Å; M353-N357 PolarHBondContact O-N 3.19Å; M353-N357 PolarHBondContact O-OD1 3.5Å; L354-N357 PolarHBondContact O-N 3.05Å; N357-T359 VanDerWaalsContact C-N 3.26Å; N357-T359 PolarHBondContact O-N 3.12Å; N357-W360 HydrophobicContact CB-CD2 4.12Å; N357-W360 HydrophobicContact CB-CE3 4.11Å; N357-W360 HydrophobicContact CB-CH2 4.49Å; N357-W360 HydrophobicContact CB-CZ2 4.5Å; N357-W360 HydrophobicContact CB-CZ3 4.29Å; N357-W360 WeakPolarHBondContact O-CB 3.36Å; N357-W360 VanDerWaalsContact O-CG 3.31Å; N357-W360 PolarHBondContact O-N 3.16Å; N357-W360 VanDerWaalsContact OD1-CH2 3.31Å; N357-W360 WeakPolarHBondContact OD1-CH2 3.3Å; N357-W360 WeakPolarHBondContact OD1-CZ2 3.47Å
358L91.3Very high89.7Confident61 Ų6132.5 Ų32.532%0.31918%0.181SC..Hα-helixtrans-65-34.1173.8-163.867000111.2L330 S331 P334 L354 A356 W360 L361L330-L358 WeakPolarHBondContact O-CD2 3.49Å; S331-L358 WeakPolarHBondContact CB-O 3.15Å; P334-L358 HydrophobicContact CG-CD2 3.99Å; L354-L358 WeakPolarHBondContact O-CB 3.49Å; L354-L358 PolarHBondContact O-N 2.03Å; A356-L358 VanDerWaalsContact C-N 3.25Å; A356-L358 PolarHBondContact O-N 3.49Å; L358-W360 PolarHBondContact O-N 3.09Å; L358-L361 HydrophobicContact CD1-CD1 3.79Å; L358-L361 HydrophobicContact CG-CD1 4.43Å; L358-L361 WeakPolarHBondContact O-CB 3.18Å; L358-L361 PolarHBondContact O-N 3.05Å
359T90.6Very high89.4Confident21 Ų2129 Ų2913%0.12916%0.158CC..G310 helixtrans-63.8-20.3176.273.20000113.1Y332 F335 A356 N357 L361 N362Y332-T359 HydrophobicContact CD2-CG2 3.82Å; Y332-T359 HydrophobicContact CE2-CG2 4.07Å; F335-T359 HydrophobicContact CB-CG2 3.85Å; F335-T359 HydrophobicContact CG-CG2 4.14Å; A356-T359 WeakPolarHBondContact O-CB 3.33Å; A356-T359 PolarHBondContact O-N 2.86Å; A356-T359 VanDerWaalsContact O-N 3.13Å; A356-T359 PolarHBondContact O-OG1 3.04Å; N357-T359 VanDerWaalsContact C-N 3.26Å; N357-T359 PolarHBondContact O-N 3.12Å; T359-L361 PolarHBondContact O-N 3.36Å; T359-N362 WeakPolarHBondContact O-CB 3.38Å; T359-N362 PolarHBondContact O-N 3.3Å; T359-N362 PolarHBondContact O-ND2 3.16Å
360W91.8Very high89.1Confident11 Ų1125.5 Ų25.54%0.04214%0.144CC..G310 helixtrans-63.7-25.8178.7-58.2-5.8000112.5A23 W26 V30 Y69 Y81 N357 L358 N362 G363A23-W360 WeakPolarHBondContact O-CZ3 3.25Å; W26-W360 AromaticContact CD1-CE3 3.56Å; V30-W360 HydrophobicContact CG1-CB 4.16Å; V30-W360 VanDerWaalsContact CG1-O 3.22Å; V30-W360 WeakPolarHBondContact CG1-O 3.43Å; V30-W360 HydrophobicContact CG2-CB 4.23Å; Y69-W360 WeakPolarHBondContact OH-CA 3.38Å; Y81-W360 AromaticContact CD2-CH2 3.98Å; Y81-W360 HydrophobicContact CD2-CH2 3.98Å; Y81-W360 HydrophobicContact CD2-CZ2 4.37Å; Y81-W360 AromaticContact CE2-CH2 3.77Å; Y81-W360 HydrophobicContact CE2-CH2 3.77Å; Y81-W360 AromaticContact CE2-CZ2 3.87Å; Y81-W360 HydrophobicContact CE2-CZ2 3.87Å; N357-W360 HydrophobicContact CB-CD2 4.12Å; N357-W360 HydrophobicContact CB-CE3 4.11Å; N357-W360 HydrophobicContact CB-CH2 4.49Å; N357-W360 HydrophobicContact CB-CZ2 4.5Å; N357-W360 HydrophobicContact CB-CZ3 4.29Å; N357-W360 WeakPolarHBondContact O-CB 3.36Å; N357-W360 VanDerWaalsContact O-CG 3.31Å; N357-W360 PolarHBondContact O-N 3.16Å; N357-W360 VanDerWaalsContact OD1-CH2 3.31Å; N357-W360 WeakPolarHBondContact OD1-CH2 3.3Å; N357-W360 WeakPolarHBondContact OD1-CZ2 3.47Å; L358-W360 PolarHBondContact O-N 3.09Å; W360-N362 PolarHBondContact O-N 3.29Å; W360-N362 VanDerWaalsContact O-N 3.09Å; W360-G363 PolarHBondContact O-N 2.91Å
361L88.8Confident88.8Confident44 Ų4424.7 Ų24.723%0.2314%0.143CC..G310 helixtrans-54.5-28.8175.2-77.7172.2000113.5W26 L358 T359 G363 C364 I365W26-L361 HydrophobicContact CH2-CD2 3.43Å; W26-L361 VanDerWaalsContact CH2-CD2 3.43Å; W26-L361 HydrophobicContact CH2-CG 4.25Å; W26-L361 HydrophobicContact CZ2-CD1 4.19Å; W26-L361 HydrophobicContact CZ2-CD2 3.25Å; W26-L361 HydrophobicContact CZ2-CG 3.59Å; L358-L361 HydrophobicContact CD1-CD1 3.79Å; L358-L361 HydrophobicContact CG-CD1 4.43Å; L358-L361 WeakPolarHBondContact O-CB 3.18Å; L358-L361 PolarHBondContact O-N 3.05Å; T359-L361 PolarHBondContact O-N 3.36Å; L361-G363 PolarHBondContact O-N 3.32Å; L361-C364 PolarHBondContact O-N 2.96Å; L361-C364 PolarHBondContact O-SG 3.32Å; L361-I365 WeakPolarHBondContact O-CB 3.44Å; L361-I365 WeakPolarHBondContact O-CG2 3.42Å; L361-I365 PolarHBondContact O-N 3.5Å
362N85.6Confident88.2Confident14 Ų1424.7 Ų24.78%0.07515%0.15CC..Hα-helixtrans-58.7-32.4-176.7-72.1-19.9000112.3F328 S331 T359 W360 N366F328-N362 HydrophobicContact CD2-CB 4.46Å; F328-N362 WeakPolarHBondContact CD2-ND2 3.35Å; F328-N362 WeakPolarHBondContact CD2-OD1 3.06Å; F328-N362 WeakPolarHBondContact CE2-ND2 3.4Å; S331-N362 PolarHBondContact OG-OD1 2.83Å; T359-N362 WeakPolarHBondContact O-CB 3.38Å; T359-N362 PolarHBondContact O-N 3.3Å; T359-N362 PolarHBondContact O-ND2 3.16Å; W360-N362 PolarHBondContact O-N 3.29Å; W360-N362 VanDerWaalsContact O-N 3.09Å; N362-N366 PolarHBondContact O-ND2 2.97Å
363G86.4Confident87.5Confident2 Ų226.7 Ų26.72%0.02116%0.16CC..Hα-helixtrans-74.2-22.2178.800000114.7N38 C70 W360 L361N38-G363 PolarHBondContact ND2-O 3.39Å; C70-G363 PolarHBondContact SG-O 2.88Å; W360-G363 PolarHBondContact O-N 2.91Å; L361-G363 PolarHBondContact O-N 3.32Å
364C89.6Confident86.8Confident9 Ų927 Ų276%0.06116%0.161CC..Hα-helixtrans-116.1-15.7-173.8680000114.8V30 T33 L361V30-C364 HydrophobicContact CG1-CB 4.38Å; T33-C364 WeakPolarHBondContact OG1-CB 3.43Å; L361-C364 PolarHBondContact O-N 2.96Å; L361-C364 PolarHBondContact O-SG 3.32Å
365I87.9Confident86.2Confident32 Ų3227.1 Ų27.116%0.16416%0.156CC..Hα-helixtrans-71.6-31.4-175.5-163.766.3000113C327 L361 V368 L369C327-I365 HydrophobicContact CB-CG1 3.87Å; L361-I365 WeakPolarHBondContact O-CB 3.44Å; L361-I365 WeakPolarHBondContact O-CG2 3.42Å; L361-I365 PolarHBondContact O-N 3.5Å; I365-V368 WeakPolarHBondContact O-CB 3.42Å; I365-V368 PolarHBondContact O-N 3.46Å; I365-L369 HydrophobicContact CG1-CD1 3.72Å; I365-L369 HydrophobicContact CG1-CG 4.12Å; I365-L369 WeakPolarHBondContact O-CG 3.11Å; I365-L369 PolarHBondContact O-N 3.47Å
366N86Confident85.7Confident6 Ų631.7 Ų31.73%0.03218%0.176CC..Hα-helixtrans-61.6-52.3-173.3-64.3-36.5000112.8L62 D66 V324 N362 V368 L369 Y370L62-N366 HydrophobicContact CD2-CB 4.4Å; D66-N366 PolarHBondContact OD2-ND2 2.98Å; V324-N366 WeakPolarHBondContact CG1-OD1 3.11Å; N362-N366 PolarHBondContact O-ND2 2.97Å; N366-V368 VanDerWaalsContact C-N 3.31Å; N366-V368 PolarHBondContact O-N 2.84Å; N366-L369 PolarHBondContact O-N 3.32Å; N366-Y370 HydrophobicContact CB-CE2 4.29Å; N366-Y370 WeakPolarHBondContact O-CD2 3.27Å; N366-Y370 VanDerWaalsContact O-CG 3.27Å; N366-Y370 PolarHBondContact O-N 3.46Å
367P86.9Confident85.4Confident5 Ų531.4 Ų31.43%0.03217%0.173CC..Hα-helixtrans-59.4-37.3175.3-26.535.4000114.5G37 N38 L369 Y370 A371G37-P367 VanDerWaalsContact C-CB 3.47Å; N38-P367 HydrophobicContact CB-CG 4.27Å; N38-P367 VanDerWaalsContact CG-CG 3.47Å; N38-P367 VanDerWaalsContact OD1-CG 3.22Å; N38-P367 WeakPolarHBondContact OD1-CG 3.35Å; P367-L369 VanDerWaalsContact C-N 3.32Å; P367-L369 PolarHBondContact O-N 3.03Å; P367-Y370 PolarHBondContact O-N 3.18Å; P367-A371 WeakPolarHBondContact O-CB 3.27Å; P367-A371 PolarHBondContact O-N 3.29Å
368V85.3Confident85.1Confident83 Ų8337.4 Ų37.450%0.50320%0.196SC..Hα-helixtrans-62-44.5178.6175.50000109.9I365 N366 A371 A372I365-V368 WeakPolarHBondContact O-CB 3.42Å; I365-V368 PolarHBondContact O-N 3.46Å; N366-V368 VanDerWaalsContact C-N 3.31Å; N366-V368 PolarHBondContact O-N 2.84Å; V368-A371 PolarHBondContact O-N 3.42Å; V368-A372 WeakPolarHBondContact O-CB 3.31Å; V368-A372 PolarHBondContact O-N 3.45Å
369L82.9Confident84.9Confident17 Ų1740.2 Ų40.29%0.08921%0.207CC..Hα-helixtrans-68.6-36.5178.4-68.7172.9000112.3A323 V324 I365 N366 P367 A372 M373A323-L369 HydrophobicContact CB-CD2 4.14Å; V324-L369 HydrophobicContact CB-CD1 3.8Å; V324-L369 HydrophobicContact CG1-CD1 4.47Å; V324-L369 HydrophobicContact CG2-CB 3.9Å; V324-L369 HydrophobicContact CG2-CD1 3.33Å; V324-L369 HydrophobicContact CG2-CG 4.25Å; I365-L369 HydrophobicContact CG1-CD1 3.72Å; I365-L369 HydrophobicContact CG1-CG 4.12Å; I365-L369 WeakPolarHBondContact O-CG 3.11Å; I365-L369 PolarHBondContact O-N 3.47Å; N366-L369 PolarHBondContact O-N 3.32Å; P367-L369 VanDerWaalsContact C-N 3.32Å; P367-L369 PolarHBondContact O-N 3.03Å; L369-A372 PolarHBondContact O-N 3.1Å; L369-M373 HydrophobicContact CD2-SD 4.05Å; L369-M373 WeakPolarHBondContact O-CB 3.4Å; L369-M373 PolarHBondContact O-N 3.01Å
370Y82.9Confident84.7Confident6 Ų639.4 Ų39.42%0.02420%0.202CC..Hα-helixtrans-63.3-43.1172.4-59.5-25.5000112.1T41 I59 L62 M320 N366 P367 N374 Y381T41-Y370 HydrophobicContact CG2-CD2 3.91Å; T41-Y370 HydrophobicContact CG2-CE2 4.15Å; I59-Y370 HydrophobicContact CG2-CD2 4.37Å; I59-Y370 HydrophobicContact CG2-CE2 3.55Å; L62-Y370 WeakPolarHBondContact CD2-OH 3.21Å; M320-Y370 HydrophobicContact CE-CD1 4.01Å; M320-Y370 HydrophobicContact CE-CE1 4.11Å; M320-Y370 HydrophobicContact SD-CD1 3.78Å; M320-Y370 HydrophobicContact SD-CE1 4.39Å; N366-Y370 HydrophobicContact CB-CE2 4.29Å; N366-Y370 WeakPolarHBondContact O-CD2 3.27Å; N366-Y370 VanDerWaalsContact O-CG 3.27Å; N366-Y370 PolarHBondContact O-N 3.46Å; P367-Y370 PolarHBondContact O-N 3.18Å; Y370-N374 WeakPolarHBondContact O-CA 3.35Å; Y370-N374 VanDerWaalsContact O-CB 3.32Å; Y370-N374 WeakPolarHBondContact O-CB 3.41Å; Y370-N374 PolarHBondContact O-N 3.46Å; Y370-Y381 WeakPolarHBondContact CB-OH 3.44Å
371A82.9Confident84.6Confident36 Ų3639.5 Ų39.530%0.29820%0.203SC..Hα-helixtrans-64.1-41.5176.700000112P367 V368 R378 Y381P367-A371 WeakPolarHBondContact O-CB 3.27Å; P367-A371 PolarHBondContact O-N 3.29Å; V368-A371 PolarHBondContact O-N 3.42Å; A371-R378 VanDerWaalsContact O-CD 3.32Å; A371-R378 WeakPolarHBondContact O-CD 3.27Å; A371-Y381 HydrophobicContact CB-CD2 3.92Å; A371-Y381 HydrophobicContact CB-CE2 3.9Å
372A80.8Confident84.6Confident63 Ų6339.3 Ų39.352%0.52121%0.208SC..Hα-helixtrans-75.1-42.8-176.600000112.9V368 L369V368-A372 WeakPolarHBondContact O-CB 3.31Å; V368-A372 PolarHBondContact O-N 3.45Å; L369-A372 PolarHBondContact O-N 3.1Å
373M74.9Confident84.6Confident44 Ų4439.9 Ų39.922%0.21721%0.213CC..Hα-helixtrans-115.8-13.7-162.8-53.5-177.573.800114.2Q319 M320 A323 L369Q319-M373 VanDerWaalsContact C-CE 3.42Å; Q319-M373 HydrophobicContact CB-CE 3.95Å; Q319-M373 HydrophobicContact CG-CE 3.77Å; Q319-M373 WeakPolarHBondContact O-CE 3.5Å; M320-M373 VanDerWaalsContact CA-CE 3.48Å; M320-M373 HydrophobicContact CB-CB 3.65Å; M320-M373 HydrophobicContact CB-CE 4.13Å; M320-M373 HydrophobicContact CB-CG 4.45Å; M320-M373 HydrophobicContact CB-SD 4.05Å; M320-M373 HydrophobicContact CG-CB 3.69Å; M320-M373 HydrophobicContact CG-CG 4.44Å; M320-M373 HydrophobicContact CG-SD 4.18Å; M320-M373 HydrophobicContact SD-CB 4.13Å; A323-M373 HydrophobicContact CB-CE 4.08Å; A323-M373 HydrophobicContact CB-SD 3.66Å; L369-M373 HydrophobicContact CD2-SD 4.05Å; L369-M373 WeakPolarHBondContact O-CB 3.4Å; L369-M373 PolarHBondContact O-N 3.01Å
374N78.8Confident84.6Confident6 Ų640.7 Ų40.73%0.03222%0.217CC..  trans-108.5104.9178.6-166.2-37000112M320 Y370 Q376 F377 R378M320-N374 HydrophobicContact CE-CB 4.47Å; M320-N374 HydrophobicContact SD-CB 3.66Å; Y370-N374 WeakPolarHBondContact O-CA 3.35Å; Y370-N374 VanDerWaalsContact O-CB 3.32Å; Y370-N374 WeakPolarHBondContact O-CB 3.41Å; Y370-N374 PolarHBondContact O-N 3.46Å; N374-Q376 VanDerWaalsContact C-N 3.26Å; N374-Q376 PolarHBondContact O-N 3.32Å; N374-Q376 WeakPolarHBondContact OD1-CB 3.38Å; N374-Q376 PolarHBondContact OD1-N 3.48Å; N374-F377 HydrophobicContact CB-CB 4.12Å; N374-F377 HydrophobicContact CB-CD2 4.22Å; N374-F377 VanDerWaalsContact ND2-CD2 3.29Å; N374-F377 WeakPolarHBondContact ND2-CD2 3.36Å; N374-F377 PolarHBondContact O-N 2.67Å; N374-F377 PolarHBondContact OD1-N 2.91Å; N374-R378 WeakPolarHBondContact O-CB 3.39Å; N374-R378 PolarHBondContact O-N 3.49Å
375R80.1Confident84.5Confident94 Ų9446.4 Ų46.436%0.35525%0.247SC..Hα-helixtrans-55.5-39.4-179.7-173.7168.177.1172.15.1112.6D309 E313 Q379D309-R375 IonicContact OD2-CZ 3.62Å; D309-R375 IonicContact OD2-NH1 2.8Å; D309-R375 PolarHBondContact OD2-NH1 3.28Å; D309-R375 IonicContact OD2-NH2 3.73Å; E313-R375 IonicContact OE1-CZ 2.99Å; E313-R375 IonicContact OE1-NE 2.86Å; E313-R375 PolarHBondContact OE1-NE 2.77Å; E313-R375 IonicContact OE1-NH2 2.66Å; E313-R375 PolarHBondContact OE1-NH2 2.81Å; E313-R375 IonicContact OE2-NH2 3.32Å; E313-R375 PolarHBondContact OE2-NH2 3.18Å; R375-Q379 WeakPolarHBondContact O-CB 3.41Å; R375-Q379 VanDerWaalsContact O-CG 3.27Å; R375-Q379 WeakPolarHBondContact O-CG 3.23Å; R375-Q379 PolarHBondContact O-N 3.25Å
376Q83.1Confident84.2Confident102 Ų10253.6 Ų53.648%0.47728%0.276SS..Hα-helixtrans-69.4-43.8-177.8-60.7-178.1-16.900111.6L51 N374 A380L51-Q376 HydrophobicContact CD2-CB 3.97Å; N374-Q376 VanDerWaalsContact C-N 3.26Å; N374-Q376 PolarHBondContact O-N 3.32Å; N374-Q376 WeakPolarHBondContact OD1-CB 3.38Å; N374-Q376 PolarHBondContact OD1-N 3.48Å; Q376-A380 WeakPolarHBondContact O-CB 3.22Å; Q376-A380 PolarHBondContact O-N 3.22Å; Q376-A380 VanDerWaalsContact O-N 3.07Å
377F84.4Confident83.5Confident0 Ų059 Ų590%030%0.296CS..Hα-helixtrans-68.9-42.1175.7-83.3-95.9000111.6T41 L45 L51 I59 N374 Q379 A380 Y381T41-F377 HydrophobicContact CG2-CD1 4.22Å; T41-F377 HydrophobicContact CG2-CE1 3.84Å; L45-F377 HydrophobicContact CD2-CE1 3.78Å; L45-F377 HydrophobicContact CD2-CZ 3.69Å; L45-F377 HydrophobicContact CG-CE1 4.04Å; L45-F377 HydrophobicContact CG-CZ 4.39Å; L51-F377 HydrophobicContact CD2-CD2 4.05Å; L51-F377 HydrophobicContact CD2-CE2 3.95Å; L51-F377 HydrophobicContact CD2-CZ 4.38Å; I59-F377 HydrophobicContact CB-CZ 4.49Å; I59-F377 HydrophobicContact CD1-CE2 3.79Å; I59-F377 HydrophobicContact CD1-CZ 3.69Å; I59-F377 HydrophobicContact CG2-CE1 4.28Å; I59-F377 HydrophobicContact CG2-CZ 3.97Å; N374-F377 HydrophobicContact CB-CB 4.12Å; N374-F377 HydrophobicContact CB-CD2 4.22Å; N374-F377 VanDerWaalsContact ND2-CD2 3.29Å; N374-F377 WeakPolarHBondContact ND2-CD2 3.36Å; N374-F377 PolarHBondContact O-N 2.67Å; N374-F377 PolarHBondContact OD1-N 2.91Å; F377-Q379 VanDerWaalsContact C-N 3.31Å; F377-Q379 PolarHBondContact O-N 3.46Å; F377-A380 CarbonylContact O-C 3.55Å; F377-A380 WeakPolarHBondContact O-CA 3.36Å; F377-A380 PolarHBondContact O-N 2.86Å; F377-Y381 HydrophobicContact CB-CE1 4.24Å; F377-Y381 AromaticContact CD1-CE1 3.81Å; F377-Y381 HydrophobicContact CD1-CE1 3.81Å; F377-Y381 AromaticContact CD1-CZ 3.97Å; F377-Y381 VanDerWaalsContact O-CD1 3.26Å; F377-Y381 WeakPolarHBondContact O-CD1 3.46Å; F377-Y381 VanDerWaalsContact O-CG 3.27Å; F377-Y381 PolarHBondContact O-N 3.05Å
378R86.8Confident82.5Confident129 Ų12960.2 Ų60.249%0.48731%0.31SS..Hα-helixtrans-57.2-43.6175.8-174172.563-1693.6112.5A371 N374 Y381 A382A371-R378 VanDerWaalsContact O-CD 3.32Å; A371-R378 WeakPolarHBondContact O-CD 3.27Å; N374-R378 WeakPolarHBondContact O-CB 3.39Å; N374-R378 PolarHBondContact O-N 3.49Å; R378-Y381 PolarHBondContact O-N 3.26Å; R378-A382 WeakPolarHBondContact O-CB 3.5Å; R378-A382 PolarHBondContact O-N 3.43Å
379Q87.1Confident81.2Confident121 Ų12161.2 Ų61.257%0.56532%0.318SS*.Hα-helixtrans-64.9-39.9174.9-74.8174.1-5.600112R375 F377 S383R375-Q379 WeakPolarHBondContact O-CB 3.41Å; R375-Q379 VanDerWaalsContact O-CG 3.27Å; R375-Q379 WeakPolarHBondContact O-CG 3.23Å; R375-Q379 PolarHBondContact O-N 3.25Å; F377-Q379 VanDerWaalsContact C-N 3.31Å; F377-Q379 PolarHBondContact O-N 3.46Å; Q379-S383 WeakPolarHBondContact O-CB 3.49Å; Q379-S383 PolarHBondContact O-N 3.4Å
380A86.1Confident80Confident3 Ų368.8 Ų68.83%0.02535%0.346CS..Hα-helixtrans-67.4-41.4176.700000112.1A44 Q48 L51 Q376 F377 A382 S383 V384A44-A380 HydrophobicContact CB-CB 3.89Å; Q48-A380 HydrophobicContact CB-CB 4.43Å; L51-A380 HydrophobicContact CD1-CB 3.33Å; Q376-A380 WeakPolarHBondContact O-CB 3.22Å; Q376-A380 PolarHBondContact O-N 3.22Å; Q376-A380 VanDerWaalsContact O-N 3.07Å; F377-A380 CarbonylContact O-C 3.55Å; F377-A380 WeakPolarHBondContact O-CA 3.36Å; F377-A380 PolarHBondContact O-N 2.86Å; A380-A382 PolarHBondContact O-N 3.03Å; A380-S383 WeakPolarHBondContact O-CB 3.46Å; A380-S383 PolarHBondContact O-N 3.14Å; A380-S383 VanDerWaalsContact O-N 3.1Å; A380-V384 WeakPolarHBondContact O-CG2 3.3Å; A380-V384 PolarHBondContact O-N 2.88Å
381Y90.1Very high78.8Confident14 Ų1468.6 Ų68.66%0.05535%0.345CS..Hα-helixtrans-59.5-47.9174.7-67.8-0.1000110.7L40 T41 A44 Y370 A371 F377 R378 S383 V384 L385L40-Y381 HydrophobicContact CD1-CD1 4.46Å; L40-Y381 HydrophobicContact CD2-CD1 4.21Å; L40-Y381 HydrophobicContact CD2-CD2 3.98Å; L40-Y381 HydrophobicContact CD2-CG 3.79Å; L40-Y381 HydrophobicContact CG-CD1 3.85Å; L40-Y381 HydrophobicContact CG-CD2 4.46Å; L40-Y381 HydrophobicContact CG-CE1 4.32Å; L40-Y381 HydrophobicContact CG-CG 3.95Å; T41-Y381 WeakPolarHBondContact CB-OH 3.37Å; T41-Y381 WeakPolarHBondContact CG2-OH 3.2Å; T41-Y381 PolarHBondContact OG1-OH 2.96Å; A44-Y381 HydrophobicContact CB-CD1 3.68Å; A44-Y381 HydrophobicContact CB-CE1 3.71Å; Y370-Y381 WeakPolarHBondContact CB-OH 3.44Å; A371-Y381 HydrophobicContact CB-CD2 3.92Å; A371-Y381 HydrophobicContact CB-CE2 3.9Å; F377-Y381 HydrophobicContact CB-CE1 4.24Å; F377-Y381 AromaticContact CD1-CE1 3.81Å; F377-Y381 HydrophobicContact CD1-CE1 3.81Å; F377-Y381 AromaticContact CD1-CZ 3.97Å; F377-Y381 VanDerWaalsContact O-CD1 3.26Å; F377-Y381 WeakPolarHBondContact O-CD1 3.46Å; F377-Y381 VanDerWaalsContact O-CG 3.27Å; F377-Y381 PolarHBondContact O-N 3.05Å; R378-Y381 PolarHBondContact O-N 3.26Å; Y381-S383 VanDerWaalsContact C-N 3.27Å; Y381-S383 PolarHBondContact O-N 3.3Å; Y381-V384 PolarHBondContact O-N 3.08Å; Y381-L385 WeakPolarHBondContact O-CB 3.43Å; Y381-L385 VanDerWaalsContact O-CG 3.31Å; Y381-L385 WeakPolarHBondContact O-CG 3.3Å; Y381-L385 PolarHBondContact O-N 2.91Å
382A87.5Confident77.6Confident40 Ų4072.1 Ų72.133%0.33135%0.354SS..Hα-helixtrans-59.9-38.4174.900000112R378 A380 K386R378-A382 WeakPolarHBondContact O-CB 3.5Å; R378-A382 PolarHBondContact O-N 3.43Å; A380-A382 PolarHBondContact O-N 3.03Å; A382-K386 WeakPolarHBondContact O-CB 3.38Å; A382-K386 WeakPolarHBondContact O-CG 3.43Å; A382-K386 PolarHBondContact O-N 3.22Å
383S85.9Confident76.4Confident26 Ų2678 Ų7818%0.18236%0.363CS..Hα-helixtrans-66.1-44.5175.6-1780000112.2Q379 A380 Y381 R387Q379-S383 WeakPolarHBondContact O-CB 3.49Å; Q379-S383 PolarHBondContact O-N 3.4Å; A380-S383 WeakPolarHBondContact O-CB 3.46Å; A380-S383 PolarHBondContact O-N 3.14Å; A380-S383 VanDerWaalsContact O-N 3.1Å; Y381-S383 VanDerWaalsContact C-N 3.27Å; Y381-S383 PolarHBondContact O-N 3.3Å; S383-R387 VanDerWaalsContact O-CB 3.24Å; S383-R387 WeakPolarHBondContact O-CB 3.32Å; S383-R387 PolarHBondContact O-N 3.42Å
384V86.8Confident75.5Confident19 Ų1982 Ų8212%0.11538%0.375CS..Hα-helixtrans-63.4-47179.4173.80000110.1L40 L43 A44 I47 A380 Y381 G388L40-V384 HydrophobicContact CD1-CB 3.94Å; L40-V384 HydrophobicContact CD1-CG1 3.71Å; L43-V384 HydrophobicContact CB-CG1 4.31Å; L43-V384 HydrophobicContact CD1-CG1 4.46Å; A44-V384 HydrophobicContact CB-CG2 4.36Å; I47-V384 HydrophobicContact CD1-CG1 4.33Å; I47-V384 HydrophobicContact CD1-CG2 3.85Å; A380-V384 WeakPolarHBondContact O-CG2 3.3Å; A380-V384 PolarHBondContact O-N 2.88Å; Y381-V384 PolarHBondContact O-N 3.08Å; V384-G388 PolarHBondContact O-N 3Å
385L86.8Confident74.2Confident129 Ų12985.7 Ų85.768%0.67540%0.395SS*.Hα-helixtrans-65.1-41.8179-68.2170.6000112.6L40 Y381L40-L385 HydrophobicContact CD1-CD2 4.43Å; L40-L385 HydrophobicContact CD1-CG 4.29Å; L40-L385 HydrophobicContact CD2-CD1 4.39Å; Y381-L385 WeakPolarHBondContact O-CB 3.43Å; Y381-L385 VanDerWaalsContact O-CG 3.31Å; Y381-L385 WeakPolarHBondContact O-CG 3.3Å; Y381-L385 PolarHBondContact O-N 2.91Å
386K83.1Confident72.3Confident182 Ų18292.5 Ų92.579%0.79143%0.43SS*.Hα-helixtrans-76.5-32.4-179-72.4-179.2179.2-1700114A382A382-K386 WeakPolarHBondContact O-CB 3.38Å; A382-K386 WeakPolarHBondContact O-CG 3.43Å; A382-K386 PolarHBondContact O-N 3.22Å
387R69.9Low71.8Confident120 Ų12092 Ų9245%0.45343%0.428SS..Hα-helixtrans-97.2-8.1-173-68.6179.8171.2169.3-2.4114S383 W390 S391S383-R387 VanDerWaalsContact O-CB 3.24Å; S383-R387 WeakPolarHBondContact O-CB 3.32Å; S383-R387 PolarHBondContact O-N 3.42Å; R387-W390 WeakPolarHBondContact O-CB 3.16Å; R387-W390 PolarHBondContact O-N 3.22Å; R387-S391 WeakPolarHBondContact CB-OG 3.47Å
388G66.8Low71.1Confident31 Ų3196.8 Ų96.832%0.3245%0.45SS..G310 helixtrans45.1-136.8170.300000113.6V384 W390 S391V384-G388 PolarHBondContact O-N 3Å; G388-W390 PolarHBondContact O-N 3.28Å; G388-W390 VanDerWaalsContact O-N 3.1Å; G388-S391 WeakPolarHBondContact O-CB 3.29Å; G388-S391 PolarHBondContact O-N 3.45Å; G388-S391 VanDerWaalsContact O-N 3.11Å; G388-S391 PolarHBondContact O-OG 3.3Å
389P57.8Low70.3Confident104 Ų10495.1 Ų95.168%0.67545%0.448SS*.G310 helixtrans-56.6-26.2-179.8-22.731.2000114.7S391 F392P389-S391 PolarHBondContact O-N 2.87Å; P389-F392 PolarHBondContact O-N 3.16Å; P389-F392 VanDerWaalsContact O-N 3.15Å
390W58.1Low69.3Low175 Ų17593.5 Ų93.566%0.66344%0.441SS*.G310 helixtrans-69.6-16.9-179.3-58.486.6000113.4R387 G388 F392R387-W390 WeakPolarHBondContact O-CB 3.16Å; R387-W390 PolarHBondContact O-N 3.22Å; G388-W390 PolarHBondContact O-N 3.28Å; G388-W390 VanDerWaalsContact O-N 3.1Å; W390-F392 VanDerWaalsContact C-N 3.27Å; W390-F392 PolarHBondContact O-N 3.22Å
391S57.5Low68.2Low2 Ų299.2 Ų99.21%0.01447%0.467CS..G310 helixtrans-66.7-29.5172.3-60.90000112.6R387 G388 P389 R394R387-S391 WeakPolarHBondContact CB-OG 3.47Å; G388-S391 WeakPolarHBondContact O-CB 3.29Å; G388-S391 PolarHBondContact O-N 3.45Å; G388-S391 VanDerWaalsContact O-N 3.11Å; G388-S391 PolarHBondContact O-OG 3.3Å; P389-S391 PolarHBondContact O-N 2.87Å; S391-R394 PolarHBondContact O-N 2.91Å
392F57.9Low66.7Low110 Ų110104.9 Ų104.948%0.48250%0.495SS..G310 helixtrans-77.3-24.1-178.5-69.7-83.9000113.2L43 P389 W390 R394 L395L43-F392 HydrophobicContact CD2-CE1 4.32Å; L43-F392 HydrophobicContact CD2-CZ 3.98Å; P389-F392 PolarHBondContact O-N 3.16Å; P389-F392 VanDerWaalsContact O-N 3.15Å; W390-F392 VanDerWaalsContact C-N 3.27Å; W390-F392 PolarHBondContact O-N 3.22Å; F392-R394 PolarHBondContact O-N 3.23Å; F392-L395 PolarHBondContact O-N 3.34Å; F392-L395 VanDerWaalsContact O-N 3.09Å
393R56Low65.3Low187 Ų187109.5 Ų109.571%0.70651%0.507SS*.G310 helixtrans-62.6-13.5173.2-74.2-170.1-174.3-153.82113.9
394R54.1Low63.7Low128 Ų128115.9 Ų115.948%0.48353%0.532SS..G310 helixtrans-89.7-5.4178.3-128.7-175.9-66.1-140-6.7113.9R49 S391 F392R49-R394 PolarHBondContact NH2-O 3.37Å; S391-R394 PolarHBondContact O-N 2.91Å; F392-R394 PolarHBondContact O-N 3.23Å
395L52.3Low61.8Low84 Ų84124 Ų12444%0.4457%0.566SS.*  trans-89.8-16.6175.4-99.7106.5000113.4V46 I47 F392V46-L395 HydrophobicContact CG1-CD1 4.23Å; V46-L395 HydrophobicContact CG1-CD2 4Å; I47-L395 HydrophobicContact CG1-CD1 4.23Å; F392-L395 PolarHBondContact O-N 3.34Å; F392-L395 VanDerWaalsContact O-N 3.09Å
396H40.6Very low59.5Low236 Ų236123.5 Ų123.5100%1.09356%0.556SS**  trans-86.90172.4-106.3-82000111.9

Retrieved 396 of 396 residues in 929.2 ms (Link to these results)

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