A0A096LS18_POEFO Loading...

Progestin and adipoQ receptor family member Va

AlphaFold DB , UniProt , Accession A0A096LS18, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 358 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
1M45.1Very low73.2Confident222 Ų222119.9 Ų119.9100%1.09460%0.599SS**  0-210-87.6-171.6179.100114.8S3M1-S3 PolarHBondContact O-N 3.46Å
2L50.8Low75.1Confident165 Ų165114.1 Ų114.186%0.86458%0.578SS**G310 helixtrans-77.7-9.2178.4-81.4150.1000115.6L4L2-L4 PolarHBondContact O-N 3.47Å
3S54.3Low76.6Confident120 Ų120108.2 Ų108.284%0.83955%0.548SS*.G310 helixtrans-86.53.2-175.376.30000115.4M1M1-S3 PolarHBondContact O-N 3.46Å
4L62.4Low77.9Confident153 Ų153111.3 Ų111.380%0.80157%0.567SS**G310 helixtrans-99-11.6-179.5-74.5166.6000113.6L2 K6L2-L4 PolarHBondContact O-N 3.47Å; L4-K6 PolarHBondContact O-N 3.35Å
5I68.5Low79Confident87 Ų87110.3 Ų110.345%0.44656%0.559SS.*  trans-90.299.8178.9-57.1176.8000108.3F7 L41I5-F7 HydrophobicContact CG2-CD1 4.44Å; I5-F7 HydrophobicContact CG2-CE1 4.11Å; I5-F7 HydrophobicContact CG2-CE2 4.24Å; I5-F7 HydrophobicContact CG2-CZ 4Å; I5-F7 PolarHBondContact O-N 3.34Å; I5-L41 HydrophobicContact CG2-CD2 4.2Å
6K77.4Confident79.8Confident196 Ų196104 Ų10485%0.85253%0.528SS*.  trans-83.7102.9174.4-165.1176-175.4177.30108.9L4L4-K6 PolarHBondContact O-N 3.35Å
7F82.5Confident80.3Confident87 Ų87101.9 Ų101.938%0.38252%0.523SS..PPolyproline II helixtrans-66.3142.3176.5-72.1-72000111.7I5 L41 F44 Q45I5-F7 HydrophobicContact CG2-CD1 4.44Å; I5-F7 HydrophobicContact CG2-CE1 4.11Å; I5-F7 HydrophobicContact CG2-CE2 4.24Å; I5-F7 HydrophobicContact CG2-CZ 4Å; I5-F7 PolarHBondContact O-N 3.34Å; F7-L41 WeakPolarHBondContact CE1-O 3.13Å; F7-F44 HydrophobicContact CE1-CB 4.05Å; F7-F44 HydrophobicContact CZ-CB 4.15Å; F7-Q45 HydrophobicContact CB-CG 4.38Å; F7-Q45 HydrophobicContact CD1-CB 3.81Å; F7-Q45 HydrophobicContact CD1-CG 4.36Å; F7-Q45 HydrophobicContact CE1-CB 4.22Å; F7-Q45 HydrophobicContact CG-CB 4.36Å; F7-Q45 HydrophobicContact CG-CG 4.45Å
8P83.6Confident80.6Confident33 Ų33105.9 Ų105.921%0.21454%0.536CS..PPolyproline II helixtrans-57150173.7-24.533.9000112.3D38 Q45P8-D38 HydrophobicContact CG-CB 4.13Å; P8-Q45 PolarHBondContact O-NE2 3.19Å; P8-Q45 PolarHBondContact O-OE1 2.87Å
9R90.4Very high80.7Confident173 Ų173102.1 Ų102.165%0.65352%0.518SS*.PPolyproline II helixtrans-65.7138.9172.7175.9178178.4-179.34.9110.3F11R9-F11 HydrophobicContact CG-CZ 4.43Å; R9-F11 WeakPolarHBondContact O-CD2 3.34Å; R9-F11 WeakPolarHBondContact O-CE2 3.5Å
10V94.3Very high81Confident45 Ų4597.4 Ų97.427%0.27349%0.494SS..PPolyproline II helixtrans-91.3154.6167.8-66.90000111.6Y29 T47V10-Y29 CarbonylContact C-O 3.01Å; V10-Y29 WeakPolarHBondContact CA-O 3.08Å; V10-T47 HydrophobicContact CG1-CG2 4.07Å
11F96.1Very high81.4Confident38 Ų3895 Ų9517%0.16748%0.481CS..BIsolated β-bridgetrans-123.2155.7-169.5-65-91.1000111.9R9 Q15 V16 G28 Y29 H31R9-F11 HydrophobicContact CG-CZ 4.43Å; R9-F11 WeakPolarHBondContact O-CD2 3.34Å; R9-F11 WeakPolarHBondContact O-CE2 3.5Å; F11-Q15 HydrophobicContact CB-CB 4.17Å; F11-Q15 HydrophobicContact CD1-CB 3.89Å; F11-V16 HydrophobicContact CB-CG1 3.91Å; F11-V16 HydrophobicContact CG-CG1 4.46Å; F11-G28 PolarHBondContact O-N 3.04Å; F11-Y29 PolarHBondContact N-O 3.27Å; F11-Y29 PolarHBondContact O-N 2.81Å; F11-H31 HydrophobicContact CD2-CB 4.48Å; F11-H31 HydrophobicContact CE2-CB 3.76Å; F11-H31 AromaticContact CE2-CD2 3.82Å; F11-H31 HydrophobicContact CZ-CB 4.41Å; F11-H31 AromaticContact CZ-CD2 3.61Å
12S96Very high83.5Confident50 Ų5087.9 Ų87.935%0.3545%0.445SS..  trans-89.3160.5167.4-55.60000111N14 Q15 I26S12-N14 PolarHBondContact O-N 3.29Å; S12-N14 VanDerWaalsContact O-N 3.12Å; S12-Q15 WeakPolarHBondContact O-CB 3.38Å; S12-Q15 PolarHBondContact O-N 3.12Å; S12-I26 CarbonylContact C-O 3.55Å; S12-I26 VanDerWaalsContact CA-O 3.31Å; S12-I26 WeakPolarHBondContact CA-O 3.47Å
13I94.4Very high85.2Confident37 Ų3783.7 Ų83.719%0.1942%0.423CS..G310 helixtrans-51.3-38.8-178.3-168.3174.5000112.8Q15 V16 H21 I26 Y29I13-Q15 PolarHBondContact O-N 3.15Å; I13-V16 WeakPolarHBondContact O-CG2 3.4Å; I13-V16 PolarHBondContact O-N 3.16Å; I13-H21 HydrophobicContact CD1-CB 4.25Å; I13-H21 HydrophobicContact CG1-CB 4.35Å; I13-H21 PolarHBondContact O-NE2 2.64Å; I13-I26 HydrophobicContact CG2-CG2 4.22Å; I13-I26 PolarHBondContact N-O 3.27Å; I13-Y29 HydrophobicContact CB-CE2 3.84Å; I13-Y29 HydrophobicContact CG1-CE2 4.28Å
14N94.4Very high87Confident152 Ų15279.6 Ų79.681%0.81340%0.395SS*.G310 helixtrans-68.6-14.3179.5-63.8-29.1000113.9S12S12-N14 PolarHBondContact O-N 3.29Å; S12-N14 VanDerWaalsContact O-N 3.12Å
15Q94.6Very high88.6Confident96 Ų9672.6 Ų72.645%0.44936%0.358SS..G310 helixtrans-100-6.8-178.1-58.2176-45.200112.7F11 S12 I13F11-Q15 HydrophobicContact CB-CB 4.17Å; F11-Q15 HydrophobicContact CD1-CB 3.89Å; S12-Q15 WeakPolarHBondContact O-CB 3.38Å; S12-Q15 PolarHBondContact O-N 3.12Å; I13-Q15 PolarHBondContact O-N 3.15Å
16V92.4Very high90Very high10 Ų1072.1 Ų72.16%0.06136%0.355CS..SBendtrans-114.6148.2179.3-66.10000111.2F11 I13 H21 Y29 P32F11-V16 HydrophobicContact CB-CG1 3.91Å; F11-V16 HydrophobicContact CG-CG1 4.46Å; I13-V16 WeakPolarHBondContact O-CG2 3.4Å; I13-V16 PolarHBondContact O-N 3.16Å; V16-H21 PolarHBondContact O-NE2 3.22Å; V16-Y29 HydrophobicContact CG1-CG 4.47Å; V16-Y29 HydrophobicContact CG2-CD1 4.06Å; V16-Y29 HydrophobicContact CG2-CD2 4.25Å; V16-Y29 HydrophobicContact CG2-CE1 4.48Å; V16-Y29 HydrophobicContact CG2-CG 3.92Å; V16-P32 HydrophobicContact CB-CG 4.11Å; V16-P32 HydrophobicContact CG1-CG 3.87Å
17P88.3Confident90.9Very high68 Ų6864.1 Ų64.144%0.44232%0.324SS..  trans-62.2149.3177.1-22.132000112.6V19 Y20 H21 P32P17-V19 HydrophobicContact CB-CG1 4.33Å; P17-V19 PolarHBondContact O-N 3.3Å; P17-Y20 HydrophobicContact CB-CD2 4.13Å; P17-Y20 HydrophobicContact CG-CD2 4.22Å; P17-Y20 HydrophobicContact CG-CE2 4.37Å; P17-Y20 PolarHBondContact O-N 2.75Å; P17-H21 PolarHBondContact O-CD2 3.35Å; P17-P32 HydrophobicContact CG-CB 4.39Å; P17-P32 HydrophobicContact CG-CG 4.29Å
18K85.1Confident91.5Very high175 Ų17560 Ų6076%0.76131%0.307SS*.G310 helixtrans-52.7-26.8-178.2-68.5-172.5177.3-175.30115.5Y20 H21K18-Y20 PolarHBondContact O-N 2.82Å; K18-H21 PolarHBondContact O-N 2.79Å
19V82.6Confident92.2Very high33 Ų3358.8 Ų58.820%0.230%0.298CS..G310 helixtrans-65.7-19.517870.50000113.1P17 R113P17-V19 HydrophobicContact CB-CG1 4.33Å; P17-V19 PolarHBondContact O-N 3.3Å; V19-R113 PolarHBondContact O-NE 2.6Å; V19-R113 PolarHBondContact O-NH2 2.72Å
20Y86.8Confident92.4Very high7 Ų751.2 Ų51.23%0.02727%0.269CS..G310 helixtrans-100.1-5.9177.9-62.8-83.6000113.4P17 K18 E22 Y29 P32 S106 P110P17-Y20 HydrophobicContact CB-CD2 4.13Å; P17-Y20 HydrophobicContact CG-CD2 4.22Å; P17-Y20 HydrophobicContact CG-CE2 4.37Å; P17-Y20 PolarHBondContact O-N 2.75Å; K18-Y20 PolarHBondContact O-N 2.82Å; Y20-E22 PolarHBondContact O-N 2.64Å; Y20-Y29 WeakPolarHBondContact O-CE1 3.47Å; Y20-P32 HydrophobicContact CD2-CB 4.03Å; Y20-P32 HydrophobicContact CD2-CG 4.25Å; Y20-P32 HydrophobicContact CE2-CB 3.55Å; Y20-P32 HydrophobicContact CE2-CG 4.27Å; Y20-P32 PolarHBondContact OH-O 3.29Å; Y20-S106 WeakPolarHBondContact CE1-O 3.32Å; Y20-P110 HydrophobicContact CE2-CG 4.37Å; Y20-P110 VanDerWaalsContact OH-CD 3.26Å; Y20-P110 WeakPolarHBondContact OH-CD 3.46Å; Y20-P110 VanDerWaalsContact OH-N 3.15Å
21H89.4Confident92.4Very high48 Ų4853 Ų5322%0.22228%0.275CS..PPolyproline II helixtrans-68.7128.8-177.2-68.1-171.9000110.1I13 V16 P17 K18I13-H21 HydrophobicContact CD1-CB 4.25Å; I13-H21 HydrophobicContact CG1-CB 4.35Å; I13-H21 PolarHBondContact O-NE2 2.64Å; V16-H21 PolarHBondContact O-NE2 3.22Å; P17-H21 PolarHBondContact O-CD2 3.35Å; K18-H21 PolarHBondContact O-N 2.79Å
22E88.9Confident92Very high73 Ų7352 Ų5234%0.34127%0.271SS..PPolyproline II helixtrans-102.8137.6167-60.3-56.8148.800108.5Y20 S24 I25 Y29 R113Y20-E22 PolarHBondContact O-N 2.64Å; E22-S24 PolarHBondContact O-N 3.3Å; E22-I25 HydrophobicContact CB-CB 4.04Å; E22-I25 HydrophobicContact CB-CG1 3.86Å; E22-I25 PolarHBondContact O-N 2.88Å; E22-Y29 PolarHBondContact N-OH 2.64Å; E22-Y29 PolarHBondContact O-OH 2.81Å; E22-R113 IonicContact OE1-CZ 2.67Å; E22-R113 IonicContact OE1-NH2 3.54Å; E22-R113 PolarHBondContact OE1-NH2 2.74Å
23D87Confident91.8Very high77 Ų7758.9 Ų58.941%0.41229%0.29SS..THydrogen-bonded Turntrans-64.3135.8-175.9-72.5-12.3000110.1I25 R252D23-I25 PolarHBondContact O-N 3.49Å; D23-I25 VanDerWaalsContact O-N 3.15Å; D23-R252 IonicContact OD2-CZ 2.73Å; D23-R252 IonicContact OD2-NH1 3.71Å; D23-R252 PolarHBondContact OD2-NH1 2.97Å; D23-R252 IonicContact OD2-NH2 3.53Å; D23-R252 PolarHBondContact OD2-NH2 3.45Å
24S92.7Very high91.8Very high34 Ų3457.6 Ų57.624%0.23828%0.284CS..THydrogen-bonded Turntrans644.6-177.5-65.10000117.1E22 E255 P259 G260E22-S24 PolarHBondContact O-N 3.3Å; S24-E255 WeakPolarHBondContact CB-O 3.49Å; S24-E255 PolarHBondContact OG-O 3.02Å; S24-P259 WeakPolarHBondContact O-CA 3.32Å; S24-G260 PolarHBondContact O-N 3.14Å
25I96.3Very high91.8Very high5 Ų552.5 Ų52.53%0.02626%0.26CS..  trans-100.2117.7174.7-54.8-61000110.2E22 D23 Y29 N48 E255 D263 H267E22-I25 HydrophobicContact CB-CB 4.04Å; E22-I25 HydrophobicContact CB-CG1 3.86Å; E22-I25 PolarHBondContact O-N 2.88Å; D23-I25 PolarHBondContact O-N 3.49Å; D23-I25 VanDerWaalsContact O-N 3.15Å; I25-Y29 HydrophobicContact CG2-CE2 4.04Å; I25-Y29 WeakPolarHBondContact O-CE2 3.36Å; I25-Y29 PolarHBondContact O-OH 3.15Å; I25-N48 HydrophobicContact CG2-CB 3.99Å; I25-E255 HydrophobicContact CD1-CB 4.47Å; I25-E255 HydrophobicContact CD1-CG 4.44Å; I25-D263 VanDerWaalsContact CA-OD1 3.28Å; I25-D263 WeakPolarHBondContact CA-OD1 3.14Å; I25-D263 HydrophobicContact CG2-CB 4.44Å; I25-H267 HydrophobicContact CD1-CB 3.9Å
26I96.7Very high91.7Very high77 Ų7750 Ų5040%0.39526%0.256SS..  trans-100.9-29.2-169.8-55.2-177.3000112.4S12 I13 P259 D263S12-I26 CarbonylContact C-O 3.55Å; S12-I26 VanDerWaalsContact CA-O 3.31Å; S12-I26 WeakPolarHBondContact CA-O 3.47Å; I13-I26 HydrophobicContact CG2-CG2 4.22Å; I13-I26 PolarHBondContact N-O 3.27Å; I26-P259 HydrophobicContact CD1-CB 4.28Å; I26-D263 PolarHBondContact N-OD1 2.95Å; I26-D263 PolarHBondContact N-OD2 3.4Å
27S96.8Very high91.8Very high28 Ų2854 Ų5420%0.19628%0.28CS..SBendtrans-141.7176.8-173.673.50000113.1D263 Y264S27-D263 WeakPolarHBondContact CA-OD2 3.32Å; S27-D263 WeakPolarHBondContact CB-OD2 3.35Å; S27-D263 PolarHBondContact N-OD2 3.42Å; S27-D263 PolarHBondContact OG-OD2 3.07Å; S27-Y264 WeakPolarHBondContact OG-CE2 3.42Å
28G95.6Very high92Very high1 Ų153.4 Ų53.41%0.0127%0.274CS..  trans87.16.3178.300000114.9F11 T47 N48 Y264F11-G28 PolarHBondContact O-N 3.04Å; G28-T47 WeakPolarHBondContact O-CA 3.49Å; G28-T47 WeakPolarHBondContact O-CB 3.16Å; G28-N48 PolarHBondContact O-N 3.01Å; G28-N48 PolarHBondContact O-OD1 3.46Å; G28-Y264 WeakPolarHBondContact CA-OH 3.3Å; G28-Y264 PolarHBondContact N-OH 2.9Å
29Y96.9Very high92.5Very high8 Ų845 Ų453%0.03124%0.237CC..BIsolated β-bridgetrans-70.6142.1-178.9-67.7-87.6000112.1V10 F11 I13 V16 Y20 E22 I25V10-Y29 CarbonylContact C-O 3.01Å; V10-Y29 WeakPolarHBondContact CA-O 3.08Å; F11-Y29 PolarHBondContact N-O 3.27Å; F11-Y29 PolarHBondContact O-N 2.81Å; I13-Y29 HydrophobicContact CB-CE2 3.84Å; I13-Y29 HydrophobicContact CG1-CE2 4.28Å; V16-Y29 HydrophobicContact CG1-CG 4.47Å; V16-Y29 HydrophobicContact CG2-CD1 4.06Å; V16-Y29 HydrophobicContact CG2-CD2 4.25Å; V16-Y29 HydrophobicContact CG2-CE1 4.48Å; V16-Y29 HydrophobicContact CG2-CG 3.92Å; Y20-Y29 WeakPolarHBondContact O-CE1 3.47Å; E22-Y29 PolarHBondContact N-OH 2.64Å; E22-Y29 PolarHBondContact O-OH 2.81Å; I25-Y29 HydrophobicContact CG2-CE2 4.04Å; I25-Y29 WeakPolarHBondContact O-CE2 3.36Å; I25-Y29 PolarHBondContact O-OH 3.15Å
30R95.8Very high93.1Very high13 Ų1347.4 Ų47.45%0.04925%0.248CC..PPolyproline II helixtrans-87.2160.8172.3-67.4171.7-70.7156.36.3111.2P32 S42 T47 E49 H103 T104 T107R30-P32 WeakPolarHBondContact O-CD 3.48Å; R30-S42 VanDerWaalsContact CD-OG 3.32Å; R30-S42 WeakPolarHBondContact CD-OG 3.42Å; R30-S42 PolarHBondContact NH1-OG 3.34Å; R30-S42 VanDerWaalsContact NH1-OG 3.08Å; R30-T47 HydrophobicContact CG-CG2 3.74Å; R30-E49 VanDerWaalsContact NH2-CB 3.32Å; R30-E49 VanDerWaalsContact NH2-CG 3.33Å; R30-H103 PolarHBondContact NH2-O 3.13Å; R30-T104 PolarHBondContact NH1-O 2.93Å; R30-T107 HydrophobicContact CB-CG2 3.79Å
31H93.6Very high93.4Very high84 Ų8450.1 Ų50.139%0.38926%0.262SS..PPolyproline II helixtrans-62.6129.3-177.3-170-102.7000111.5F11 R33 S34 T107F11-H31 HydrophobicContact CD2-CB 4.48Å; F11-H31 HydrophobicContact CE2-CB 3.76Å; F11-H31 AromaticContact CE2-CD2 3.82Å; F11-H31 HydrophobicContact CZ-CB 4.41Å; F11-H31 AromaticContact CZ-CD2 3.61Å; H31-R33 PolarHBondContact ND1-N 3.31Å; H31-R33 PolarHBondContact O-N 2.9Å; H31-S34 PolarHBondContact O-N 3.44Å; H31-S34 VanDerWaalsContact O-N 3.12Å; H31-S34 PolarHBondContact O-OG 2.98Å; H31-T107 VanDerWaalsContact O-O 3.11Å
32P87.9Confident93.6Very high15 Ų1547.9 Ų47.910%0.09725%0.253CS..THydrogen-bonded Turntrans-62.81.4-177.2-29.337.4000118.1V16 P17 Y20 R30 T107V16-P32 HydrophobicContact CB-CG 4.11Å; V16-P32 HydrophobicContact CG1-CG 3.87Å; P17-P32 HydrophobicContact CG-CB 4.39Å; P17-P32 HydrophobicContact CG-CG 4.29Å; Y20-P32 HydrophobicContact CD2-CB 4.03Å; Y20-P32 HydrophobicContact CD2-CG 4.25Å; Y20-P32 HydrophobicContact CE2-CB 3.55Å; Y20-P32 HydrophobicContact CE2-CG 4.27Å; Y20-P32 PolarHBondContact OH-O 3.29Å; R30-P32 WeakPolarHBondContact O-CD 3.48Å; P32-T107 CarbonylContact C-O 3.49Å
33R92.1Very high93.8Very high196 Ų19645.9 Ų45.974%0.7424%0.244SC*.THydrogen-bonded Turntrans-141.943.2178.5-61.4-176.7179.8165.7-0.5109.9H31 T107 M108H31-R33 PolarHBondContact ND1-N 3.31Å; H31-R33 PolarHBondContact O-N 2.9Å; R33-T107 PolarHBondContact N-O 3Å; R33-M108 WeakPolarHBondContact CA-O 3.16Å
34S93.2Very high94.1Very high10 Ų1048.8 Ų48.87%0.0725%0.253CS..  trans-64.4140.4178.9-67.80000109.8H31 T107 M108H31-S34 PolarHBondContact O-N 3.44Å; H31-S34 VanDerWaalsContact O-N 3.12Å; H31-S34 PolarHBondContact O-OG 2.98Å; S34-T107 PolarHBondContact N-O 2.64Å; S34-T107 VanDerWaalsContact N-O 3.07Å; S34-M108 WeakPolarHBondContact O-CA 3.47Å
35S94.3Very high94.2Very high45 Ų4548.7 Ų48.732%0.31525%0.249SC..  trans-67.9161.8167.966.60000110.2T37 D38 C39S35-T37 PolarHBondContact O-N 3.31Å; S35-T37 PolarHBondContact OG-OG1 3.38Å; S35-D38 WeakPolarHBondContact CB-OD2 3.24Å; S35-D38 PolarHBondContact N-OD2 3.3Å; S35-D38 WeakPolarHBondContact O-CB 3.32Å; S35-D38 PolarHBondContact O-N 3.3Å; S35-D38 PolarHBondContact OG-N 2.87Å; S35-D38 VanDerWaalsContact OG-N 3.07Å; S35-D38 PolarHBondContact OG-OD2 2.9Å; S35-C39 PolarHBondContact O-N 3.31Å; S35-C39 PolarHBondContact O-SG 3.06Å; S35-C39 VanDerWaalsContact O-SG 3.4Å
36A94Very high94.1Very high43 Ų4353 Ų5336%0.35527%0.27SS..Hα-helixtrans-57.3-37.2174.900000111.6C39 I40 M108A36-C39 WeakPolarHBondContact O-CB 3.37Å; A36-C39 PolarHBondContact O-N 2.68Å; A36-I40 WeakPolarHBondContact O-CG1 3.38Å; A36-I40 PolarHBondContact O-N 3.16Å; A36-M108 HydrophobicContact CB-CE 3.9Å; A36-M108 HydrophobicContact CB-SD 4.35Å
37T93.4Very high94.1Very high93 Ų9349.3 Ų49.357%0.57125%0.251SS*.Hα-helixtrans-61.7-44.7172.227.30000112.7S35 C39 I40 L41S35-T37 PolarHBondContact O-N 3.31Å; S35-T37 PolarHBondContact OG-OG1 3.38Å; T37-C39 VanDerWaalsContact C-N 3.29Å; T37-C39 PolarHBondContact O-N 2.78Å; T37-I40 PolarHBondContact O-N 3.08Å; T37-L41 WeakPolarHBondContact O-CB 3.48Å; T37-L41 WeakPolarHBondContact O-CG 3.21Å; T37-L41 PolarHBondContact O-N 3.39Å
38D93.6Very high94.1Very high56 Ų5648.2 Ų48.230%0.29924%0.243SC..Hα-helixtrans-62.3-39.1175.6-61.6-42.6000111.3P8 S35 L41 S42P8-D38 HydrophobicContact CG-CB 4.13Å; S35-D38 WeakPolarHBondContact CB-OD2 3.24Å; S35-D38 PolarHBondContact N-OD2 3.3Å; S35-D38 WeakPolarHBondContact O-CB 3.32Å; S35-D38 PolarHBondContact O-N 3.3Å; S35-D38 PolarHBondContact OG-N 2.87Å; S35-D38 VanDerWaalsContact OG-N 3.07Å; S35-D38 PolarHBondContact OG-OD2 2.9Å; D38-L41 PolarHBondContact O-N 3.01Å; D38-S42 WeakPolarHBondContact O-CB 3.34Å; D38-S42 PolarHBondContact O-N 2.84Å
39C95Very high94.1Very high0 Ų048.6 Ų48.60%025%0.245CC..Hα-helixtrans-61.7-45175.8-65.80000111.6S35 A36 T37 S42 T104 F105 T107 M108S35-C39 PolarHBondContact O-N 3.31Å; S35-C39 PolarHBondContact O-SG 3.06Å; S35-C39 VanDerWaalsContact O-SG 3.4Å; A36-C39 WeakPolarHBondContact O-CB 3.37Å; A36-C39 PolarHBondContact O-N 2.68Å; T37-C39 VanDerWaalsContact C-N 3.29Å; T37-C39 PolarHBondContact O-N 2.78Å; C39-S42 PolarHBondContact O-N 3.04Å; C39-S42 PolarHBondContact O-OG 3.26Å; C39-T104 HydrophobicContact CB-CG2 4.16Å; C39-T104 WeakPolarHBondContact CB-O 3.43Å; C39-F105 HydrophobicContact CB-CD1 3.85Å; C39-F105 HydrophobicContact CB-CE1 4.13Å; C39-T107 PolarHBondContact SG-OG1 3.25Å; C39-M108 VanDerWaalsContact SG-CG 3.54Å
40I94.6Very high94.1Very high83 Ų8348.6 Ų48.643%0.42625%0.246SC..Hα-helixtrans-67.2-43.2177.7-66166.6000111A36 T37 S42 L43 F105A36-I40 WeakPolarHBondContact O-CG1 3.38Å; A36-I40 PolarHBondContact O-N 3.16Å; T37-I40 PolarHBondContact O-N 3.08Å; I40-S42 PolarHBondContact O-N 2.94Å; I40-L43 HydrophobicContact CG2-CD1 4.36Å; I40-L43 VanDerWaalsContact O-CB 3.24Å; I40-L43 WeakPolarHBondContact O-CB 3.44Å; I40-L43 WeakPolarHBondContact O-CD1 3.35Å; I40-L43 WeakPolarHBondContact O-CG 3.31Å; I40-L43 PolarHBondContact O-N 3.22Å; I40-L43 VanDerWaalsContact O-N 3.15Å; I40-F105 HydrophobicContact CG1-CE1 4.27Å; I40-F105 HydrophobicContact CG1-CZ 4.35Å
41L92.9Very high94.2Very high63 Ų6350.5 Ų50.533%0.3326%0.256SS..Hα-helixtrans-62-33175.8-71.9174.3000111.7I5 F7 T37 D38 L43 F44I5-L41 HydrophobicContact CG2-CD2 4.2Å; F7-L41 WeakPolarHBondContact CE1-O 3.13Å; T37-L41 WeakPolarHBondContact O-CB 3.48Å; T37-L41 WeakPolarHBondContact O-CG 3.21Å; T37-L41 PolarHBondContact O-N 3.39Å; D38-L41 PolarHBondContact O-N 3.01Å; L41-L43 PolarHBondContact O-N 3.02Å; L41-L43 VanDerWaalsContact O-N 3.15Å; L41-F44 PolarHBondContact O-N 2.73Å; L41-F44 VanDerWaalsContact O-N 3.12Å
42S93.6Very high94.4Very high2 Ų246.8 Ų46.81%0.01424%0.239CC..G310 helixtrans-65-15.2178.479.50000114.2R30 D38 C39 I40 F44 Q45R30-S42 VanDerWaalsContact CD-OG 3.32Å; R30-S42 WeakPolarHBondContact CD-OG 3.42Å; R30-S42 PolarHBondContact NH1-OG 3.34Å; R30-S42 VanDerWaalsContact NH1-OG 3.08Å; D38-S42 WeakPolarHBondContact O-CB 3.34Å; D38-S42 PolarHBondContact O-N 2.84Å; C39-S42 PolarHBondContact O-N 3.04Å; C39-S42 PolarHBondContact O-OG 3.26Å; I40-S42 PolarHBondContact O-N 2.94Å; S42-F44 PolarHBondContact O-N 2.78Å; S42-Q45 PolarHBondContact O-N 3.29Å; S42-Q45 VanDerWaalsContact O-N 3.16Å; S42-Q45 VanDerWaalsContact O-O 3.1Å
43L93.9Very high94.9Very high31 Ų3146.1 Ų46.116%0.16224%0.235CC..G310 helixtrans-58.6-32.6171.9-62.2176.4000111.9I40 L41 I53 W54 T104I40-L43 HydrophobicContact CG2-CD1 4.36Å; I40-L43 VanDerWaalsContact O-CB 3.24Å; I40-L43 WeakPolarHBondContact O-CB 3.44Å; I40-L43 WeakPolarHBondContact O-CD1 3.35Å; I40-L43 WeakPolarHBondContact O-CG 3.31Å; I40-L43 PolarHBondContact O-N 3.22Å; I40-L43 VanDerWaalsContact O-N 3.15Å; L41-L43 PolarHBondContact O-N 3.02Å; L41-L43 VanDerWaalsContact O-N 3.15Å; L43-I53 HydrophobicContact CD2-CB 4.35Å; L43-I53 HydrophobicContact CD2-CD1 4.03Å; L43-I53 HydrophobicContact CD2-CG2 3.39Å; L43-W54 HydrophobicContact CB-CZ2 4.45Å; L43-W54 PolarHBondContact O-NE1 2.86Å; L43-T104 HydrophobicContact CD2-CG2 4.15Å
44F94.2Very high95.2Very high138 Ų13840 Ų4061%0.60521%0.212SC*.G310 helixtrans-100.710.3-177.9-53.3-76.2000112.8F7 L41 S42 W54F7-F44 HydrophobicContact CE1-CB 4.05Å; F7-F44 HydrophobicContact CZ-CB 4.15Å; L41-F44 PolarHBondContact O-N 2.73Å; L41-F44 VanDerWaalsContact O-N 3.12Å; S42-F44 PolarHBondContact O-N 2.78Å; F44-W54 HydrophobicContact CD1-CZ2 4.25Å; F44-W54 HydrophobicContact CE1-CH2 4.22Å; F44-W54 AromaticContact CE1-CZ2 3.92Å; F44-W54 HydrophobicContact CE1-CZ2 3.92Å
45Q93.3Very high95.4Very high31 Ų3140.8 Ų40.815%0.14522%0.216CC..SBendtrans-112.6141.8176.1-174.4175.411.800109.7F7 P8 S42 T47 T50F7-Q45 HydrophobicContact CB-CG 4.38Å; F7-Q45 HydrophobicContact CD1-CB 3.81Å; F7-Q45 HydrophobicContact CD1-CG 4.36Å; F7-Q45 HydrophobicContact CE1-CB 4.22Å; F7-Q45 HydrophobicContact CG-CB 4.36Å; F7-Q45 HydrophobicContact CG-CG 4.45Å; P8-Q45 PolarHBondContact O-NE2 3.19Å; P8-Q45 PolarHBondContact O-OE1 2.87Å; S42-Q45 PolarHBondContact O-N 3.29Å; S42-Q45 VanDerWaalsContact O-N 3.16Å; S42-Q45 VanDerWaalsContact O-O 3.1Å; Q45-T47 HydrophobicContact CB-CG2 4.32Å; Q45-T47 HydrophobicContact CG-CG2 4.16Å; Q45-T47 PolarHBondContact O-N 3.12Å; Q45-T50 PolarHBondContact O-OG1 2.87Å
46M95.4Very high95.6Very high96 Ų9639 Ų3947%0.47320%0.203SC..  trans-73.3116.3170.8-72.6-58.3-67.200110.6T50 Y264 I265M46-T50 HydrophobicContact SD-CG2 4.09Å; M46-Y264 HydrophobicContact CB-CD1 4.33Å; M46-I265 HydrophobicContact CE-CD1 4.12Å; M46-I265 HydrophobicContact CE-CG1 4.05Å
47T96.3Very high95.8Very high0 Ų040 Ų400%020%0.2CC..  trans-138169.817971.20000108.3V10 G28 R30 Q45 E49 T50V10-T47 HydrophobicContact CG1-CG2 4.07Å; G28-T47 WeakPolarHBondContact O-CA 3.49Å; G28-T47 WeakPolarHBondContact O-CB 3.16Å; R30-T47 HydrophobicContact CG-CG2 3.74Å; Q45-T47 HydrophobicContact CB-CG2 4.32Å; Q45-T47 HydrophobicContact CG-CG2 4.16Å; Q45-T47 PolarHBondContact O-N 3.12Å; T47-E49 PolarHBondContact O-N 2.82Å; T47-E49 PolarHBondContact OG1-N 3.03Å; T47-T50 PolarHBondContact N-OG1 3.34Å; T47-T50 PolarHBondContact O-N 3.26Å; T47-T50 PolarHBondContact O-OG1 2.73Å; T47-T50 PolarHBondContact OG1-N 3.44Å; T47-T50 PolarHBondContact OG1-OG1 3.14Å
48N96.2Very high96Very high5 Ų540.6 Ų40.63%0.02720%0.198CC..THydrogen-bonded Turntrans-64.8-9.1174.871.4-43.8000113.6I25 G28 N52 D263 H267I25-N48 HydrophobicContact CG2-CB 3.99Å; G28-N48 PolarHBondContact O-N 3.01Å; G28-N48 PolarHBondContact O-OD1 3.46Å; N48-N52 PolarHBondContact O-ND2 3.43Å; N48-D263 WeakPolarHBondContact CA-O 3.09Å; N48-D263 WeakPolarHBondContact CB-O 3.32Å; N48-H267 PolarHBondContact O-NE2 3.45Å
49E97Very high96.2Very high9 Ų939 Ų394%0.04219%0.191CC..THydrogen-bonded Turntrans-111-9.2-176-66.5-78.6-162.400112.7R30 T47 L51 N52 I53 H103R30-E49 VanDerWaalsContact NH2-CB 3.32Å; R30-E49 VanDerWaalsContact NH2-CG 3.33Å; T47-E49 PolarHBondContact O-N 2.82Å; T47-E49 PolarHBondContact OG1-N 3.03Å; E49-L51 PolarHBondContact O-N 3.4Å; E49-N52 WeakPolarHBondContact O-CB 3.37Å; E49-N52 PolarHBondContact O-N 3.12Å; E49-N52 VanDerWaalsContact O-N 3.11Å; E49-N52 PolarHBondContact OE2-ND2 3.15Å; E49-I53 HydrophobicContact CB-CD1 4.3Å; E49-I53 WeakPolarHBondContact O-CD1 3.43Å; E49-I53 VanDerWaalsContact O-CG1 3.25Å; E49-I53 WeakPolarHBondContact O-CG1 3.5Å; E49-I53 PolarHBondContact O-N 3.25Å; E49-H103 IonicContact OE1-ND1 2.64Å; E49-H103 IonicContact OE2-CE1 3.89Å; E49-H103 IonicContact OE2-CG 3.14Å; E49-H103 IonicContact OE2-ND1 3.61Å; E49-H103 PolarHBondContact OE2-ND1 3.32Å
50T96.8Very high96.4Very high8 Ų839.2 Ų39.25%0.04919%0.193CC..Hα-helixtrans-58.7-50.2-172-560000111.4Q45 M46 T47 I53 W54Q45-T50 PolarHBondContact O-OG1 2.87Å; M46-T50 HydrophobicContact SD-CG2 4.09Å; T47-T50 PolarHBondContact N-OG1 3.34Å; T47-T50 PolarHBondContact O-N 3.26Å; T47-T50 PolarHBondContact O-OG1 2.73Å; T47-T50 PolarHBondContact OG1-N 3.44Å; T47-T50 PolarHBondContact OG1-OG1 3.14Å; T50-I53 PolarHBondContact O-N 3.48Å; T50-W54 PolarHBondContact O-N 3.15Å
51L97.3Very high96.5Very high53 Ų5341.5 Ų41.528%0.27720%0.196SC..Hα-helixtrans-71.6-32.2177.5-67.9-178.4000112.3E49 I53 W54 T55 I265 Q270E49-L51 PolarHBondContact O-N 3.4Å; L51-I53 PolarHBondContact O-N 3.43Å; L51-W54 PolarHBondContact O-N 3.36Å; L51-T55 VanDerWaalsContact O-CB 3.22Å; L51-T55 WeakPolarHBondContact O-CB 3.23Å; L51-T55 WeakPolarHBondContact O-CG2 3.28Å; L51-T55 PolarHBondContact O-N 3.22Å; L51-T55 PolarHBondContact O-OG1 3.2Å; L51-I265 HydrophobicContact CD1-CB 4.12Å; L51-I265 HydrophobicContact CD1-CG1 3.86Å; L51-I265 HydrophobicContact CD1-CG2 3.87Å; L51-Q270 HydrophobicContact CB-CG 3.78Å; L51-Q270 VanDerWaalsContact CD1-OE1 3.29Å
52N97.4Very high96.8Very high5 Ų542 Ų423%0.02719%0.194CC..Hα-helixtrans-58-38.4173.1-61.5-28.5000111.1N48 E49 T55 H103 H267 Q270 H273N48-N52 PolarHBondContact O-ND2 3.43Å; E49-N52 WeakPolarHBondContact O-CB 3.37Å; E49-N52 PolarHBondContact O-N 3.12Å; E49-N52 VanDerWaalsContact O-N 3.11Å; E49-N52 PolarHBondContact OE2-ND2 3.15Å; N52-T55 PolarHBondContact O-OG1 3.47Å; N52-H103 HydrophobicContact CB-CB 4.41Å; N52-H267 PolarHBondContact OD1-CE1 3.36Å; N52-Q270 WeakPolarHBondContact OD1-CG 3.47Å; N52-Q270 PolarHBondContact OD1-N 3.46Å; N52-H273 PolarHBondContact O-CE1 3.5Å; N52-H273 PolarHBondContact O-ND1 3.07Å
53I98.3Very high97Very high1 Ų142 Ų421%0.00519%0.194CC..Hα-helixtrans-72.4-57.5178-62.1161.3000111.1L43 E49 T50 L51 T55 H56 F57 S100 H103 T104L43-I53 HydrophobicContact CD2-CB 4.35Å; L43-I53 HydrophobicContact CD2-CD1 4.03Å; L43-I53 HydrophobicContact CD2-CG2 3.39Å; E49-I53 HydrophobicContact CB-CD1 4.3Å; E49-I53 WeakPolarHBondContact O-CD1 3.43Å; E49-I53 VanDerWaalsContact O-CG1 3.25Å; E49-I53 WeakPolarHBondContact O-CG1 3.5Å; E49-I53 PolarHBondContact O-N 3.25Å; T50-I53 PolarHBondContact O-N 3.48Å; L51-I53 PolarHBondContact O-N 3.43Å; I53-T55 PolarHBondContact O-N 3.26Å; I53-H56 PolarHBondContact O-N 3.37Å; I53-F57 WeakPolarHBondContact O-CB 3.37Å; I53-F57 PolarHBondContact O-N 3.01Å; I53-S100 WeakPolarHBondContact CG2-OG 3.48Å; I53-H103 HydrophobicContact CG1-CB 3.66Å; I53-T104 WeakPolarHBondContact CG2-OG1 3.33Å
54W98.3Very high97.3Very high69 Ų6943.5 Ų43.526%0.26120%0.202SC..Hα-helixtrans-66.9-33.6-172-78.7102.4000113.9L43 F44 T50 L51 H56 F57 L58L43-W54 HydrophobicContact CB-CZ2 4.45Å; L43-W54 PolarHBondContact O-NE1 2.86Å; F44-W54 HydrophobicContact CD1-CZ2 4.25Å; F44-W54 HydrophobicContact CE1-CH2 4.22Å; F44-W54 AromaticContact CE1-CZ2 3.92Å; F44-W54 HydrophobicContact CE1-CZ2 3.92Å; T50-W54 PolarHBondContact O-N 3.15Å; L51-W54 PolarHBondContact O-N 3.36Å; W54-H56 PolarHBondContact O-N 2.92Å; W54-F57 AromaticContact CE3-CD1 4Å; W54-F57 HydrophobicContact CE3-CD1 4Å; W54-F57 AromaticContact CZ3-CD1 3.8Å; W54-F57 HydrophobicContact CZ3-CD1 3.8Å; W54-F57 HydrophobicContact CZ3-CE1 4.21Å; W54-F57 PolarHBondContact O-N 3.18Å; W54-L58 HydrophobicContact CE3-CD1 4.12Å; W54-L58 HydrophobicContact CE3-CD2 3.85Å; W54-L58 HydrophobicContact CE3-CG 3.79Å; W54-L58 HydrophobicContact CZ3-CD2 3.76Å; W54-L58 HydrophobicContact CZ3-CG 4.24Å; W54-L58 PolarHBondContact O-N 2.97Å; W54-L58 VanDerWaalsContact O-N 3.15Å
55T98.1Very high97.4Very high26 Ų2644.2 Ų44.216%0.1620%0.2CC..Hα-helixtrans-63.9-21.117852.70000113L51 N52 I53 P59 H273 V274L51-T55 VanDerWaalsContact O-CB 3.22Å; L51-T55 WeakPolarHBondContact O-CB 3.23Å; L51-T55 WeakPolarHBondContact O-CG2 3.28Å; L51-T55 PolarHBondContact O-N 3.22Å; L51-T55 PolarHBondContact O-OG1 3.2Å; N52-T55 PolarHBondContact O-OG1 3.47Å; I53-T55 PolarHBondContact O-N 3.26Å; T55-P59 VanDerWaalsContact O-CD 3.26Å; T55-P59 WeakPolarHBondContact O-CD 3.45Å; T55-P59 WeakPolarHBondContact O-CG 3.36Å; T55-H273 VanDerWaalsContact OG1-CB 3.28Å; T55-H273 WeakPolarHBondContact OG1-CB 3.45Å; T55-H273 PolarHBondContact OG1-ND1 3Å; T55-V274 HydrophobicContact CG2-CG2 3.57Å
56H98.3Very high97.6Very high8 Ų844.7 Ų44.74%0.03720%0.202CC..Hα-helixtrans-104.7-32.5172.3-79.7-175.3000112.8I53 W54 P59 T60 P96 S99 H273I53-H56 PolarHBondContact O-N 3.37Å; W54-H56 PolarHBondContact O-N 2.92Å; H56-P59 WeakPolarHBondContact O-CD 3.32Å; H56-T60 PolarHBondContact O-N 2.59Å; H56-T60 PolarHBondContact O-OG1 3.46Å; H56-P96 HydrophobicContact CB-CB 3.78Å; H56-P96 WeakPolarHBondContact CB-O 3.26Å; H56-P96 WeakPolarHBondContact O-CB 3.19Å; H56-S99 PolarHBondContact CE1-OG 2.9Å; H56-S99 WeakPolarHBondContact ND1-CB 3.41Å; H56-S99 PolarHBondContact ND1-OG 3.45Å; H56-H273 AromaticContact CD2-CG 3.81Å; H56-H273 AromaticContact CD2-ND1 3.97Å; H56-H273 AromaticContact CE1-CD2 3.28Å; H56-H273 PolarHBondContact CE1-CD2 2.79Å; H56-H273 AromaticContact CE1-CE1 3.68Å; H56-H273 AromaticContact CE1-CG 3.46Å; H56-H273 VanDerWaalsContact CE1-CG 3.46Å; H56-H273 AromaticContact CE1-ND1 3.68Å; H56-H273 AromaticContact CE1-NE2 3.47Å; H56-H273 PolarHBondContact CE1-NE2 2.69Å; H56-H273 AromaticContact CG-ND1 3.91Å; H56-H273 AromaticContact ND1-CE1 3.66Å; H56-H273 AromaticContact ND1-CG 3.95Å; H56-H273 AromaticContact ND1-ND1 3.7Å; H56-H273 AromaticContact ND1-NE2 3.87Å; H56-H273 WeakPolarHBondContact NE2-CB 3.45Å; H56-H273 AromaticContact NE2-CD2 3.52Å; H56-H273 AromaticContact NE2-CG 3.36Å; H56-H273 AromaticContact NE2-ND1 3.86Å
57F98.2Very high97.7Very high64 Ų6441.1 Ų41.128%0.28119%0.185SC..Hα-helixtrans-62.4-47.9179.6-173.3-108.8000112.9I53 W54 T60 W61I53-F57 WeakPolarHBondContact O-CB 3.37Å; I53-F57 PolarHBondContact O-N 3.01Å; W54-F57 AromaticContact CE3-CD1 4Å; W54-F57 HydrophobicContact CE3-CD1 4Å; W54-F57 AromaticContact CZ3-CD1 3.8Å; W54-F57 HydrophobicContact CZ3-CD1 3.8Å; W54-F57 HydrophobicContact CZ3-CE1 4.21Å; W54-F57 PolarHBondContact O-N 3.18Å; F57-T60 WeakPolarHBondContact O-CB 3.45Å; F57-T60 PolarHBondContact O-N 2.89Å; F57-W61 AromaticContact CD1-NE1 3.94Å; F57-W61 AromaticContact CE1-NE1 3.47Å; F57-W61 HydrophobicContact CE2-CZ2 4.04Å; F57-W61 AromaticContact CE2-NE1 3.55Å; F57-W61 AromaticContact CZ-CE2 3.93Å; F57-W61 AromaticContact CZ-CZ2 3.99Å; F57-W61 HydrophobicContact CZ-CZ2 3.99Å; F57-W61 AromaticContact CZ-NE1 3.26Å; F57-W61 VanDerWaalsContact CZ-NE1 3.26Å; F57-W61 PolarHBondContact O-NE1 3.28Å
58L97.7Very high97.7Very high104 Ų10444.1 Ų44.155%0.54520%0.203SC..Hα-helixtrans-66-48.6-178.4-63.8173.4000112.8W54 T60 W61W54-L58 HydrophobicContact CE3-CD1 4.12Å; W54-L58 HydrophobicContact CE3-CD2 3.85Å; W54-L58 HydrophobicContact CE3-CG 3.79Å; W54-L58 HydrophobicContact CZ3-CD2 3.76Å; W54-L58 HydrophobicContact CZ3-CG 4.24Å; W54-L58 PolarHBondContact O-N 2.97Å; W54-L58 VanDerWaalsContact O-N 3.15Å; L58-T60 PolarHBondContact O-N 3.36Å; L58-W61 PolarHBondContact O-N 2.92Å; L58-W61 VanDerWaalsContact O-N 3.14Å
59P98Very high97.6Very high23 Ų2345.8 Ų45.815%0.14921%0.213CC..Hα-helixtrans-64.6-26.7-179.7-23.435.6000113.8T55 H56 W61 Y62 F63 I277T55-P59 VanDerWaalsContact O-CD 3.26Å; T55-P59 WeakPolarHBondContact O-CD 3.45Å; T55-P59 WeakPolarHBondContact O-CG 3.36Å; H56-P59 WeakPolarHBondContact O-CD 3.32Å; P59-W61 PolarHBondContact O-N 3.34Å; P59-Y62 WeakPolarHBondContact O-CB 3.34Å; P59-Y62 PolarHBondContact O-N 2.95Å; P59-F63 HydrophobicContact CB-CD2 4.29Å; P59-F63 HydrophobicContact CB-CE2 3.96Å; P59-F63 WeakPolarHBondContact O-CD2 3.44Å; P59-F63 PolarHBondContact O-N 2.78Å; P59-I277 HydrophobicContact CB-CD1 3.91Å; P59-I277 HydrophobicContact CB-CG1 4.39Å; P59-I277 HydrophobicContact CB-CG2 3.55Å; P59-I277 HydrophobicContact CG-CB 4.4Å; P59-I277 HydrophobicContact CG-CD1 4.16Å; P59-I277 HydrophobicContact CG-CG1 4.16Å; P59-I277 HydrophobicContact CG-CG2 3.48Å; P59-I277 VanDerWaalsContact CG-CG2 3.48Å
60T98.3Very high97.4Very high5 Ų545.5 Ų45.53%0.03121%0.212CC..Hα-helixtrans-50-45.5172.5-62.40000110.9H56 F57 L58 F63 L64 P96 L97H56-T60 PolarHBondContact O-N 2.59Å; H56-T60 PolarHBondContact O-OG1 3.46Å; F57-T60 WeakPolarHBondContact O-CB 3.45Å; F57-T60 PolarHBondContact O-N 2.89Å; L58-T60 PolarHBondContact O-N 3.36Å; T60-F63 PolarHBondContact O-N 3.11Å; T60-L64 VanDerWaalsContact O-CB 3.32Å; T60-L64 WeakPolarHBondContact O-CB 3.26Å; T60-L64 PolarHBondContact O-N 2.67Å; T60-P96 WeakPolarHBondContact OG1-CG 3.46Å; T60-L97 HydrophobicContact CG2-CB 3.82Å; T60-L97 HydrophobicContact CG2-CD1 4.23Å; T60-L97 HydrophobicContact CG2-CD2 4.43Å; T60-L97 HydrophobicContact CG2-CG 4.37Å; T60-L97 PolarHBondContact OG1-N 2.98Å
61W98.3Very high97.2Very high131 Ų13146.7 Ų46.750%0.49622%0.219SC..Hα-helixtrans-72.2-32.2-178.5-58.6108.9000112.7F57 L58 P59 L64 W65F57-W61 AromaticContact CD1-NE1 3.94Å; F57-W61 AromaticContact CE1-NE1 3.47Å; F57-W61 HydrophobicContact CE2-CZ2 4.04Å; F57-W61 AromaticContact CE2-NE1 3.55Å; F57-W61 AromaticContact CZ-CE2 3.93Å; F57-W61 AromaticContact CZ-CZ2 3.99Å; F57-W61 HydrophobicContact CZ-CZ2 3.99Å; F57-W61 AromaticContact CZ-NE1 3.26Å; F57-W61 VanDerWaalsContact CZ-NE1 3.26Å; F57-W61 PolarHBondContact O-NE1 3.28Å; L58-W61 PolarHBondContact O-N 2.92Å; L58-W61 VanDerWaalsContact O-N 3.14Å; P59-W61 PolarHBondContact O-N 3.34Å; W61-L64 HydrophobicContact CE3-CD2 3.76Å; W61-L64 HydrophobicContact CZ3-CD2 3.72Å; W61-W65 WeakPolarHBondContact O-CB 3.37Å; W61-W65 PolarHBondContact O-N 2.98Å
62Y98.4Very high96.9Very high74 Ų7449.2 Ų49.229%0.2923%0.232SC..Hα-helixtrans-63.7-48.9172.1170-97000111.6P59 L64 W65 K66 H281 M284P59-Y62 WeakPolarHBondContact O-CB 3.34Å; P59-Y62 PolarHBondContact O-N 2.95Å; Y62-L64 VanDerWaalsContact C-N 3.32Å; Y62-L64 PolarHBondContact O-N 3.23Å; Y62-W65 HydrophobicContact CD2-CE3 4.08Å; Y62-W65 HydrophobicContact CD2-CZ3 4.26Å; Y62-W65 HydrophobicContact CE2-CE3 4.1Å; Y62-W65 AromaticContact CE2-CZ3 3.85Å; Y62-W65 HydrophobicContact CE2-CZ3 3.85Å; Y62-W65 PolarHBondContact O-N 3.46Å; Y62-K66 HydrophobicContact CE1-CG 4.27Å; Y62-K66 HydrophobicContact CE2-CG 4.48Å; Y62-K66 PolarHBondContact O-N 3.43Å; Y62-K66 WeakPolarHBondContact OH-CE 3.25Å; Y62-H281 AromaticContact CE1-ND1 3.6Å; Y62-H281 AromaticContact CZ-CE1 3.91Å; Y62-H281 AromaticContact CZ-ND1 3.84Å; Y62-H281 PolarHBondContact OH-CE1 3.34Å; Y62-H281 VanDerWaalsContact OH-CE1 3.32Å; Y62-M284 HydrophobicContact CE1-CE 3.87Å; Y62-M284 HydrophobicContact CE1-SD 4.35Å; Y62-M284 WeakPolarHBondContact OH-CE 3.48Å
63F98.5Very high96.3Very high1 Ų156.2 Ų56.20%0.00427%0.267CS..Hα-helixtrans-66.6-35.2177.5-65.4-59.4000112P59 T60 K66 L67 C92 I277 T280 M284P59-F63 HydrophobicContact CB-CD2 4.29Å; P59-F63 HydrophobicContact CB-CE2 3.96Å; P59-F63 WeakPolarHBondContact O-CD2 3.44Å; P59-F63 PolarHBondContact O-N 2.78Å; T60-F63 PolarHBondContact O-N 3.11Å; F63-K66 WeakPolarHBondContact O-CB 3.49Å; F63-K66 PolarHBondContact O-N 3.2Å; F63-L67 PolarHBondContact O-N 3.34Å; F63-C92 HydrophobicContact CB-CB 4.11Å; F63-C92 HydrophobicContact CD1-CB 4.01Å; F63-C92 HydrophobicContact CD2-CB 4.24Å; F63-C92 WeakPolarHBondContact CD2-O 3.43Å; F63-C92 HydrophobicContact CG-CB 3.87Å; F63-I277 HydrophobicContact CE2-CD1 4.29Å; F63-I277 HydrophobicContact CE2-CG2 4.49Å; F63-T280 HydrophobicContact CE1-CG2 4.1Å; F63-T280 HydrophobicContact CE2-CG2 4.26Å; F63-T280 HydrophobicContact CZ-CG2 3.71Å; F63-M284 HydrophobicContact CD1-SD 3.9Å; F63-M284 HydrophobicContact CE1-SD 3.97Å
64L98.2Very high95.6Very high63 Ų6361.4 Ų61.433%0.3329%0.291SS..Hα-helixtrans-64.3-44.5174.5-178.561.4000111.4T60 W61 Y62 K66 L67 V68 C93T60-L64 VanDerWaalsContact O-CB 3.32Å; T60-L64 WeakPolarHBondContact O-CB 3.26Å; T60-L64 PolarHBondContact O-N 2.67Å; W61-L64 HydrophobicContact CE3-CD2 3.76Å; W61-L64 HydrophobicContact CZ3-CD2 3.72Å; Y62-L64 VanDerWaalsContact C-N 3.32Å; Y62-L64 PolarHBondContact O-N 3.23Å; L64-K66 VanDerWaalsContact C-N 3.28Å; L64-K66 PolarHBondContact O-N 3.19Å; L64-L67 PolarHBondContact O-N 3.39Å; L64-V68 HydrophobicContact CD1-CG2 4.16Å; L64-V68 HydrophobicContact CG-CG2 4.38Å; L64-V68 WeakPolarHBondContact O-CB 3.28Å; L64-V68 VanDerWaalsContact O-CG2 3.27Å; L64-V68 WeakPolarHBondContact O-CG2 3.1Å; L64-V68 PolarHBondContact O-N 3.35Å; L64-C93 VanDerWaalsContact CA-SG 3.5Å; L64-C93 PolarHBondContact N-SG 3.23Å; L64-C93 VanDerWaalsContact N-SG 3.37Å
65W97.7Very high94.7Very high152 Ų15263.4 Ų63.458%0.57630%0.303SS*.Hα-helixtrans-58.1-42.5174166.466.5000111.6W61 Y62 V68 T69W61-W65 WeakPolarHBondContact O-CB 3.37Å; W61-W65 PolarHBondContact O-N 2.98Å; Y62-W65 HydrophobicContact CD2-CE3 4.08Å; Y62-W65 HydrophobicContact CD2-CZ3 4.26Å; Y62-W65 HydrophobicContact CE2-CE3 4.1Å; Y62-W65 AromaticContact CE2-CZ3 3.85Å; Y62-W65 HydrophobicContact CE2-CZ3 3.85Å; Y62-W65 PolarHBondContact O-N 3.46Å; W65-V68 PolarHBondContact O-N 3.46Å; W65-T69 WeakPolarHBondContact O-CB 3.49Å; W65-T69 PolarHBondContact O-N 2.98Å; W65-T69 PolarHBondContact O-OG1 3.35Å
66K97.4Very high93.6Very high41 Ų4162.1 Ų62.118%0.17830%0.296CS..Hα-helixtrans-61.1-49.3174.2-77.3-66.4-160.1153.20112.5Y62 F63 L64 V68 T69 V70 L89 M284 E288Y62-K66 HydrophobicContact CE1-CG 4.27Å; Y62-K66 HydrophobicContact CE2-CG 4.48Å; Y62-K66 PolarHBondContact O-N 3.43Å; Y62-K66 WeakPolarHBondContact OH-CE 3.25Å; F63-K66 WeakPolarHBondContact O-CB 3.49Å; F63-K66 PolarHBondContact O-N 3.2Å; L64-K66 VanDerWaalsContact C-N 3.28Å; L64-K66 PolarHBondContact O-N 3.19Å; K66-V68 PolarHBondContact O-N 3.05Å; K66-T69 WeakPolarHBondContact O-CB 3.22Å; K66-T69 PolarHBondContact O-N 2.78Å; K66-V70 PolarHBondContact O-N 2.97Å; K66-L89 HydrophobicContact CB-CD2 4.38Å; K66-M284 HydrophobicContact CB-SD 4.38Å; K66-M284 HydrophobicContact CG-CE 4.41Å; K66-M284 HydrophobicContact CG-SD 4.07Å; K66-E288 IonicContact NZ-OE2 3.56Å
67L97.1Very high92.9Very high21 Ų2168.8 Ų68.811%0.1132%0.321CS..Hα-helixtrans-56.9-49.1176.6176.361.5000111.7F63 L64 T69 V70 V71 M86 L89 L90F63-L67 PolarHBondContact O-N 3.34Å; L64-L67 PolarHBondContact O-N 3.39Å; L67-T69 VanDerWaalsContact C-N 3.27Å; L67-T69 PolarHBondContact O-N 3.42Å; L67-V70 PolarHBondContact O-N 2.74Å; L67-V71 HydrophobicContact CD1-CG2 4.12Å; L67-V71 WeakPolarHBondContact O-CG2 3.49Å; L67-V71 PolarHBondContact O-N 3.4Å; L67-M86 HydrophobicContact CD1-CB 4.47Å; L67-L89 HydrophobicContact CB-CB 4.09Å; L67-L89 HydrophobicContact CD1-CB 3.86Å; L67-L90 HydrophobicContact CD2-CB 4.24Å; L67-L90 HydrophobicContact CD2-CD1 4.06Å
68V96Very high92.4Very high63 Ų6373.2 Ų73.238%0.38234%0.342SS..Hα-helixtrans-61.3-38.4178.7171.10000110.9L64 W65 K66 V71 L72L64-V68 HydrophobicContact CD1-CG2 4.16Å; L64-V68 HydrophobicContact CG-CG2 4.38Å; L64-V68 WeakPolarHBondContact O-CB 3.28Å; L64-V68 VanDerWaalsContact O-CG2 3.27Å; L64-V68 WeakPolarHBondContact O-CG2 3.1Å; L64-V68 PolarHBondContact O-N 3.35Å; W65-V68 PolarHBondContact O-N 3.46Å; K66-V68 PolarHBondContact O-N 3.05Å; V68-V71 PolarHBondContact O-N 3.33Å; V68-L72 HydrophobicContact CG1-CD1 3.53Å; V68-L72 HydrophobicContact CG1-CG 4.09Å; V68-L72 WeakPolarHBondContact O-CB 3.42Å; V68-L72 WeakPolarHBondContact O-CG 3.4Å; V68-L72 PolarHBondContact O-N 3.39Å
69T94.9Very high92Very high40 Ų4070.8 Ų70.825%0.24533%0.33CS..Hα-helixtrans-62.8-45.9175.8-58.70000111.4W65 K66 L67 M73 Q74W65-T69 WeakPolarHBondContact O-CB 3.49Å; W65-T69 PolarHBondContact O-N 2.98Å; W65-T69 PolarHBondContact O-OG1 3.35Å; K66-T69 WeakPolarHBondContact O-CB 3.22Å; K66-T69 PolarHBondContact O-N 2.78Å; L67-T69 VanDerWaalsContact C-N 3.27Å; L67-T69 PolarHBondContact O-N 3.42Å; T69-M73 HydrophobicContact CG2-CB 4.25Å; T69-M73 HydrophobicContact CG2-CG 4.29Å; T69-M73 WeakPolarHBondContact O-CA 3.43Å; T69-M73 VanDerWaalsContact O-CB 3.23Å; T69-M73 WeakPolarHBondContact O-CB 3.46Å; T69-M73 PolarHBondContact O-N 3.07Å; T69-Q74 PolarHBondContact O-N 2.82Å
70V93.3Very high91.8Very high4 Ų471.9 Ų71.92%0.02434%0.338CS..Hα-helixtrans-62.9-44.7176.91730000111.2K66 L67 Q74 G76 L85 M86 L89K66-V70 PolarHBondContact O-N 2.97Å; L67-V70 PolarHBondContact O-N 2.74Å; V70-Q74 CarbonylContact O-C 3.44Å; V70-Q74 WeakPolarHBondContact O-CB 3.03Å; V70-Q74 PolarHBondContact O-N 3.15Å; V70-G76 PolarHBondContact O-N 3.28Å; V70-L85 HydrophobicContact CG1-CD2 4.5Å; V70-L85 HydrophobicContact CG2-CD2 4.28Å; V70-M86 HydrophobicContact CG1-CG 4.05Å; V70-L89 HydrophobicContact CB-CD1 4.31Å; V70-L89 HydrophobicContact CG2-CD1 3.76Å
71V92.2Very high91.7Very high33 Ų3372.6 Ų72.620%0.234%0.341CS..Hα-helixtrans-66.3-48.8-178.5167.60000112.1L67 V68 M86L67-V71 HydrophobicContact CD1-CG2 4.12Å; L67-V71 WeakPolarHBondContact O-CG2 3.49Å; L67-V71 PolarHBondContact O-N 3.4Å; V68-V71 PolarHBondContact O-N 3.33Å; V71-M86 HydrophobicContact CG2-SD 3.78Å
72L90.3Very high91.5Very high105 Ų10566.7 Ų66.755%0.5532%0.319SS..Hα-helixtrans-90-41.2-171.3-60.9-177.2000113.3V68 Q75V68-L72 HydrophobicContact CG1-CD1 3.53Å; V68-L72 HydrophobicContact CG1-CG 4.09Å; V68-L72 WeakPolarHBondContact O-CB 3.42Å; V68-L72 WeakPolarHBondContact O-CG 3.4Å; V68-L72 PolarHBondContact O-N 3.39Å; L72-Q75 PolarHBondContact O-NE2 3.11Å
73M85.8Confident91.5Very high152 Ų15265.8 Ų65.875%0.74932%0.315SS*.THydrogen-bonded Turntrans-94.2-33.1-171.8-56-62.4-178.500112.5T69T69-M73 HydrophobicContact CG2-CB 4.25Å; T69-M73 HydrophobicContact CG2-CG 4.29Å; T69-M73 WeakPolarHBondContact O-CA 3.43Å; T69-M73 VanDerWaalsContact O-CB 3.23Å; T69-M73 WeakPolarHBondContact O-CB 3.46Å; T69-M73 PolarHBondContact O-N 3.07Å
74Q82.7Confident91.4Very high111 Ų11165.7 Ų65.752%0.51932%0.315SS..SBendtrans-97.26179-57.9-177.2-5.400113.1T69 V70 G76T69-Q74 PolarHBondContact O-N 2.82Å; V70-Q74 CarbonylContact O-C 3.44Å; V70-Q74 WeakPolarHBondContact O-CB 3.03Å; V70-Q74 PolarHBondContact O-N 3.15Å; Q74-G76 PolarHBondContact O-N 3.44Å
75Q79.8Confident91.4Very high110 Ų11062.8 Ų62.851%0.51430%0.299SS..  trans50.543-179.7-60.7-64.5-34.400112.2L72 W77 Q78L72-Q75 PolarHBondContact O-NE2 3.11Å; Q75-W77 PolarHBondContact O-N 2.91Å; Q75-Q78 HydrophobicContact CB-CB 4.36Å; Q75-Q78 HydrophobicContact CB-CG 4.01Å; Q75-Q78 WeakPolarHBondContact O-CB 3.4Å; Q75-Q78 PolarHBondContact O-N 3.49Å
76G75.4Confident91.4Very high0 Ų055.9 Ų55.90%027%0.274CS..THydrogen-bonded Turntrans-57.2-16.3-172.800000115.2V70 Q74 T82 M86V70-G76 PolarHBondContact O-N 3.28Å; Q74-G76 PolarHBondContact O-N 3.44Å; G76-T82 WeakPolarHBondContact CA-OG1 3.01Å; G76-T82 PolarHBondContact O-OG1 2.93Å; G76-M86 VanDerWaalsContact O-CE 3.23Å; G76-M86 WeakPolarHBondContact O-CE 3.21Å
77W83.6Confident91.4Very high148 Ų14854.2 Ų54.256%0.56127%0.267SS*.THydrogen-bonded Turntrans-74.1-27.6172.6-66.7109.4000114Q75 M86 L311Q75-W77 PolarHBondContact O-N 2.91Å; W77-M86 HydrophobicContact CD2-CE 4.34Å; W77-M86 HydrophobicContact CE3-CE 4.16Å; W77-M86 HydrophobicContact CZ3-CE 4.34Å; W77-L311 HydrophobicContact CZ3-CD1 4.43Å
78Q86.5Confident91.4Very high157 Ų15753.2 Ų53.273%0.73426%0.261SS*.THydrogen-bonded Turntrans-80.1-29.9-176.1-59.4-60.6-26.900112.5Q75Q75-Q78 HydrophobicContact CB-CB 4.36Å; Q75-Q78 HydrophobicContact CB-CG 4.01Å; Q75-Q78 WeakPolarHBondContact O-CB 3.4Å; Q75-Q78 PolarHBondContact O-N 3.49Å
79D90.7Very high91.6Very high52 Ų5250.2 Ų50.228%0.27824%0.243SC..  trans-109.7107.2-179.3-174-6.1000111F81 T82 R295D79-F81 PolarHBondContact O-N 3.12Å; D79-F81 WeakPolarHBondContact OD1-CB 3.37Å; D79-F81 PolarHBondContact OD1-N 3.26Å; D79-T82 HydrophobicContact CB-CG2 4.4Å; D79-T82 PolarHBondContact O-N 2.95Å; D79-T82 PolarHBondContact O-OG1 3.49Å; D79-R295 IonicContact OD1-NH1 3.96Å; D79-R295 IonicContact OD2-CZ 2.6Å; D79-R295 IonicContact OD2-NH1 2.72Å; D79-R295 PolarHBondContact OD2-NH1 3.25Å; D79-R295 IonicContact OD2-NH2 2.94Å; D79-R295 PolarHBondContact OD2-NH2 3.38Å
80S93.8Very high91.7Very high47 Ų4751.8 Ų51.833%0.32925%0.25SS..G310 helixtrans-57.6-25.3179.2660000112.9T82 W83 V305S80-T82 PolarHBondContact O-N 3.38Å; S80-T82 VanDerWaalsContact O-N 3.09Å; S80-W83 WeakPolarHBondContact O-CB 3.27Å; S80-W83 PolarHBondContact O-N 3.06Å; S80-W83 VanDerWaalsContact O-N 3.12Å; S80-V305 WeakPolarHBondContact O-CB 3.41Å; S80-V305 WeakPolarHBondContact O-CG1 3.47Å
81F94.9Very high92Very high20 Ų2051.6 Ų51.69%0.08825%0.249CC..G310 helixtrans-62.6-17177-162.3-101.2000113.2D79 Y138 M291 R295 L298 V305D79-F81 PolarHBondContact O-N 3.12Å; D79-F81 WeakPolarHBondContact OD1-CB 3.37Å; D79-F81 PolarHBondContact OD1-N 3.26Å; F81-Y138 HydrophobicContact CD1-CE1 4.09Å; F81-Y138 HydrophobicContact CE1-CD1 4.1Å; F81-Y138 AromaticContact CE1-CE1 3.66Å; F81-Y138 HydrophobicContact CE1-CE1 3.66Å; F81-Y138 HydrophobicContact CE2-CE1 4.36Å; F81-Y138 AromaticContact CZ-CD1 3.99Å; F81-Y138 HydrophobicContact CZ-CD1 3.99Å; F81-Y138 AromaticContact CZ-CE1 3.81Å; F81-Y138 HydrophobicContact CZ-CE1 3.81Å; F81-Y138 PolarHBondContact O-OH 3.31Å; F81-M291 HydrophobicContact CD1-CG 4.04Å; F81-M291 HydrophobicContact CE1-CG 3.71Å; F81-R295 HydrophobicContact CD1-CG 4.38Å; F81-R295 HydrophobicContact CE1-CB 3.85Å; F81-R295 HydrophobicContact CE1-CG 4.08Å; F81-R295 HydrophobicContact CZ-CB 4.21Å; F81-R295 HydrophobicContact CZ-CG 4.46Å; F81-L298 HydrophobicContact CE2-CB 4.19Å; F81-L298 HydrophobicContact CZ-CB 4.13Å; F81-L298 HydrophobicContact CZ-CD1 4.05Å; F81-V305 HydrophobicContact CD2-CG2 4.12Å
82T95.5Very high92.3Very high6 Ų650 Ų504%0.03724%0.239CC..G310 helixtrans-95.5-10.5177.962.60000114.2G76 D79 S80 P84 L85 M86 M291G76-T82 WeakPolarHBondContact CA-OG1 3.01Å; G76-T82 PolarHBondContact O-OG1 2.93Å; D79-T82 HydrophobicContact CB-CG2 4.4Å; D79-T82 PolarHBondContact O-N 2.95Å; D79-T82 PolarHBondContact O-OG1 3.49Å; S80-T82 PolarHBondContact O-N 3.38Å; S80-T82 VanDerWaalsContact O-N 3.09Å; T82-P84 VanDerWaalsContact C-CD 3.45Å; T82-L85 WeakPolarHBondContact O-CB 3.4Å; T82-L85 PolarHBondContact O-N 2.76Å; T82-L85 VanDerWaalsContact O-N 3.14Å; T82-M86 PolarHBondContact O-N 3.37Å; T82-M291 HydrophobicContact CG2-SD 4.46Å
83W96.8Very high92.7Very high55 Ų5545.5 Ų45.521%0.20822%0.216CC..Hα-helixtrans-57.7-40.4-179.7-62.32000114.1S80 L85 M86 V87 V305 F307 L311S80-W83 WeakPolarHBondContact O-CB 3.27Å; S80-W83 PolarHBondContact O-N 3.06Å; S80-W83 VanDerWaalsContact O-N 3.12Å; W83-L85 VanDerWaalsContact C-N 3.33Å; W83-L85 PolarHBondContact O-N 2.81Å; W83-M86 HydrophobicContact CB-CE 4.33Å; W83-M86 HydrophobicContact CG-CE 4.05Å; W83-M86 PolarHBondContact O-N 2.9Å; W83-V87 WeakPolarHBondContact O-CG2 3.15Å; W83-V87 PolarHBondContact O-N 3.27Å; W83-V305 HydrophobicContact CB-CG1 4.43Å; W83-F307 HydrophobicContact CZ3-CB 4.24Å; W83-L311 HydrophobicContact CB-CD1 4.48Å; W83-L311 HydrophobicContact CB-CG 4.33Å; W83-L311 HydrophobicContact CD2-CD1 3.82Å; W83-L311 HydrophobicContact CD2-CG 4.49Å; W83-L311 HydrophobicContact CE3-CD1 3.75Å; W83-L311 HydrophobicContact CE3-CG 4.3Å; W83-L311 HydrophobicContact CG-CD1 4.19Å; W83-L311 HydrophobicContact CZ3-CD1 4.28Å
84P97.6Very high93.3Very high0 Ų041.2 Ų41.20%020%0.196CC..Hα-helixtrans-59.1-43.9175.1-25.437.1000111.9T82 M86 V87 F88 V133 V134 F137 Y138 V305T82-P84 VanDerWaalsContact C-CD 3.45Å; P84-M86 PolarHBondContact O-N 2.94Å; P84-V87 PolarHBondContact O-N 3.06Å; P84-F88 PolarHBondContact O-N 3.04Å; P84-F88 VanDerWaalsContact O-N 3.07Å; P84-V133 HydrophobicContact CB-CG1 3.71Å; P84-V133 HydrophobicContact CG-CG1 4.49Å; P84-V134 HydrophobicContact CB-CG1 4.26Å; P84-V134 VanDerWaalsContact O-CG1 3.24Å; P84-V134 WeakPolarHBondContact O-CG1 3.13Å; P84-F137 HydrophobicContact CB-CB 4.34Å; P84-F137 HydrophobicContact CB-CD2 3.78Å; P84-F137 HydrophobicContact CB-CG 4.3Å; P84-F137 HydrophobicContact CG-CB 4.18Å; P84-F137 HydrophobicContact CG-CD2 3.43Å; P84-F137 VanDerWaalsContact CG-CD2 3.43Å; P84-F137 HydrophobicContact CG-CE2 3.95Å; P84-F137 HydrophobicContact CG-CG 3.79Å; P84-Y138 HydrophobicContact CB-CE2 4.12Å; P84-Y138 WeakPolarHBondContact CD-OH 3.4Å; P84-V305 HydrophobicContact CG-CG1 3.93Å; P84-V305 HydrophobicContact CG-CG2 4.19Å
85L97.7Very high94Very high1 Ų136.4 Ų36.41%0.00517%0.173CC..Hα-helixtrans-61.7-42.2175.8-178.263.7000111.6V70 T82 W83 V87 F88 L89 Y138 V287 E288 M291V70-L85 HydrophobicContact CG1-CD2 4.5Å; V70-L85 HydrophobicContact CG2-CD2 4.28Å; T82-L85 WeakPolarHBondContact O-CB 3.4Å; T82-L85 PolarHBondContact O-N 2.76Å; T82-L85 VanDerWaalsContact O-N 3.14Å; W83-L85 VanDerWaalsContact C-N 3.33Å; W83-L85 PolarHBondContact O-N 2.81Å; L85-V87 PolarHBondContact O-N 3.32Å; L85-F88 HydrophobicContact CD1-CD1 4.38Å; L85-F88 PolarHBondContact O-N 2.92Å; L85-L89 HydrophobicContact CD1-CD1 4.17Å; L85-L89 HydrophobicContact CD1-CG 4.08Å; L85-L89 HydrophobicContact CD2-CD1 4.39Å; L85-L89 HydrophobicContact CG-CD1 3.88Å; L85-L89 HydrophobicContact CG-CG 4.22Å; L85-L89 WeakPolarHBondContact O-CB 3.32Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.47Å; L85-Y138 HydrophobicContact CB-CE2 4.14Å; L85-Y138 PolarHBondContact N-OH 3.06Å; L85-V287 HydrophobicContact CD1-CG2 4.21Å; L85-E288 HydrophobicContact CD1-CG 4.16Å; L85-E288 HydrophobicContact CD2-CG 4.3Å; L85-M291 HydrophobicContact CB-SD 4.25Å; L85-M291 HydrophobicContact CD2-CE 3.75Å; L85-M291 HydrophobicContact CD2-SD 3.81Å
86M96.5Very high94.9Very high8 Ų831.2 Ų31.24%0.03915%0.148CC..Hα-helixtrans-63-41.1177.3-70-167.5-69.100112.6L67 V70 V71 G76 W77 T82 W83 P84 F88 L89 L90L67-M86 HydrophobicContact CD1-CB 4.47Å; V70-M86 HydrophobicContact CG1-CG 4.05Å; V71-M86 HydrophobicContact CG2-SD 3.78Å; G76-M86 VanDerWaalsContact O-CE 3.23Å; G76-M86 WeakPolarHBondContact O-CE 3.21Å; W77-M86 HydrophobicContact CD2-CE 4.34Å; W77-M86 HydrophobicContact CE3-CE 4.16Å; W77-M86 HydrophobicContact CZ3-CE 4.34Å; T82-M86 PolarHBondContact O-N 3.37Å; W83-M86 HydrophobicContact CB-CE 4.33Å; W83-M86 HydrophobicContact CG-CE 4.05Å; W83-M86 PolarHBondContact O-N 2.9Å; P84-M86 PolarHBondContact O-N 2.94Å; M86-F88 VanDerWaalsContact C-N 3.34Å; M86-L89 PolarHBondContact O-N 3.45Å; M86-L90 VanDerWaalsContact O-CB 3.26Å; M86-L90 WeakPolarHBondContact O-CB 3.24Å; M86-L90 PolarHBondContact O-N 3.28Å
87V97.8Very high96Very high5 Ų534.5 Ų34.53%0.0317%0.166CC..Hα-helixtrans-59.4-47.1174.5170.10000110.7W83 P84 L85 L90 S91 L311 A314W83-V87 WeakPolarHBondContact O-CG2 3.15Å; W83-V87 PolarHBondContact O-N 3.27Å; P84-V87 PolarHBondContact O-N 3.06Å; L85-V87 PolarHBondContact O-N 3.32Å; V87-L90 PolarHBondContact O-N 3.45Å; V87-S91 PolarHBondContact O-N 2.9Å; V87-L311 HydrophobicContact CG2-CD2 3.72Å; V87-A314 HydrophobicContact CB-CB 4.43Å; V87-A314 HydrophobicContact CG1-CB 3.59Å; V87-A314 HydrophobicContact CG2-CB 3.91Å
88F98.6Very high96.7Very high0 Ų028.3 Ų28.30%015%0.146CC..Hα-helixtrans-65.3-44.6178.4171.6-104.8000112.9P84 L85 M86 L90 S91 C92 Y127 A131 V134 Q283 M284 V287P84-F88 PolarHBondContact O-N 3.04Å; P84-F88 VanDerWaalsContact O-N 3.07Å; L85-F88 HydrophobicContact CD1-CD1 4.38Å; L85-F88 PolarHBondContact O-N 2.92Å; M86-F88 VanDerWaalsContact C-N 3.34Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.34Å; F88-S91 PolarHBondContact O-N 3.45Å; F88-S91 PolarHBondContact O-OG 3.14Å; F88-C92 WeakPolarHBondContact CZ-SG 3.39Å; F88-C92 PolarHBondContact O-N 3.23Å; F88-C92 PolarHBondContact O-SG 3.43Å; F88-Y127 HydrophobicContact CD2-CE2 4.5Å; F88-Y127 HydrophobicContact CE2-CD2 4.39Å; F88-Y127 AromaticContact CE2-CE2 3.71Å; F88-Y127 HydrophobicContact CE2-CE2 3.71Å; F88-Y127 HydrophobicContact CZ-CE2 4.36Å; F88-A131 HydrophobicContact CE2-CB 4.5Å; F88-V134 HydrophobicContact CB-CB 4.39Å; F88-V134 HydrophobicContact CB-CG1 3.37Å; F88-V134 HydrophobicContact CB-CG2 4.14Å; F88-V134 HydrophobicContact CD1-CG1 4.4Å; F88-V134 HydrophobicContact CD1-CG2 4.47Å; F88-V134 HydrophobicContact CD2-CG2 3.89Å; F88-V134 HydrophobicContact CE2-CG2 4.44Å; F88-V134 HydrophobicContact CG-CG1 3.93Å; F88-V134 HydrophobicContact CG-CG2 3.9Å; F88-Q283 HydrophobicContact CE2-CG 4.21Å; F88-Q283 HydrophobicContact CZ-CB 4.25Å; F88-Q283 HydrophobicContact CZ-CG 3.83Å; F88-M284 HydrophobicContact CE1-CB 3.95Å; F88-M284 HydrophobicContact CE1-CG 4.26Å; F88-V287 HydrophobicContact CD1-CG2 4.2Å; F88-V287 HydrophobicContact CE1-CG2 4.03Å
89L98.4Very high97.2Very high0 Ų020.9 Ų20.90%011%0.112CC..Hα-helixtrans-65-38.2177.8-73.6176.8000111.7K66 L67 V70 L85 M86 S91 C92 C93 M284K66-L89 HydrophobicContact CB-CD2 4.38Å; L67-L89 HydrophobicContact CB-CB 4.09Å; L67-L89 HydrophobicContact CD1-CB 3.86Å; V70-L89 HydrophobicContact CB-CD1 4.31Å; V70-L89 HydrophobicContact CG2-CD1 3.76Å; L85-L89 HydrophobicContact CD1-CD1 4.17Å; L85-L89 HydrophobicContact CD1-CG 4.08Å; L85-L89 HydrophobicContact CD2-CD1 4.39Å; L85-L89 HydrophobicContact CG-CD1 3.88Å; L85-L89 HydrophobicContact CG-CG 4.22Å; L85-L89 WeakPolarHBondContact O-CB 3.32Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.47Å; M86-L89 PolarHBondContact O-N 3.45Å; L89-S91 VanDerWaalsContact C-N 3.34Å; L89-C92 WeakPolarHBondContact O-CB 3.42Å; L89-C92 PolarHBondContact O-N 2.75Å; L89-C93 PolarHBondContact O-N 2.9Å; L89-C93 VanDerWaalsContact O-N 3.1Å; L89-C93 PolarHBondContact O-SG 3.17Å; L89-M284 HydrophobicContact CD2-CG 3.84Å; L89-M284 HydrophobicContact CD2-SD 3.77Å
90L98.3Very high97.6Very high74 Ų7418.6 Ų18.639%0.38710%0.1SC..Hα-helixtrans-61-44.4172.5-179.963.9000111.1L67 M86 V87 F88 C92 C93 I94 F126L67-L90 HydrophobicContact CD2-CB 4.24Å; L67-L90 HydrophobicContact CD2-CD1 4.06Å; M86-L90 VanDerWaalsContact O-CB 3.26Å; M86-L90 WeakPolarHBondContact O-CB 3.24Å; M86-L90 PolarHBondContact O-N 3.28Å; V87-L90 PolarHBondContact O-N 3.45Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.34Å; L90-C92 VanDerWaalsContact C-N 3.33Å; L90-C92 PolarHBondContact O-N 3.33Å; L90-C93 WeakPolarHBondContact O-CB 3.39Å; L90-C93 PolarHBondContact O-N 3.24Å; L90-C93 VanDerWaalsContact O-N 3.1Å; L90-I94 HydrophobicContact CD1-CD1 3.89Å; L90-I94 HydrophobicContact CD1-CG1 4.28Å; L90-I94 HydrophobicContact CD2-CD1 4.4Å; L90-I94 HydrophobicContact CG-CD1 3.79Å; L90-I94 HydrophobicContact CG-CG1 4.47Å; L90-I94 WeakPolarHBondContact O-CG1 3.42Å; L90-I94 PolarHBondContact O-N 3.32Å; L90-F126 HydrophobicContact CD2-CE1 4.45Å; L90-F126 HydrophobicContact CD2-CZ 4.44Å; L90-F126 HydrophobicContact CG-CE1 4.33Å
91S98.5Very high97.8Very high0 Ų018.7 Ų18.70%010%0.1CC..Hα-helixtrans-65.3-37.3177.380.40000112.1V87 F88 L89 C93 I94 Y95 F126V87-S91 PolarHBondContact O-N 2.9Å; F88-S91 PolarHBondContact O-N 3.45Å; F88-S91 PolarHBondContact O-OG 3.14Å; L89-S91 VanDerWaalsContact C-N 3.34Å; S91-C93 PolarHBondContact O-N 2.97Å; S91-I94 PolarHBondContact O-N 3.23Å; S91-Y95 WeakPolarHBondContact O-CD1 3.49Å; S91-Y95 PolarHBondContact O-N 2.84Å; S91-F126 VanDerWaalsContact CB-CD1 3.47Å
92C98.6Very high97.9Very high0 Ų017.8 Ų17.80%010%0.096CC..Hα-helixtrans-62.7-22172-65.20000113.8F63 F88 L89 L90 P96 T280F63-C92 HydrophobicContact CB-CB 4.11Å; F63-C92 HydrophobicContact CD1-CB 4.01Å; F63-C92 HydrophobicContact CD2-CB 4.24Å; F63-C92 WeakPolarHBondContact CD2-O 3.43Å; F63-C92 HydrophobicContact CG-CB 3.87Å; F88-C92 WeakPolarHBondContact CZ-SG 3.39Å; F88-C92 PolarHBondContact O-N 3.23Å; F88-C92 PolarHBondContact O-SG 3.43Å; L89-C92 WeakPolarHBondContact O-CB 3.42Å; L89-C92 PolarHBondContact O-N 2.75Å; L90-C92 VanDerWaalsContact C-N 3.33Å; L90-C92 PolarHBondContact O-N 3.33Å; C92-P96 WeakPolarHBondContact O-CD 3.47Å; C92-P96 WeakPolarHBondContact O-CG 3.36Å; C92-T280 HydrophobicContact CB-CG2 4.19Å; C92-T280 WeakPolarHBondContact SG-CG2 3.42Å
93C98.6Very high98Very high9 Ų917.8 Ų17.86%0.06110%0.096CC..Hα-helixtrans-83.4-45.3171.6-59.90000111.4L64 L89 L90 S91 P96 L97L64-C93 VanDerWaalsContact CA-SG 3.5Å; L64-C93 PolarHBondContact N-SG 3.23Å; L64-C93 VanDerWaalsContact N-SG 3.37Å; L89-C93 PolarHBondContact O-N 2.9Å; L89-C93 VanDerWaalsContact O-N 3.1Å; L89-C93 PolarHBondContact O-SG 3.17Å; L90-C93 WeakPolarHBondContact O-CB 3.39Å; L90-C93 PolarHBondContact O-N 3.24Å; L90-C93 VanDerWaalsContact O-N 3.1Å; S91-C93 PolarHBondContact O-N 2.97Å; C93-P96 WeakPolarHBondContact O-CD 3.37Å; C93-L97 VanDerWaalsContact O-CB 3.29Å; C93-L97 WeakPolarHBondContact O-CB 3.12Å; C93-L97 PolarHBondContact O-N 3.03Å
94I98.4Very high98.1Very high62 Ų6215.6 Ų15.632%0.3189%0.088SC..Hα-helixtrans-71.7-44.1-169.8-66172.8000111.6L90 S91 L97 A98 A123 F126L90-I94 HydrophobicContact CD1-CD1 3.89Å; L90-I94 HydrophobicContact CD1-CG1 4.28Å; L90-I94 HydrophobicContact CD2-CD1 4.4Å; L90-I94 HydrophobicContact CG-CD1 3.79Å; L90-I94 HydrophobicContact CG-CG1 4.47Å; L90-I94 WeakPolarHBondContact O-CG1 3.42Å; L90-I94 PolarHBondContact O-N 3.32Å; S91-I94 PolarHBondContact O-N 3.23Å; I94-L97 PolarHBondContact O-N 3.42Å; I94-A98 VanDerWaalsContact O-CB 3.26Å; I94-A98 WeakPolarHBondContact O-CB 3.37Å; I94-A98 PolarHBondContact O-N 2.91Å; I94-A123 HydrophobicContact CG2-CB 3.92Å; I94-F126 HydrophobicContact CD1-CD1 4.26Å; I94-F126 HydrophobicContact CD1-CE1 3.99Å
95Y98.1Very high98.1Very high11 Ų1118.1 Ų18.14%0.04310%0.099CC..Hα-helixtrans-63.7-47.9-176.394.7-99.7000114.1S91 L97 A98 S99 L124 Y127 I277 T280S91-Y95 WeakPolarHBondContact O-CD1 3.49Å; S91-Y95 PolarHBondContact O-N 2.84Å; Y95-L97 VanDerWaalsContact C-N 3.32Å; Y95-L97 PolarHBondContact O-N 3.49Å; Y95-A98 PolarHBondContact O-N 2.84Å; Y95-S99 WeakPolarHBondContact O-CB 3.47Å; Y95-S99 PolarHBondContact O-N 3.45Å; Y95-L124 HydrophobicContact CD2-CD1 4.45Å; Y95-Y127 HydrophobicContact CD1-CD1 4.36Å; Y95-Y127 AromaticContact CD1-CD2 3.64Å; Y95-Y127 HydrophobicContact CD1-CD2 3.64Å; Y95-Y127 HydrophobicContact CD1-CE2 4.34Å; Y95-Y127 AromaticContact CD1-CG 3.65Å; Y95-Y127 HydrophobicContact CD1-CG 3.65Å; Y95-Y127 AromaticContact CE1-CD2 3.77Å; Y95-Y127 HydrophobicContact CE1-CD2 3.77Å; Y95-Y127 AromaticContact CE1-CE2 3.99Å; Y95-Y127 HydrophobicContact CE1-CE2 3.99Å; Y95-Y127 HydrophobicContact CE1-CG 4.05Å; Y95-Y127 HydrophobicContact CG-CG 4.32Å; Y95-I277 HydrophobicContact CE2-CD1 4.28Å; Y95-I277 WeakPolarHBondContact OH-CD1 3.39Å; Y95-T280 HydrophobicContact CE1-CG2 4.17Å; Y95-T280 PolarHBondContact OH-OG1 3.37Å
96P98.4Very high97.9Very high0 Ų018.1 Ų18.10%010%0.099CC..Hα-helixtrans-69.6-34.6179.229.1-35.6000110.9H56 T60 C92 C93 S99 S100 I277H56-P96 HydrophobicContact CB-CB 3.78Å; H56-P96 WeakPolarHBondContact CB-O 3.26Å; H56-P96 WeakPolarHBondContact O-CB 3.19Å; T60-P96 WeakPolarHBondContact OG1-CG 3.46Å; C92-P96 WeakPolarHBondContact O-CD 3.47Å; C92-P96 WeakPolarHBondContact O-CG 3.36Å; C93-P96 WeakPolarHBondContact O-CD 3.37Å; P96-S99 PolarHBondContact O-N 3.06Å; P96-S100 VanDerWaalsContact O-CB 3.26Å; P96-S100 WeakPolarHBondContact O-CB 3.47Å; P96-S100 PolarHBondContact O-N 2.85Å; P96-I277 HydrophobicContact CB-CD1 3.92Å; P96-I277 HydrophobicContact CG-CD1 4.49Å
97L98.5Very high97.7Very high69 Ų6918.1 Ų18.136%0.36110%0.1SC..Hα-helixtrans-62.6-48.3175.6-17456.1000111.9T60 C93 I94 Y95 S99 S100 C101T60-L97 HydrophobicContact CG2-CB 3.82Å; T60-L97 HydrophobicContact CG2-CD1 4.23Å; T60-L97 HydrophobicContact CG2-CD2 4.43Å; T60-L97 HydrophobicContact CG2-CG 4.37Å; T60-L97 PolarHBondContact OG1-N 2.98Å; C93-L97 VanDerWaalsContact O-CB 3.29Å; C93-L97 WeakPolarHBondContact O-CB 3.12Å; C93-L97 PolarHBondContact O-N 3.03Å; I94-L97 PolarHBondContact O-N 3.42Å; Y95-L97 VanDerWaalsContact C-N 3.32Å; Y95-L97 PolarHBondContact O-N 3.49Å; L97-S99 VanDerWaalsContact C-N 3.32Å; L97-S99 PolarHBondContact O-N 3.26Å; L97-S100 PolarHBondContact O-N 2.91Å; L97-C101 WeakPolarHBondContact O-CB 3.11Å; L97-C101 PolarHBondContact O-N 2.96Å; L97-C101 PolarHBondContact O-SG 3.25Å; L97-C101 VanDerWaalsContact O-SG 3.33Å
98A98.3Very high97.6Very high18 Ų1821.1 Ų21.115%0.14911%0.114CC..Hα-helixtrans-60.5-43.7178.600000111.1I94 Y95 C101 A102 A123I94-A98 VanDerWaalsContact O-CB 3.26Å; I94-A98 WeakPolarHBondContact O-CB 3.37Å; I94-A98 PolarHBondContact O-N 2.91Å; Y95-A98 PolarHBondContact O-N 2.84Å; A98-C101 PolarHBondContact O-N 2.96Å; A98-A102 WeakPolarHBondContact O-CB 3.46Å; A98-A102 PolarHBondContact O-N 3.41Å; A98-A123 HydrophobicContact CB-CB 3.56Å
99S98.1Very high97.2Very high2 Ų222.9 Ų22.91%0.01413%0.127CC..Hα-helixtrans-62.3-48.3175.7-175.60000112.6H56 Y95 P96 L97 C101 A102 H103 D120H56-S99 PolarHBondContact CE1-OG 2.9Å; H56-S99 WeakPolarHBondContact ND1-CB 3.41Å; H56-S99 PolarHBondContact ND1-OG 3.45Å; Y95-S99 WeakPolarHBondContact O-CB 3.47Å; Y95-S99 PolarHBondContact O-N 3.45Å; P96-S99 PolarHBondContact O-N 3.06Å; L97-S99 VanDerWaalsContact C-N 3.32Å; L97-S99 PolarHBondContact O-N 3.26Å; S99-C101 PolarHBondContact O-N 3.28Å; S99-A102 WeakPolarHBondContact O-CB 3.26Å; S99-A102 PolarHBondContact O-N 2.88Å; S99-H103 PolarHBondContact O-CD2 3.45Å; S99-H103 VanDerWaalsContact O-CD2 3.26Å; S99-H103 PolarHBondContact O-N 3.27Å; S99-D120 VanDerWaalsContact CA-OD1 3.24Å; S99-D120 WeakPolarHBondContact CA-OD1 3.31Å; S99-D120 WeakPolarHBondContact CB-OD1 3.41Å
100S98.4Very high96.7Very high3 Ų324.7 Ų24.72%0.02114%0.138CC..Hα-helixtrans-58.1-46.2176.2168.80000111.7I53 P96 L97 A102 H103 T104I53-S100 WeakPolarHBondContact CG2-OG 3.48Å; P96-S100 VanDerWaalsContact O-CB 3.26Å; P96-S100 WeakPolarHBondContact O-CB 3.47Å; P96-S100 PolarHBondContact O-N 2.85Å; L97-S100 PolarHBondContact O-N 2.91Å; S100-A102 VanDerWaalsContact C-N 3.31Å; S100-A102 PolarHBondContact O-N 3Å; S100-H103 PolarHBondContact O-N 3.44Å; S100-T104 VanDerWaalsContact O-CB 3.32Å; S100-T104 WeakPolarHBondContact O-CB 3.15Å; S100-T104 PolarHBondContact O-N 3.31Å; S100-T104 PolarHBondContact O-OG1 3.19Å
101C98.2Very high96.2Very high50 Ų5024.2 Ų24.234%0.33813%0.132SC..Hα-helixtrans-60.1-42.2173.5-74.90000111.3L97 A98 S99 T104 F105L97-C101 WeakPolarHBondContact O-CB 3.11Å; L97-C101 PolarHBondContact O-N 2.96Å; L97-C101 PolarHBondContact O-SG 3.25Å; L97-C101 VanDerWaalsContact O-SG 3.33Å; A98-C101 PolarHBondContact O-N 2.96Å; S99-C101 PolarHBondContact O-N 3.28Å; C101-T104 PolarHBondContact O-N 3.47Å; C101-F105 HydrophobicContact CB-CD2 4.37Å; C101-F105 VanDerWaalsContact O-CD2 3.24Å; C101-F105 WeakPolarHBondContact O-CD2 3.41Å; C101-F105 PolarHBondContact O-N 2.83Å
102A97.6Very high95.8Very high1 Ų125.2 Ų25.21%0.00814%0.14CC..Hα-helixtrans-64.5-47.3-178.900000112.3A98 S99 S100 T104 S106 C116 F117 D120A98-A102 WeakPolarHBondContact O-CB 3.46Å; A98-A102 PolarHBondContact O-N 3.41Å; S99-A102 WeakPolarHBondContact O-CB 3.26Å; S99-A102 PolarHBondContact O-N 2.88Å; S100-A102 VanDerWaalsContact C-N 3.31Å; S100-A102 PolarHBondContact O-N 3Å; A102-T104 VanDerWaalsContact C-N 3.32Å; A102-T104 PolarHBondContact O-N 3.26Å; A102-S106 WeakPolarHBondContact O-CA 3.46Å; A102-S106 WeakPolarHBondContact O-CB 3.18Å; A102-S106 PolarHBondContact O-N 3.49Å; A102-C116 HydrophobicContact CB-CB 3.89Å; A102-C116 WeakPolarHBondContact CB-O 3.4Å; A102-F117 HydrophobicContact CB-CD1 4.32Å; A102-F117 HydrophobicContact CB-CD2 4.22Å; A102-F117 HydrophobicContact CB-CG 4.21Å; A102-D120 HydrophobicContact CB-CB 4.07Å
103H97.6Very high95.5Very high6 Ų626.2 Ų26.23%0.02814%0.144CC..Hα-helixtrans-62.2-40.7173.7-76.3-79000111.2R30 E49 N52 I53 S99 S100 S106 F117 H269 H273R30-H103 PolarHBondContact NH2-O 3.13Å; E49-H103 IonicContact OE1-ND1 2.64Å; E49-H103 IonicContact OE2-CE1 3.89Å; E49-H103 IonicContact OE2-CG 3.14Å; E49-H103 IonicContact OE2-ND1 3.61Å; E49-H103 PolarHBondContact OE2-ND1 3.32Å; N52-H103 HydrophobicContact CB-CB 4.41Å; I53-H103 HydrophobicContact CG1-CB 3.66Å; S99-H103 PolarHBondContact O-CD2 3.45Å; S99-H103 VanDerWaalsContact O-CD2 3.26Å; S99-H103 PolarHBondContact O-N 3.27Å; S100-H103 PolarHBondContact O-N 3.44Å; H103-S106 PolarHBondContact O-OG 3.3Å; H103-F117 AromaticContact CE1-CZ 3.93Å; H103-F117 AromaticContact NE2-CE1 3.95Å; H103-H269 AromaticContact CE1-CD2 3.72Å; H103-H269 AromaticContact CE1-NE2 3.3Å; H103-H269 PolarHBondContact CE1-NE2 2.76Å; H103-H269 VanDerWaalsContact CE1-NE2 3.3Å; H103-H269 AromaticContact NE2-CD2 3.9Å; H103-H269 AromaticContact NE2-NE2 3.13Å; H103-H269 PolarHBondContact NE2-NE2 3.41Å; H103-H269 VanDerWaalsContact NE2-NE2 3.13Å; H103-H273 AromaticContact CD2-CE1 3.7Å; H103-H273 AromaticContact NE2-CE1 3.52Å; H103-H273 AromaticContact NE2-NE2 3.78Å
104T97.7Very high95.1Very high8 Ų827.3 Ų27.35%0.04915%0.148CC..Hα-helixtrans-60.3-54.4178.4-59.70000112.4R30 C39 L43 I53 S100 C101 A102R30-T104 PolarHBondContact NH1-O 2.93Å; C39-T104 HydrophobicContact CB-CG2 4.16Å; C39-T104 WeakPolarHBondContact CB-O 3.43Å; L43-T104 HydrophobicContact CD2-CG2 4.15Å; I53-T104 WeakPolarHBondContact CG2-OG1 3.33Å; S100-T104 VanDerWaalsContact O-CB 3.32Å; S100-T104 WeakPolarHBondContact O-CB 3.15Å; S100-T104 PolarHBondContact O-N 3.31Å; S100-T104 PolarHBondContact O-OG1 3.19Å; C101-T104 PolarHBondContact O-N 3.47Å; A102-T104 VanDerWaalsContact C-N 3.32Å; A102-T104 PolarHBondContact O-N 3.26Å
105F97.1Very high94.8Very high54 Ų5426.1 Ų26.124%0.23714%0.141CC..Hα-helixtrans-94.1-1.7-170.3-62-66.3000114.6C39 I40 C101 T107 M108C39-F105 HydrophobicContact CB-CD1 3.85Å; C39-F105 HydrophobicContact CB-CE1 4.13Å; I40-F105 HydrophobicContact CG1-CE1 4.27Å; I40-F105 HydrophobicContact CG1-CZ 4.35Å; C101-F105 HydrophobicContact CB-CD2 4.37Å; C101-F105 VanDerWaalsContact O-CD2 3.24Å; C101-F105 WeakPolarHBondContact O-CD2 3.41Å; C101-F105 PolarHBondContact O-N 2.83Å; F105-T107 PolarHBondContact O-N 3.5Å; F105-M108 HydrophobicContact CB-CG 4.46Å; F105-M108 HydrophobicContact CB-SD 3.95Å; F105-M108 HydrophobicContact CD1-CG 4.47Å; F105-M108 HydrophobicContact CD1-SD 3.63Å; F105-M108 HydrophobicContact CG-SD 4.18Å; F105-M108 WeakPolarHBondContact O-CG 3.33Å; F105-M108 PolarHBondContact O-N 3.46Å; F105-M108 VanDerWaalsContact O-N 3.14Å
106S93.7Very high94.7Very high0 Ų026.8 Ų26.80%015%0.147CC..THydrogen-bonded Turntrans-57.6-17.5179.360.70000114.9Y20 A102 H103 R113Y20-S106 WeakPolarHBondContact CE1-O 3.32Å; A102-S106 WeakPolarHBondContact O-CA 3.46Å; A102-S106 WeakPolarHBondContact O-CB 3.18Å; A102-S106 PolarHBondContact O-N 3.49Å; H103-S106 PolarHBondContact O-OG 3.3Å; S106-R113 VanDerWaalsContact O-CB 3.31Å; S106-R113 WeakPolarHBondContact O-CB 3.42Å
107T93.8Very high94.6Very high8 Ų827.2 Ų27.25%0.04915%0.149CC..THydrogen-bonded Turntrans-96.5-1.9-175.654.20000113.2R30 H31 P32 R33 S34 C39 F105R30-T107 HydrophobicContact CB-CG2 3.79Å; H31-T107 VanDerWaalsContact O-O 3.11Å; P32-T107 CarbonylContact C-O 3.49Å; R33-T107 PolarHBondContact N-O 3Å; S34-T107 PolarHBondContact N-O 2.64Å; S34-T107 VanDerWaalsContact N-O 3.07Å; C39-T107 PolarHBondContact SG-OG1 3.25Å; F105-T107 PolarHBondContact O-N 3.5Å
108M94.2Very high94.5Very high68 Ų6824 Ų2434%0.33513%0.132SC..SBendtrans-68.1-42.3179.5-67.2-17968.700112.6R33 S34 A36 C39 F105 A112R33-M108 WeakPolarHBondContact CA-O 3.16Å; S34-M108 WeakPolarHBondContact O-CA 3.47Å; A36-M108 HydrophobicContact CB-CE 3.9Å; A36-M108 HydrophobicContact CB-SD 4.35Å; C39-M108 VanDerWaalsContact SG-CG 3.54Å; F105-M108 HydrophobicContact CB-CG 4.46Å; F105-M108 HydrophobicContact CB-SD 3.95Å; F105-M108 HydrophobicContact CD1-CG 4.47Å; F105-M108 HydrophobicContact CD1-SD 3.63Å; F105-M108 HydrophobicContact CG-SD 4.18Å; F105-M108 WeakPolarHBondContact O-CG 3.33Å; F105-M108 PolarHBondContact O-N 3.46Å; F105-M108 VanDerWaalsContact O-N 3.14Å; M108-A112 HydrophobicContact CB-CB 4.02Å
109S91.1Very high94.5Very high37 Ų3727.6 Ų27.626%0.25915%0.145SC..  trans-168163174.8650000110.1R111 A112 R113S109-R111 PolarHBondContact O-N 3.34Å; S109-A112 PolarHBondContact O-N 3.09Å; S109-A112 WeakPolarHBondContact OG-CB 3.39Å; S109-A112 PolarHBondContact OG-N 2.87Å; S109-R113 WeakPolarHBondContact O-CB 3.16Å; S109-R113 PolarHBondContact O-N 3.29Å
110P86.6Confident94.4Very high38 Ų3828.4 Ų28.425%0.24715%0.149CC..Hα-helixtrans-57.5-36172.3-25.835.6000112.4Y20 R113 H114Y20-P110 HydrophobicContact CE2-CG 4.37Å; Y20-P110 VanDerWaalsContact OH-CD 3.26Å; Y20-P110 WeakPolarHBondContact OH-CD 3.46Å; Y20-P110 VanDerWaalsContact OH-N 3.15Å; P110-R113 WeakPolarHBondContact O-CB 3.32Å; P110-R113 PolarHBondContact O-N 2.74Å; P110-H114 PolarHBondContact O-CD2 3.29Å; P110-H114 PolarHBondContact O-N 2.87Å; P110-H114 VanDerWaalsContact O-N 3.11Å
111R88.5Confident94.4Very high65 Ų6528.4 Ų28.425%0.24515%0.149CC..Hα-helixtrans-63.5-51.6176.9-64.2177-174.3-178.10.3111.3S109 R113 H114 I115 F184 L332 G335 P336S109-R111 PolarHBondContact O-N 3.34Å; R111-R113 VanDerWaalsContact C-N 3.26Å; R111-R113 PolarHBondContact O-N 3.22Å; R111-H114 PolarHBondContact O-N 3.27Å; R111-I115 WeakPolarHBondContact O-CG1 3.41Å; R111-I115 PolarHBondContact O-N 3Å; R111-F184 HydrophobicContact CG-CE1 4.25Å; R111-F184 VanDerWaalsContact NE-CE1 3.33Å; R111-L332 VanDerWaalsContact CD-O 3.28Å; R111-L332 WeakPolarHBondContact CD-O 3.21Å; R111-L332 PolarHBondContact NE-O 2.85Å; R111-G335 PolarHBondContact NH2-O 3.39Å; R111-G335 VanDerWaalsContact NH2-O 3.13Å; R111-P336 PolarHBondContact NH2-O 3.14Å
112A91Very high94.3Very high21 Ų2126.3 Ų26.317%0.17414%0.135CC..Hα-helixtrans-57.7-41.6176.300000111.1M108 S109 H114 I115 C116M108-A112 HydrophobicContact CB-CB 4.02Å; S109-A112 PolarHBondContact O-N 3.09Å; S109-A112 WeakPolarHBondContact OG-CB 3.39Å; S109-A112 PolarHBondContact OG-N 2.87Å; A112-H114 VanDerWaalsContact C-N 3.29Å; A112-H114 PolarHBondContact O-N 2.87Å; A112-I115 PolarHBondContact O-N 3.38Å; A112-C116 WeakPolarHBondContact O-CB 2.99Å; A112-C116 PolarHBondContact O-N 3.17Å; A112-C116 PolarHBondContact O-SG 2.93Å
113R91.1Very high94.4Very high21 Ų2126.6 Ų26.68%0.07914%0.137CC..Hα-helixtrans-59-32.7174.6-174166169.6121.6-3113.7V19 E22 S106 S109 P110 R111 F117 R172V19-R113 PolarHBondContact O-NE 2.6Å; V19-R113 PolarHBondContact O-NH2 2.72Å; E22-R113 IonicContact OE1-CZ 2.67Å; E22-R113 IonicContact OE1-NH2 3.54Å; E22-R113 PolarHBondContact OE1-NH2 2.74Å; S106-R113 VanDerWaalsContact O-CB 3.31Å; S106-R113 WeakPolarHBondContact O-CB 3.42Å; S109-R113 WeakPolarHBondContact O-CB 3.16Å; S109-R113 PolarHBondContact O-N 3.29Å; P110-R113 WeakPolarHBondContact O-CB 3.32Å; P110-R113 PolarHBondContact O-N 2.74Å; R111-R113 VanDerWaalsContact C-N 3.26Å; R111-R113 PolarHBondContact O-N 3.22Å; R113-F117 HydrophobicContact CG-CD2 4.4Å; R113-F117 HydrophobicContact CG-CE2 4.35Å; R113-F117 WeakPolarHBondContact O-CD2 3.45Å; R113-R172 VanDerWaalsContact CG-NH2 3.34Å; R113-R172 PolarHBondContact O-NE 3.14Å; R113-R172 PolarHBondContact O-NH2 3.1Å
114H90.3Very high94.4Very high32 Ų3228.5 Ų28.515%0.14815%0.148CC..Hα-helixtrans-77.1-52.6174.9-76.7-75000110.9P110 R111 A112 C116 F117 F118 R172 L332P110-H114 PolarHBondContact O-CD2 3.29Å; P110-H114 PolarHBondContact O-N 2.87Å; P110-H114 VanDerWaalsContact O-N 3.11Å; R111-H114 PolarHBondContact O-N 3.27Å; A112-H114 VanDerWaalsContact C-N 3.29Å; A112-H114 PolarHBondContact O-N 2.87Å; H114-C116 PolarHBondContact O-N 3.42Å; H114-F117 PolarHBondContact O-N 3.27Å; H114-F118 HydrophobicContact CB-CE2 4.2Å; H114-F118 HydrophobicContact CB-CZ 4.16Å; H114-F118 VanDerWaalsContact O-CG 3.27Å; H114-F118 WeakPolarHBondContact O-CG 3.33Å; H114-F118 PolarHBondContact O-N 2.88Å; H114-R172 PolarHBondContact CE1-O 3.22Å; H114-L332 HydrophobicContact CB-CD1 3.56Å
115I93.5Very high94.3Very high36 Ų3628.1 Ų28.119%0.18515%0.145CC..Hα-helixtrans-58.3-48.2-176.5-64.4172.1000111.2R111 A112 F117 F118 F119 L332 L333R111-I115 WeakPolarHBondContact O-CG1 3.41Å; R111-I115 PolarHBondContact O-N 3Å; A112-I115 PolarHBondContact O-N 3.38Å; I115-F117 VanDerWaalsContact C-N 3.3Å; I115-F117 PolarHBondContact O-N 3.4Å; I115-F118 WeakPolarHBondContact O-CB 3.42Å; I115-F118 PolarHBondContact O-N 3.14Å; I115-F118 VanDerWaalsContact O-N 3.08Å; I115-F119 HydrophobicContact CG2-CD2 4.01Å; I115-F119 HydrophobicContact CG2-CE2 3.72Å; I115-F119 VanDerWaalsContact O-CD2 3.3Å; I115-F119 WeakPolarHBondContact O-CD2 3.43Å; I115-F119 PolarHBondContact O-N 2.86Å; I115-F119 VanDerWaalsContact O-N 3.15Å; I115-L332 HydrophobicContact CG1-CD1 4.08Å; I115-L333 HydrophobicContact CD1-CD2 4.17Å
116C95.9Very high94.4Very high25 Ų2525.9 Ų25.917%0.16914%0.135CC..Hα-helixtrans-55.5-44.7178.9-77.90000112.8A102 A112 H114 F119 D120A102-C116 HydrophobicContact CB-CB 3.89Å; A102-C116 WeakPolarHBondContact CB-O 3.4Å; A112-C116 WeakPolarHBondContact O-CB 2.99Å; A112-C116 PolarHBondContact O-N 3.17Å; A112-C116 PolarHBondContact O-SG 2.93Å; H114-C116 PolarHBondContact O-N 3.42Å; C116-F119 WeakPolarHBondContact O-CB 3.41Å; C116-F119 PolarHBondContact O-N 3.45Å; C116-D120 PolarHBondContact O-N 2.88Å; C116-D120 VanDerWaalsContact O-N 3.08Å
117F95.4Very high94.6Very high10 Ų1027.3 Ų27.34%0.04414%0.141CC..Hα-helixtrans-79-18.3179.9-81.2-88.3000113.1A102 H103 R113 H114 I115 D120 Y121 R172A102-F117 HydrophobicContact CB-CD1 4.32Å; A102-F117 HydrophobicContact CB-CD2 4.22Å; A102-F117 HydrophobicContact CB-CG 4.21Å; H103-F117 AromaticContact CE1-CZ 3.93Å; H103-F117 AromaticContact NE2-CE1 3.95Å; R113-F117 HydrophobicContact CG-CD2 4.4Å; R113-F117 HydrophobicContact CG-CE2 4.35Å; R113-F117 WeakPolarHBondContact O-CD2 3.45Å; H114-F117 PolarHBondContact O-N 3.27Å; I115-F117 VanDerWaalsContact C-N 3.3Å; I115-F117 PolarHBondContact O-N 3.4Å; F117-D120 HydrophobicContact CD1-CB 4.4Å; F117-D120 PolarHBondContact O-N 3.14Å; F117-Y121 HydrophobicContact CB-CE1 4.5Å; F117-Y121 HydrophobicContact CD1-CE1 4.44Å; F117-Y121 VanDerWaalsContact O-CD1 3.27Å; F117-Y121 WeakPolarHBondContact O-CD1 3.38Å; F117-Y121 VanDerWaalsContact O-CD2 3.23Å; F117-Y121 WeakPolarHBondContact O-CD2 3.4Å; F117-Y121 PolarHBondContact O-N 3.03Å; F117-R172 VanDerWaalsContact CD2-CZ 3.42Å; F117-R172 VanDerWaalsContact CE2-NH2 3.29Å; F117-R172 VanDerWaalsContact CG-NH2 3.29Å
118F96.3Very high94.8Very high0 Ų027.7 Ų27.70%014%0.144CC..Hα-helixtrans-66.3-40.7166.6-61.2-29.6000111.2H114 I115 Y121 G122 C169 R172 L173 I325 F328 L332H114-F118 HydrophobicContact CB-CE2 4.2Å; H114-F118 HydrophobicContact CB-CZ 4.16Å; H114-F118 VanDerWaalsContact O-CG 3.27Å; H114-F118 WeakPolarHBondContact O-CG 3.33Å; H114-F118 PolarHBondContact O-N 2.88Å; I115-F118 WeakPolarHBondContact O-CB 3.42Å; I115-F118 PolarHBondContact O-N 3.14Å; I115-F118 VanDerWaalsContact O-N 3.08Å; F118-Y121 HydrophobicContact CD1-CD2 4.47Å; F118-Y121 PolarHBondContact O-N 3.2Å; F118-G122 PolarHBondContact O-N 2.87Å; F118-C169 HydrophobicContact CD1-CB 3.95Å; F118-C169 WeakPolarHBondContact CD1-SG 3.23Å; F118-C169 HydrophobicContact CE1-CB 3.95Å; F118-R172 HydrophobicContact CE1-CB 4.13Å; F118-L173 HydrophobicContact CE1-CB 4.47Å; F118-L173 HydrophobicContact CE2-CD2 4.4Å; F118-L173 HydrophobicContact CZ-CB 3.9Å; F118-L173 HydrophobicContact CZ-CD2 4Å; F118-I325 HydrophobicContact CB-CG1 4.11Å; F118-I325 HydrophobicContact CB-CG2 4.01Å; F118-F328 HydrophobicContact CD2-CB 4.23Å; F118-F328 HydrophobicContact CE2-CB 3.8Å; F118-F328 HydrophobicContact CZ-CB 4.06Å; F118-L332 HydrophobicContact CE2-CD1 3.96Å
119F97.8Very high95Very high94 Ų9424.4 Ų24.441%0.41213%0.128SC..Hα-helixtrans-63-42.7171.5-77.5-74.6000112.2I115 C116 Y121 G122 A123 L322 I325I115-F119 HydrophobicContact CG2-CD2 4.01Å; I115-F119 HydrophobicContact CG2-CE2 3.72Å; I115-F119 VanDerWaalsContact O-CD2 3.3Å; I115-F119 WeakPolarHBondContact O-CD2 3.43Å; I115-F119 PolarHBondContact O-N 2.86Å; I115-F119 VanDerWaalsContact O-N 3.15Å; C116-F119 WeakPolarHBondContact O-CB 3.41Å; C116-F119 PolarHBondContact O-N 3.45Å; F119-Y121 PolarHBondContact O-N 3.39Å; F119-G122 PolarHBondContact O-N 3.43Å; F119-A123 VanDerWaalsContact O-CB 3.29Å; F119-A123 WeakPolarHBondContact O-CB 3.37Å; F119-A123 PolarHBondContact O-N 3.17Å; F119-L322 HydrophobicContact CE1-CD2 3.84Å; F119-I325 HydrophobicContact CD1-CD1 3.91Å; F119-I325 HydrophobicContact CD2-CG2 4.28Å; F119-I325 HydrophobicContact CE1-CD1 4.25Å; F119-I325 HydrophobicContact CE1-CG2 4.24Å; F119-I325 HydrophobicContact CE2-CG2 3.99Å; F119-I325 HydrophobicContact CG-CD1 4.38Å; F119-I325 HydrophobicContact CZ-CG2 3.96Å
120D97.8Very high95.4Very high19 Ų1922.7 Ų22.710%0.10212%0.116CC..Hα-helixtrans-55.7-48.6173.6-176.631.9000111.8S99 A102 C116 F117 G122 A123 L124S99-D120 VanDerWaalsContact CA-OD1 3.24Å; S99-D120 WeakPolarHBondContact CA-OD1 3.31Å; S99-D120 WeakPolarHBondContact CB-OD1 3.41Å; A102-D120 HydrophobicContact CB-CB 4.07Å; C116-D120 PolarHBondContact O-N 2.88Å; C116-D120 VanDerWaalsContact O-N 3.08Å; F117-D120 HydrophobicContact CD1-CB 4.4Å; F117-D120 PolarHBondContact O-N 3.14Å; D120-G122 PolarHBondContact O-N 3.43Å; D120-A123 PolarHBondContact O-N 3.24Å; D120-L124 PolarHBondContact O-N 3.39Å
121Y96.5Very high95.9Very high4 Ų421.1 Ų21.12%0.01611%0.106CC..Hα-helixtrans-64.3-43.1178.5-59.3-19.1000113.3F117 F118 F119 A123 L124 S125 A168 R172 R199 F203F117-Y121 HydrophobicContact CB-CE1 4.5Å; F117-Y121 HydrophobicContact CD1-CE1 4.44Å; F117-Y121 VanDerWaalsContact O-CD1 3.27Å; F117-Y121 WeakPolarHBondContact O-CD1 3.38Å; F117-Y121 VanDerWaalsContact O-CD2 3.23Å; F117-Y121 WeakPolarHBondContact O-CD2 3.4Å; F117-Y121 PolarHBondContact O-N 3.03Å; F118-Y121 HydrophobicContact CD1-CD2 4.47Å; F118-Y121 PolarHBondContact O-N 3.2Å; F119-Y121 PolarHBondContact O-N 3.39Å; Y121-A123 VanDerWaalsContact C-N 3.29Å; Y121-A123 PolarHBondContact O-N 3.13Å; Y121-L124 PolarHBondContact O-N 3.16Å; Y121-S125 PolarHBondContact O-N 3.1Å; Y121-A168 HydrophobicContact CD2-CB 3.49Å; Y121-A168 VanDerWaalsContact CD2-CB 3.49Å; Y121-A168 HydrophobicContact CE2-CB 4.15Å; Y121-A168 VanDerWaalsContact CE2-O 3.3Å; Y121-A168 WeakPolarHBondContact CE2-O 3.46Å; Y121-A168 HydrophobicContact CG-CB 3.69Å; Y121-R172 HydrophobicContact CE2-CB 4.19Å; Y121-R172 PolarHBondContact OH-NH1 3.27Å; Y121-R199 VanDerWaalsContact OH-CZ 3.3Å; Y121-R199 PolarHBondContact OH-NE 3.27Å; Y121-R199 PolarHBondContact OH-NH2 3.1Å; Y121-F203 HydrophobicContact CD1-CE2 4.28Å; Y121-F203 AromaticContact CD1-CZ 3.9Å; Y121-F203 HydrophobicContact CD1-CZ 3.9Å; Y121-F203 HydrophobicContact CG-CZ 4.08Å
122G97.8Very high96.4Very high5 Ų518 Ų185%0.05210%0.095CC..Hα-helixtrans-66.1-32.5176.600000112.7F118 F119 D120 S125 F126 N321F118-G122 PolarHBondContact O-N 2.87Å; F119-G122 PolarHBondContact O-N 3.43Å; D120-G122 PolarHBondContact O-N 3.43Å; G122-S125 PolarHBondContact O-OG 3.01Å; G122-F126 WeakPolarHBondContact O-CB 3.44Å; G122-F126 PolarHBondContact O-N 3.2Å; G122-N321 PolarHBondContact O-ND2 3.36Å; G122-N321 VanDerWaalsContact O-ND2 3.15Å
123A98.3Very high96.7Very high7 Ų717 Ų176%0.0589%0.086CC..Hα-helixtrans-71.5-38.2174.800000112I94 A98 F119 D120 Y121 F126 Y127I94-A123 HydrophobicContact CG2-CB 3.92Å; A98-A123 HydrophobicContact CB-CB 3.56Å; F119-A123 VanDerWaalsContact O-CB 3.29Å; F119-A123 WeakPolarHBondContact O-CB 3.37Å; F119-A123 PolarHBondContact O-N 3.17Å; D120-A123 PolarHBondContact O-N 3.24Å; Y121-A123 VanDerWaalsContact C-N 3.29Å; Y121-A123 PolarHBondContact O-N 3.13Å; A123-F126 PolarHBondContact O-N 2.96Å; A123-Y127 PolarHBondContact O-N 3.08Å
124L97.2Very high97.1Very high46 Ų4616 Ų1624%0.2418%0.083CC..Hα-helixtrans-66.2-37.4174.4-170.960.3000112.1Y95 D120 Y121 Y127 S128 F203Y95-L124 HydrophobicContact CD2-CD1 4.45Å; D120-L124 PolarHBondContact O-N 3.39Å; Y121-L124 PolarHBondContact O-N 3.16Å; L124-Y127 HydrophobicContact CD1-CD1 4.18Å; L124-Y127 WeakPolarHBondContact O-CB 3.42Å; L124-Y127 PolarHBondContact O-N 3.4Å; L124-S128 PolarHBondContact O-N 3.45Å; L124-S128 VanDerWaalsContact O-N 3.07Å; L124-F203 HydrophobicContact CB-CD1 4.48Å; L124-F203 HydrophobicContact CB-CE1 3.97Å; L124-F203 HydrophobicContact CD2-CD1 3.5Å; L124-F203 VanDerWaalsContact CD2-CD1 3.5Å; L124-F203 HydrophobicContact CD2-CD2 4.29Å; L124-F203 HydrophobicContact CD2-CE1 3.52Å; L124-F203 HydrophobicContact CD2-CE2 4.31Å; L124-F203 HydrophobicContact CD2-CG 3.91Å; L124-F203 HydrophobicContact CD2-CZ 3.95Å; L124-F203 HydrophobicContact CG-CD1 3.89Å; L124-F203 HydrophobicContact CG-CE1 3.87Å
125S97.6Very high97.4Very high0 Ų014.6 Ų14.60%08%0.076CC..Hα-helixtrans-68.6-35.4173.773.50000112.3Y121 G122 Y127 S128 L129 T161 T165 N321Y121-S125 PolarHBondContact O-N 3.1Å; G122-S125 PolarHBondContact O-OG 3.01Å; S125-Y127 VanDerWaalsContact C-N 3.34Å; S125-S128 PolarHBondContact O-N 2.86Å; S125-L129 PolarHBondContact O-N 3.07Å; S125-L129 VanDerWaalsContact O-N 3.14Å; S125-T161 VanDerWaalsContact O-CG2 3.27Å; S125-T161 WeakPolarHBondContact O-CG2 3.27Å; S125-T165 WeakPolarHBondContact CB-OG1 3.45Å; S125-T165 PolarHBondContact OG-OG1 3.06Å; S125-N321 PolarHBondContact OG-ND2 2.79Å; S125-N321 PolarHBondContact OG-OD1 3.31Å
126F98.4Very high97.6Very high7 Ų713.1 Ų13.13%0.0317%0.069CC..Hα-helixtrans-64.4-37.4171.2-176.1-118.6000112.5L90 S91 I94 G122 A123 L129 G130 A314 C317 V318L90-F126 HydrophobicContact CD2-CE1 4.45Å; L90-F126 HydrophobicContact CD2-CZ 4.44Å; L90-F126 HydrophobicContact CG-CE1 4.33Å; S91-F126 VanDerWaalsContact CB-CD1 3.47Å; I94-F126 HydrophobicContact CD1-CD1 4.26Å; I94-F126 HydrophobicContact CD1-CE1 3.99Å; G122-F126 WeakPolarHBondContact O-CB 3.44Å; G122-F126 PolarHBondContact O-N 3.2Å; A123-F126 PolarHBondContact O-N 2.96Å; F126-L129 PolarHBondContact O-N 3.33Å; F126-G130 PolarHBondContact O-N 3.43Å; F126-A314 HydrophobicContact CE2-CB 3.85Å; F126-A314 HydrophobicContact CZ-CB 4.27Å; F126-C317 HydrophobicContact CD2-CB 4.23Å; F126-V318 HydrophobicContact CD2-CG2 3.97Å; F126-V318 HydrophobicContact CE2-CG2 3.8Å; F126-V318 HydrophobicContact CG-CG2 4.45Å; F126-V318 HydrophobicContact CZ-CG2 4.14Å
127Y98.4Very high97.7Very high30 Ų3012.7 Ų12.712%0.1186%0.064CC..Hα-helixtrans-61.5-45.2172.5169.8-106000112.9F88 Y95 A123 L124 S125 L129 G130 A131 T280 Q283F88-Y127 HydrophobicContact CD2-CE2 4.5Å; F88-Y127 HydrophobicContact CE2-CD2 4.39Å; F88-Y127 AromaticContact CE2-CE2 3.71Å; F88-Y127 HydrophobicContact CE2-CE2 3.71Å; F88-Y127 HydrophobicContact CZ-CE2 4.36Å; Y95-Y127 HydrophobicContact CD1-CD1 4.36Å; Y95-Y127 AromaticContact CD1-CD2 3.64Å; Y95-Y127 HydrophobicContact CD1-CD2 3.64Å; Y95-Y127 HydrophobicContact CD1-CE2 4.34Å; Y95-Y127 AromaticContact CD1-CG 3.65Å; Y95-Y127 HydrophobicContact CD1-CG 3.65Å; Y95-Y127 AromaticContact CE1-CD2 3.77Å; Y95-Y127 HydrophobicContact CE1-CD2 3.77Å; Y95-Y127 AromaticContact CE1-CE2 3.99Å; Y95-Y127 HydrophobicContact CE1-CE2 3.99Å; Y95-Y127 HydrophobicContact CE1-CG 4.05Å; Y95-Y127 HydrophobicContact CG-CG 4.32Å; A123-Y127 PolarHBondContact O-N 3.08Å; L124-Y127 HydrophobicContact CD1-CD1 4.18Å; L124-Y127 WeakPolarHBondContact O-CB 3.42Å; L124-Y127 PolarHBondContact O-N 3.4Å; S125-Y127 VanDerWaalsContact C-N 3.34Å; Y127-L129 PolarHBondContact O-N 3.32Å; Y127-G130 PolarHBondContact O-N 3.34Å; Y127-G130 VanDerWaalsContact O-N 3.11Å; Y127-A131 PolarHBondContact O-N 3.19Å; Y127-T280 HydrophobicContact CE2-CG2 3.78Å; Y127-T280 PolarHBondContact OH-OG1 3.22Å; Y127-Q283 PolarHBondContact OH-OE1 2.86Å
128S97.9Very high97.7Very high16 Ų1612.2 Ų12.211%0.1126%0.062CC..Hα-helixtrans-55.8-46.9173.9166.30000111.9L124 S125 G130 A131 A132 P206 D210L124-S128 PolarHBondContact O-N 3.45Å; L124-S128 VanDerWaalsContact O-N 3.07Å; S125-S128 PolarHBondContact O-N 2.86Å; S128-G130 PolarHBondContact O-N 3.37Å; S128-A131 WeakPolarHBondContact O-CB 3.08Å; S128-A131 PolarHBondContact O-N 2.93Å; S128-A132 PolarHBondContact O-N 3.05Å; S128-P206 WeakPolarHBondContact OG-CB 3.4Å; S128-D210 WeakPolarHBondContact CB-OD2 3.29Å; S128-D210 VanDerWaalsContact O-OD2 3.1Å; S128-D210 PolarHBondContact OG-OD2 3.36Å
129L98.4Very high97.6Very high0 Ų012.2 Ų12.20%06%0.062CC..Hα-helixtrans-62.3-42.1174.2178.663.1000112.9S125 F126 Y127 A131 A132 V133 A157 T161 P313 C317S125-L129 PolarHBondContact O-N 3.07Å; S125-L129 VanDerWaalsContact O-N 3.14Å; F126-L129 PolarHBondContact O-N 3.33Å; Y127-L129 PolarHBondContact O-N 3.32Å; L129-A131 VanDerWaalsContact C-N 3.27Å; L129-A131 PolarHBondContact O-N 3.05Å; L129-A132 PolarHBondContact O-N 3.11Å; L129-V133 HydrophobicContact CD1-CG2 4.13Å; L129-V133 HydrophobicContact CG-CG2 4.32Å; L129-V133 WeakPolarHBondContact O-CB 3.26Å; L129-V133 VanDerWaalsContact O-CG2 3.32Å; L129-V133 WeakPolarHBondContact O-CG2 3.28Å; L129-V133 PolarHBondContact O-N 2.89Å; L129-A157 HydrophobicContact CD1-CB 4.04Å; L129-T161 HydrophobicContact CB-CG2 3.64Å; L129-T161 HydrophobicContact CD2-CG2 4.45Å; L129-P313 HydrophobicContact CD2-CB 4.45Å; L129-P313 WeakPolarHBondContact CD2-O 3.02Å; L129-C317 HydrophobicContact CD2-CB 3.38Å
130G98.4Very high97.5Very high0 Ų07.9 Ų7.90%04%0.043CC..Hα-helixtrans-57-43.4175.700000111.9F126 Y127 S128 V133 V134F126-G130 PolarHBondContact O-N 3.43Å; Y127-G130 PolarHBondContact O-N 3.34Å; Y127-G130 VanDerWaalsContact O-N 3.11Å; S128-G130 PolarHBondContact O-N 3.37Å; G130-V133 PolarHBondContact O-N 3.08Å; G130-V134 WeakPolarHBondContact O-CG2 3.11Å; G130-V134 PolarHBondContact O-N 3.41Å; G130-V134 VanDerWaalsContact O-N 3.11Å
131A98.3Very high97.2Very high6 Ų67 Ų75%0.054%0.039CC..Hα-helixtrans-61.6-48.617500000112F88 Y127 S128 L129 V133 V134 Y135F88-A131 HydrophobicContact CE2-CB 4.5Å; Y127-A131 PolarHBondContact O-N 3.19Å; S128-A131 WeakPolarHBondContact O-CB 3.08Å; S128-A131 PolarHBondContact O-N 2.93Å; L129-A131 VanDerWaalsContact C-N 3.27Å; L129-A131 PolarHBondContact O-N 3.05Å; A131-V133 VanDerWaalsContact C-N 3.32Å; A131-V133 PolarHBondContact O-N 3.01Å; A131-V134 WeakPolarHBondContact O-CG2 3.12Å; A131-V134 PolarHBondContact O-N 3.48Å; A131-Y135 HydrophobicContact CB-CE2 4.47Å; A131-Y135 WeakPolarHBondContact O-CB 3.36Å; A131-Y135 WeakPolarHBondContact O-CD2 3.34Å; A131-Y135 PolarHBondContact O-N 3.37Å
132A98.3Very high97Very high0 Ų08.7 Ų8.70%05%0.048CC..Hα-helixtrans-58.3-44.117600000111.6S128 L129 V134 Y135 S136 Y153 A157S128-A132 PolarHBondContact O-N 3.05Å; L129-A132 PolarHBondContact O-N 3.11Å; A132-V134 PolarHBondContact O-N 3.41Å; A132-Y135 PolarHBondContact O-N 3Å; A132-S136 WeakPolarHBondContact O-CB 3.35Å; A132-S136 PolarHBondContact O-N 3.26Å; A132-Y153 HydrophobicContact CB-CE1 3.98Å; A132-Y153 VanDerWaalsContact O-CE1 3.28Å; A132-Y153 WeakPolarHBondContact O-CE1 3.47Å; A132-A157 HydrophobicContact CB-CB 3.53Å
133V98.3Very high96.6Very high0 Ų014 Ų140%07%0.069CC..Hα-helixtrans-59.1-51.7178.41670000110.9P84 L129 G130 A131 Y135 S136 F137 I154P84-V133 HydrophobicContact CB-CG1 3.71Å; P84-V133 HydrophobicContact CG-CG1 4.49Å; L129-V133 HydrophobicContact CD1-CG2 4.13Å; L129-V133 HydrophobicContact CG-CG2 4.32Å; L129-V133 WeakPolarHBondContact O-CB 3.26Å; L129-V133 VanDerWaalsContact O-CG2 3.32Å; L129-V133 WeakPolarHBondContact O-CG2 3.28Å; L129-V133 PolarHBondContact O-N 2.89Å; G130-V133 PolarHBondContact O-N 3.08Å; A131-V133 VanDerWaalsContact C-N 3.32Å; A131-V133 PolarHBondContact O-N 3.01Å; V133-Y135 VanDerWaalsContact C-N 3.34Å; V133-Y135 PolarHBondContact O-N 3.49Å; V133-S136 WeakPolarHBondContact O-CB 3.48Å; V133-S136 PolarHBondContact O-N 3.38Å; V133-F137 HydrophobicContact CG1-CD2 4.32Å; V133-F137 HydrophobicContact CG1-CE2 4.44Å; V133-F137 VanDerWaalsContact O-CD2 3.25Å; V133-F137 WeakPolarHBondContact O-CD2 3.16Å; V133-F137 PolarHBondContact O-N 3.01Å; V133-I154 HydrophobicContact CG2-CD1 4.39Å; V133-I154 HydrophobicContact CG2-CG2 4.33Å
134V97.9Very high96.3Very high0 Ų016.8 Ų16.80%08%0.079CC..Hα-helixtrans-66.9-33.3178.7-69.60000113.3P84 F88 G130 A131 A132 F137 Y138 V287P84-V134 HydrophobicContact CB-CG1 4.26Å; P84-V134 VanDerWaalsContact O-CG1 3.24Å; P84-V134 WeakPolarHBondContact O-CG1 3.13Å; F88-V134 HydrophobicContact CB-CB 4.39Å; F88-V134 HydrophobicContact CB-CG1 3.37Å; F88-V134 HydrophobicContact CB-CG2 4.14Å; F88-V134 HydrophobicContact CD1-CG1 4.4Å; F88-V134 HydrophobicContact CD1-CG2 4.47Å; F88-V134 HydrophobicContact CD2-CG2 3.89Å; F88-V134 HydrophobicContact CE2-CG2 4.44Å; F88-V134 HydrophobicContact CG-CG1 3.93Å; F88-V134 HydrophobicContact CG-CG2 3.9Å; G130-V134 WeakPolarHBondContact O-CG2 3.11Å; G130-V134 PolarHBondContact O-N 3.41Å; G130-V134 VanDerWaalsContact O-N 3.11Å; A131-V134 WeakPolarHBondContact O-CG2 3.12Å; A131-V134 PolarHBondContact O-N 3.48Å; A132-V134 PolarHBondContact O-N 3.41Å; V134-F137 PolarHBondContact O-N 3.28Å; V134-Y138 HydrophobicContact CB-CD2 4.03Å; V134-Y138 HydrophobicContact CB-CE2 4.28Å; V134-Y138 HydrophobicContact CG1-CD2 4.27Å; V134-Y138 HydrophobicContact CG1-CE2 4.01Å; V134-Y138 WeakPolarHBondContact O-CB 3.34Å; V134-Y138 PolarHBondContact O-N 2.89Å; V134-V287 HydrophobicContact CB-CB 4.38Å; V134-V287 HydrophobicContact CB-CG1 4.26Å; V134-V287 HydrophobicContact CG2-CB 4.41Å; V134-V287 HydrophobicContact CG2-CG1 3.89Å; V134-V287 HydrophobicContact CG2-CG2 4.47Å
135Y97.7Very high96.2Very high1 Ų115.5 Ų15.50%0.0047%0.073CC..Iπ-helixtrans-67.7-40.4175.6-69.1-17000112.5A131 A132 V133 F137 A139 F140 D210 L214 H238 Q283 V287A131-Y135 HydrophobicContact CB-CE2 4.47Å; A131-Y135 WeakPolarHBondContact O-CB 3.36Å; A131-Y135 WeakPolarHBondContact O-CD2 3.34Å; A131-Y135 PolarHBondContact O-N 3.37Å; A132-Y135 PolarHBondContact O-N 3Å; V133-Y135 VanDerWaalsContact C-N 3.34Å; V133-Y135 PolarHBondContact O-N 3.49Å; Y135-F137 VanDerWaalsContact C-N 3.28Å; Y135-F137 PolarHBondContact O-N 3.07Å; Y135-A139 HydrophobicContact CD1-CB 3.88Å; Y135-A139 HydrophobicContact CG-CB 4.43Å; Y135-A139 CarbonylContact O-C 3.31Å; Y135-A139 PolarHBondContact O-N 3.42Å; Y135-F140 PolarHBondContact O-N 3.47Å; Y135-D210 WeakPolarHBondContact CD2-O 3.38Å; Y135-L214 HydrophobicContact CD1-CD1 4.27Å; Y135-L214 HydrophobicContact CD1-CG 4.46Å; Y135-L214 HydrophobicContact CD2-CD1 4.25Å; Y135-L214 HydrophobicContact CD2-CG 4.39Å; Y135-L214 HydrophobicContact CE1-CD1 3.63Å; Y135-L214 HydrophobicContact CE1-CG 4.29Å; Y135-L214 HydrophobicContact CE2-CD1 3.59Å; Y135-L214 HydrophobicContact CE2-CG 4.21Å; Y135-L214 HydrophobicContact CG-CG 4.5Å; Y135-L214 VanDerWaalsContact OH-CD1 3.27Å; Y135-L214 WeakPolarHBondContact OH-CD1 3.24Å; Y135-H238 PolarHBondContact OH-CD2 3.38Å; Y135-H238 PolarHBondContact OH-NE2 3.45Å; Y135-Q283 HydrophobicContact CE1-CG 4.05Å; Y135-Q283 WeakPolarHBondContact OH-CG 3.2Å; Y135-Q283 PolarHBondContact OH-NE2 3.46Å; Y135-V287 HydrophobicContact CD1-CG1 4.01Å; Y135-V287 HydrophobicContact CE1-CG1 3.81Å
136S97.3Very high96Very high6 Ų618.6 Ų18.64%0.0429%0.089CC..Iπ-helixtrans-57-43.6174.7-159.40000111.5A132 V133 F140 H150A132-S136 WeakPolarHBondContact O-CB 3.35Å; A132-S136 PolarHBondContact O-N 3.26Å; V133-S136 WeakPolarHBondContact O-CB 3.48Å; V133-S136 PolarHBondContact O-N 3.38Å; S136-F140 WeakPolarHBondContact O-CB 3.13Å; S136-H150 PolarHBondContact O-NE2 2.86Å; S136-H150 PolarHBondContact OG-CD2 3.22Å; S136-H150 PolarHBondContact OG-NE2 3.42Å
137F96.9Very high95.8Very high16 Ų1620 Ų207%0.0710%0.1CC..Iπ-helixtrans-85.4-38.2-175.1-76.3-72.2000114.4P84 V133 V134 Y135 I154 L298 V305 N309P84-F137 HydrophobicContact CB-CB 4.34Å; P84-F137 HydrophobicContact CB-CD2 3.78Å; P84-F137 HydrophobicContact CB-CG 4.3Å; P84-F137 HydrophobicContact CG-CB 4.18Å; P84-F137 HydrophobicContact CG-CD2 3.43Å; P84-F137 VanDerWaalsContact CG-CD2 3.43Å; P84-F137 HydrophobicContact CG-CE2 3.95Å; P84-F137 HydrophobicContact CG-CG 3.79Å; V133-F137 HydrophobicContact CG1-CD2 4.32Å; V133-F137 HydrophobicContact CG1-CE2 4.44Å; V133-F137 VanDerWaalsContact O-CD2 3.25Å; V133-F137 WeakPolarHBondContact O-CD2 3.16Å; V133-F137 PolarHBondContact O-N 3.01Å; V134-F137 PolarHBondContact O-N 3.28Å; Y135-F137 VanDerWaalsContact C-N 3.28Å; Y135-F137 PolarHBondContact O-N 3.07Å; F137-I154 HydrophobicContact CE2-CD1 3.86Å; F137-I154 HydrophobicContact CZ-CD1 4.48Å; F137-L298 VanDerWaalsContact O-CD1 3.24Å; F137-L298 WeakPolarHBondContact O-CD1 3.47Å; F137-V305 HydrophobicContact CD1-CG2 3.66Å; F137-V305 HydrophobicContact CE1-CB 4.29Å; F137-V305 HydrophobicContact CE1-CG2 3.65Å; F137-V305 HydrophobicContact CG-CG2 4.32Å; F137-V305 HydrophobicContact CZ-CG1 4.4Å; F137-V305 HydrophobicContact CZ-CG2 4.3Å; F137-N309 WeakPolarHBondContact CE2-O 3.45Å; F137-N309 HydrophobicContact CZ-CB 4.11Å
138Y96.4Very high95.7Very high0 Ų022.9 Ų22.90%012%0.124CC..Iπ-helixtrans-114.9-24.3-168.4-49-41.3000113.9F81 P84 L85 V134 V287 D290 M291 R294F81-Y138 HydrophobicContact CD1-CE1 4.09Å; F81-Y138 HydrophobicContact CE1-CD1 4.1Å; F81-Y138 AromaticContact CE1-CE1 3.66Å; F81-Y138 HydrophobicContact CE1-CE1 3.66Å; F81-Y138 HydrophobicContact CE2-CE1 4.36Å; F81-Y138 AromaticContact CZ-CD1 3.99Å; F81-Y138 HydrophobicContact CZ-CD1 3.99Å; F81-Y138 AromaticContact CZ-CE1 3.81Å; F81-Y138 HydrophobicContact CZ-CE1 3.81Å; F81-Y138 PolarHBondContact O-OH 3.31Å; P84-Y138 HydrophobicContact CB-CE2 4.12Å; P84-Y138 WeakPolarHBondContact CD-OH 3.4Å; L85-Y138 HydrophobicContact CB-CE2 4.14Å; L85-Y138 PolarHBondContact N-OH 3.06Å; V134-Y138 HydrophobicContact CB-CD2 4.03Å; V134-Y138 HydrophobicContact CB-CE2 4.28Å; V134-Y138 HydrophobicContact CG1-CD2 4.27Å; V134-Y138 HydrophobicContact CG1-CE2 4.01Å; V134-Y138 WeakPolarHBondContact O-CB 3.34Å; V134-Y138 PolarHBondContact O-N 2.89Å; Y138-V287 HydrophobicContact CD2-CB 4.44Å; Y138-D290 WeakPolarHBondContact O-CB 3.5Å; Y138-M291 HydrophobicContact CD1-CB 4Å; Y138-M291 HydrophobicContact CD1-CG 4.06Å; Y138-M291 HydrophobicContact CD2-CB 3.97Å; Y138-M291 HydrophobicContact CD2-CG 4.46Å; Y138-M291 HydrophobicContact CE1-CB 4.12Å; Y138-M291 HydrophobicContact CE1-CG 3.7Å; Y138-M291 HydrophobicContact CE1-SD 4.42Å; Y138-M291 HydrophobicContact CE2-CB 4.08Å; Y138-M291 HydrophobicContact CE2-CG 4.13Å; Y138-M291 HydrophobicContact CE2-SD 4.22Å; Y138-M291 HydrophobicContact CG-CB 3.93Å; Y138-M291 HydrophobicContact CG-CG 4.43Å; Y138-R294 WeakPolarHBondContact O-CD 3.48Å; Y138-R294 PolarHBondContact O-NH1 2.88Å
139A94.9Very high95.6Very high0 Ų025.1 Ų25.10%013%0.132CC..Iπ-helixtrans-114.7-8.2-171.600000114.4Y135 L214 R294Y135-A139 HydrophobicContact CD1-CB 3.88Å; Y135-A139 HydrophobicContact CG-CB 4.43Å; Y135-A139 CarbonylContact O-C 3.31Å; Y135-A139 PolarHBondContact O-N 3.42Å; A139-L214 HydrophobicContact CB-CD2 3.68Å; A139-R294 VanDerWaalsContact C-NH1 3.34Å
140F94.5Very high95.6Very high2 Ų225.6 Ų25.61%0.00913%0.134CC..SBendtrans-61.3136.2-177.7-140.3-99.6000111.2Y135 S136 W144 F149 H150 Y153 P213 R294Y135-F140 PolarHBondContact O-N 3.47Å; S136-F140 WeakPolarHBondContact O-CB 3.13Å; F140-W144 HydrophobicContact CD1-CB 3.73Å; F140-W144 HydrophobicContact CE1-CB 3.38Å; F140-W144 HydrophobicContact CE1-CE3 4.17Å; F140-W144 HydrophobicContact CE1-CG 4.44Å; F140-W144 WeakPolarHBondContact CE1-O 3.39Å; F140-W144 HydrophobicContact CZ-CB 4.48Å; F140-W144 HydrophobicContact CZ-CE3 4.37Å; F140-F149 HydrophobicContact CE1-CD1 4.29Å; F140-F149 HydrophobicContact CE2-CD1 4.47Å; F140-F149 HydrophobicContact CE2-CE1 4.23Å; F140-F149 AromaticContact CZ-CD1 3.56Å; F140-F149 HydrophobicContact CZ-CD1 3.56Å; F140-F149 AromaticContact CZ-CE1 3.73Å; F140-F149 HydrophobicContact CZ-CE1 3.73Å; F140-H150 HydrophobicContact CD1-CB 4.22Å; F140-H150 AromaticContact CD1-CD2 3.9Å; F140-H150 AromaticContact CD2-CD2 3.94Å; F140-H150 HydrophobicContact CE1-CB 3.55Å; F140-H150 AromaticContact CE1-CD2 3.87Å; F140-H150 AromaticContact CE1-CG 3.84Å; F140-H150 AromaticContact CE2-CD2 3.93Å; F140-H150 AromaticContact CG-CD2 3.91Å; F140-H150 HydrophobicContact CZ-CB 3.84Å; F140-H150 AromaticContact CZ-CD2 3.89Å; F140-Y153 HydrophobicContact CE2-CD1 4.12Å; F140-Y153 HydrophobicContact CE2-CD2 4.29Å; F140-Y153 HydrophobicContact CE2-CE1 4.41Å; F140-Y153 HydrophobicContact CE2-CG 4.04Å; F140-P213 HydrophobicContact CD2-CB 3.68Å; F140-P213 HydrophobicContact CD2-CG 3.63Å; F140-P213 HydrophobicContact CE2-CB 3.9Å; F140-P213 HydrophobicContact CE2-CG 3.41Å; F140-P213 VanDerWaalsContact CE2-CG 3.41Å; F140-P213 HydrophobicContact CG-CB 4.3Å; F140-P213 HydrophobicContact CZ-CG 4.29Å; F140-R294 PolarHBondContact O-NH1 2.92Å; F140-R294 PolarHBondContact O-NH2 3.21Å
141P92.8Very high95.4Very high2 Ų230.4 Ų30.41%0.01316%0.157CC..  trans-59.5136.9179.3-23.731.3000112.3K143 W144 V145 P213 Y216 R217P141-K143 PolarHBondContact O-N 3.03Å; P141-K143 VanDerWaalsContact O-N 3.16Å; P141-W144 HydrophobicContact CB-CD2 4.39Å; P141-W144 HydrophobicContact CB-CG 4.35Å; P141-W144 HydrophobicContact CG-CD2 4.19Å; P141-W144 HydrophobicContact CG-CE3 3.92Å; P141-W144 HydrophobicContact CG-CZ3 4.41Å; P141-W144 PolarHBondContact O-N 3.39Å; P141-V145 PolarHBondContact O-N 2.86Å; P141-P213 HydrophobicContact CG-CB 4.46Å; P141-P213 WeakPolarHBondContact CG-O 3.4Å; P141-Y216 HydrophobicContact CB-CD1 3.74Å; P141-Y216 HydrophobicContact CB-CE1 3.98Å; P141-Y216 HydrophobicContact CG-CD1 3.5Å; P141-Y216 HydrophobicContact CG-CE1 4.25Å; P141-Y216 HydrophobicContact CG-CG 4.36Å; P141-R217 HydrophobicContact CG-CB 4.34Å
142D91.5Very high95.3Very high39 Ų3937.9 Ų37.921%0.20918%0.184CC..G310 helixtrans-51.4-43.5-176.6-61-35.4000112.4W144 V145 T227 R294 W297D142-W144 PolarHBondContact O-N 3.32Å; D142-V145 WeakPolarHBondContact O-CB 3.45Å; D142-V145 PolarHBondContact O-N 3.44Å; D142-T227 PolarHBondContact OD1-OG1 2.73Å; D142-T227 PolarHBondContact OD2-OG1 2.78Å; D142-R294 IonicContact OD1-CZ 3.63Å; D142-R294 IonicContact OD1-NE 2.8Å; D142-R294 IonicContact OD1-NH2 2.63Å; D142-R294 PolarHBondContact OD1-NH2 2.91Å; D142-W297 HydrophobicContact CB-CH2 3.71Å; D142-W297 HydrophobicContact CB-CZ2 3.91Å; D142-W297 HydrophobicContact CB-CZ3 4.4Å; D142-W297 WeakPolarHBondContact OD1-CH2 3.12Å; D142-W297 VanDerWaalsContact OD1-CZ3 3.32Å; D142-W297 WeakPolarHBondContact OD1-CZ3 3.33Å
143K89.9Confident95.3Very high116 Ų11637.9 Ų37.950%0.50418%0.184SC..G310 helixtrans-63.3-21.6179-64.6-179.6-177.6171.10114.2P141 D224P141-K143 PolarHBondContact O-N 3.03Å; P141-K143 VanDerWaalsContact O-N 3.16Å; K143-D224 WeakPolarHBondContact CE-O 3.44Å; K143-D224 PolarHBondContact NZ-O 3.28Å
144W92.5Very high95.3Very high66 Ų6638.5 Ų38.525%0.2519%0.187CC..G310 helixtrans-104.3-8-178.1-60.5-6.5000112.6F140 P141 D142 N146 S147 F149 H150 I212 Y216F140-W144 HydrophobicContact CD1-CB 3.73Å; F140-W144 HydrophobicContact CE1-CB 3.38Å; F140-W144 HydrophobicContact CE1-CE3 4.17Å; F140-W144 HydrophobicContact CE1-CG 4.44Å; F140-W144 WeakPolarHBondContact CE1-O 3.39Å; F140-W144 HydrophobicContact CZ-CB 4.48Å; F140-W144 HydrophobicContact CZ-CE3 4.37Å; P141-W144 HydrophobicContact CB-CD2 4.39Å; P141-W144 HydrophobicContact CB-CG 4.35Å; P141-W144 HydrophobicContact CG-CD2 4.19Å; P141-W144 HydrophobicContact CG-CE3 3.92Å; P141-W144 HydrophobicContact CG-CZ3 4.41Å; P141-W144 PolarHBondContact O-N 3.39Å; D142-W144 PolarHBondContact O-N 3.32Å; W144-N146 PolarHBondContact O-N 3.19Å; W144-S147 WeakPolarHBondContact O-CB 3.35Å; W144-S147 PolarHBondContact O-N 2.92Å; W144-S147 PolarHBondContact O-OG 3.28Å; W144-F149 HydrophobicContact CE3-CD1 4.03Å; W144-F149 HydrophobicContact CE3-CE1 4.11Å; W144-F149 HydrophobicContact CZ3-CD1 4.28Å; W144-F149 HydrophobicContact CZ3-CE1 4Å; W144-H150 WeakPolarHBondContact O-CB 3.49Å; W144-I212 HydrophobicContact CH2-CG2 4.39Å; W144-I212 HydrophobicContact CZ3-CG2 4.13Å; W144-Y216 HydrophobicContact CD2-CD1 4.48Å; W144-Y216 VanDerWaalsContact CH2-CB 3.46Å; W144-Y216 HydrophobicContact CH2-CD1 4.16Å; W144-Y216 AromaticContact CH2-CD2 3.67Å; W144-Y216 HydrophobicContact CH2-CD2 3.67Å; W144-Y216 HydrophobicContact CH2-CE2 4.45Å; W144-Y216 AromaticContact CH2-CG 3.48Å; W144-Y216 HydrophobicContact CH2-CG 3.48Å; W144-Y216 VanDerWaalsContact CH2-CG 3.48Å; W144-Y216 AromaticContact CZ2-CD1 3.89Å; W144-Y216 HydrophobicContact CZ2-CD1 3.89Å; W144-Y216 AromaticContact CZ2-CD2 3.31Å; W144-Y216 HydrophobicContact CZ2-CD2 3.31Å; W144-Y216 HydrophobicContact CZ2-CE1 4.16Å; W144-Y216 AromaticContact CZ2-CE2 3.65Å; W144-Y216 HydrophobicContact CZ2-CE2 3.65Å; W144-Y216 AromaticContact CZ2-CG 3.42Å; W144-Y216 HydrophobicContact CZ2-CG 3.42Å; W144-Y216 VanDerWaalsContact CZ2-CG 3.42Å; W144-Y216 HydrophobicContact CZ3-CG 4.16Å
145V93.6Very high95.2Very high19 Ų1941.4 Ų41.412%0.11521%0.206CC..THydrogen-bonded Turntrans-56.7137.5174.31750000109.3P141 D142 S147 W297 A302P141-V145 PolarHBondContact O-N 2.86Å; D142-V145 WeakPolarHBondContact O-CB 3.45Å; D142-V145 PolarHBondContact O-N 3.44Å; V145-S147 PolarHBondContact O-N 3.35Å; V145-W297 HydrophobicContact CB-CH2 4.26Å; V145-W297 HydrophobicContact CG2-CH2 4.11Å; V145-W297 HydrophobicContact CG2-CZ3 4.02Å; V145-A302 HydrophobicContact CG1-CB 3.66Å
146N93.6Very high95.2Very high64 Ų6444.1 Ų44.134%0.34222%0.22SC..THydrogen-bonded Turntrans59.62-173.6-51.8-28.8000117.1W144 H150 Q151 N301 M303W144-N146 PolarHBondContact O-N 3.19Å; N146-H150 PolarHBondContact N-ND1 2.86Å; N146-H150 VanDerWaalsContact N-ND1 3.17Å; N146-Q151 PolarHBondContact O-NE2 3.46Å; N146-Q151 VanDerWaalsContact O-NE2 3.16Å; N146-N301 PolarHBondContact ND2-O 2.87Å; N146-M303 WeakPolarHBondContact OD1-CG 3.35Å; N146-M303 PolarHBondContact OD1-N 3.33Å; N146-M303 VanDerWaalsContact OD1-N 3.11Å
147S95.4Very high95.3Very high38 Ų3843.9 Ų43.927%0.26622%0.218SC..SBendtrans-63.3164.3173.170.90000112.2W144 V145 F149 H150 Q151W144-S147 WeakPolarHBondContact O-CB 3.35Å; W144-S147 PolarHBondContact O-N 2.92Å; W144-S147 PolarHBondContact O-OG 3.28Å; V145-S147 PolarHBondContact O-N 3.35Å; S147-F149 PolarHBondContact O-N 3.31Å; S147-H150 WeakPolarHBondContact O-CB 3.41Å; S147-H150 PolarHBondContact O-N 3.45Å; S147-H150 VanDerWaalsContact O-N 3.07Å; S147-H150 PolarHBondContact OG-N 3.44Å; S147-Q151 WeakPolarHBondContact O-CG 3.46Å; S147-Q151 PolarHBondContact O-N 3.25Å
148S95.8Very high95.3Very high89 Ų8944 Ų4462%0.62222%0.22SC*.Hα-helixtrans-57.7-36.2174.3-52.10000112.4Q151 W152S148-Q151 PolarHBondContact O-N 3.06Å; S148-W152 VanDerWaalsContact O-CD1 3.31Å; S148-W152 PolarHBondContact O-N 3.43Å
149F96.4Very high95.3Very high64 Ų6446.3 Ų46.328%0.28124%0.239SC..Hα-helixtrans-63.1-44.3175.6178.6-121.3000111F140 W144 S147 Q151 W152 Y153 F209 I212 P213F140-F149 HydrophobicContact CE1-CD1 4.29Å; F140-F149 HydrophobicContact CE2-CD1 4.47Å; F140-F149 HydrophobicContact CE2-CE1 4.23Å; F140-F149 AromaticContact CZ-CD1 3.56Å; F140-F149 HydrophobicContact CZ-CD1 3.56Å; F140-F149 AromaticContact CZ-CE1 3.73Å; F140-F149 HydrophobicContact CZ-CE1 3.73Å; W144-F149 HydrophobicContact CE3-CD1 4.03Å; W144-F149 HydrophobicContact CE3-CE1 4.11Å; W144-F149 HydrophobicContact CZ3-CD1 4.28Å; W144-F149 HydrophobicContact CZ3-CE1 4Å; S147-F149 PolarHBondContact O-N 3.31Å; F149-Q151 PolarHBondContact O-N 3Å; F149-W152 PolarHBondContact O-N 2.95Å; F149-Y153 HydrophobicContact CE1-CD2 4.4Å; F149-Y153 HydrophobicContact CE2-CD2 4.36Å; F149-Y153 AromaticContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CE2 4.42Å; F149-Y153 WeakPolarHBondContact O-CB 3.26Å; F149-Y153 PolarHBondContact O-N 2.66Å; F149-F209 HydrophobicContact CE2-CE2 4.22Å; F149-I212 HydrophobicContact CE1-CG2 4.14Å; F149-I212 HydrophobicContact CZ-CB 4.43Å; F149-I212 HydrophobicContact CZ-CG2 4Å; F149-P213 HydrophobicContact CE1-CG 4.49Å
150H96.5Very high95.4Very high9 Ų946.6 Ų46.64%0.04224%0.241CC..Hα-helixtrans-60.6-43.1177.1-172.9-145.9000112.5S136 F140 W144 N146 S147 W152 Y153S136-H150 PolarHBondContact O-NE2 2.86Å; S136-H150 PolarHBondContact OG-CD2 3.22Å; S136-H150 PolarHBondContact OG-NE2 3.42Å; F140-H150 HydrophobicContact CD1-CB 4.22Å; F140-H150 AromaticContact CD1-CD2 3.9Å; F140-H150 AromaticContact CD2-CD2 3.94Å; F140-H150 HydrophobicContact CE1-CB 3.55Å; F140-H150 AromaticContact CE1-CD2 3.87Å; F140-H150 AromaticContact CE1-CG 3.84Å; F140-H150 AromaticContact CE2-CD2 3.93Å; F140-H150 AromaticContact CG-CD2 3.91Å; F140-H150 HydrophobicContact CZ-CB 3.84Å; F140-H150 AromaticContact CZ-CD2 3.89Å; W144-H150 WeakPolarHBondContact O-CB 3.49Å; N146-H150 PolarHBondContact N-ND1 2.86Å; N146-H150 VanDerWaalsContact N-ND1 3.17Å; S147-H150 WeakPolarHBondContact O-CB 3.41Å; S147-H150 PolarHBondContact O-N 3.45Å; S147-H150 VanDerWaalsContact O-N 3.07Å; S147-H150 PolarHBondContact OG-N 3.44Å; H150-W152 VanDerWaalsContact C-N 3.34Å; H150-W152 PolarHBondContact O-N 2.92Å; H150-Y153 WeakPolarHBondContact O-CB 3.48Å; H150-Y153 PolarHBondContact O-N 3.36Å
151Q94.6Very high95.5Very high101 Ų10146.6 Ų46.647%0.47224%0.241SC..Hα-helixtrans-64.5-37.1-179.6-66.3175.317.200112.7N146 S147 S148 F149 M303N146-Q151 PolarHBondContact O-NE2 3.46Å; N146-Q151 VanDerWaalsContact O-NE2 3.16Å; S147-Q151 WeakPolarHBondContact O-CG 3.46Å; S147-Q151 PolarHBondContact O-N 3.25Å; S148-Q151 PolarHBondContact O-N 3.06Å; F149-Q151 PolarHBondContact O-N 3Å; Q151-M303 HydrophobicContact CG-CE 4.19Å; Q151-M303 HydrophobicContact CG-SD 4.43Å
152W96.7Very high95.7Very high164 Ų16449 Ų4962%0.62126%0.255SS*.Hα-helixtrans-88.1-10.3179.4-75.9106.5000114.4S148 F149 H150 I154 P155 I156S148-W152 VanDerWaalsContact O-CD1 3.31Å; S148-W152 PolarHBondContact O-N 3.43Å; F149-W152 PolarHBondContact O-N 2.95Å; H150-W152 VanDerWaalsContact C-N 3.34Å; H150-W152 PolarHBondContact O-N 2.92Å; W152-I154 PolarHBondContact O-N 2.84Å; W152-P155 HydrophobicContact CE3-CB 4.05Å; W152-P155 HydrophobicContact CE3-CG 4.33Å; W152-P155 HydrophobicContact CZ3-CB 4.41Å; W152-P155 WeakPolarHBondContact O-CD 3.44Å; W152-I156 HydrophobicContact CB-CD1 3.94Å; W152-I156 HydrophobicContact CB-CG1 4.49Å; W152-I156 WeakPolarHBondContact O-CB 3.37Å; W152-I156 WeakPolarHBondContact O-CD1 3.41Å; W152-I156 WeakPolarHBondContact O-CG1 3.44Å; W152-I156 PolarHBondContact O-N 3.24Å
153Y97.9Very high95.8Very high0 Ų051.3 Ų51.30%027%0.267CS..Hα-helixtrans-60.2-50.7-173.5-179.7-107.7000113.2A132 F140 F149 H150 I156 A157 F209 D210 P213A132-Y153 HydrophobicContact CB-CE1 3.98Å; A132-Y153 VanDerWaalsContact O-CE1 3.28Å; A132-Y153 WeakPolarHBondContact O-CE1 3.47Å; F140-Y153 HydrophobicContact CE2-CD1 4.12Å; F140-Y153 HydrophobicContact CE2-CD2 4.29Å; F140-Y153 HydrophobicContact CE2-CE1 4.41Å; F140-Y153 HydrophobicContact CE2-CG 4.04Å; F149-Y153 HydrophobicContact CE1-CD2 4.4Å; F149-Y153 HydrophobicContact CE2-CD2 4.36Å; F149-Y153 AromaticContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CE2 4.42Å; F149-Y153 WeakPolarHBondContact O-CB 3.26Å; F149-Y153 PolarHBondContact O-N 2.66Å; H150-Y153 WeakPolarHBondContact O-CB 3.48Å; H150-Y153 PolarHBondContact O-N 3.36Å; Y153-I156 PolarHBondContact O-N 2.91Å; Y153-A157 WeakPolarHBondContact O-CB 3.3Å; Y153-A157 PolarHBondContact O-N 3.09Å; Y153-F209 AromaticContact CD2-CE1 3.6Å; Y153-F209 HydrophobicContact CD2-CE1 3.6Å; Y153-F209 HydrophobicContact CD2-CE2 4.47Å; Y153-F209 AromaticContact CD2-CZ 3.55Å; Y153-F209 HydrophobicContact CD2-CZ 3.55Å; Y153-F209 HydrophobicContact CE2-CD1 4.15Å; Y153-F209 AromaticContact CE2-CE1 3.6Å; Y153-F209 HydrophobicContact CE2-CE1 3.6Å; Y153-F209 AromaticContact CE2-CZ 3.95Å; Y153-F209 HydrophobicContact CE2-CZ 3.95Å; Y153-F209 HydrophobicContact CG-CE1 4.46Å; Y153-F209 HydrophobicContact CG-CZ 4.46Å; Y153-D210 WeakPolarHBondContact OH-CA 3.43Å; Y153-D210 PolarHBondContact OH-O 3.49Å; Y153-P213 HydrophobicContact CE2-CG 3.91Å
154I97.7Very high96Very high12 Ų1245.9 Ų45.96%0.06224%0.244CC..Hα-helixtrans-67.2-44.5178.3-63178.3000112.5V133 F137 W152 I156 A157 T158 N309 P313V133-I154 HydrophobicContact CG2-CD1 4.39Å; V133-I154 HydrophobicContact CG2-CG2 4.33Å; F137-I154 HydrophobicContact CE2-CD1 3.86Å; F137-I154 HydrophobicContact CZ-CD1 4.48Å; W152-I154 PolarHBondContact O-N 2.84Å; I154-I156 VanDerWaalsContact C-N 3.34Å; I154-I156 PolarHBondContact O-N 2.99Å; I154-A157 PolarHBondContact O-N 3.48Å; I154-T158 WeakPolarHBondContact O-CB 3.43Å; I154-T158 PolarHBondContact O-N 3.48Å; I154-T158 PolarHBondContact O-OG1 3.38Å; I154-N309 WeakPolarHBondContact CD1-O 3.44Å; I154-P313 HydrophobicContact CG2-CB 4.04Å; I154-P313 HydrophobicContact CG2-CG 3.87Å
155P97.3Very high96.2Very high61 Ų6142.8 Ų42.840%0.39623%0.232SC..Hα-helixtrans-55.6-44171.9-29.334.5000113.7W152 T158 A159W152-P155 HydrophobicContact CE3-CB 4.05Å; W152-P155 HydrophobicContact CE3-CG 4.33Å; W152-P155 HydrophobicContact CZ3-CB 4.41Å; W152-P155 WeakPolarHBondContact O-CD 3.44Å; P155-T158 WeakPolarHBondContact O-CB 3.34Å; P155-T158 PolarHBondContact O-N 3.3Å; P155-A159 PolarHBondContact O-N 3.45Å
156I97.9Very high96.2Very high59 Ų5944.1 Ų44.130%0.30324%0.24SC..Hα-helixtrans-66-45177-66.8165.7000110.3W152 Y153 I154 T158 A159 N160 F209W152-I156 HydrophobicContact CB-CD1 3.94Å; W152-I156 HydrophobicContact CB-CG1 4.49Å; W152-I156 WeakPolarHBondContact O-CB 3.37Å; W152-I156 WeakPolarHBondContact O-CD1 3.41Å; W152-I156 WeakPolarHBondContact O-CG1 3.44Å; W152-I156 PolarHBondContact O-N 3.24Å; Y153-I156 PolarHBondContact O-N 2.91Å; I154-I156 VanDerWaalsContact C-N 3.34Å; I154-I156 PolarHBondContact O-N 2.99Å; I156-T158 PolarHBondContact O-N 3.41Å; I156-A159 PolarHBondContact O-N 2.89Å; I156-A159 VanDerWaalsContact O-N 3.12Å; I156-N160 WeakPolarHBondContact O-CB 3.34Å; I156-N160 PolarHBondContact O-N 2.9Å; I156-N160 PolarHBondContact O-OD1 3.4Å; I156-F209 HydrophobicContact CB-CE1 4.22Å; I156-F209 HydrophobicContact CB-CE2 4.31Å; I156-F209 HydrophobicContact CB-CZ 3.67Å; I156-F209 HydrophobicContact CD1-CZ 4.38Å; I156-F209 HydrophobicContact CG2-CD2 4.28Å; I156-F209 HydrophobicContact CG2-CE1 3.86Å; I156-F209 HydrophobicContact CG2-CE2 3.58Å; I156-F209 HydrophobicContact CG2-CZ 3.34Å
157A98.1Very high96.2Very high0 Ų042.9 Ų42.90%023%0.233CC..Hα-helixtrans-58-38.2175.100000111.9L129 A132 Y153 I154 N160 T161 F209L129-A157 HydrophobicContact CD1-CB 4.04Å; A132-A157 HydrophobicContact CB-CB 3.53Å; Y153-A157 WeakPolarHBondContact O-CB 3.3Å; Y153-A157 PolarHBondContact O-N 3.09Å; I154-A157 PolarHBondContact O-N 3.48Å; A157-N160 WeakPolarHBondContact O-CB 3.39Å; A157-N160 PolarHBondContact O-N 3.31Å; A157-T161 WeakPolarHBondContact O-CG2 3.26Å; A157-T161 PolarHBondContact O-N 3.2Å; A157-T161 VanDerWaalsContact O-N 3.14Å; A157-F209 HydrophobicContact CB-CE1 4.15Å
158T97.7Very high96Very high18 Ų1841.1 Ų41.111%0.1122%0.221CC..Hα-helixtrans-67.3-41.1175.9-530000111.8I154 P155 I156 N160 T161 L316I154-T158 WeakPolarHBondContact O-CB 3.43Å; I154-T158 PolarHBondContact O-N 3.48Å; I154-T158 PolarHBondContact O-OG1 3.38Å; P155-T158 WeakPolarHBondContact O-CB 3.34Å; P155-T158 PolarHBondContact O-N 3.3Å; I156-T158 PolarHBondContact O-N 3.41Å; T158-N160 VanDerWaalsContact C-N 3.29Å; T158-N160 PolarHBondContact O-N 2.95Å; T158-T161 PolarHBondContact O-N 3.39Å; T158-T161 PolarHBondContact O-OG1 3.49Å; T158-L316 HydrophobicContact CG2-CD2 4.21Å
159A97.1Very high95.8Very high49 Ų4936.9 Ų36.941%0.40519%0.191SC..Hα-helixtrans-64.6-36.9172.900000111.7P155 I156 T161 V162 I163P155-A159 PolarHBondContact O-N 3.45Å; I156-A159 PolarHBondContact O-N 2.89Å; I156-A159 VanDerWaalsContact O-N 3.12Å; A159-T161 VanDerWaalsContact C-N 3.28Å; A159-T161 PolarHBondContact O-N 3.47Å; A159-V162 WeakPolarHBondContact O-CB 3.45Å; A159-V162 PolarHBondContact O-N 3.29Å; A159-I163 WeakPolarHBondContact O-CG1 3.41Å; A159-I163 PolarHBondContact O-N 2.9Å; A159-I163 VanDerWaalsContact O-N 3.16Å
160N96.8Very high95.4Very high6 Ų635.8 Ų35.83%0.03219%0.185CC..Hα-helixtrans-62.4-33.1177.3-70.1-12.2000112.1I156 A157 T158 I163 C164 Y205 P206 F209I156-N160 WeakPolarHBondContact O-CB 3.34Å; I156-N160 PolarHBondContact O-N 2.9Å; I156-N160 PolarHBondContact O-OD1 3.4Å; A157-N160 WeakPolarHBondContact O-CB 3.39Å; A157-N160 PolarHBondContact O-N 3.31Å; T158-N160 VanDerWaalsContact C-N 3.29Å; T158-N160 PolarHBondContact O-N 2.95Å; N160-I163 PolarHBondContact O-N 2.72Å; N160-C164 WeakPolarHBondContact O-CB 3.48Å; N160-C164 PolarHBondContact O-N 3.23Å; N160-Y205 WeakPolarHBondContact OD1-CE1 3.23Å; N160-P206 HydrophobicContact CB-CB 4.4Å; N160-P206 HydrophobicContact CB-CG 4.3Å; N160-F209 WeakPolarHBondContact ND2-CD1 3.28Å
161T96.3Very high95Very high2 Ų236 Ų361%0.01219%0.187CC..Hα-helixtrans-65.8-39176.2700000112.4S125 L129 A157 T158 A159 C164 T165 C317S125-T161 VanDerWaalsContact O-CG2 3.27Å; S125-T161 WeakPolarHBondContact O-CG2 3.27Å; L129-T161 HydrophobicContact CB-CG2 3.64Å; L129-T161 HydrophobicContact CD2-CG2 4.45Å; A157-T161 WeakPolarHBondContact O-CG2 3.26Å; A157-T161 PolarHBondContact O-N 3.2Å; A157-T161 VanDerWaalsContact O-N 3.14Å; T158-T161 PolarHBondContact O-N 3.39Å; T158-T161 PolarHBondContact O-OG1 3.49Å; A159-T161 VanDerWaalsContact C-N 3.28Å; A159-T161 PolarHBondContact O-N 3.47Å; T161-C164 WeakPolarHBondContact O-CB 3.32Å; T161-C164 PolarHBondContact O-N 3.3Å; T161-T165 WeakPolarHBondContact O-CB 3.43Å; T161-T165 PolarHBondContact O-N 3.19Å; T161-T165 PolarHBondContact O-OG1 3Å; T161-C317 PolarHBondContact OG1-SG 3.41Å; T161-C317 VanDerWaalsContact OG1-SG 3.38Å
162V95.8Very high94.4Very high52 Ų5233.2 Ų33.232%0.31517%0.173SC..Hα-helixtrans-61.8-50.5176-1790000110A159 C164 T165 V166 V320 I324A159-V162 WeakPolarHBondContact O-CB 3.45Å; A159-V162 PolarHBondContact O-N 3.29Å; V162-C164 VanDerWaalsContact C-N 3.34Å; V162-C164 PolarHBondContact O-N 3.45Å; V162-T165 PolarHBondContact O-N 3.05Å; V162-V166 WeakPolarHBondContact O-CB 3.35Å; V162-V166 VanDerWaalsContact O-CG2 3.28Å; V162-V166 WeakPolarHBondContact O-CG2 3.48Å; V162-V166 PolarHBondContact O-N 2.82Å; V162-V320 HydrophobicContact CG1-CG1 4.36Å; V162-V320 HydrophobicContact CG2-CG1 3.72Å; V162-I324 HydrophobicContact CG1-CD1 4.15Å
163I94.4Very high93.4Very high88 Ų8827.7 Ų27.745%0.45116%0.155SC..Hα-helixtrans-60.2-47.3178.9-64.7167.9000110.1A159 N160 V166 L167A159-I163 WeakPolarHBondContact O-CG1 3.41Å; A159-I163 PolarHBondContact O-N 2.9Å; A159-I163 VanDerWaalsContact O-N 3.16Å; N160-I163 PolarHBondContact O-N 2.72Å; I163-V166 PolarHBondContact O-N 3.47Å; I163-L167 HydrophobicContact CG2-CD1 3.7Å; I163-L167 HydrophobicContact CG2-CG 4.19Å; I163-L167 WeakPolarHBondContact O-CB 3.3Å; I163-L167 VanDerWaalsContact O-CG 3.24Å; I163-L167 WeakPolarHBondContact O-CG 3.2Å; I163-L167 PolarHBondContact O-N 3.45Å
164C95.1Very high92.2Very high3 Ų328 Ų282%0.0216%0.158CC..Hα-helixtrans-55-55.8178.1177.10000111.8N160 T161 V162 V166 L167 A168 A202 F203 P206N160-C164 WeakPolarHBondContact O-CB 3.48Å; N160-C164 PolarHBondContact O-N 3.23Å; T161-C164 WeakPolarHBondContact O-CB 3.32Å; T161-C164 PolarHBondContact O-N 3.3Å; V162-C164 VanDerWaalsContact C-N 3.34Å; V162-C164 PolarHBondContact O-N 3.45Å; C164-V166 PolarHBondContact O-N 2.99Å; C164-L167 PolarHBondContact O-N 3.19Å; C164-A168 VanDerWaalsContact O-CB 3.23Å; C164-A168 WeakPolarHBondContact O-CB 3.32Å; C164-A168 PolarHBondContact O-N 3.47Å; C164-A202 WeakPolarHBondContact CB-O 3.44Å; C164-A202 PolarHBondContact SG-O 2.66Å; C164-F203 WeakPolarHBondContact SG-CD1 3.37Å; C164-F203 WeakPolarHBondContact SG-CE1 3.41Å; C164-P206 HydrophobicContact CB-CG 4.2Å
165T95.8Very high90.4Very high0 Ų032.1 Ų32.10%018%0.176CC..Hα-helixtrans-64.3-42.4-177.3-56.40000111.5S125 T161 V162 A168 C169 N321 I324S125-T165 WeakPolarHBondContact CB-OG1 3.45Å; S125-T165 PolarHBondContact OG-OG1 3.06Å; T161-T165 WeakPolarHBondContact O-CB 3.43Å; T161-T165 PolarHBondContact O-N 3.19Å; T161-T165 PolarHBondContact O-OG1 3Å; V162-T165 PolarHBondContact O-N 3.05Å; T165-A168 PolarHBondContact O-N 2.96Å; T165-C169 VanDerWaalsContact O-CB 3.32Å; T165-C169 WeakPolarHBondContact O-CB 3.27Å; T165-C169 PolarHBondContact O-N 2.83Å; T165-C169 PolarHBondContact O-SG 2.96Å; T165-N321 VanDerWaalsContact CB-OD1 3.28Å; T165-N321 WeakPolarHBondContact CB-OD1 3.46Å; T165-N321 WeakPolarHBondContact CG2-OD1 3.2Å; T165-N321 PolarHBondContact OG1-OD1 3Å; T165-I324 HydrophobicContact CG2-CB 4.23Å; T165-I324 HydrophobicContact CG2-CD1 4.32Å; T165-I324 HydrophobicContact CG2-CG2 3.82Å
166V94.1Very high88.3Confident47 Ų4729.8 Ų29.829%0.28516%0.16SC..Hα-helixtrans-61.6-49.9176.9170.40000111V162 I163 C164 A168 C169 Y170 I324V162-V166 WeakPolarHBondContact O-CB 3.35Å; V162-V166 VanDerWaalsContact O-CG2 3.28Å; V162-V166 WeakPolarHBondContact O-CG2 3.48Å; V162-V166 PolarHBondContact O-N 2.82Å; I163-V166 PolarHBondContact O-N 3.47Å; C164-V166 PolarHBondContact O-N 2.99Å; V166-A168 VanDerWaalsContact C-N 3.34Å; V166-A168 PolarHBondContact O-N 3.43Å; V166-C169 PolarHBondContact O-N 3.3Å; V166-Y170 WeakPolarHBondContact O-CB 3.29Å; V166-Y170 PolarHBondContact O-N 3.26Å; V166-I324 HydrophobicContact CG2-CD1 3.9Å; V166-I324 HydrophobicContact CG2-CG1 4.12Å; V166-I324 HydrophobicContact CG2-CG2 3.98Å
167L92.8Very high86.2Confident39 Ų3933.1 Ų33.120%0.20417%0.173CC..Hα-helixtrans-63.8-39.6179.7-70.6-179.7000111.8I163 C164 S171 F198 A202I163-L167 HydrophobicContact CG2-CD1 3.7Å; I163-L167 HydrophobicContact CG2-CG 4.19Å; I163-L167 WeakPolarHBondContact O-CB 3.3Å; I163-L167 VanDerWaalsContact O-CG 3.24Å; I163-L167 WeakPolarHBondContact O-CG 3.2Å; I163-L167 PolarHBondContact O-N 3.45Å; C164-L167 PolarHBondContact O-N 3.19Å; L167-S171 VanDerWaalsContact O-CB 3.3Å; L167-S171 WeakPolarHBondContact O-CB 3.4Å; L167-S171 PolarHBondContact O-N 3.31Å; L167-F198 HydrophobicContact CD2-CD1 3.86Å; L167-F198 HydrophobicContact CD2-CE1 4.17Å; L167-A202 HydrophobicContact CB-CB 3.83Å
168A92.3Very high83.9Confident0 Ų040.5 Ų40.50%021%0.212CC..Hα-helixtrans-67.5-45.8178.600000111.7Y121 C164 T165 V166 S171 R172 A202 F203Y121-A168 HydrophobicContact CD2-CB 3.49Å; Y121-A168 VanDerWaalsContact CD2-CB 3.49Å; Y121-A168 HydrophobicContact CE2-CB 4.15Å; Y121-A168 VanDerWaalsContact CE2-O 3.3Å; Y121-A168 WeakPolarHBondContact CE2-O 3.46Å; Y121-A168 HydrophobicContact CG-CB 3.69Å; C164-A168 VanDerWaalsContact O-CB 3.23Å; C164-A168 WeakPolarHBondContact O-CB 3.32Å; C164-A168 PolarHBondContact O-N 3.47Å; T165-A168 PolarHBondContact O-N 2.96Å; V166-A168 VanDerWaalsContact C-N 3.34Å; V166-A168 PolarHBondContact O-N 3.43Å; A168-S171 PolarHBondContact O-N 3.11Å; A168-S171 PolarHBondContact O-OG 3.13Å; A168-R172 PolarHBondContact O-N 2.88Å; A168-A202 HydrophobicContact CB-CB 4.34Å; A168-F203 HydrophobicContact CB-CE2 4.04Å; A168-F203 HydrophobicContact CB-CZ 3.7Å
169C91.8Very high81.5Confident0 Ų044.3 Ų44.30%023%0.228CC..Hα-helixtrans-62.5-45174.2-70.90000111.6F118 T165 V166 S171 R172 L173 F328F118-C169 HydrophobicContact CD1-CB 3.95Å; F118-C169 WeakPolarHBondContact CD1-SG 3.23Å; F118-C169 HydrophobicContact CE1-CB 3.95Å; T165-C169 VanDerWaalsContact O-CB 3.32Å; T165-C169 WeakPolarHBondContact O-CB 3.27Å; T165-C169 PolarHBondContact O-N 2.83Å; T165-C169 PolarHBondContact O-SG 2.96Å; V166-C169 PolarHBondContact O-N 3.3Å; C169-S171 PolarHBondContact O-N 2.94Å; C169-R172 PolarHBondContact O-N 3.33Å; C169-R172 VanDerWaalsContact O-N 3.14Å; C169-L173 PolarHBondContact O-N 2.89Å; C169-L173 VanDerWaalsContact O-N 3.09Å; C169-F328 HydrophobicContact CB-CB 4.31Å; C169-F328 HydrophobicContact CB-CD1 3.87Å; C169-F328 HydrophobicContact CB-CD2 3.58Å; C169-F328 HydrophobicContact CB-CE1 4.01Å; C169-F328 HydrophobicContact CB-CE2 3.74Å; C169-F328 HydrophobicContact CB-CG 3.65Å; C169-F328 HydrophobicContact CB-CZ 3.95Å
170Y88.1Confident79Confident42 Ų4249.7 Ų49.717%0.16524%0.239CC..Hα-helixtrans-59.6-44.2175.6176.2-103.8000112.2V166 R172 L173 G174 F175V166-Y170 WeakPolarHBondContact O-CB 3.29Å; V166-Y170 PolarHBondContact O-N 3.26Å; Y170-R172 PolarHBondContact O-N 3.31Å; Y170-L173 PolarHBondContact O-N 3.47Å; Y170-G174 VanDerWaalsContact CD2-C 3.42Å; Y170-G174 WeakPolarHBondContact O-CA 3.27Å; Y170-G174 PolarHBondContact O-N 3.5Å; Y170-F175 HydrophobicContact CD2-CB 4.46Å; Y170-F175 AromaticContact CD2-CD2 3.72Å; Y170-F175 HydrophobicContact CD2-CD2 3.72Å; Y170-F175 AromaticContact CD2-CE2 3.98Å; Y170-F175 HydrophobicContact CD2-CE2 3.98Å; Y170-F175 AromaticContact CD2-CG 3.99Å; Y170-F175 HydrophobicContact CD2-CG 3.99Å; Y170-F175 HydrophobicContact CE2-CB 4.1Å; Y170-F175 AromaticContact CE2-CD2 3.21Å; Y170-F175 HydrophobicContact CE2-CD2 3.21Å; Y170-F175 AromaticContact CE2-CE2 3.7Å; Y170-F175 HydrophobicContact CE2-CE2 3.7Å; Y170-F175 AromaticContact CE2-CG 3.78Å; Y170-F175 HydrophobicContact CE2-CG 3.78Å; Y170-F175 VanDerWaalsContact CE2-N 3.33Å
171S86.3Confident76.4Confident12 Ų1256.6 Ų56.68%0.08428%0.276CS..Hα-helixtrans-57.9-25.3178.977.70000113L167 A168 C169 S195 R199L167-S171 VanDerWaalsContact O-CB 3.3Å; L167-S171 WeakPolarHBondContact O-CB 3.4Å; L167-S171 PolarHBondContact O-N 3.31Å; A168-S171 PolarHBondContact O-N 3.11Å; A168-S171 PolarHBondContact O-OG 3.13Å; C169-S171 PolarHBondContact O-N 2.94Å; S171-S195 VanDerWaalsContact O-CB 3.31Å; S171-S195 WeakPolarHBondContact O-CB 3.23Å; S171-S195 PolarHBondContact O-OG 2.85Å; S171-R199 WeakPolarHBondContact OG-CG 3.34Å
172R83.1Confident74Confident43 Ų4359.5 Ų59.516%0.16231%0.306CS..Hα-helixtrans-95.8-36.4-175.3-161.6-177.6-178101.6-2112.9R113 H114 F117 F118 Y121 A168 C169 Y170R113-R172 VanDerWaalsContact CG-NH2 3.34Å; R113-R172 PolarHBondContact O-NE 3.14Å; R113-R172 PolarHBondContact O-NH2 3.1Å; H114-R172 PolarHBondContact CE1-O 3.22Å; F117-R172 VanDerWaalsContact CD2-CZ 3.42Å; F117-R172 VanDerWaalsContact CE2-NH2 3.29Å; F117-R172 VanDerWaalsContact CG-NH2 3.29Å; F118-R172 HydrophobicContact CE1-CB 4.13Å; Y121-R172 HydrophobicContact CE2-CB 4.19Å; Y121-R172 PolarHBondContact OH-NH1 3.27Å; A168-R172 PolarHBondContact O-N 2.88Å; C169-R172 PolarHBondContact O-N 3.33Å; C169-R172 VanDerWaalsContact O-N 3.14Å; Y170-R172 PolarHBondContact O-N 3.31Å
173L76.6Confident71.7Confident49 Ų4964.4 Ų64.426%0.25733%0.331SS..Hα-helixtrans-114.6-24.6-174.6-172.863.2000114.7F118 C169 Y170 F328 L332F118-L173 HydrophobicContact CE1-CB 4.47Å; F118-L173 HydrophobicContact CE2-CD2 4.4Å; F118-L173 HydrophobicContact CZ-CB 3.9Å; F118-L173 HydrophobicContact CZ-CD2 4Å; C169-L173 PolarHBondContact O-N 2.89Å; C169-L173 VanDerWaalsContact O-N 3.09Å; Y170-L173 PolarHBondContact O-N 3.47Å; L173-F328 HydrophobicContact CD2-CD1 4.45Å; L173-F328 VanDerWaalsContact CD2-O 3.29Å; L173-F328 WeakPolarHBondContact CD2-O 3.33Å; L173-L332 HydrophobicContact CD1-CD2 3.88Å; L173-L332 HydrophobicContact CD2-CD1 4.25Å; L173-L332 HydrophobicContact CD2-CD2 4.32Å; L173-L332 HydrophobicContact CD2-CG 4.17Å
174G71.8Confident69.5Low5 Ų564.8 Ų64.85%0.05233%0.329CS..  trans81.9-174.4-164.900000112.3Y170Y170-G174 VanDerWaalsContact CD2-C 3.42Å; Y170-G174 WeakPolarHBondContact O-CA 3.27Å; Y170-G174 PolarHBondContact O-N 3.5Å
175F59.2Low67.2Low100 Ų10068.6 Ų68.644%0.43935%0.352SS..  trans-78.1122.7179.4-98.1-66.4000109.6Y170 F177 L178Y170-F175 HydrophobicContact CD2-CB 4.46Å; Y170-F175 AromaticContact CD2-CD2 3.72Å; Y170-F175 HydrophobicContact CD2-CD2 3.72Å; Y170-F175 AromaticContact CD2-CE2 3.98Å; Y170-F175 HydrophobicContact CD2-CE2 3.98Å; Y170-F175 AromaticContact CD2-CG 3.99Å; Y170-F175 HydrophobicContact CD2-CG 3.99Å; Y170-F175 HydrophobicContact CE2-CB 4.1Å; Y170-F175 AromaticContact CE2-CD2 3.21Å; Y170-F175 HydrophobicContact CE2-CD2 3.21Å; Y170-F175 AromaticContact CE2-CE2 3.7Å; Y170-F175 HydrophobicContact CE2-CE2 3.7Å; Y170-F175 AromaticContact CE2-CG 3.78Å; Y170-F175 HydrophobicContact CE2-CG 3.78Å; Y170-F175 VanDerWaalsContact CE2-N 3.33Å; F175-F177 VanDerWaalsContact C-N 3.27Å; F175-F177 PolarHBondContact O-N 3.36Å; F175-F177 VanDerWaalsContact O-N 3.15Å; F175-L178 HydrophobicContact CB-CB 4.39Å
176P53.5Low64.6Low11 Ų1177.9 Ų77.97%0.07139%0.393CS..THydrogen-bonded Turntrans-65.6-25.1-168.4-16.225.6000115.3F327 F328 P331P176-F327 HydrophobicContact CG-CD1 4.4Å; P176-F327 HydrophobicContact CG-CE1 4Å; P176-F328 HydrophobicContact CG-CD1 3.72Å; P176-F328 HydrophobicContact CG-CE1 4Å; P176-F328 HydrophobicContact CG-CG 4.33Å; P176-P331 HydrophobicContact CB-CG 3.43Å; P176-P331 VanDerWaalsContact CB-CG 3.43Å; P176-P331 HydrophobicContact CG-CG 4.48Å
177F53.2Low62.4Low129 Ų12982.6 Ų82.657%0.56641%0.405SS*.THydrogen-bonded Turntrans-111.8-21.7-170.6-63.4-80.7000115.1F175 F327F175-F177 VanDerWaalsContact C-N 3.27Å; F175-F177 PolarHBondContact O-N 3.36Å; F175-F177 VanDerWaalsContact O-N 3.15Å; F177-F327 HydrophobicContact CD2-CE1 4.33Å; F177-F327 AromaticContact CD2-CE2 3.99Å; F177-F327 HydrophobicContact CD2-CE2 3.99Å; F177-F327 AromaticContact CD2-CZ 3.59Å; F177-F327 HydrophobicContact CD2-CZ 3.59Å; F177-F327 HydrophobicContact CE2-CD2 4.09Å; F177-F327 HydrophobicContact CE2-CE1 4.09Å; F177-F327 AromaticContact CE2-CE2 3.36Å; F177-F327 HydrophobicContact CE2-CE2 3.36Å; F177-F327 AromaticContact CE2-CZ 3.37Å; F177-F327 HydrophobicContact CE2-CZ 3.37Å; F177-F327 HydrophobicContact CZ-CE2 4.27Å
178L49.9Very low60.1Low155 Ų15583.7 Ų83.781%0.81241%0.411SS*.THydrogen-bonded Turntrans-89.4-19.5178.4-97.1123.8000113.4F175F175-L178 HydrophobicContact CB-CB 4.39Å
179Q48.2Very low57.6Low98 Ų9890.3 Ų90.346%0.45845%0.454SS..SBendtrans-119.426.9-173.6-67.2169.3-22.100111.5N181Q179-N181 PolarHBondContact O-N 2.97Å
180Y43.5Very low55.5Low162 Ų16291.4 Ų91.464%0.63547%0.466SS*.  trans-74.289.4179.6-170-96.6000110.4
181N43.2Very low54.1Low152 Ų15294.4 Ų94.481%0.81348%0.484SS*.  trans-116.4133.8161.6-101.8-13.8000109.2Q179 D183Q179-N181 PolarHBondContact O-N 2.97Å; N181-D183 PolarHBondContact O-N 3.38Å
182G45.8Very low53.1Low62 Ų6297.4 Ų97.464%0.63950%0.503SS*.SBendtrans-62.9-4-165.400000117.4F184G182-F184 VanDerWaalsContact C-N 3.3Å; G182-F184 PolarHBondContact O-N 3.46Å
183D47.1Very low52.4Low156 Ų15698.9 Ų98.983%0.83452%0.521SS*.  trans-88.674.8177.9-73.5-24.6000111.5N181N181-D183 PolarHBondContact O-N 3.38Å
184F47.9Very low52.4Low95 Ų95101.4 Ų101.442%0.41753%0.529SS..THydrogen-bonded Turntrans-29.7138.2166.3-127.1-104.3000113.7R111 G182R111-F184 HydrophobicContact CG-CE1 4.25Å; R111-F184 VanDerWaalsContact NE-CE1 3.33Å; G182-F184 VanDerWaalsContact C-N 3.3Å; G182-F184 PolarHBondContact O-N 3.46Å
185V46.7Very low52.7Low84 Ų84102.4 Ų102.451%0.50954%0.536SS..THydrogen-bonded Turntrans95-15.4165-169.10000117.6R187V185-R187 PolarHBondContact O-N 2.98Å
186K42.4Very low53.7Low195 Ų195100.3 Ų100.385%0.84853%0.527SS*.  trans-76.2105168-86178.7-179.1172.10109.2L188K186-L188 PolarHBondContact O-N 3.47Å
187R48.1Very low55.2Low146 Ų146105.1 Ų105.155%0.55155%0.547SS*.  trans-20.5124.5139.6-167.2179.3-161.6158.52.5106V185V185-R187 PolarHBondContact O-N 2.98Å
188L43Very low56.9Low61 Ų61100.7 Ų100.732%0.31953%0.527SS..  trans-31.6135.3171.6-153.585.2000107K186 G190K186-L188 PolarHBondContact O-N 3.47Å; L188-G190 PolarHBondContact O-N 3.15Å
189P41.4Very low58.6Low140 Ų14096 Ų9691%0.90950%0.499SS*.SBendtrans-62.224.6158.628.8-31.8000110.9N191P189-N191 PolarHBondContact O-N 3.08Å
190G47.6Very low60.5Low23 Ų2394.6 Ų94.624%0.23749%0.494CS..SBendtrans-65.9111.8159.100000108.3L188L188-G190 PolarHBondContact O-N 3.15Å
191N57.3Low62.8Low104 Ų10490.4 Ų90.456%0.55648%0.482SS*.  trans-22118.9161.4-172.9-15.2000111.4P189 S193 F194P189-N191 PolarHBondContact O-N 3.08Å; N191-S193 PolarHBondContact O-N 2.98Å; N191-S193 WeakPolarHBondContact OD1-CB 3.26Å; N191-S193 PolarHBondContact OD1-N 2.74Å; N191-F194 HydrophobicContact CB-CB 4.37Å; N191-F194 WeakPolarHBondContact O-CA 3.14Å; N191-F194 VanDerWaalsContact O-CB 3.31Å; N191-F194 WeakPolarHBondContact O-CB 3.38Å; N191-F194 PolarHBondContact O-N 3.04Å
192P64.7Low65.1Low75 Ų7583.3 Ų83.349%0.48744%0.444SS..Hα-helixtrans-49.3-27.6176.5-27.934000113.3K196P192-K196 WeakPolarHBondContact O-CB 3.38Å; P192-K196 PolarHBondContact O-N 3.34Å; P192-K196 VanDerWaalsContact O-N 3.11Å
193S70.2Confident67.2Low75 Ų7582.2 Ų82.252%0.52442%0.422SS..Hα-helixtrans-61.5-38.8172.3-166.10000113.3N191 K196 F197N191-S193 PolarHBondContact O-N 2.98Å; N191-S193 WeakPolarHBondContact OD1-CB 3.26Å; N191-S193 PolarHBondContact OD1-N 2.74Å; S193-K196 PolarHBondContact O-N 2.93Å; S193-F197 WeakPolarHBondContact O-CB 3.41Å; S193-F197 PolarHBondContact O-N 2.88Å
194F75.3Confident69.4Low101 Ų10176.1 Ų76.144%0.44340%0.396SS..Hα-helixtrans-69.2-47.5-179.8-163.9-108.3000111.6N191 K196 F197 F198N191-F194 HydrophobicContact CB-CB 4.37Å; N191-F194 WeakPolarHBondContact O-CA 3.14Å; N191-F194 VanDerWaalsContact O-CB 3.31Å; N191-F194 WeakPolarHBondContact O-CB 3.38Å; N191-F194 PolarHBondContact O-N 3.04Å; F194-K196 VanDerWaalsContact C-N 3.29Å; F194-K196 PolarHBondContact O-N 2.85Å; F194-F197 WeakPolarHBondContact O-CB 3.36Å; F194-F197 PolarHBondContact O-N 2.57Å; F194-F198 AromaticContact CD1-CD2 3.82Å; F194-F198 HydrophobicContact CD1-CD2 3.82Å; F194-F198 AromaticContact CD1-CE2 3.57Å; F194-F198 HydrophobicContact CD1-CE2 3.57Å; F194-F198 AromaticContact CD2-CE2 3.89Å; F194-F198 HydrophobicContact CD2-CE2 3.89Å; F194-F198 AromaticContact CE1-CD2 3.87Å; F194-F198 HydrophobicContact CE1-CD2 3.87Å; F194-F198 AromaticContact CE1-CE2 3.21Å; F194-F198 HydrophobicContact CE1-CE2 3.21Å; F194-F198 HydrophobicContact CE1-CZ 4.09Å; F194-F198 AromaticContact CE2-CE2 3.56Å; F194-F198 HydrophobicContact CE2-CE2 3.56Å; F194-F198 HydrophobicContact CE2-CZ 4.23Å; F194-F198 HydrophobicContact CG-CD2 4.21Å; F194-F198 AromaticContact CG-CE2 3.93Å; F194-F198 HydrophobicContact CG-CE2 3.93Å; F194-F198 HydrophobicContact CZ-CD2 4.28Å; F194-F198 AromaticContact CZ-CE2 3.23Å; F194-F198 HydrophobicContact CZ-CE2 3.23Å; F194-F198 AromaticContact CZ-CZ 3.81Å; F194-F198 HydrophobicContact CZ-CZ 3.81Å; F194-F198 VanDerWaalsContact O-CD2 3.25Å; F194-F198 WeakPolarHBondContact O-CD2 3.45Å; F194-F198 PolarHBondContact O-N 2.89Å
195S78.1Confident71.5Confident27 Ų2776.9 Ų76.919%0.18940%0.397CS..Hα-helixtrans-57.7-43.9173.7174.70000111.4S171 F198 R199S171-S195 VanDerWaalsContact O-CB 3.31Å; S171-S195 WeakPolarHBondContact O-CB 3.23Å; S171-S195 PolarHBondContact O-OG 2.85Å; S195-F198 PolarHBondContact O-N 2.87Å; S195-R199 WeakPolarHBondContact O-CG 3.44Å; S195-R199 PolarHBondContact O-N 3.07Å; S195-R199 VanDerWaalsContact O-N 3.11Å
196K80.4Confident73.8Confident56 Ų5673 Ų7324%0.24337%0.374CS..Hα-helixtrans-61.9-45.3175.4-175.5176.2178.6178.40112P192 S193 F194 F198 R199 I200 A250P192-K196 WeakPolarHBondContact O-CB 3.38Å; P192-K196 PolarHBondContact O-N 3.34Å; P192-K196 VanDerWaalsContact O-N 3.11Å; S193-K196 PolarHBondContact O-N 2.93Å; F194-K196 VanDerWaalsContact C-N 3.29Å; F194-K196 PolarHBondContact O-N 2.85Å; K196-F198 PolarHBondContact O-N 3.41Å; K196-R199 PolarHBondContact O-N 2.99Å; K196-I200 HydrophobicContact CG-CD1 3.93Å; K196-I200 HydrophobicContact CG-CG1 4.48Å; K196-I200 WeakPolarHBondContact O-CG1 3.48Å; K196-I200 PolarHBondContact O-N 3.4Å; K196-A250 WeakPolarHBondContact CE-O 3.46Å; K196-A250 PolarHBondContact NZ-O 2.78Å
197F86.3Confident76.2Confident111 Ų11166.4 Ų66.449%0.48735%0.351SS..Hα-helixtrans-57.2-49.1177.4173.3-99.7000111.8S193 F194 R199 I200 L201S193-F197 WeakPolarHBondContact O-CB 3.41Å; S193-F197 PolarHBondContact O-N 2.88Å; F194-F197 WeakPolarHBondContact O-CB 3.36Å; F194-F197 PolarHBondContact O-N 2.57Å; F197-R199 VanDerWaalsContact C-N 3.32Å; F197-R199 PolarHBondContact O-N 2.65Å; F197-I200 PolarHBondContact O-N 3.09Å; F197-L201 HydrophobicContact CE1-CD2 4.26Å; F197-L201 HydrophobicContact CZ-CD2 4.43Å; F197-L201 WeakPolarHBondContact O-CB 3.3Å; F197-L201 PolarHBondContact O-N 3.37Å
198F87.4Confident78.4Confident37 Ų3764.3 Ų64.316%0.16235%0.351CS..Hα-helixtrans-63.9-35.1177.8-80.2-73.6000113.2L167 F194 S195 K196 L201 A202L167-F198 HydrophobicContact CD2-CD1 3.86Å; L167-F198 HydrophobicContact CD2-CE1 4.17Å; F194-F198 AromaticContact CD1-CD2 3.82Å; F194-F198 HydrophobicContact CD1-CD2 3.82Å; F194-F198 AromaticContact CD1-CE2 3.57Å; F194-F198 HydrophobicContact CD1-CE2 3.57Å; F194-F198 AromaticContact CD2-CE2 3.89Å; F194-F198 HydrophobicContact CD2-CE2 3.89Å; F194-F198 AromaticContact CE1-CD2 3.87Å; F194-F198 HydrophobicContact CE1-CD2 3.87Å; F194-F198 AromaticContact CE1-CE2 3.21Å; F194-F198 HydrophobicContact CE1-CE2 3.21Å; F194-F198 HydrophobicContact CE1-CZ 4.09Å; F194-F198 AromaticContact CE2-CE2 3.56Å; F194-F198 HydrophobicContact CE2-CE2 3.56Å; F194-F198 HydrophobicContact CE2-CZ 4.23Å; F194-F198 HydrophobicContact CG-CD2 4.21Å; F194-F198 AromaticContact CG-CE2 3.93Å; F194-F198 HydrophobicContact CG-CE2 3.93Å; F194-F198 HydrophobicContact CZ-CD2 4.28Å; F194-F198 AromaticContact CZ-CE2 3.23Å; F194-F198 HydrophobicContact CZ-CE2 3.23Å; F194-F198 AromaticContact CZ-CZ 3.81Å; F194-F198 HydrophobicContact CZ-CZ 3.81Å; F194-F198 VanDerWaalsContact O-CD2 3.25Å; F194-F198 WeakPolarHBondContact O-CD2 3.45Å; F194-F198 PolarHBondContact O-N 2.89Å; S195-F198 PolarHBondContact O-N 2.87Å; K196-F198 PolarHBondContact O-N 3.41Å; F198-L201 PolarHBondContact O-N 2.95Å; F198-A202 WeakPolarHBondContact O-CB 3.07Å; F198-A202 PolarHBondContact O-N 3.13Å
199R86.1Confident81Confident56 Ų5662.2 Ų62.221%0.21134%0.339CS..Hα-helixtrans-67.3-43.2174.7-70179.974.5-1591.3111.9Y121 S171 S195 K196 F197 L201 A202 F203 F249Y121-R199 VanDerWaalsContact OH-CZ 3.3Å; Y121-R199 PolarHBondContact OH-NE 3.27Å; Y121-R199 PolarHBondContact OH-NH2 3.1Å; S171-R199 WeakPolarHBondContact OG-CG 3.34Å; S195-R199 WeakPolarHBondContact O-CG 3.44Å; S195-R199 PolarHBondContact O-N 3.07Å; S195-R199 VanDerWaalsContact O-N 3.11Å; K196-R199 PolarHBondContact O-N 2.99Å; F197-R199 VanDerWaalsContact C-N 3.32Å; F197-R199 PolarHBondContact O-N 2.65Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.38Å; R199-A202 PolarHBondContact O-N 3.46Å; R199-F203 VanDerWaalsContact O-CD2 3.23Å; R199-F203 WeakPolarHBondContact O-CD2 3.37Å; R199-F203 PolarHBondContact O-N 3.22Å; R199-F249 HydrophobicContact CB-CZ 4.34Å
200I88.1Confident83.6Confident68 Ų6855.8 Ų55.835%0.34930%0.297SS..Hα-helixtrans-61.3-44.2175.4-68.4170.9000110K196 F197 G204 F249 A250K196-I200 HydrophobicContact CG-CD1 3.93Å; K196-I200 HydrophobicContact CG-CG1 4.48Å; K196-I200 WeakPolarHBondContact O-CG1 3.48Å; K196-I200 PolarHBondContact O-N 3.4Å; F197-I200 PolarHBondContact O-N 3.09Å; I200-G204 VanDerWaalsContact O-CA 3.24Å; I200-G204 WeakPolarHBondContact O-CA 3.27Å; I200-G204 PolarHBondContact O-N 3.09Å; I200-F249 HydrophobicContact CG1-CD1 4.12Å; I200-F249 HydrophobicContact CG1-CE1 3.81Å; I200-A250 HydrophobicContact CD1-CB 4.45Å
201L91.1Very high85.9Confident75 Ų7555.2 Ų55.239%0.39329%0.288SS..Hα-helixtrans-65.3-45.8177.9-177.162.3000111.9F197 F198 R199 F203 Y205F197-L201 HydrophobicContact CE1-CD2 4.26Å; F197-L201 HydrophobicContact CZ-CD2 4.43Å; F197-L201 WeakPolarHBondContact O-CB 3.3Å; F197-L201 PolarHBondContact O-N 3.37Å; F198-L201 PolarHBondContact O-N 2.95Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.38Å; L201-F203 VanDerWaalsContact C-N 3.28Å; L201-F203 PolarHBondContact O-N 3.44Å; L201-Y205 WeakPolarHBondContact O-CB 3.3Å; L201-Y205 PolarHBondContact O-N 2.96Å; L201-Y205 VanDerWaalsContact O-N 3.09Å
202A91.3Very high87.8Confident2 Ų253.2 Ų53.22%0.01728%0.277CS..Hα-helixtrans-58.1-37.6-176.700000112.9C164 L167 A168 F198 R199 P206C164-A202 WeakPolarHBondContact CB-O 3.44Å; C164-A202 PolarHBondContact SG-O 2.66Å; L167-A202 HydrophobicContact CB-CB 3.83Å; A168-A202 HydrophobicContact CB-CB 4.34Å; F198-A202 WeakPolarHBondContact O-CB 3.07Å; F198-A202 PolarHBondContact O-N 3.13Å; R199-A202 PolarHBondContact O-N 3.46Å; A202-P206 WeakPolarHBondContact O-CD 3.44Å; A202-P206 WeakPolarHBondContact O-CG 3.06Å
203F91.5Very high89.2Confident39 Ų3949.7 Ų49.717%0.17125%0.254CS..Hα-helixtrans-103.4-30.2-179.2-59.4-64.3000113.3Y121 L124 C164 A168 R199 L201 C207Y121-F203 HydrophobicContact CD1-CE2 4.28Å; Y121-F203 AromaticContact CD1-CZ 3.9Å; Y121-F203 HydrophobicContact CD1-CZ 3.9Å; Y121-F203 HydrophobicContact CG-CZ 4.08Å; L124-F203 HydrophobicContact CB-CD1 4.48Å; L124-F203 HydrophobicContact CB-CE1 3.97Å; L124-F203 HydrophobicContact CD2-CD1 3.5Å; L124-F203 VanDerWaalsContact CD2-CD1 3.5Å; L124-F203 HydrophobicContact CD2-CD2 4.29Å; L124-F203 HydrophobicContact CD2-CE1 3.52Å; L124-F203 HydrophobicContact CD2-CE2 4.31Å; L124-F203 HydrophobicContact CD2-CG 3.91Å; L124-F203 HydrophobicContact CD2-CZ 3.95Å; L124-F203 HydrophobicContact CG-CD1 3.89Å; L124-F203 HydrophobicContact CG-CE1 3.87Å; C164-F203 WeakPolarHBondContact SG-CD1 3.37Å; C164-F203 WeakPolarHBondContact SG-CE1 3.41Å; A168-F203 HydrophobicContact CB-CE2 4.04Å; A168-F203 HydrophobicContact CB-CZ 3.7Å; R199-F203 VanDerWaalsContact O-CD2 3.23Å; R199-F203 WeakPolarHBondContact O-CD2 3.37Å; R199-F203 PolarHBondContact O-N 3.22Å; L201-F203 VanDerWaalsContact C-N 3.28Å; L201-F203 PolarHBondContact O-N 3.44Å; F203-C207 WeakPolarHBondContact O-CB 3.3Å; F203-C207 PolarHBondContact O-N 3.22Å; F203-C207 VanDerWaalsContact O-N 3.15Å
204G91.9Very high90.3Very high29 Ų2946.1 Ų46.130%0.29923%0.229SC..Hα-helixtrans-69.2-41.8179.500000112.8I200 C207 L208I200-G204 VanDerWaalsContact O-CA 3.24Å; I200-G204 WeakPolarHBondContact O-CA 3.27Å; I200-G204 PolarHBondContact O-N 3.09Å; G204-C207 PolarHBondContact O-N 2.97Å; G204-L208 VanDerWaalsContact O-CG 3.3Å; G204-L208 WeakPolarHBondContact O-CG 3.31Å; G204-L208 PolarHBondContact O-N 2.97Å
205Y93.1Very high91.2Very high110 Ų11044 Ų4443%0.43122%0.22SC..Hα-helixtrans-64.7-51.4178.8168-101000112.9N160 L201 C207 L208 F209N160-Y205 WeakPolarHBondContact OD1-CE1 3.23Å; L201-Y205 WeakPolarHBondContact O-CB 3.3Å; L201-Y205 PolarHBondContact O-N 2.96Å; L201-Y205 VanDerWaalsContact O-N 3.09Å; Y205-C207 VanDerWaalsContact C-N 3.32Å; Y205-C207 PolarHBondContact O-N 3.17Å; Y205-L208 PolarHBondContact O-N 3.18Å; Y205-F209 PolarHBondContact O-N 3.26Å
206P94.5Very high91.9Very high4 Ų445.2 Ų45.23%0.02622%0.221CC..Hα-helixtrans-59.7-41.7175.1-24.935.5000112.4S128 N160 C164 A202 L208 F209 D210S128-P206 WeakPolarHBondContact OG-CB 3.4Å; N160-P206 HydrophobicContact CB-CB 4.4Å; N160-P206 HydrophobicContact CB-CG 4.3Å; C164-P206 HydrophobicContact CB-CG 4.2Å; A202-P206 WeakPolarHBondContact O-CD 3.44Å; A202-P206 WeakPolarHBondContact O-CG 3.06Å; P206-L208 VanDerWaalsContact C-N 3.33Å; P206-L208 PolarHBondContact O-N 3.15Å; P206-F209 PolarHBondContact O-N 2.8Å; P206-D210 WeakPolarHBondContact O-CB 3.37Å; P206-D210 PolarHBondContact O-N 3.26Å
207C93.8Very high92.5Very high55 Ų5542.8 Ų42.837%0.37221%0.21SC..Hα-helixtrans-57.4-45176.1-1800000112.2F203 G204 Y205 N211F203-C207 WeakPolarHBondContact O-CB 3.3Å; F203-C207 PolarHBondContact O-N 3.22Å; F203-C207 VanDerWaalsContact O-N 3.15Å; G204-C207 PolarHBondContact O-N 2.97Å; Y205-C207 VanDerWaalsContact C-N 3.32Å; Y205-C207 PolarHBondContact O-N 3.17Å; C207-N211 WeakPolarHBondContact O-CB 3.31Å; C207-N211 PolarHBondContact O-N 3.03Å; C207-N211 PolarHBondContact O-ND2 3.02Å
208L94.3Very high92.8Very high103 Ų10338 Ų3854%0.53919%0.189SC..Hα-helixtrans-65-44.9176.5-71.6173.3000111.8G204 Y205 P206 N211 I212 F215G204-L208 VanDerWaalsContact O-CG 3.3Å; G204-L208 WeakPolarHBondContact O-CG 3.31Å; G204-L208 PolarHBondContact O-N 2.97Å; Y205-L208 PolarHBondContact O-N 3.18Å; P206-L208 VanDerWaalsContact C-N 3.33Å; P206-L208 PolarHBondContact O-N 3.15Å; L208-N211 PolarHBondContact O-N 3.24Å; L208-I212 WeakPolarHBondContact O-CG1 3.1Å; L208-I212 PolarHBondContact O-N 2.91Å; L208-F215 HydrophobicContact CD2-CE2 4.35Å
209F97.1Very high92.9Very high17 Ų1741.8 Ų41.88%0.07521%0.206CC..Hα-helixtrans-60.1-49.5178.4176.1-94.5000111.9F149 Y153 I156 A157 N160 Y205 P206 N211 I212F149-F209 HydrophobicContact CE2-CE2 4.22Å; Y153-F209 AromaticContact CD2-CE1 3.6Å; Y153-F209 HydrophobicContact CD2-CE1 3.6Å; Y153-F209 HydrophobicContact CD2-CE2 4.47Å; Y153-F209 AromaticContact CD2-CZ 3.55Å; Y153-F209 HydrophobicContact CD2-CZ 3.55Å; Y153-F209 HydrophobicContact CE2-CD1 4.15Å; Y153-F209 AromaticContact CE2-CE1 3.6Å; Y153-F209 HydrophobicContact CE2-CE1 3.6Å; Y153-F209 AromaticContact CE2-CZ 3.95Å; Y153-F209 HydrophobicContact CE2-CZ 3.95Å; Y153-F209 HydrophobicContact CG-CE1 4.46Å; Y153-F209 HydrophobicContact CG-CZ 4.46Å; I156-F209 HydrophobicContact CB-CE1 4.22Å; I156-F209 HydrophobicContact CB-CE2 4.31Å; I156-F209 HydrophobicContact CB-CZ 3.67Å; I156-F209 HydrophobicContact CD1-CZ 4.38Å; I156-F209 HydrophobicContact CG2-CD2 4.28Å; I156-F209 HydrophobicContact CG2-CE1 3.86Å; I156-F209 HydrophobicContact CG2-CE2 3.58Å; I156-F209 HydrophobicContact CG2-CZ 3.34Å; A157-F209 HydrophobicContact CB-CE1 4.15Å; N160-F209 WeakPolarHBondContact ND2-CD1 3.28Å; Y205-F209 PolarHBondContact O-N 3.26Å; P206-F209 PolarHBondContact O-N 2.8Å; F209-N211 PolarHBondContact O-N 2.96Å; F209-I212 HydrophobicContact CD2-CD1 3.96Å; F209-I212 WeakPolarHBondContact O-CB 3.37Å; F209-I212 WeakPolarHBondContact O-CG1 3.11Å; F209-I212 PolarHBondContact O-N 3.41Å; F209-I212 VanDerWaalsContact O-N 3.13Å
210D96.7Very high93.1Very high4 Ų445 Ų452%0.02123%0.227CC..Hα-helixtrans-60.6-36.3-178.5-64.1-14.3000110.5S128 Y135 Y153 P206 I212 P213S128-D210 WeakPolarHBondContact CB-OD2 3.29Å; S128-D210 VanDerWaalsContact O-OD2 3.1Å; S128-D210 PolarHBondContact OG-OD2 3.36Å; Y135-D210 WeakPolarHBondContact CD2-O 3.38Å; Y153-D210 WeakPolarHBondContact OH-CA 3.43Å; Y153-D210 PolarHBondContact OH-O 3.49Å; P206-D210 WeakPolarHBondContact O-CB 3.37Å; P206-D210 PolarHBondContact O-N 3.26Å; D210-I212 PolarHBondContact O-N 2.63Å; D210-P213 VanDerWaalsContact O-CD 3.3Å; D210-P213 WeakPolarHBondContact O-CD 3.49Å
211N95.4Very high93Very high11 Ų1142.5 Ų42.56%0.05922%0.215CC..THydrogen-bonded Turntrans-84-2.3-179.2-75.3-81.1000114.8C207 L208 F209 L214 F215C207-N211 WeakPolarHBondContact O-CB 3.31Å; C207-N211 PolarHBondContact O-N 3.03Å; C207-N211 PolarHBondContact O-ND2 3.02Å; L208-N211 PolarHBondContact O-N 3.24Å; F209-N211 PolarHBondContact O-N 2.96Å; N211-L214 PolarHBondContact O-N 3.25Å; N211-L214 VanDerWaalsContact O-N 3.14Å; N211-F215 HydrophobicContact CB-CD2 4.08Å; N211-F215 HydrophobicContact CB-CE1 4.3Å; N211-F215 HydrophobicContact CB-CE2 3.67Å; N211-F215 HydrophobicContact CB-CZ 3.8Å; N211-F215 WeakPolarHBondContact O-CD2 3.34Å; N211-F215 WeakPolarHBondContact O-CG 3.49Å; N211-F215 PolarHBondContact O-N 3.18Å
212I96Very high92.6Very high63 Ų6344.8 Ų44.832%0.32323%0.233SC..Hα-helixtrans-51.2-49.8178.1-68.7170.5000112.6W144 F149 L208 F209 D210 L214 F215 Y216W144-I212 HydrophobicContact CH2-CG2 4.39Å; W144-I212 HydrophobicContact CZ3-CG2 4.13Å; F149-I212 HydrophobicContact CE1-CG2 4.14Å; F149-I212 HydrophobicContact CZ-CB 4.43Å; F149-I212 HydrophobicContact CZ-CG2 4Å; L208-I212 WeakPolarHBondContact O-CG1 3.1Å; L208-I212 PolarHBondContact O-N 2.91Å; F209-I212 HydrophobicContact CD2-CD1 3.96Å; F209-I212 WeakPolarHBondContact O-CB 3.37Å; F209-I212 WeakPolarHBondContact O-CG1 3.11Å; F209-I212 PolarHBondContact O-N 3.41Å; F209-I212 VanDerWaalsContact O-N 3.13Å; D210-I212 PolarHBondContact O-N 2.63Å; I212-L214 VanDerWaalsContact C-N 3.32Å; I212-L214 PolarHBondContact O-N 2.94Å; I212-F215 PolarHBondContact O-N 2.84Å; I212-Y216 PolarHBondContact O-N 2.89Å
213P94.7Very high91.9Very high0 Ų047.5 Ų47.50%026%0.261CS..Hα-helixtrans-64.8-36.7-178.8-18.933.3000112.3F140 P141 F149 Y153 D210 R217F140-P213 HydrophobicContact CD2-CB 3.68Å; F140-P213 HydrophobicContact CD2-CG 3.63Å; F140-P213 HydrophobicContact CE2-CB 3.9Å; F140-P213 HydrophobicContact CE2-CG 3.41Å; F140-P213 VanDerWaalsContact CE2-CG 3.41Å; F140-P213 HydrophobicContact CG-CB 4.3Å; F140-P213 HydrophobicContact CZ-CG 4.29Å; P141-P213 HydrophobicContact CG-CB 4.46Å; P141-P213 WeakPolarHBondContact CG-O 3.4Å; F149-P213 HydrophobicContact CE1-CG 4.49Å; Y153-P213 HydrophobicContact CE2-CG 3.91Å; D210-P213 VanDerWaalsContact O-CD 3.3Å; D210-P213 WeakPolarHBondContact O-CD 3.49Å; P213-R217 WeakPolarHBondContact O-CB 3.43Å; P213-R217 PolarHBondContact O-N 3.49Å
214L93.9Very high91Very high0 Ų053.2 Ų53.20%029%0.293CS..Hα-helixtrans-68.4-44.2176.2-74.4-170.8000112.1Y135 A139 N211 I212 Y216 R217 V218 I239Y135-L214 HydrophobicContact CD1-CD1 4.27Å; Y135-L214 HydrophobicContact CD1-CG 4.46Å; Y135-L214 HydrophobicContact CD2-CD1 4.25Å; Y135-L214 HydrophobicContact CD2-CG 4.39Å; Y135-L214 HydrophobicContact CE1-CD1 3.63Å; Y135-L214 HydrophobicContact CE1-CG 4.29Å; Y135-L214 HydrophobicContact CE2-CD1 3.59Å; Y135-L214 HydrophobicContact CE2-CG 4.21Å; Y135-L214 HydrophobicContact CG-CG 4.5Å; Y135-L214 VanDerWaalsContact OH-CD1 3.27Å; Y135-L214 WeakPolarHBondContact OH-CD1 3.24Å; A139-L214 HydrophobicContact CB-CD2 3.68Å; N211-L214 PolarHBondContact O-N 3.25Å; N211-L214 VanDerWaalsContact O-N 3.14Å; I212-L214 VanDerWaalsContact C-N 3.32Å; I212-L214 PolarHBondContact O-N 2.94Å; L214-Y216 VanDerWaalsContact C-N 3.26Å; L214-Y216 PolarHBondContact O-N 3.24Å; L214-R217 PolarHBondContact O-N 3.11Å; L214-V218 VanDerWaalsContact O-CB 3.25Å; L214-V218 WeakPolarHBondContact O-CB 3.21Å; L214-V218 VanDerWaalsContact O-CG2 3.32Å; L214-V218 WeakPolarHBondContact O-CG2 3.23Å; L214-V218 PolarHBondContact O-N 3.38Å; L214-I239 HydrophobicContact CB-CD1 4.45Å
215F94.3Very high90Very high58 Ų5853.9 Ų53.925%0.25430%0.3SS..Hα-helixtrans-59.8-41.2176.9-69.1-34.8000111.5L208 N211 I212 F219 I239L208-F215 HydrophobicContact CD2-CE2 4.35Å; N211-F215 HydrophobicContact CB-CD2 4.08Å; N211-F215 HydrophobicContact CB-CE1 4.3Å; N211-F215 HydrophobicContact CB-CE2 3.67Å; N211-F215 HydrophobicContact CB-CZ 3.8Å; N211-F215 WeakPolarHBondContact O-CD2 3.34Å; N211-F215 WeakPolarHBondContact O-CG 3.49Å; N211-F215 PolarHBondContact O-N 3.18Å; I212-F215 PolarHBondContact O-N 2.84Å; F215-F219 HydrophobicContact CB-CD2 4.43Å; F215-F219 AromaticContact CD1-CD2 3.99Å; F215-F219 HydrophobicContact CD1-CD2 3.99Å; F215-F219 AromaticContact CD1-CE2 3.82Å; F215-F219 HydrophobicContact CD1-CE2 3.82Å; F215-F219 HydrophobicContact CE1-CE2 4.36Å; F215-F219 WeakPolarHBondContact O-CB 3.43Å; F215-F219 PolarHBondContact O-N 3.11Å; F215-I239 HydrophobicContact CD1-CD1 4.09Å; F215-I239 HydrophobicContact CE1-CD1 4.11Å; F215-I239 HydrophobicContact CE1-CG1 4.21Å; F215-I239 HydrophobicContact CE1-CG2 3.79Å
216Y93.2Very high89.4Confident51 Ų5149.7 Ų49.720%0.229%0.287CS..Iπ-helixtrans-62.9-52.1173.6-178.4-92.5000111.8P141 W144 I212 L214 V218 L220 C221P141-Y216 HydrophobicContact CB-CD1 3.74Å; P141-Y216 HydrophobicContact CB-CE1 3.98Å; P141-Y216 HydrophobicContact CG-CD1 3.5Å; P141-Y216 HydrophobicContact CG-CE1 4.25Å; P141-Y216 HydrophobicContact CG-CG 4.36Å; W144-Y216 HydrophobicContact CD2-CD1 4.48Å; W144-Y216 VanDerWaalsContact CH2-CB 3.46Å; W144-Y216 HydrophobicContact CH2-CD1 4.16Å; W144-Y216 AromaticContact CH2-CD2 3.67Å; W144-Y216 HydrophobicContact CH2-CD2 3.67Å; W144-Y216 HydrophobicContact CH2-CE2 4.45Å; W144-Y216 AromaticContact CH2-CG 3.48Å; W144-Y216 HydrophobicContact CH2-CG 3.48Å; W144-Y216 VanDerWaalsContact CH2-CG 3.48Å; W144-Y216 AromaticContact CZ2-CD1 3.89Å; W144-Y216 HydrophobicContact CZ2-CD1 3.89Å; W144-Y216 AromaticContact CZ2-CD2 3.31Å; W144-Y216 HydrophobicContact CZ2-CD2 3.31Å; W144-Y216 HydrophobicContact CZ2-CE1 4.16Å; W144-Y216 AromaticContact CZ2-CE2 3.65Å; W144-Y216 HydrophobicContact CZ2-CE2 3.65Å; W144-Y216 AromaticContact CZ2-CG 3.42Å; W144-Y216 HydrophobicContact CZ2-CG 3.42Å; W144-Y216 VanDerWaalsContact CZ2-CG 3.42Å; W144-Y216 HydrophobicContact CZ3-CG 4.16Å; I212-Y216 PolarHBondContact O-N 2.89Å; L214-Y216 VanDerWaalsContact C-N 3.26Å; L214-Y216 PolarHBondContact O-N 3.24Å; Y216-V218 VanDerWaalsContact C-N 3.3Å; Y216-V218 PolarHBondContact O-N 3.45Å; Y216-L220 HydrophobicContact CD2-CB 3.88Å; Y216-L220 HydrophobicContact CD2-CD1 4.02Å; Y216-L220 HydrophobicContact CE2-CB 4.25Å; Y216-L220 HydrophobicContact CG-CB 4.46Å; Y216-L220 CarbonylContact O-C 3.58Å; Y216-L220 PolarHBondContact O-N 3.46Å; Y216-C221 HydrophobicContact CD1-CB 4.07Å; Y216-C221 HydrophobicContact CE1-CB 3.77Å; Y216-C221 WeakPolarHBondContact O-CB 3.49Å; Y216-C221 PolarHBondContact O-N 2.76Å
217R92.1Very high88.8Confident6 Ų650.2 Ų50.22%0.02329%0.29CS..Iπ-helixtrans-55.3-45-179.5175.1175.9171.8-179.1-4.9112.4P141 P213 L214 T227 N229 N232 D290P141-R217 HydrophobicContact CG-CB 4.34Å; P213-R217 WeakPolarHBondContact O-CB 3.43Å; P213-R217 PolarHBondContact O-N 3.49Å; L214-R217 PolarHBondContact O-N 3.11Å; R217-T227 PolarHBondContact NE-O 2.83Å; R217-N229 PolarHBondContact NH2-OD1 3.24Å; R217-N229 VanDerWaalsContact NH2-OD1 3.15Å; R217-N232 PolarHBondContact NE-OD1 3.12Å; R217-N232 PolarHBondContact NH2-OD1 3.38Å; R217-D290 IonicContact CZ-OD1 2.78Å; R217-D290 IonicContact CZ-OD2 3.52Å; R217-D290 VanDerWaalsContact NH1-CG 3.28Å; R217-D290 IonicContact NH1-OD1 3.94Å; R217-D290 PolarHBondContact NH1-OD1 3.01Å; R217-D290 IonicContact NH1-OD2 3.47Å; R217-D290 PolarHBondContact NH1-OD2 3.29Å; R217-D290 IonicContact NH2-OD1 3.24Å; R217-D290 PolarHBondContact NH2-OD1 3.46Å; R217-D290 IonicContact NH2-OD2 2.73Å
218V91.5Very high88.3Confident9 Ų954.1 Ų54.16%0.05531%0.307CS..Iπ-helixtrans-92.6-27.9-166.2175.40000113L214 Y216 H235 Y236L214-V218 VanDerWaalsContact O-CB 3.25Å; L214-V218 WeakPolarHBondContact O-CB 3.21Å; L214-V218 VanDerWaalsContact O-CG2 3.32Å; L214-V218 WeakPolarHBondContact O-CG2 3.23Å; L214-V218 PolarHBondContact O-N 3.38Å; Y216-V218 VanDerWaalsContact C-N 3.3Å; Y216-V218 PolarHBondContact O-N 3.45Å; V218-H235 HydrophobicContact CG2-CB 4.01Å; V218-Y236 HydrophobicContact CB-CE1 4.48Å; V218-Y236 HydrophobicContact CG1-CD1 3.47Å; V218-Y236 VanDerWaalsContact CG1-CD1 3.47Å; V218-Y236 HydrophobicContact CG1-CD2 4.17Å; V218-Y236 HydrophobicContact CG1-CE1 3.01Å; V218-Y236 HydrophobicContact CG1-CE2 3.79Å; V218-Y236 HydrophobicContact CG1-CG 4.02Å; V218-Y236 WeakPolarHBondContact CG1-OH 3.49Å; V218-Y236 PolarHBondContact O-OH 2.85Å
219F90.8Very high87.9Confident117 Ų11751.2 Ų51.251%0.51329%0.292SS..Iπ-helixtrans-116.8-24.1-175.8-62.2-71000115F215 Y236 I239F215-F219 HydrophobicContact CB-CD2 4.43Å; F215-F219 AromaticContact CD1-CD2 3.99Å; F215-F219 HydrophobicContact CD1-CD2 3.99Å; F215-F219 AromaticContact CD1-CE2 3.82Å; F215-F219 HydrophobicContact CD1-CE2 3.82Å; F215-F219 HydrophobicContact CE1-CE2 4.36Å; F215-F219 WeakPolarHBondContact O-CB 3.43Å; F215-F219 PolarHBondContact O-N 3.11Å; F219-Y236 HydrophobicContact CD1-CE1 4.18Å; F219-Y236 HydrophobicContact CE1-CD1 4.14Å; F219-Y236 AromaticContact CE1-CE1 3.58Å; F219-Y236 HydrophobicContact CE1-CE1 3.58Å; F219-Y236 HydrophobicContact CZ-CD1 4.08Å; F219-Y236 AromaticContact CZ-CE1 3.93Å; F219-Y236 HydrophobicContact CZ-CE1 3.93Å; F219-I239 HydrophobicContact CE2-CD1 4.12Å; F219-I239 HydrophobicContact CE2-CG2 4.42Å
220L89.7Confident87.6Confident123 Ų12356.9 Ų56.964%0.64432%0.323SS*.Iπ-helixtrans-114.7-31.7-171.4-58.4178000113.2Y216 T222Y216-L220 HydrophobicContact CD2-CB 3.88Å; Y216-L220 HydrophobicContact CD2-CD1 4.02Å; Y216-L220 HydrophobicContact CE2-CB 4.25Å; Y216-L220 HydrophobicContact CG-CB 4.46Å; Y216-L220 CarbonylContact O-C 3.58Å; Y216-L220 PolarHBondContact O-N 3.46Å; L220-T222 PolarHBondContact O-N 2.95Å
221C86.9Confident87.4Confident16 Ų1656.7 Ų56.711%0.10832%0.322CS..  trans-81.8111.4-178.1-150.90000109.9Y216 C226Y216-C221 HydrophobicContact CD1-CB 4.07Å; Y216-C221 HydrophobicContact CE1-CB 3.77Å; Y216-C221 WeakPolarHBondContact O-CB 3.49Å; Y216-C221 PolarHBondContact O-N 2.76Å; C221-C226 WeakPolarHBondContact CA-SG 3.49Å; C221-C226 HydrophobicContact CB-CB 3.76Å; C221-C226 WeakPolarHBondContact CB-SG 3.18Å; C221-C226 VanDerWaalsContact SG-CA 3.54Å; C221-C226 WeakPolarHBondContact SG-CB 3.26Å; C221-C226 CovalentContact SG-SG 2.03Å; C221-C226 PolarHBondContact SG-SG 2.81Å
222T82.1Confident87.3Confident123 Ų12356.7 Ų56.776%0.75532%0.322SS*.  trans-128.4147.7172.253.80000110.2L220 C226L220-T222 PolarHBondContact O-N 2.95Å; T222-C226 PolarHBondContact N-SG 3.05Å
223G77.3Confident87.3Confident59 Ų5958.3 Ų58.361%0.60833%0.331SS*.SBendtrans84.5-157177.900000114.8C226G223-C226 WeakPolarHBondContact O-CB 3.46Å; G223-C226 PolarHBondContact O-N 2.7Å
224D71.8Confident87.4Confident159 Ų15959.3 Ų59.385%0.8534%0.336SS*.THydrogen-bonded Turntrans-65.2135.1-170.3-65-31.8000113.1K143 C226K143-D224 WeakPolarHBondContact CE-O 3.44Å; K143-D224 PolarHBondContact NZ-O 3.28Å; D224-C226 VanDerWaalsContact C-N 3.34Å
225G70.3Confident87.5Confident44 Ų4459.3 Ų59.345%0.45434%0.336SS..THydrogen-bonded Turntrans77.215.5-178.900000114.7
226C81.5Confident87.6Confident22 Ų2261.6 Ų61.615%0.14934%0.343CS..SBendtrans-98.1140.1167.9-66.10000110.4C221 T222 G223 D224 D228C221-C226 WeakPolarHBondContact CA-SG 3.49Å; C221-C226 HydrophobicContact CB-CB 3.76Å; C221-C226 WeakPolarHBondContact CB-SG 3.18Å; C221-C226 VanDerWaalsContact SG-CA 3.54Å; C221-C226 WeakPolarHBondContact SG-CB 3.26Å; C221-C226 CovalentContact SG-SG 2.03Å; C221-C226 PolarHBondContact SG-SG 2.81Å; T222-C226 PolarHBondContact N-SG 3.05Å; G223-C226 WeakPolarHBondContact O-CB 3.46Å; G223-C226 PolarHBondContact O-N 2.7Å; D224-C226 VanDerWaalsContact C-N 3.34Å; C226-D228 VanDerWaalsContact C-N 3.34Å; C226-D228 PolarHBondContact O-N 3.07Å
227T81.4Confident87.8Confident14 Ų1463.8 Ų63.89%0.08635%0.354CS..  trans-77.485.8176.2-43.30000109.8D142 R217 N232D142-T227 PolarHBondContact OD1-OG1 2.73Å; D142-T227 PolarHBondContact OD2-OG1 2.78Å; R217-T227 PolarHBondContact NE-O 2.83Å; T227-N232 PolarHBondContact O-ND2 3.04Å
228D83.4Confident88Confident138 Ų13863.9 Ų63.974%0.73836%0.355SS*.  trans-106.3109174.7-165.322.3000111.3C226 N232C226-D228 VanDerWaalsContact C-N 3.34Å; C226-D228 PolarHBondContact O-N 3.07Å; D228-N232 PolarHBondContact OD1-ND2 2.98Å
229N86.8Confident88.3Confident41 Ų4163.9 Ų63.922%0.21935%0.354CS..SBendtrans-152.8171.8-178.562.526000110.8R217 T231 N232R217-N229 PolarHBondContact NH2-OD1 3.24Å; R217-N229 VanDerWaalsContact NH2-OD1 3.15Å; N229-T231 PolarHBondContact O-N 2.73Å; N229-T231 WeakPolarHBondContact OD1-CB 3.37Å; N229-T231 PolarHBondContact OD1-N 3.09Å; N229-T231 VanDerWaalsContact OD1-N 3.09Å; N229-T231 PolarHBondContact OD1-OG1 3.04Å; N229-T231 VanDerWaalsContact OD1-OG1 3.13Å; N229-N232 WeakPolarHBondContact O-CB 3.43Å; N229-N232 PolarHBondContact O-N 2.89Å
230D89.3Confident88.5Confident137 Ų13760.2 Ų60.273%0.73335%0.35SS*.THydrogen-bonded Turntrans-57.3-18.7-179.7-67.2-27.1000113.5N232 I233D230-N232 PolarHBondContact O-N 3.14Å; D230-I233 WeakPolarHBondContact O-CG2 3.3Å; D230-I233 PolarHBondContact O-N 2.64Å
231T94Very high88.9Confident0 Ų055.8 Ų55.80%033%0.326CS..THydrogen-bonded Turntrans-64.4-27.7175.3-440000112.3N229 I233 L234 H235 A286 Q289 D290N229-T231 PolarHBondContact O-N 2.73Å; N229-T231 WeakPolarHBondContact OD1-CB 3.37Å; N229-T231 PolarHBondContact OD1-N 3.09Å; N229-T231 VanDerWaalsContact OD1-N 3.09Å; N229-T231 PolarHBondContact OD1-OG1 3.04Å; N229-T231 VanDerWaalsContact OD1-OG1 3.13Å; T231-I233 PolarHBondContact O-N 2.54Å; T231-L234 WeakPolarHBondContact O-CB 3.24Å; T231-L234 PolarHBondContact O-N 3.21Å; T231-H235 PolarHBondContact O-N 3.29Å; T231-A286 HydrophobicContact CG2-CB 4.02Å; T231-A286 WeakPolarHBondContact CG2-O 3.39Å; T231-Q289 HydrophobicContact CG2-CB 4.06Å; T231-Q289 HydrophobicContact CG2-CG 4.31Å; T231-Q289 WeakPolarHBondContact OG1-CG 3.45Å; T231-Q289 PolarHBondContact OG1-NE2 3.44Å; T231-D290 HydrophobicContact CG2-CB 4.43Å; T231-D290 WeakPolarHBondContact CG2-OD1 3.21Å; T231-D290 PolarHBondContact OG1-OD1 3.48Å
232N93.5Very high89.3Confident10 Ų1056.4 Ų56.45%0.05333%0.333CS..Hα-helixtrans-59.3-30.7-178.3-72.1-15000112.4R217 T227 D228 N229 D230 L234 H235 Y236R217-N232 PolarHBondContact NE-OD1 3.12Å; R217-N232 PolarHBondContact NH2-OD1 3.38Å; T227-N232 PolarHBondContact O-ND2 3.04Å; D228-N232 PolarHBondContact OD1-ND2 2.98Å; N229-N232 WeakPolarHBondContact O-CB 3.43Å; N229-N232 PolarHBondContact O-N 2.89Å; D230-N232 PolarHBondContact O-N 3.14Å; N232-L234 VanDerWaalsContact C-N 3.27Å; N232-L234 PolarHBondContact O-N 3.33Å; N232-H235 PolarHBondContact O-N 3.3Å; N232-Y236 HydrophobicContact CB-CE2 4.47Å; N232-Y236 WeakPolarHBondContact O-CD2 3.2Å; N232-Y236 PolarHBondContact O-N 3.44Å
233I94.9Very high90Very high98 Ų9855.9 Ų55.950%0.50333%0.325SS..Hα-helixtrans-63-33.7175.3-163.258.3000112.7D230 T231 K237D230-I233 WeakPolarHBondContact O-CG2 3.3Å; D230-I233 PolarHBondContact O-N 2.64Å; T231-I233 PolarHBondContact O-N 2.54Å; I233-K237 WeakPolarHBondContact O-CG 3.49Å; I233-K237 PolarHBondContact O-N 3.14Å
234L97.3Very high90.9Very high21 Ų2156.7 Ų56.711%0.1131%0.314CS..Hα-helixtrans-73.5-39.1177.6-58.8174.9000110.3T231 N232 K237 H238 F282 L285 A286 Q289T231-L234 WeakPolarHBondContact O-CB 3.24Å; T231-L234 PolarHBondContact O-N 3.21Å; N232-L234 VanDerWaalsContact C-N 3.27Å; N232-L234 PolarHBondContact O-N 3.33Å; L234-K237 PolarHBondContact O-N 2.96Å; L234-H238 PolarHBondContact O-N 3.43Å; L234-F282 HydrophobicContact CD2-CD1 4.13Å; L234-L285 HydrophobicContact CD1-CB 3.99Å; L234-A286 HydrophobicContact CB-CB 3.61Å; L234-A286 HydrophobicContact CD1-CB 4.38Å; L234-Q289 VanDerWaalsContact CD1-OE1 3.25Å
235H96.2Very high92Very high0 Ų049.8 Ų49.80%028%0.278CS..Hα-helixtrans-62.5-41.9173-70.6-52.9000112.1V218 T231 N232 K237 H238 I239 A286 D290V218-H235 HydrophobicContact CG2-CB 4.01Å; T231-H235 PolarHBondContact O-N 3.29Å; N232-H235 PolarHBondContact O-N 3.3Å; H235-K237 PolarHBondContact O-N 3.38Å; H235-H238 PolarHBondContact O-N 3.42Å; H235-I239 WeakPolarHBondContact O-CB 3.44Å; H235-I239 VanDerWaalsContact O-CG1 3.28Å; H235-I239 WeakPolarHBondContact O-CG1 3.32Å; H235-I239 PolarHBondContact O-N 3.49Å; H235-A286 WeakPolarHBondContact CE1-CB 3.34Å; H235-D290 IonicContact CD2-OD2 3.83Å; H235-D290 IonicContact CE1-OD2 2.76Å; H235-D290 IonicContact NE2-OD2 3.71Å; H235-D290 PolarHBondContact NE2-OD2 2.86Å
236Y95.8Very high93.2Very high105 Ų10549.6 Ų49.641%0.41228%0.276SS..Hα-helixtrans-58.9-45.3173.1-77.1-63.3000112.2V218 F219 N232 I239 G240V218-Y236 HydrophobicContact CB-CE1 4.48Å; V218-Y236 HydrophobicContact CG1-CD1 3.47Å; V218-Y236 VanDerWaalsContact CG1-CD1 3.47Å; V218-Y236 HydrophobicContact CG1-CD2 4.17Å; V218-Y236 HydrophobicContact CG1-CE1 3.01Å; V218-Y236 HydrophobicContact CG1-CE2 3.79Å; V218-Y236 HydrophobicContact CG1-CG 4.02Å; V218-Y236 WeakPolarHBondContact CG1-OH 3.49Å; V218-Y236 PolarHBondContact O-OH 2.85Å; F219-Y236 HydrophobicContact CD1-CE1 4.18Å; F219-Y236 HydrophobicContact CE1-CD1 4.14Å; F219-Y236 AromaticContact CE1-CE1 3.58Å; F219-Y236 HydrophobicContact CE1-CE1 3.58Å; F219-Y236 HydrophobicContact CZ-CD1 4.08Å; F219-Y236 AromaticContact CZ-CE1 3.93Å; F219-Y236 HydrophobicContact CZ-CE1 3.93Å; N232-Y236 HydrophobicContact CB-CE2 4.47Å; N232-Y236 WeakPolarHBondContact O-CD2 3.2Å; N232-Y236 PolarHBondContact O-N 3.44Å; Y236-I239 PolarHBondContact O-N 3.42Å; Y236-G240 PolarHBondContact O-N 3.49Å
237K97.4Very high93.8Very high97 Ų9753.7 Ų53.742%0.42229%0.292SS..Hα-helixtrans-62.3-44.7177.3-72175.6-176.8177.20111.6I233 L234 H235 L241 F282I233-K237 WeakPolarHBondContact O-CG 3.49Å; I233-K237 PolarHBondContact O-N 3.14Å; L234-K237 PolarHBondContact O-N 2.96Å; H235-K237 PolarHBondContact O-N 3.38Å; K237-L241 WeakPolarHBondContact O-CB 3.49Å; K237-L241 WeakPolarHBondContact O-CG 3.36Å; K237-L241 PolarHBondContact O-N 3.42Å; K237-F282 HydrophobicContact CB-CB 4.32Å; K237-F282 HydrophobicContact CB-CD1 4.11Å; K237-F282 HydrophobicContact CB-CD2 4.08Å; K237-F282 HydrophobicContact CB-CE1 4.5Å; K237-F282 HydrophobicContact CB-CE2 4.44Å; K237-F282 HydrophobicContact CB-CG 3.9Å; K237-F282 HydrophobicContact CD-CD1 3.87Å; K237-F282 HydrophobicContact CD-CE1 3.59Å; K237-F282 HydrophobicContact CD-CE2 4.49Å; K237-F282 HydrophobicContact CD-CG 4.46Å; K237-F282 HydrophobicContact CD-CZ 3.93Å
238H97.3Very high94.5Very high9 Ų953.7 Ų53.74%0.04229%0.291CS..Hα-helixtrans-58.6-52.4175.6170.361000111.6Y135 L234 H235 G240 L241 A242 G279 F282Y135-H238 PolarHBondContact OH-CD2 3.38Å; Y135-H238 PolarHBondContact OH-NE2 3.45Å; L234-H238 PolarHBondContact O-N 3.43Å; H235-H238 PolarHBondContact O-N 3.42Å; H238-G240 PolarHBondContact O-N 2.91Å; H238-L241 PolarHBondContact O-N 2.91Å; H238-A242 WeakPolarHBondContact O-CB 3.5Å; H238-A242 PolarHBondContact O-N 3.44Å; H238-G279 PolarHBondContact ND1-O 3.01Å; H238-F282 HydrophobicContact CB-CB 4.24Å
239I95.8Very high94.8Very high9 Ų949 Ų495%0.04626%0.264CS..Hα-helixtrans-59.8-46-179.4-71.3166.3000110.9L214 F215 F219 H235 Y236 L241 A242 L243L214-I239 HydrophobicContact CB-CD1 4.45Å; F215-I239 HydrophobicContact CD1-CD1 4.09Å; F215-I239 HydrophobicContact CE1-CD1 4.11Å; F215-I239 HydrophobicContact CE1-CG1 4.21Å; F215-I239 HydrophobicContact CE1-CG2 3.79Å; F219-I239 HydrophobicContact CE2-CD1 4.12Å; F219-I239 HydrophobicContact CE2-CG2 4.42Å; H235-I239 WeakPolarHBondContact O-CB 3.44Å; H235-I239 VanDerWaalsContact O-CG1 3.28Å; H235-I239 WeakPolarHBondContact O-CG1 3.32Å; H235-I239 PolarHBondContact O-N 3.49Å; Y236-I239 PolarHBondContact O-N 3.42Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3.42Å; I239-A242 PolarHBondContact O-N 3.36Å; I239-L243 HydrophobicContact CG2-CD1 4.11Å; I239-L243 HydrophobicContact CG2-CG 4.48Å; I239-L243 WeakPolarHBondContact O-CG 3.28Å; I239-L243 PolarHBondContact O-N 3.04Å
240G96.7Very high95Very high40 Ų4048.9 Ų48.941%0.41227%0.269SS..Hα-helixtrans-58.8-44.6178.100000112.5Y236 H238 L243 L244Y236-G240 PolarHBondContact O-N 3.49Å; H238-G240 PolarHBondContact O-N 2.91Å; G240-L243 PolarHBondContact O-N 2.88Å; G240-L244 WeakPolarHBondContact O-CB 3.45Å; G240-L244 PolarHBondContact O-N 3.18Å
241L97.9Very high95.2Very high30 Ų3043.9 Ų43.916%0.15724%0.243CC..Hα-helixtrans-68.6-36.1176.5-74.4165.6000112.6K237 H238 I239 L244 T245 C275 L278 F282K237-L241 WeakPolarHBondContact O-CB 3.49Å; K237-L241 WeakPolarHBondContact O-CG 3.36Å; K237-L241 PolarHBondContact O-N 3.42Å; H238-L241 PolarHBondContact O-N 2.91Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3.42Å; L241-L244 PolarHBondContact O-N 3.31Å; L241-T245 VanDerWaalsContact O-CB 3.26Å; L241-T245 WeakPolarHBondContact O-CB 3.22Å; L241-T245 PolarHBondContact O-N 3.11Å; L241-T245 PolarHBondContact O-OG1 3.26Å; L241-C275 HydrophobicContact CD2-CB 4.38Å; L241-L278 HydrophobicContact CD1-CB 3.83Å; L241-L278 HydrophobicContact CD2-CB 4.48Å; L241-F282 HydrophobicContact CD1-CD2 3.49Å; L241-F282 VanDerWaalsContact CD1-CD2 3.49Å; L241-F282 HydrophobicContact CD1-CE2 3.8Å
242A95.5Very high95.1Very high29 Ų2947.7 Ų47.724%0.2426%0.258CS..Hα-helixtrans-64-42.7175.400000111.7H238 I239 T245 G246H238-A242 WeakPolarHBondContact O-CB 3.5Å; H238-A242 PolarHBondContact O-N 3.44Å; I239-A242 PolarHBondContact O-N 3.36Å; A242-T245 WeakPolarHBondContact O-CB 3.45Å; A242-T245 PolarHBondContact O-N 2.94Å; A242-G246 PolarHBondContact O-N 3.39Å
243L95.3Very high95.1Very high112 Ų11249.5 Ų49.559%0.58627%0.267SS*.Hα-helixtrans-64.2-44.2174.8-68.9174.1000111.7I239 G240 T245 G246 F247I239-L243 HydrophobicContact CG2-CD1 4.11Å; I239-L243 HydrophobicContact CG2-CG 4.48Å; I239-L243 WeakPolarHBondContact O-CG 3.28Å; I239-L243 PolarHBondContact O-N 3.04Å; G240-L243 PolarHBondContact O-N 2.88Å; L243-T245 VanDerWaalsContact C-N 3.32Å; L243-T245 PolarHBondContact O-N 3.42Å; L243-G246 PolarHBondContact O-N 3.39Å; L243-F247 WeakPolarHBondContact O-CB 3.29Å; L243-F247 PolarHBondContact O-N 3.47Å
244L96.8Very high95.2Very high75 Ų7546.5 Ų46.539%0.39325%0.254SS..Hα-helixtrans-61.3-41.4175.518059000111.8G240 L241 F247 L248G240-L244 WeakPolarHBondContact O-CB 3.45Å; G240-L244 PolarHBondContact O-N 3.18Å; L241-L244 PolarHBondContact O-N 3.31Å; L244-F247 HydrophobicContact CD1-CD1 4.35Å; L244-F247 WeakPolarHBondContact O-CB 3.49Å; L244-F247 PolarHBondContact O-N 3.07Å; L244-L248 HydrophobicContact CD1-CD1 4.19Å; L244-L248 HydrophobicContact CD1-CG 4.18Å; L244-L248 HydrophobicContact CG-CD1 4Å; L244-L248 HydrophobicContact CG-CG 4.46Å; L244-L248 VanDerWaalsContact O-CG 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.21Å; L244-L248 PolarHBondContact O-N 3.39Å
245T95.9Very high95.2Very high15 Ų1546 Ų469%0.09225%0.251CS..Hα-helixtrans-58.3-50.5175.4-61.60000110.4L241 A242 L243 F247 L248 F249 F272 C275 G276L241-T245 VanDerWaalsContact O-CB 3.26Å; L241-T245 WeakPolarHBondContact O-CB 3.22Å; L241-T245 PolarHBondContact O-N 3.11Å; L241-T245 PolarHBondContact O-OG1 3.26Å; A242-T245 WeakPolarHBondContact O-CB 3.45Å; A242-T245 PolarHBondContact O-N 2.94Å; L243-T245 VanDerWaalsContact C-N 3.32Å; L243-T245 PolarHBondContact O-N 3.42Å; T245-F247 VanDerWaalsContact C-N 3.34Å; T245-F247 PolarHBondContact O-N 3.11Å; T245-L248 PolarHBondContact O-N 2.87Å; T245-F249 PolarHBondContact O-N 3.04Å; T245-F249 VanDerWaalsContact O-N 3.09Å; T245-F272 HydrophobicContact CG2-CD2 3.21Å; T245-F272 HydrophobicContact CG2-CE2 3.26Å; T245-F272 HydrophobicContact CG2-CG 4.17Å; T245-F272 HydrophobicContact CG2-CZ 4.23Å; T245-F272 WeakPolarHBondContact O-CD2 3.25Å; T245-C275 WeakPolarHBondContact OG1-CB 3.19Å; T245-G276 PolarHBondContact OG1-N 2.65Å
246G93.8Very high95.1Very high40 Ų4053.3 Ų53.341%0.41228%0.279SS..Hα-helixtrans-59.6-41.617500000113.2A242 L243 F249 A250A242-G246 PolarHBondContact O-N 3.39Å; L243-G246 PolarHBondContact O-N 3.39Å; G246-F249 PolarHBondContact O-N 2.96Å; G246-A250 VanDerWaalsContact O-CB 3.3Å; G246-A250 WeakPolarHBondContact O-CB 3.34Å; G246-A250 PolarHBondContact O-N 3.39Å
247F95.1Very high95.1Very high108 Ų10855 Ų5547%0.47429%0.294SS..Hα-helixtrans-61.5-48.1177.1173.1-93.7000112.4L243 L244 T245 F249 A250 T251 L253L243-F247 WeakPolarHBondContact O-CB 3.29Å; L243-F247 PolarHBondContact O-N 3.47Å; L244-F247 HydrophobicContact CD1-CD1 4.35Å; L244-F247 WeakPolarHBondContact O-CB 3.49Å; L244-F247 PolarHBondContact O-N 3.07Å; T245-F247 VanDerWaalsContact C-N 3.34Å; T245-F247 PolarHBondContact O-N 3.11Å; F247-F249 PolarHBondContact O-N 3.48Å; F247-A250 PolarHBondContact O-N 2.96Å; F247-T251 HydrophobicContact CD2-CG2 3.83Å; F247-T251 HydrophobicContact CE1-CG2 4.42Å; F247-T251 HydrophobicContact CE2-CG2 3.61Å; F247-T251 HydrophobicContact CG-CG2 4.35Å; F247-T251 HydrophobicContact CZ-CG2 3.93Å; F247-T251 WeakPolarHBondContact O-CB 3.39Å; F247-T251 WeakPolarHBondContact O-CG2 3.45Å; F247-T251 PolarHBondContact O-N 3.15Å; F247-T251 PolarHBondContact O-OG1 2.61Å; F247-L253 HydrophobicContact CE1-CD1 4.2Å; F247-L253 HydrophobicContact CZ-CD1 3.93Å
248L95.2Very high95.1Very high14 Ų1452 Ų527%0.07329%0.287CS..Hα-helixtrans-63.1-41.8179.7-71.1165.8000111.7L244 T245 R252 S268 L271 F272L244-L248 HydrophobicContact CD1-CD1 4.19Å; L244-L248 HydrophobicContact CD1-CG 4.18Å; L244-L248 HydrophobicContact CG-CD1 4Å; L244-L248 HydrophobicContact CG-CG 4.46Å; L244-L248 VanDerWaalsContact O-CG 3.32Å; L244-L248 WeakPolarHBondContact O-CG 3.21Å; L244-L248 PolarHBondContact O-N 3.39Å; T245-L248 PolarHBondContact O-N 2.87Å; L248-R252 PolarHBondContact O-N 3.42Å; L248-R252 VanDerWaalsContact O-N 3.1Å; L248-S268 WeakPolarHBondContact O-CB 3.25Å; L248-S268 PolarHBondContact O-OG 3.37Å; L248-L271 HydrophobicContact CD1-CB 3.67Å; L248-L271 HydrophobicContact CD2-CB 4.25Å; L248-L271 HydrophobicContact CD2-CD1 4.18Å; L248-F272 HydrophobicContact CB-CB 4.48Å
249F91.3Very high95.1Very high40 Ų4054.9 Ų54.918%0.17531%0.307CS..Hα-helixtrans-63.7-43.6175.9-177.2-102.8000112.1R199 I200 T245 G246 F247 F272R199-F249 HydrophobicContact CB-CZ 4.34Å; I200-F249 HydrophobicContact CG1-CD1 4.12Å; I200-F249 HydrophobicContact CG1-CE1 3.81Å; T245-F249 PolarHBondContact O-N 3.04Å; T245-F249 VanDerWaalsContact O-N 3.09Å; G246-F249 PolarHBondContact O-N 2.96Å; F247-F249 PolarHBondContact O-N 3.48Å; F249-F272 HydrophobicContact CB-CD2 3.75Å; F249-F272 HydrophobicContact CB-CE2 4.03Å; F249-F272 HydrophobicContact CD2-CD2 4.37Å; F249-F272 HydrophobicContact CD2-CE2 4.27Å; F249-F272 HydrophobicContact CG-CD2 4.42Å; F249-F272 HydrophobicContact CG-CE2 4.33Å
250A91.2Very high95Very high38 Ų3855.7 Ų55.731%0.31432%0.317SS..Hα-helixtrans-72.5-40.3-178.100000112.7K196 I200 G246 F247K196-A250 WeakPolarHBondContact CE-O 3.46Å; K196-A250 PolarHBondContact NZ-O 2.78Å; I200-A250 HydrophobicContact CD1-CB 4.45Å; G246-A250 VanDerWaalsContact O-CB 3.3Å; G246-A250 WeakPolarHBondContact O-CB 3.34Å; G246-A250 PolarHBondContact O-N 3.39Å; F247-A250 PolarHBondContact O-N 2.96Å
251T92.5Very high95.1Very high31 Ų3157.9 Ų57.919%0.1933%0.326CS..Hα-helixtrans-90.4-29.9-170.159.90000114.3F247 L253 R256F247-T251 HydrophobicContact CD2-CG2 3.83Å; F247-T251 HydrophobicContact CE1-CG2 4.42Å; F247-T251 HydrophobicContact CE2-CG2 3.61Å; F247-T251 HydrophobicContact CG-CG2 4.35Å; F247-T251 HydrophobicContact CZ-CG2 3.93Å; F247-T251 WeakPolarHBondContact O-CB 3.39Å; F247-T251 WeakPolarHBondContact O-CG2 3.45Å; F247-T251 PolarHBondContact O-N 3.15Å; F247-T251 PolarHBondContact O-OG1 2.61Å; T251-L253 VanDerWaalsContact C-N 3.35Å; T251-R256 WeakPolarHBondContact O-CD 3.4Å
252R91.3Very high95Very high81 Ų8159.3 Ų59.331%0.30633%0.331SS..  trans61.240.3-172.7-59.1-171-63.2-155.212.4113.9D23 L248 E255 R256 S268D23-R252 IonicContact OD2-CZ 2.73Å; D23-R252 IonicContact OD2-NH1 3.71Å; D23-R252 PolarHBondContact OD2-NH1 2.97Å; D23-R252 IonicContact OD2-NH2 3.53Å; D23-R252 PolarHBondContact OD2-NH2 3.45Å; L248-R252 PolarHBondContact O-N 3.42Å; L248-R252 VanDerWaalsContact O-N 3.1Å; R252-E255 WeakPolarHBondContact CB-OE1 3.27Å; R252-R256 HydrophobicContact CB-CB 4.45Å; R252-R256 WeakPolarHBondContact O-CB 3.45Å; R252-R256 PolarHBondContact O-N 3.03Å; R252-S268 WeakPolarHBondContact CA-OG 3.4Å
253L94.3Very high95.1Very high47 Ų4758.3 Ų58.325%0.24632%0.322CS..THydrogen-bonded Turntrans-93.9142.5174.2-65.8174.4000109.8F247 T251 R256 L257 S268F247-L253 HydrophobicContact CE1-CD1 4.2Å; F247-L253 HydrophobicContact CZ-CD1 3.93Å; T251-L253 VanDerWaalsContact C-N 3.35Å; L253-R256 HydrophobicContact CD2-CB 4.38Å; L253-L257 HydrophobicContact CD2-CD1 3.65Å; L253-L257 HydrophobicContact CD2-CD2 4.17Å; L253-L257 HydrophobicContact CD2-CG 3.5Å; L253-S268 WeakPolarHBondContact O-CA 3.32Å; L253-S268 WeakPolarHBondContact O-CB 3.41Å
254P96.8Very high95.1Very high36 Ų3656.3 Ų56.323%0.23431%0.307CS..THydrogen-bonded Turncis-93.2-11.19.235.7-36.2000115.7R256 L257 A258 F262 G266P254-R256 PolarHBondContact O-N 3.28Å; P254-R256 VanDerWaalsContact O-N 3.12Å; P254-L257 PolarHBondContact O-N 2.88Å; P254-A258 PolarHBondContact O-N 3.47Å; P254-F262 HydrophobicContact CB-CD2 4.28Å; P254-F262 HydrophobicContact CB-CE1 4.25Å; P254-F262 HydrophobicContact CB-CE2 3.71Å; P254-F262 HydrophobicContact CB-CZ 3.7Å; P254-F262 HydrophobicContact CG-CD1 3.71Å; P254-F262 HydrophobicContact CG-CD2 3.89Å; P254-F262 HydrophobicContact CG-CE1 3.49Å; P254-F262 VanDerWaalsContact CG-CE1 3.49Å; P254-F262 HydrophobicContact CG-CE2 3.66Å; P254-F262 HydrophobicContact CG-CG 3.91Å; P254-F262 HydrophobicContact CG-CZ 3.46Å; P254-F262 VanDerWaalsContact CG-CZ 3.46Å; P254-G266 WeakPolarHBondContact CD-O 3.21Å; P254-G266 WeakPolarHBondContact CG-O 3.11Å
255E96.6Very high95.2Very high9 Ų957.9 Ų57.94%0.04232%0.315CS..THydrogen-bonded Turntrans-60.4-27.9-171.371.8-79.3-16900113.9S24 I25 R252 L257 A258 F262 H267 S268S24-E255 WeakPolarHBondContact CB-O 3.49Å; S24-E255 PolarHBondContact OG-O 3.02Å; I25-E255 HydrophobicContact CD1-CB 4.47Å; I25-E255 HydrophobicContact CD1-CG 4.44Å; R252-E255 WeakPolarHBondContact CB-OE1 3.27Å; E255-L257 PolarHBondContact O-N 2.71Å; E255-A258 CarbonylContact O-C 3.58Å; E255-A258 VanDerWaalsContact O-C 3.31Å; E255-A258 PolarHBondContact O-N 3.41Å; E255-F262 HydrophobicContact CB-CB 4.06Å; E255-F262 HydrophobicContact CB-CD2 4.34Å; E255-H267 HydrophobicContact CB-CB 4.09Å; E255-H267 HydrophobicContact CG-CB 4.16Å; E255-S268 VanDerWaalsContact CD-N 3.32Å; E255-S268 VanDerWaalsContact OE1-CB 3.27Å; E255-S268 WeakPolarHBondContact OE1-CB 3.37Å; E255-S268 PolarHBondContact OE1-N 2.92Å; E255-S268 PolarHBondContact OE1-OG 3.31Å; E255-S268 VanDerWaalsContact OE1-OG 3.07Å; E255-S268 WeakPolarHBondContact OE2-CB 3.23Å; E255-S268 PolarHBondContact OE2-N 3.1Å
256R94.8Very high95.2Very high155 Ų15558 Ų5859%0.58532%0.318SS*.THydrogen-bonded Turntrans-60.7-31172.9179.4177.7172.5178.3-3.2113.2T251 R252 L253 P254T251-R256 WeakPolarHBondContact O-CD 3.4Å; R252-R256 HydrophobicContact CB-CB 4.45Å; R252-R256 WeakPolarHBondContact O-CB 3.45Å; R252-R256 PolarHBondContact O-N 3.03Å; L253-R256 HydrophobicContact CD2-CB 4.38Å; P254-R256 PolarHBondContact O-N 3.28Å; P254-R256 VanDerWaalsContact O-N 3.12Å
257L96.5Very high95.3Very high139 Ų13956.5 Ų56.573%0.72830%0.301SS*.THydrogen-bonded Turntrans-86.9-27.2-178.9-61177.7000112.8L253 P254 E255L253-L257 HydrophobicContact CD2-CD1 3.65Å; L253-L257 HydrophobicContact CD2-CD2 4.17Å; L253-L257 HydrophobicContact CD2-CG 3.5Å; P254-L257 PolarHBondContact O-N 2.88Å; E255-L257 PolarHBondContact O-N 2.71Å
258A96.3Very high95.4Very high34 Ų3451.6 Ų51.628%0.28128%0.28SS..SBendtrans-137.677.7177.800000111P254 E255 G260 S261 F262P254-A258 PolarHBondContact O-N 3.47Å; E255-A258 CarbonylContact O-C 3.58Å; E255-A258 VanDerWaalsContact O-C 3.31Å; E255-A258 PolarHBondContact O-N 3.41Å; A258-G260 PolarHBondContact O-N 2.92Å; A258-S261 WeakPolarHBondContact O-CB 3.49Å; A258-S261 PolarHBondContact O-N 2.87Å; A258-S261 VanDerWaalsContact O-N 3.14Å; A258-S261 PolarHBondContact O-OG 3.49Å; A258-F262 HydrophobicContact CB-CE2 4.09Å
259P96.8Very high95.5Very high71 Ų7153 Ų5346%0.46129%0.286SS..THydrogen-bonded Turntrans-54.4137.4178.9-25.635000112S24 I26 S261S24-P259 WeakPolarHBondContact O-CA 3.32Å; I26-P259 HydrophobicContact CD1-CB 4.28Å; P259-S261 PolarHBondContact O-N 3.35Å
260G95.4Very high95.8Very high25 Ų2551.3 Ų51.326%0.25828%0.279SS..THydrogen-bonded Turntrans84.5-22.1-177.800000115.4S24 A258 F262 D263S24-G260 PolarHBondContact O-N 3.14Å; A258-G260 PolarHBondContact O-N 2.92Å; G260-F262 VanDerWaalsContact C-N 3.33Å; G260-F262 PolarHBondContact O-N 3.42Å; G260-D263 VanDerWaalsContact CA-OD1 3.23Å; G260-D263 WeakPolarHBondContact CA-OD1 3.39Å; G260-D263 VanDerWaalsContact O-CG 3.32Å
261S97.1Very high96.1Very high86 Ų8652.5 Ų52.560%0.60128%0.279SS*.THydrogen-bonded Turntrans-76.3-24.3-175-59.10000113A258 P259A258-S261 WeakPolarHBondContact O-CB 3.49Å; A258-S261 PolarHBondContact O-N 2.87Å; A258-S261 VanDerWaalsContact O-N 3.14Å; A258-S261 PolarHBondContact O-OG 3.49Å; P259-S261 PolarHBondContact O-N 3.35Å
262F97.1Very high96.3Very high61 Ų6153.1 Ų53.127%0.26828%0.279SS..THydrogen-bonded Turntrans-115.423.9-175.4-60.7-83.6000112.3P254 E255 A258 G260 Y264 I265 H267P254-F262 HydrophobicContact CB-CD2 4.28Å; P254-F262 HydrophobicContact CB-CE1 4.25Å; P254-F262 HydrophobicContact CB-CE2 3.71Å; P254-F262 HydrophobicContact CB-CZ 3.7Å; P254-F262 HydrophobicContact CG-CD1 3.71Å; P254-F262 HydrophobicContact CG-CD2 3.89Å; P254-F262 HydrophobicContact CG-CE1 3.49Å; P254-F262 VanDerWaalsContact CG-CE1 3.49Å; P254-F262 HydrophobicContact CG-CE2 3.66Å; P254-F262 HydrophobicContact CG-CG 3.91Å; P254-F262 HydrophobicContact CG-CZ 3.46Å; P254-F262 VanDerWaalsContact CG-CZ 3.46Å; E255-F262 HydrophobicContact CB-CB 4.06Å; E255-F262 HydrophobicContact CB-CD2 4.34Å; A258-F262 HydrophobicContact CB-CE2 4.09Å; G260-F262 VanDerWaalsContact C-N 3.33Å; G260-F262 PolarHBondContact O-N 3.42Å; F262-Y264 VanDerWaalsContact C-N 3.26Å; F262-Y264 PolarHBondContact O-N 3.21Å; F262-I265 WeakPolarHBondContact CA-O 3.37Å; F262-I265 WeakPolarHBondContact CD1-O 3.17Å; F262-H267 HydrophobicContact CB-CB 3.98Å; F262-H267 WeakPolarHBondContact O-CB 3.41Å; F262-H267 PolarHBondContact O-CD2 3.14Å
263D96.8Very high96.6Very high7 Ų749.4 Ų49.44%0.03727%0.265CS..THydrogen-bonded Turntrans-57.6-36.3-174-79.2-5.6000113.6I25 I26 S27 N48 G260I25-D263 VanDerWaalsContact CA-OD1 3.28Å; I25-D263 WeakPolarHBondContact CA-OD1 3.14Å; I25-D263 HydrophobicContact CG2-CB 4.44Å; I26-D263 PolarHBondContact N-OD1 2.95Å; I26-D263 PolarHBondContact N-OD2 3.4Å; S27-D263 WeakPolarHBondContact CA-OD2 3.32Å; S27-D263 WeakPolarHBondContact CB-OD2 3.35Å; S27-D263 PolarHBondContact N-OD2 3.42Å; S27-D263 PolarHBondContact OG-OD2 3.07Å; N48-D263 WeakPolarHBondContact CA-O 3.09Å; N48-D263 WeakPolarHBondContact CB-O 3.32Å; G260-D263 VanDerWaalsContact CA-OD1 3.23Å; G260-D263 WeakPolarHBondContact CA-OD1 3.39Å; G260-D263 VanDerWaalsContact O-CG 3.32Å
264Y96.6Very high96.8Very high71 Ų7149.9 Ų49.928%0.27827%0.27SS..THydrogen-bonded Turntrans-108.1-35.5-176.7-64.5-90.5000113.2S27 G28 M46 F262 Q270S27-Y264 WeakPolarHBondContact OG-CE2 3.42Å; G28-Y264 WeakPolarHBondContact CA-OH 3.3Å; G28-Y264 PolarHBondContact N-OH 2.9Å; M46-Y264 HydrophobicContact CB-CD1 4.33Å; F262-Y264 VanDerWaalsContact C-N 3.26Å; F262-Y264 PolarHBondContact O-N 3.21Å; Y264-Q270 PolarHBondContact O-NE2 3.46Å
265I97.6Very high96.9Very high108 Ų10848.9 Ų48.955%0.55426%0.264SS*.THydrogen-bonded Turntrans-138.3134.1-172.4-55.6-178000109.6M46 L51 F262 Q270M46-I265 HydrophobicContact CE-CD1 4.12Å; M46-I265 HydrophobicContact CE-CG1 4.05Å; L51-I265 HydrophobicContact CD1-CB 4.12Å; L51-I265 HydrophobicContact CD1-CG1 3.86Å; L51-I265 HydrophobicContact CD1-CG2 3.87Å; F262-I265 WeakPolarHBondContact CA-O 3.37Å; F262-I265 WeakPolarHBondContact CD1-O 3.17Å; I265-Q270 VanDerWaalsContact CA-OE1 3.28Å
266G95.7Very high96.9Very high16 Ų1649.4 Ų49.417%0.16527%0.271CS..THydrogen-bonded Turntrans86.87.6166.400000115.6P254 L271P254-G266 WeakPolarHBondContact CD-O 3.21Å; P254-G266 WeakPolarHBondContact CG-O 3.11Å; G266-L271 WeakPolarHBondContact O-CD1 3.12Å
267H97.2Very high97.1Very high9 Ų942.7 Ų42.74%0.04225%0.247CC..  trans-71.1157.4171.567.769000111.2I25 N48 N52 E255 F262 H269 Q270 L271I25-H267 HydrophobicContact CD1-CB 3.9Å; N48-H267 PolarHBondContact O-NE2 3.45Å; N52-H267 PolarHBondContact OD1-CE1 3.36Å; E255-H267 HydrophobicContact CB-CB 4.09Å; E255-H267 HydrophobicContact CG-CB 4.16Å; F262-H267 HydrophobicContact CB-CB 3.98Å; F262-H267 WeakPolarHBondContact O-CB 3.41Å; F262-H267 PolarHBondContact O-CD2 3.14Å; H267-H269 VanDerWaalsContact C-N 3.26Å; H267-H269 PolarHBondContact ND1-N 2.59Å; H267-H269 PolarHBondContact O-N 3.43Å; H267-H269 VanDerWaalsContact O-N 3.11Å; H267-Q270 PolarHBondContact CD2-NE2 3.14Å; H267-Q270 VanDerWaalsContact CD2-NE2 3.34Å; H267-Q270 VanDerWaalsContact CE1-CG 3.46Å; H267-Q270 WeakPolarHBondContact CE1-CG 3.3Å; H267-Q270 PolarHBondContact ND1-N 3.45Å; H267-Q270 PolarHBondContact NE2-NE2 2.78Å; H267-Q270 WeakPolarHBondContact O-CB 3.39Å; H267-Q270 PolarHBondContact O-N 2.86Å; H267-L271 PolarHBondContact O-N 3.03Å
268S96.9Very high97.2Very high5 Ų539.9 Ų39.94%0.03523%0.232CC..Hα-helixtrans-57.2-37.2-167.392.60000113.3L248 R252 L253 E255 Q270 L271 F272L248-S268 WeakPolarHBondContact O-CB 3.25Å; L248-S268 PolarHBondContact O-OG 3.37Å; R252-S268 WeakPolarHBondContact CA-OG 3.4Å; L253-S268 WeakPolarHBondContact O-CA 3.32Å; L253-S268 WeakPolarHBondContact O-CB 3.41Å; E255-S268 VanDerWaalsContact CD-N 3.32Å; E255-S268 VanDerWaalsContact OE1-CB 3.27Å; E255-S268 WeakPolarHBondContact OE1-CB 3.37Å; E255-S268 PolarHBondContact OE1-N 2.92Å; E255-S268 PolarHBondContact OE1-OG 3.31Å; E255-S268 VanDerWaalsContact OE1-OG 3.07Å; E255-S268 WeakPolarHBondContact OE2-CB 3.23Å; E255-S268 PolarHBondContact OE2-N 3.1Å; S268-Q270 VanDerWaalsContact C-N 3.33Å; S268-Q270 PolarHBondContact O-N 2.9Å; S268-L271 CarbonylContact O-C 3.59Å; S268-L271 PolarHBondContact O-N 2.73Å; S268-F272 WeakPolarHBondContact O-CB 3.38Å; S268-F272 PolarHBondContact O-N 3.24Å
269H96.4Very high97.3Very high44 Ų4438.4 Ų38.420%0.20422%0.22CC..Hα-helixtrans-65.4-33.6-180-163.583.3000112.8H103 H267 F272 H273H103-H269 AromaticContact CE1-CD2 3.72Å; H103-H269 AromaticContact CE1-NE2 3.3Å; H103-H269 PolarHBondContact CE1-NE2 2.76Å; H103-H269 VanDerWaalsContact CE1-NE2 3.3Å; H103-H269 AromaticContact NE2-CD2 3.9Å; H103-H269 AromaticContact NE2-NE2 3.13Å; H103-H269 PolarHBondContact NE2-NE2 3.41Å; H103-H269 VanDerWaalsContact NE2-NE2 3.13Å; H267-H269 VanDerWaalsContact C-N 3.26Å; H267-H269 PolarHBondContact ND1-N 2.59Å; H267-H269 PolarHBondContact O-N 3.43Å; H267-H269 VanDerWaalsContact O-N 3.11Å; H269-F272 WeakPolarHBondContact O-CB 3.42Å; H269-H273 AromaticContact CD2-CE1 3.91Å; H269-H273 AromaticContact CD2-NE2 3.65Å; H269-H273 AromaticContact CE1-NE2 3.79Å; H269-H273 AromaticContact NE2-CD2 3.83Å; H269-H273 AromaticContact NE2-CE1 3.54Å; H269-H273 AromaticContact NE2-NE2 3Å; H269-H273 PolarHBondContact NE2-NE2 3.27Å; H269-H273 PolarHBondContact O-N 3.3Å; H269-H273 VanDerWaalsContact O-N 3.09Å
270Q97.8Very high97.4Very high5 Ų535.1 Ų35.12%0.02320%0.199CC..Hα-helixtrans-68.8-45.3171.9-68.5169.79.400110.9L51 N52 Y264 I265 H267 S268 F272 H273 V274L51-Q270 HydrophobicContact CB-CG 3.78Å; L51-Q270 VanDerWaalsContact CD1-OE1 3.29Å; N52-Q270 WeakPolarHBondContact OD1-CG 3.47Å; N52-Q270 PolarHBondContact OD1-N 3.46Å; Y264-Q270 PolarHBondContact O-NE2 3.46Å; I265-Q270 VanDerWaalsContact CA-OE1 3.28Å; H267-Q270 PolarHBondContact CD2-NE2 3.14Å; H267-Q270 VanDerWaalsContact CD2-NE2 3.34Å; H267-Q270 VanDerWaalsContact CE1-CG 3.46Å; H267-Q270 WeakPolarHBondContact CE1-CG 3.3Å; H267-Q270 PolarHBondContact ND1-N 3.45Å; H267-Q270 PolarHBondContact NE2-NE2 2.78Å; H267-Q270 WeakPolarHBondContact O-CB 3.39Å; H267-Q270 PolarHBondContact O-N 2.86Å; S268-Q270 VanDerWaalsContact C-N 3.33Å; S268-Q270 PolarHBondContact O-N 2.9Å; Q270-F272 PolarHBondContact O-N 3.46Å; Q270-H273 PolarHBondContact O-N 3.44Å; Q270-V274 WeakPolarHBondContact O-CG2 3.36Å; Q270-V274 PolarHBondContact O-N 2.84Å
271L97.8Very high97.5Very high63 Ų6336.5 Ų36.533%0.3320%0.199SC..Hα-helixtrans-63.8-35.5178.4-59.2179.8000111.1L248 G266 H267 S268 V274 C275L248-L271 HydrophobicContact CD1-CB 3.67Å; L248-L271 HydrophobicContact CD2-CB 4.25Å; L248-L271 HydrophobicContact CD2-CD1 4.18Å; G266-L271 WeakPolarHBondContact O-CD1 3.12Å; H267-L271 PolarHBondContact O-N 3.03Å; S268-L271 CarbonylContact O-C 3.59Å; S268-L271 PolarHBondContact O-N 2.73Å; L271-V274 PolarHBondContact O-N 3.36Å; L271-C275 WeakPolarHBondContact O-CB 3.24Å; L271-C275 PolarHBondContact O-N 3.18Å; L271-C275 PolarHBondContact O-SG 2.78Å
272F96.9Very high97.6Very high43 Ų4334.6 Ų34.619%0.18918%0.18CC..Hα-helixtrans-60.3-47.5172.5163.7-95.5000111.1T245 L248 F249 S268 H269 Q270 G276T245-F272 HydrophobicContact CG2-CD2 3.21Å; T245-F272 HydrophobicContact CG2-CE2 3.26Å; T245-F272 HydrophobicContact CG2-CG 4.17Å; T245-F272 HydrophobicContact CG2-CZ 4.23Å; T245-F272 WeakPolarHBondContact O-CD2 3.25Å; L248-F272 HydrophobicContact CB-CB 4.48Å; F249-F272 HydrophobicContact CB-CD2 3.75Å; F249-F272 HydrophobicContact CB-CE2 4.03Å; F249-F272 HydrophobicContact CD2-CD2 4.37Å; F249-F272 HydrophobicContact CD2-CE2 4.27Å; F249-F272 HydrophobicContact CG-CD2 4.42Å; F249-F272 HydrophobicContact CG-CE2 4.33Å; S268-F272 WeakPolarHBondContact O-CB 3.38Å; S268-F272 PolarHBondContact O-N 3.24Å; H269-F272 WeakPolarHBondContact O-CB 3.42Å; Q270-F272 PolarHBondContact O-N 3.46Å; F272-G276 PolarHBondContact O-N 3.49Å
273H98Very high97.7Very high3 Ų331.8 Ų31.81%0.01417%0.168CC..Hα-helixtrans-60.4-47.2174.3-73.5-169.6000112.2N52 T55 H56 H103 H269 Q270 G276 I277N52-H273 PolarHBondContact O-CE1 3.5Å; N52-H273 PolarHBondContact O-ND1 3.07Å; T55-H273 VanDerWaalsContact OG1-CB 3.28Å; T55-H273 WeakPolarHBondContact OG1-CB 3.45Å; T55-H273 PolarHBondContact OG1-ND1 3Å; H56-H273 AromaticContact CD2-CG 3.81Å; H56-H273 AromaticContact CD2-ND1 3.97Å; H56-H273 AromaticContact CE1-CD2 3.28Å; H56-H273 PolarHBondContact CE1-CD2 2.79Å; H56-H273 AromaticContact CE1-CE1 3.68Å; H56-H273 AromaticContact CE1-CG 3.46Å; H56-H273 VanDerWaalsContact CE1-CG 3.46Å; H56-H273 AromaticContact CE1-ND1 3.68Å; H56-H273 AromaticContact CE1-NE2 3.47Å; H56-H273 PolarHBondContact CE1-NE2 2.69Å; H56-H273 AromaticContact CG-ND1 3.91Å; H56-H273 AromaticContact ND1-CE1 3.66Å; H56-H273 AromaticContact ND1-CG 3.95Å; H56-H273 AromaticContact ND1-ND1 3.7Å; H56-H273 AromaticContact ND1-NE2 3.87Å; H56-H273 WeakPolarHBondContact NE2-CB 3.45Å; H56-H273 AromaticContact NE2-CD2 3.52Å; H56-H273 AromaticContact NE2-CG 3.36Å; H56-H273 AromaticContact NE2-ND1 3.86Å; H103-H273 AromaticContact CD2-CE1 3.7Å; H103-H273 AromaticContact NE2-CE1 3.52Å; H103-H273 AromaticContact NE2-NE2 3.78Å; H269-H273 AromaticContact CD2-CE1 3.91Å; H269-H273 AromaticContact CD2-NE2 3.65Å; H269-H273 AromaticContact CE1-NE2 3.79Å; H269-H273 AromaticContact NE2-CD2 3.83Å; H269-H273 AromaticContact NE2-CE1 3.54Å; H269-H273 AromaticContact NE2-NE2 3Å; H269-H273 PolarHBondContact NE2-NE2 3.27Å; H269-H273 PolarHBondContact O-N 3.3Å; H269-H273 VanDerWaalsContact O-N 3.09Å; Q270-H273 PolarHBondContact O-N 3.44Å; H273-G276 PolarHBondContact O-N 3.41Å; H273-I277 WeakPolarHBondContact O-CG1 3.39Å; H273-I277 PolarHBondContact O-N 3.15Å
274V98.3Very high97.8Very high58 Ų5831.5 Ų31.535%0.35217%0.166SC..Hα-helixtrans-61.2-50180173.70000111.1T55 Q270 L271 G276 I277 L278T55-V274 HydrophobicContact CG2-CG2 3.57Å; Q270-V274 WeakPolarHBondContact O-CG2 3.36Å; Q270-V274 PolarHBondContact O-N 2.84Å; L271-V274 PolarHBondContact O-N 3.36Å; V274-G276 VanDerWaalsContact C-N 3.32Å; V274-G276 PolarHBondContact O-N 3.48Å; V274-I277 PolarHBondContact O-N 2.81Å; V274-L278 HydrophobicContact CG1-CD1 3.96Å; V274-L278 HydrophobicContact CG1-CG 4.49Å; V274-L278 WeakPolarHBondContact O-CB 3.43Å; V274-L278 WeakPolarHBondContact O-CG 3.17Å; V274-L278 PolarHBondContact O-N 2.8Å
275C98.1Very high97.8Very high15 Ų1530.5 Ų30.510%0.10117%0.165CC..Hα-helixtrans-64-39.3179.1-64.70000111.6L241 T245 L271 L278 G279L241-C275 HydrophobicContact CD2-CB 4.38Å; T245-C275 WeakPolarHBondContact OG1-CB 3.19Å; L271-C275 WeakPolarHBondContact O-CB 3.24Å; L271-C275 PolarHBondContact O-N 3.18Å; L271-C275 PolarHBondContact O-SG 2.78Å; C275-L278 PolarHBondContact O-N 2.81Å; C275-G279 PolarHBondContact O-N 2.97Å
276G97.8Very high97.9Very high19 Ų1925.4 Ų25.420%0.19614%0.139CC..Hα-helixtrans-59.5-52176.400000111.8T245 F272 H273 V274 L278 G279 T280T245-G276 PolarHBondContact OG1-N 2.65Å; F272-G276 PolarHBondContact O-N 3.49Å; H273-G276 PolarHBondContact O-N 3.41Å; V274-G276 VanDerWaalsContact C-N 3.32Å; V274-G276 PolarHBondContact O-N 3.48Å; G276-L278 PolarHBondContact O-N 3.17Å; G276-G279 WeakPolarHBondContact O-CA 3.46Å; G276-G279 PolarHBondContact O-N 3.26Å; G276-T280 PolarHBondContact O-N 3.35Å; G276-T280 PolarHBondContact O-OG1 2.86Å; G276-T280 VanDerWaalsContact O-OG1 3.07Å
277I98.4Very high98Very high15 Ų1524.6 Ų24.68%0.07713%0.131CC..Hα-helixtrans-62.8-44.5178.7-68.1-69.7000112.2P59 F63 Y95 P96 H273 V274 G279 T280 H281P59-I277 HydrophobicContact CB-CD1 3.91Å; P59-I277 HydrophobicContact CB-CG1 4.39Å; P59-I277 HydrophobicContact CB-CG2 3.55Å; P59-I277 HydrophobicContact CG-CB 4.4Å; P59-I277 HydrophobicContact CG-CD1 4.16Å; P59-I277 HydrophobicContact CG-CG1 4.16Å; P59-I277 HydrophobicContact CG-CG2 3.48Å; P59-I277 VanDerWaalsContact CG-CG2 3.48Å; F63-I277 HydrophobicContact CE2-CD1 4.29Å; F63-I277 HydrophobicContact CE2-CG2 4.49Å; Y95-I277 HydrophobicContact CE2-CD1 4.28Å; Y95-I277 WeakPolarHBondContact OH-CD1 3.39Å; P96-I277 HydrophobicContact CB-CD1 3.92Å; P96-I277 HydrophobicContact CG-CD1 4.49Å; H273-I277 WeakPolarHBondContact O-CG1 3.39Å; H273-I277 PolarHBondContact O-N 3.15Å; V274-I277 PolarHBondContact O-N 2.81Å; I277-G279 VanDerWaalsContact C-N 3.27Å; I277-G279 PolarHBondContact O-N 3.19Å; I277-T280 PolarHBondContact O-N 3.36Å; I277-H281 WeakPolarHBondContact O-CB 3.43Å; I277-H281 PolarHBondContact O-N 3.27Å
278L98.6Very high97.9Very high79 Ų7926 Ų2641%0.41414%0.138SC..Hα-helixtrans-62.2-40.1176.2-70.9175.9000110.6L241 V274 C275 G276 H281 F282L241-L278 HydrophobicContact CD1-CB 3.83Å; L241-L278 HydrophobicContact CD2-CB 4.48Å; V274-L278 HydrophobicContact CG1-CD1 3.96Å; V274-L278 HydrophobicContact CG1-CG 4.49Å; V274-L278 WeakPolarHBondContact O-CB 3.43Å; V274-L278 WeakPolarHBondContact O-CG 3.17Å; V274-L278 PolarHBondContact O-N 2.8Å; C275-L278 PolarHBondContact O-N 2.81Å; G276-L278 PolarHBondContact O-N 3.17Å; L278-H281 WeakPolarHBondContact O-CB 3.45Å; L278-H281 PolarHBondContact O-N 3.41Å; L278-F282 WeakPolarHBondContact O-CD2 3.47Å; L278-F282 PolarHBondContact O-N 2.97Å
279G98.3Very high98Very high3 Ų329.1 Ų29.13%0.03115%0.152CC..Hα-helixtrans-59.5-47.1173.900000111.8H238 C275 G276 I277 H281 F282 Q283H238-G279 PolarHBondContact ND1-O 3.01Å; C275-G279 PolarHBondContact O-N 2.97Å; G276-G279 WeakPolarHBondContact O-CA 3.46Å; G276-G279 PolarHBondContact O-N 3.26Å; I277-G279 VanDerWaalsContact C-N 3.27Å; I277-G279 PolarHBondContact O-N 3.19Å; G279-H281 VanDerWaalsContact C-N 3.33Å; G279-H281 PolarHBondContact O-N 3.14Å; G279-F282 PolarHBondContact O-N 3.09Å; G279-Q283 WeakPolarHBondContact O-CB 3.27Å; G279-Q283 PolarHBondContact O-N 2.76Å
280T98.5Very high98Very high3 Ų327 Ų272%0.01814%0.142CC..Hα-helixtrans-62.6-38175.1-57.80000112.1F63 C92 Y95 Y127 G276 I277 Q283 M284F63-T280 HydrophobicContact CE1-CG2 4.1Å; F63-T280 HydrophobicContact CE2-CG2 4.26Å; F63-T280 HydrophobicContact CZ-CG2 3.71Å; C92-T280 HydrophobicContact CB-CG2 4.19Å; C92-T280 WeakPolarHBondContact SG-CG2 3.42Å; Y95-T280 HydrophobicContact CE1-CG2 4.17Å; Y95-T280 PolarHBondContact OH-OG1 3.37Å; Y127-T280 HydrophobicContact CE2-CG2 3.78Å; Y127-T280 PolarHBondContact OH-OG1 3.22Å; G276-T280 PolarHBondContact O-N 3.35Å; G276-T280 PolarHBondContact O-OG1 2.86Å; G276-T280 VanDerWaalsContact O-OG1 3.07Å; I277-T280 PolarHBondContact O-N 3.36Å; T280-Q283 WeakPolarHBondContact O-CB 3.46Å; T280-Q283 PolarHBondContact O-N 2.84Å; T280-M284 WeakPolarHBondContact O-CB 3.26Å; T280-M284 PolarHBondContact O-N 3Å
281H98.6Very high97.9Very high53 Ų5327.4 Ų27.425%0.24514%0.144CC..Hα-helixtrans-62.5-48.3175.5177.277.7000111.8Y62 I277 L278 G279 Q283 M284 L285Y62-H281 AromaticContact CE1-ND1 3.6Å; Y62-H281 AromaticContact CZ-CE1 3.91Å; Y62-H281 AromaticContact CZ-ND1 3.84Å; Y62-H281 PolarHBondContact OH-CE1 3.34Å; Y62-H281 VanDerWaalsContact OH-CE1 3.32Å; I277-H281 WeakPolarHBondContact O-CB 3.43Å; I277-H281 PolarHBondContact O-N 3.27Å; L278-H281 WeakPolarHBondContact O-CB 3.45Å; L278-H281 PolarHBondContact O-N 3.41Å; G279-H281 VanDerWaalsContact C-N 3.33Å; G279-H281 PolarHBondContact O-N 3.14Å; H281-Q283 VanDerWaalsContact C-N 3.33Å; H281-Q283 PolarHBondContact O-N 3.23Å; H281-M284 WeakPolarHBondContact O-CB 3.39Å; H281-M284 PolarHBondContact O-N 3.04Å; H281-L285 WeakPolarHBondContact O-CG 3.28Å; H281-L285 PolarHBondContact O-N 2.97Å
282F98.5Very high97.7Very high47 Ų4729.3 Ų29.321%0.20616%0.158CC..Hα-helixtrans-66-36.1176.1-75-64000112.6L234 K237 H238 L241 L278 G279 M284 L285 A286L234-F282 HydrophobicContact CD2-CD1 4.13Å; K237-F282 HydrophobicContact CB-CB 4.32Å; K237-F282 HydrophobicContact CB-CD1 4.11Å; K237-F282 HydrophobicContact CB-CD2 4.08Å; K237-F282 HydrophobicContact CB-CE1 4.5Å; K237-F282 HydrophobicContact CB-CE2 4.44Å; K237-F282 HydrophobicContact CB-CG 3.9Å; K237-F282 HydrophobicContact CD-CD1 3.87Å; K237-F282 HydrophobicContact CD-CE1 3.59Å; K237-F282 HydrophobicContact CD-CE2 4.49Å; K237-F282 HydrophobicContact CD-CG 4.46Å; K237-F282 HydrophobicContact CD-CZ 3.93Å; H238-F282 HydrophobicContact CB-CB 4.24Å; L241-F282 HydrophobicContact CD1-CD2 3.49Å; L241-F282 VanDerWaalsContact CD1-CD2 3.49Å; L241-F282 HydrophobicContact CD1-CE2 3.8Å; L278-F282 WeakPolarHBondContact O-CD2 3.47Å; L278-F282 PolarHBondContact O-N 2.97Å; G279-F282 PolarHBondContact O-N 3.09Å; F282-M284 VanDerWaalsContact C-N 3.35Å; F282-L285 HydrophobicContact CD1-CD1 4.43Å; F282-L285 PolarHBondContact O-N 3.32Å; F282-A286 WeakPolarHBondContact O-CB 3.44Å; F282-A286 PolarHBondContact O-N 3.5Å
283Q98.4Very high97.6Very high2 Ų231 Ų311%0.00917%0.172CC..Hα-helixtrans-58.4-48.5172.4-171.8179.919.300111.2F88 Y127 Y135 G279 T280 H281 L285 A286 V287F88-Q283 HydrophobicContact CE2-CG 4.21Å; F88-Q283 HydrophobicContact CZ-CB 4.25Å; F88-Q283 HydrophobicContact CZ-CG 3.83Å; Y127-Q283 PolarHBondContact OH-OE1 2.86Å; Y135-Q283 HydrophobicContact CE1-CG 4.05Å; Y135-Q283 WeakPolarHBondContact OH-CG 3.2Å; Y135-Q283 PolarHBondContact OH-NE2 3.46Å; G279-Q283 WeakPolarHBondContact O-CB 3.27Å; G279-Q283 PolarHBondContact O-N 2.76Å; T280-Q283 WeakPolarHBondContact O-CB 3.46Å; T280-Q283 PolarHBondContact O-N 2.84Å; H281-Q283 VanDerWaalsContact C-N 3.33Å; H281-Q283 PolarHBondContact O-N 3.23Å; Q283-L285 PolarHBondContact O-N 2.93Å; Q283-A286 PolarHBondContact O-N 2.79Å; Q283-V287 HydrophobicContact CG-CG1 4.42Å; Q283-V287 WeakPolarHBondContact O-CG1 3.46Å; Q283-V287 WeakPolarHBondContact O-CG2 3.37Å; Q283-V287 PolarHBondContact O-N 3.49Å
284M98.4Very high97.5Very high0 Ų031.5 Ų31.50%017%0.174CC..Hα-helixtrans-58.1-48.5178.8-175.5-163.368.600111.3Y62 F63 K66 F88 L89 T280 H281 F282 A286 V287 E288Y62-M284 HydrophobicContact CE1-CE 3.87Å; Y62-M284 HydrophobicContact CE1-SD 4.35Å; Y62-M284 WeakPolarHBondContact OH-CE 3.48Å; F63-M284 HydrophobicContact CD1-SD 3.9Å; F63-M284 HydrophobicContact CE1-SD 3.97Å; K66-M284 HydrophobicContact CB-SD 4.38Å; K66-M284 HydrophobicContact CG-CE 4.41Å; K66-M284 HydrophobicContact CG-SD 4.07Å; F88-M284 HydrophobicContact CE1-CB 3.95Å; F88-M284 HydrophobicContact CE1-CG 4.26Å; L89-M284 HydrophobicContact CD2-CG 3.84Å; L89-M284 HydrophobicContact CD2-SD 3.77Å; T280-M284 WeakPolarHBondContact O-CB 3.26Å; T280-M284 PolarHBondContact O-N 3Å; H281-M284 WeakPolarHBondContact O-CB 3.39Å; H281-M284 PolarHBondContact O-N 3.04Å; F282-M284 VanDerWaalsContact C-N 3.35Å; M284-A286 VanDerWaalsContact C-N 3.31Å; M284-A286 PolarHBondContact O-N 3.32Å; M284-V287 WeakPolarHBondContact O-CG2 3.25Å; M284-V287 PolarHBondContact O-N 2.92Å; M284-E288 WeakPolarHBondContact O-CB 3.24Å; M284-E288 VanDerWaalsContact O-CG 3.32Å; M284-E288 WeakPolarHBondContact O-CG 3.42Å; M284-E288 PolarHBondContact O-N 3.05Å
285L98.3Very high97.3Very high51 Ų5132.5 Ų32.527%0.26717%0.171SC..Hα-helixtrans-59.7-42.8176.5-66.4178.7000111.8L234 H281 F282 Q283 Q289L234-L285 HydrophobicContact CD1-CB 3.99Å; H281-L285 WeakPolarHBondContact O-CG 3.28Å; H281-L285 PolarHBondContact O-N 2.97Å; F282-L285 HydrophobicContact CD1-CD1 4.43Å; F282-L285 PolarHBondContact O-N 3.32Å; Q283-L285 PolarHBondContact O-N 2.93Å; L285-Q289 WeakPolarHBondContact O-CB 3.5Å; L285-Q289 PolarHBondContact O-N 2.64Å
286A98.1Very high97.2Very high0 Ų036.5 Ų36.50%020%0.197CC..Hα-helixtrans-64.5-47.1-179.800000111.8T231 L234 H235 F282 Q283 M284 Q289 D290T231-A286 HydrophobicContact CG2-CB 4.02Å; T231-A286 WeakPolarHBondContact CG2-O 3.39Å; L234-A286 HydrophobicContact CB-CB 3.61Å; L234-A286 HydrophobicContact CD1-CB 4.38Å; H235-A286 WeakPolarHBondContact CE1-CB 3.34Å; F282-A286 WeakPolarHBondContact O-CB 3.44Å; F282-A286 PolarHBondContact O-N 3.5Å; Q283-A286 PolarHBondContact O-N 2.79Å; M284-A286 VanDerWaalsContact C-N 3.31Å; M284-A286 PolarHBondContact O-N 3.32Å; A286-Q289 PolarHBondContact O-N 3.33Å; A286-D290 WeakPolarHBondContact O-CB 3.44Å; A286-D290 PolarHBondContact O-N 3.32Å
287V97.6Very high97Very high0 Ų040.2 Ų40.20%021%0.205CC..Hα-helixtrans-71.5-33.7-179.1-58.90000112.4L85 F88 V134 Y135 Y138 Q283 M284 M291L85-V287 HydrophobicContact CD1-CG2 4.21Å; F88-V287 HydrophobicContact CD1-CG2 4.2Å; F88-V287 HydrophobicContact CE1-CG2 4.03Å; V134-V287 HydrophobicContact CB-CB 4.38Å; V134-V287 HydrophobicContact CB-CG1 4.26Å; V134-V287 HydrophobicContact CG2-CB 4.41Å; V134-V287 HydrophobicContact CG2-CG1 3.89Å; V134-V287 HydrophobicContact CG2-CG2 4.47Å; Y135-V287 HydrophobicContact CD1-CG1 4.01Å; Y135-V287 HydrophobicContact CE1-CG1 3.81Å; Y138-V287 HydrophobicContact CD2-CB 4.44Å; Q283-V287 HydrophobicContact CG-CG1 4.42Å; Q283-V287 WeakPolarHBondContact O-CG1 3.46Å; Q283-V287 WeakPolarHBondContact O-CG2 3.37Å; Q283-V287 PolarHBondContact O-N 3.49Å; M284-V287 WeakPolarHBondContact O-CG2 3.25Å; M284-V287 PolarHBondContact O-N 2.92Å; V287-M291 WeakPolarHBondContact O-CB 3.43Å; V287-M291 PolarHBondContact O-N 3.25Å
288E97.1Very high96.8Very high38 Ų3839.8 Ų39.818%0.17820%0.203CC..Hα-helixtrans-62.2-45.4171.6-77.2-179.1173.100110.6K66 L85 M284 M291 V292K66-E288 IonicContact NZ-OE2 3.56Å; L85-E288 HydrophobicContact CD1-CG 4.16Å; L85-E288 HydrophobicContact CD2-CG 4.3Å; M284-E288 WeakPolarHBondContact O-CB 3.24Å; M284-E288 VanDerWaalsContact O-CG 3.32Å; M284-E288 WeakPolarHBondContact O-CG 3.42Å; M284-E288 PolarHBondContact O-N 3.05Å; E288-M291 PolarHBondContact O-N 3.32Å; E288-V292 WeakPolarHBondContact O-CG2 3.28Å; E288-V292 PolarHBondContact O-N 3.32Å; E288-V292 VanDerWaalsContact O-N 3.11Å
289Q97.2Very high96.6Very high71 Ų7140.6 Ų40.633%0.33221%0.211SC..Hα-helixtrans-67.8-41.4179.1-173.1174.7-19.200112.1T231 L234 L285 A286 V292 T293T231-Q289 HydrophobicContact CG2-CB 4.06Å; T231-Q289 HydrophobicContact CG2-CG 4.31Å; T231-Q289 WeakPolarHBondContact OG1-CG 3.45Å; T231-Q289 PolarHBondContact OG1-NE2 3.44Å; L234-Q289 VanDerWaalsContact CD1-OE1 3.25Å; L285-Q289 WeakPolarHBondContact O-CB 3.5Å; L285-Q289 PolarHBondContact O-N 2.64Å; A286-Q289 PolarHBondContact O-N 3.33Å; Q289-V292 PolarHBondContact O-N 3.38Å; Q289-T293 VanDerWaalsContact O-CB 3.26Å; Q289-T293 WeakPolarHBondContact O-CB 3.5Å; Q289-T293 PolarHBondContact O-N 2.89Å; Q289-T293 PolarHBondContact O-OG1 2.88Å
290D96.8Very high96.5Very high0 Ų044.1 Ų44.10%024%0.24CC..Hα-helixtrans-63.8-42.9174.3-88.7-23.4000111.8Y138 R217 T231 H235 A286 V292 T293 R294Y138-D290 WeakPolarHBondContact O-CB 3.5Å; R217-D290 IonicContact CZ-OD1 2.78Å; R217-D290 IonicContact CZ-OD2 3.52Å; R217-D290 VanDerWaalsContact NH1-CG 3.28Å; R217-D290 IonicContact NH1-OD1 3.94Å; R217-D290 PolarHBondContact NH1-OD1 3.01Å; R217-D290 IonicContact NH1-OD2 3.47Å; R217-D290 PolarHBondContact NH1-OD2 3.29Å; R217-D290 IonicContact NH2-OD1 3.24Å; R217-D290 PolarHBondContact NH2-OD1 3.46Å; R217-D290 IonicContact NH2-OD2 2.73Å; T231-D290 HydrophobicContact CG2-CB 4.43Å; T231-D290 WeakPolarHBondContact CG2-OD1 3.21Å; T231-D290 PolarHBondContact OG1-OD1 3.48Å; H235-D290 IonicContact CD2-OD2 3.83Å; H235-D290 IonicContact CE1-OD2 2.76Å; H235-D290 IonicContact NE2-OD2 3.71Å; H235-D290 PolarHBondContact NE2-OD2 2.86Å; A286-D290 WeakPolarHBondContact O-CB 3.44Å; A286-D290 PolarHBondContact O-N 3.32Å; D290-V292 VanDerWaalsContact C-N 3.29Å; D290-V292 PolarHBondContact O-N 2.87Å; D290-T293 PolarHBondContact O-N 3.45Å; D290-R294 WeakPolarHBondContact O-CB 3.39Å; D290-R294 WeakPolarHBondContact O-CG 3.37Å; D290-R294 PolarHBondContact O-N 2.93Å
291M95.6Very high96.3Very high13 Ų1347.6 Ų47.66%0.06426%0.258CS..Hα-helixtrans-56.2-45.6176.2180-171.970.200110.7F81 T82 L85 Y138 V287 E288 R295F81-M291 HydrophobicContact CD1-CG 4.04Å; F81-M291 HydrophobicContact CE1-CG 3.71Å; T82-M291 HydrophobicContact CG2-SD 4.46Å; L85-M291 HydrophobicContact CB-SD 4.25Å; L85-M291 HydrophobicContact CD2-CE 3.75Å; L85-M291 HydrophobicContact CD2-SD 3.81Å; Y138-M291 HydrophobicContact CD1-CB 4Å; Y138-M291 HydrophobicContact CD1-CG 4.06Å; Y138-M291 HydrophobicContact CD2-CB 3.97Å; Y138-M291 HydrophobicContact CD2-CG 4.46Å; Y138-M291 HydrophobicContact CE1-CB 4.12Å; Y138-M291 HydrophobicContact CE1-CG 3.7Å; Y138-M291 HydrophobicContact CE1-SD 4.42Å; Y138-M291 HydrophobicContact CE2-CB 4.08Å; Y138-M291 HydrophobicContact CE2-CG 4.13Å; Y138-M291 HydrophobicContact CE2-SD 4.22Å; Y138-M291 HydrophobicContact CG-CB 3.93Å; Y138-M291 HydrophobicContact CG-CG 4.43Å; V287-M291 WeakPolarHBondContact O-CB 3.43Å; V287-M291 PolarHBondContact O-N 3.25Å; E288-M291 PolarHBondContact O-N 3.32Å; M291-R295 WeakPolarHBondContact O-CB 3.41Å; M291-R295 PolarHBondContact O-N 2.98Å
292V94.8Very high96Very high103 Ų10346.1 Ų46.162%0.62426%0.256SS*.Hα-helixtrans-71.7-52.11801740000111.3E288 Q289 D290 R294E288-V292 WeakPolarHBondContact O-CG2 3.28Å; E288-V292 PolarHBondContact O-N 3.32Å; E288-V292 VanDerWaalsContact O-N 3.11Å; Q289-V292 PolarHBondContact O-N 3.38Å; D290-V292 VanDerWaalsContact C-N 3.29Å; D290-V292 PolarHBondContact O-N 2.87Å; V292-R294 PolarHBondContact O-N 3.49Å
293T94.9Very high95.6Very high79 Ų7947.5 Ų47.549%0.48526%0.264SS..Hα-helixtrans-67-38.5-171.9-51.90000111.8Q289 D290Q289-T293 VanDerWaalsContact O-CB 3.26Å; Q289-T293 WeakPolarHBondContact O-CB 3.5Å; Q289-T293 PolarHBondContact O-N 2.89Å; Q289-T293 PolarHBondContact O-OG1 2.88Å; D290-T293 PolarHBondContact O-N 3.45Å
294R94.4Very high95.3Very high12 Ų1252.4 Ų52.45%0.04530%0.296CS..Hα-helixtrans-94.6-8.8-174.6-58.9-178.267.7-162.71.3114Y138 A139 F140 D142 D290 V292 P296 W297 L298Y138-R294 WeakPolarHBondContact O-CD 3.48Å; Y138-R294 PolarHBondContact O-NH1 2.88Å; A139-R294 VanDerWaalsContact C-NH1 3.34Å; F140-R294 PolarHBondContact O-NH1 2.92Å; F140-R294 PolarHBondContact O-NH2 3.21Å; D142-R294 IonicContact OD1-CZ 3.63Å; D142-R294 IonicContact OD1-NE 2.8Å; D142-R294 IonicContact OD1-NH2 2.63Å; D142-R294 PolarHBondContact OD1-NH2 2.91Å; D290-R294 WeakPolarHBondContact O-CB 3.39Å; D290-R294 WeakPolarHBondContact O-CG 3.37Å; D290-R294 PolarHBondContact O-N 2.93Å; V292-R294 PolarHBondContact O-N 3.49Å; R294-P296 VanDerWaalsContact C-CD 3.5Å; R294-W297 PolarHBondContact O-N 2.86Å; R294-W297 VanDerWaalsContact O-N 3.15Å; R294-L298 HydrophobicContact CB-CD1 3.54Å; R294-L298 HydrophobicContact CB-CG 4.03Å; R294-L298 WeakPolarHBondContact O-CB 3.28Å; R294-L298 WeakPolarHBondContact O-CG 3.46Å; R294-L298 PolarHBondContact O-N 3.15Å
295R94.8Very high95.2Very high80 Ų8053.1 Ų53.130%0.30230%0.3SS..Hα-helixtrans-47.1-51.3-178.6169-177.6-81-113.58.7113.2D79 F81 M291 W297 L298 T299D79-R295 IonicContact OD1-NH1 3.96Å; D79-R295 IonicContact OD2-CZ 2.6Å; D79-R295 IonicContact OD2-NH1 2.72Å; D79-R295 PolarHBondContact OD2-NH1 3.25Å; D79-R295 IonicContact OD2-NH2 2.94Å; D79-R295 PolarHBondContact OD2-NH2 3.38Å; F81-R295 HydrophobicContact CD1-CG 4.38Å; F81-R295 HydrophobicContact CE1-CB 3.85Å; F81-R295 HydrophobicContact CE1-CG 4.08Å; F81-R295 HydrophobicContact CZ-CB 4.21Å; F81-R295 HydrophobicContact CZ-CG 4.46Å; M291-R295 WeakPolarHBondContact O-CB 3.41Å; M291-R295 PolarHBondContact O-N 2.98Å; R295-W297 VanDerWaalsContact C-N 3.28Å; R295-W297 PolarHBondContact O-N 2.99Å; R295-L298 PolarHBondContact O-N 2.91Å; R295-T299 WeakPolarHBondContact O-CB 3.24Å; R295-T299 PolarHBondContact O-N 3.25Å; R295-T299 PolarHBondContact O-OG1 3.38Å
296P95.3Very high95.1Very high99 Ų9952.9 Ų52.964%0.64330%0.303SS*.Hα-helixtrans-58.3-40.6-175.9-24.534.6000113R294R294-P296 VanDerWaalsContact C-CD 3.5Å
297W94.6Very high94.9Very high96 Ų9658.2 Ų58.236%0.36433%0.326SS..Hα-helixtrans-74.5-43.9179.4-174.591.9000111.8D142 V145 R294 R295 A300 N301D142-W297 HydrophobicContact CB-CH2 3.71Å; D142-W297 HydrophobicContact CB-CZ2 3.91Å; D142-W297 HydrophobicContact CB-CZ3 4.4Å; D142-W297 WeakPolarHBondContact OD1-CH2 3.12Å; D142-W297 VanDerWaalsContact OD1-CZ3 3.32Å; D142-W297 WeakPolarHBondContact OD1-CZ3 3.33Å; V145-W297 HydrophobicContact CB-CH2 4.26Å; V145-W297 HydrophobicContact CG2-CH2 4.11Å; V145-W297 HydrophobicContact CG2-CZ3 4.02Å; R294-W297 PolarHBondContact O-N 2.86Å; R294-W297 VanDerWaalsContact O-N 3.15Å; R295-W297 VanDerWaalsContact C-N 3.28Å; R295-W297 PolarHBondContact O-N 2.99Å; W297-A300 PolarHBondContact O-N 3.25Å; W297-N301 HydrophobicContact CD2-CB 4.25Å; W297-N301 HydrophobicContact CE3-CB 4.37Å; W297-N301 HydrophobicContact CH2-CB 4.09Å; W297-N301 HydrophobicContact CZ2-CB 3.96Å; W297-N301 HydrophobicContact CZ3-CB 4.3Å; W297-N301 WeakPolarHBondContact O-CB 3.32Å; W297-N301 PolarHBondContact O-N 3.34Å; W297-N301 PolarHBondContact O-ND2 2.83Å
298L95.2Very high94.9Very high6 Ų662 Ų623%0.03136%0.357CS..Hα-helixtrans-65.8-40-178.5-71.9166.5000112.3F81 F137 R294 R295 A300 N301 A302F81-L298 HydrophobicContact CE2-CB 4.19Å; F81-L298 HydrophobicContact CZ-CB 4.13Å; F81-L298 HydrophobicContact CZ-CD1 4.05Å; F137-L298 VanDerWaalsContact O-CD1 3.24Å; F137-L298 WeakPolarHBondContact O-CD1 3.47Å; R294-L298 HydrophobicContact CB-CD1 3.54Å; R294-L298 HydrophobicContact CB-CG 4.03Å; R294-L298 WeakPolarHBondContact O-CB 3.28Å; R294-L298 WeakPolarHBondContact O-CG 3.46Å; R294-L298 PolarHBondContact O-N 3.15Å; R295-L298 PolarHBondContact O-N 2.91Å; L298-A300 PolarHBondContact O-N 3.01Å; L298-N301 PolarHBondContact O-N 3.15Å; L298-A302 HydrophobicContact CB-CB 4.48Å; L298-A302 HydrophobicContact CD2-CB 4.07Å; L298-A302 VanDerWaalsContact O-CB 3.25Å; L298-A302 WeakPolarHBondContact O-CB 3.42Å; L298-A302 PolarHBondContact O-N 2.93Å
299T94.3Very high94.7Very high97 Ų9761.6 Ų61.660%0.59536%0.357SS*.Hα-helixtrans-64.1-29.2177.1-55.30000112.3R295R295-T299 WeakPolarHBondContact O-CB 3.24Å; R295-T299 PolarHBondContact O-N 3.25Å; R295-T299 PolarHBondContact O-OG1 3.38Å
300A95.1Very high94.6Very high77 Ų7758.2 Ų58.264%0.63634%0.341SS*.Hα-helixtrans-86.2-28.9178.400000113.7W297 L298W297-A300 PolarHBondContact O-N 3.25Å; L298-A300 PolarHBondContact O-N 3.01Å
301N94Very high94.6Very high75 Ų7559.8 Ų59.840%0.40135%0.349SS..Hα-helixtrans-120.2-17.9-166.7-63.4-82.9000115N146 W297 L298N146-N301 PolarHBondContact ND2-O 2.87Å; W297-N301 HydrophobicContact CD2-CB 4.25Å; W297-N301 HydrophobicContact CE3-CB 4.37Å; W297-N301 HydrophobicContact CH2-CB 4.09Å; W297-N301 HydrophobicContact CZ2-CB 3.96Å; W297-N301 HydrophobicContact CZ3-CB 4.3Å; W297-N301 WeakPolarHBondContact O-CB 3.32Å; W297-N301 PolarHBondContact O-N 3.34Å; W297-N301 PolarHBondContact O-ND2 2.83Å; L298-N301 PolarHBondContact O-N 3.15Å
302A94Very high94.7Very high23 Ų2359.9 Ų59.919%0.1935%0.354CS..SBendtrans-102.7161.4-176.300000112.5V145 L298V145-A302 HydrophobicContact CG1-CB 3.66Å; L298-A302 HydrophobicContact CB-CB 4.48Å; L298-A302 HydrophobicContact CD2-CB 4.07Å; L298-A302 VanDerWaalsContact O-CB 3.25Å; L298-A302 WeakPolarHBondContact O-CB 3.42Å; L298-A302 PolarHBondContact O-N 2.93Å
303M89.1Confident94.9Very high75 Ų7555.7 Ų55.737%0.36933%0.328SS..PPolyproline II helixtrans-56.5137.4169.7-64.7-162.3-59.200110.9N146 Q151N146-M303 WeakPolarHBondContact OD1-CG 3.35Å; N146-M303 PolarHBondContact OD1-N 3.33Å; N146-M303 VanDerWaalsContact OD1-N 3.11Å; Q151-M303 HydrophobicContact CG-CE 4.19Å; Q151-M303 HydrophobicContact CG-SD 4.43Å
304P92.9Very high95Very high106 Ų10652.2 Ų52.269%0.68831%0.308SS*.PPolyproline II helixtrans-64.3147.9179.626.9-34.2000111.1S306 N309P304-S306 PolarHBondContact O-N 3.14Å; P304-N309 PolarHBondContact O-ND2 3.36Å; P304-N309 VanDerWaalsContact O-ND2 3.15Å
305V95.4Very high95.1Very high15 Ų1556.4 Ų56.49%0.09133%0.331CS..PPolyproline II helixtrans-67.9130.7170.2-172.50000108.9S80 F81 W83 P84 F137S80-V305 WeakPolarHBondContact O-CB 3.41Å; S80-V305 WeakPolarHBondContact O-CG1 3.47Å; F81-V305 HydrophobicContact CD2-CG2 4.12Å; W83-V305 HydrophobicContact CB-CG1 4.43Å; P84-V305 HydrophobicContact CG-CG1 3.93Å; P84-V305 HydrophobicContact CG-CG2 4.19Å; F137-V305 HydrophobicContact CD1-CG2 3.66Å; F137-V305 HydrophobicContact CE1-CB 4.29Å; F137-V305 HydrophobicContact CE1-CG2 3.65Å; F137-V305 HydrophobicContact CG-CG2 4.32Å; F137-V305 HydrophobicContact CZ-CG1 4.4Å; F137-V305 HydrophobicContact CZ-CG2 4.3Å
306S95.6Very high95.3Very high46 Ų4657.2 Ų57.232%0.32234%0.34SS..  trans-133.7169.4177.472.90000109.8P304 A308 N309 S310P304-S306 PolarHBondContact O-N 3.14Å; S306-A308 VanDerWaalsContact C-N 3.27Å; S306-A308 PolarHBondContact O-N 2.83Å; S306-A308 PolarHBondContact OG-N 3.48Å; S306-N309 WeakPolarHBondContact CA-OD1 3.45Å; S306-N309 PolarHBondContact N-OD1 3.46Å; S306-N309 PolarHBondContact O-OD1 3.42Å; S306-N309 VanDerWaalsContact OG-CG 3.25Å; S306-N309 PolarHBondContact OG-N 3.28Å; S306-N309 PolarHBondContact OG-OD1 2.91Å; S306-S310 PolarHBondContact O-N 3.42Å; S306-S310 PolarHBondContact O-OG 3Å
307F95.5Very high95.4Very high111 Ų11152.6 Ų52.649%0.48731%0.31SS..THydrogen-bonded Turntrans-60.5-40.8173.4-179.6-91.5000111.3W83 N309 S310 L311 G312 L315W83-F307 HydrophobicContact CZ3-CB 4.24Å; F307-N309 VanDerWaalsContact C-N 3.28Å; F307-N309 PolarHBondContact O-N 2.84Å; F307-S310 PolarHBondContact O-N 3.45Å; F307-L311 HydrophobicContact CD2-CB 3.6Å; F307-L311 HydrophobicContact CD2-CD1 4.04Å; F307-L311 HydrophobicContact CD2-CG 4.45Å; F307-L311 HydrophobicContact CE2-CB 3.66Å; F307-L311 HydrophobicContact CE2-CD1 4.43Å; F307-L311 HydrophobicContact CG-CB 4.42Å; F307-L311 PolarHBondContact O-N 3.21Å; F307-G312 WeakPolarHBondContact O-CA 3.47Å; F307-G312 PolarHBondContact O-N 2.89Å; F307-L315 HydrophobicContact CE2-CD1 3.84Å; F307-L315 HydrophobicContact CZ-CD1 3.53Å
308A96Very high95.5Very high79 Ų7950.8 Ų50.865%0.65331%0.31SS*.THydrogen-bonded Turntrans-66.3-25.1-173.600000114.4S306 P313S306-A308 VanDerWaalsContact C-N 3.27Å; S306-A308 PolarHBondContact O-N 2.83Å; S306-A308 PolarHBondContact OG-N 3.48Å; A308-P313 VanDerWaalsContact O-CD 3.22Å; A308-P313 WeakPolarHBondContact O-CD 3.44Å; A308-P313 WeakPolarHBondContact O-CG 3.37Å
309N94.3Very high95.6Very high31 Ų3154.3 Ų54.317%0.16633%0.331CS..THydrogen-bonded Turntrans-109.65.9179.762.36.7000113.4F137 I154 P304 S306 F307F137-N309 WeakPolarHBondContact CE2-O 3.45Å; F137-N309 HydrophobicContact CZ-CB 4.11Å; I154-N309 WeakPolarHBondContact CD1-O 3.44Å; P304-N309 PolarHBondContact O-ND2 3.36Å; P304-N309 VanDerWaalsContact O-ND2 3.15Å; S306-N309 WeakPolarHBondContact CA-OD1 3.45Å; S306-N309 PolarHBondContact N-OD1 3.46Å; S306-N309 PolarHBondContact O-OD1 3.42Å; S306-N309 VanDerWaalsContact OG-CG 3.25Å; S306-N309 PolarHBondContact OG-N 3.28Å; S306-N309 PolarHBondContact OG-OD1 2.91Å; F307-N309 VanDerWaalsContact C-N 3.28Å; F307-N309 PolarHBondContact O-N 2.84Å
310S95.4Very high95.8Very high0 Ų051.5 Ų51.50%031%0.314CS..THydrogen-bonded Turntrans-133.3-82.9177.462.40000112.7S306 F307 G312 P313 A314S306-S310 PolarHBondContact O-N 3.42Å; S306-S310 PolarHBondContact O-OG 3Å; F307-S310 PolarHBondContact O-N 3.45Å; S310-G312 PolarHBondContact O-N 3.41Å; S310-P313 WeakPolarHBondContact O-CD 3.06Å; S310-A314 PolarHBondContact O-N 3.16Å
311L96.5Very high95.9Very high32 Ų3248.1 Ų48.117%0.16829%0.285CS..Hα-helixtrans-67.6-35.5-176.2-67.3170.5000113.2W77 W83 V87 F307 A314 L315W77-L311 HydrophobicContact CZ3-CD1 4.43Å; W83-L311 HydrophobicContact CB-CD1 4.48Å; W83-L311 HydrophobicContact CB-CG 4.33Å; W83-L311 HydrophobicContact CD2-CD1 3.82Å; W83-L311 HydrophobicContact CD2-CG 4.49Å; W83-L311 HydrophobicContact CE3-CD1 3.75Å; W83-L311 HydrophobicContact CE3-CG 4.3Å; W83-L311 HydrophobicContact CG-CD1 4.19Å; W83-L311 HydrophobicContact CZ3-CD1 4.28Å; V87-L311 HydrophobicContact CG2-CD2 3.72Å; F307-L311 HydrophobicContact CD2-CB 3.6Å; F307-L311 HydrophobicContact CD2-CD1 4.04Å; F307-L311 HydrophobicContact CD2-CG 4.45Å; F307-L311 HydrophobicContact CE2-CB 3.66Å; F307-L311 HydrophobicContact CE2-CD1 4.43Å; F307-L311 HydrophobicContact CG-CB 4.42Å; F307-L311 PolarHBondContact O-N 3.21Å; L311-A314 WeakPolarHBondContact O-CB 3.42Å; L311-A314 PolarHBondContact O-N 2.93Å; L311-L315 WeakPolarHBondContact O-CG 3.22Å; L311-L315 PolarHBondContact O-N 3.06Å
312G97.4Very high96.1Very high16 Ų1648.3 Ų48.317%0.16529%0.286CS..Hα-helixtrans-60.3-55.6-179.800000113F307 S310 A314 L315 L316F307-G312 WeakPolarHBondContact O-CA 3.47Å; F307-G312 PolarHBondContact O-N 2.89Å; S310-G312 PolarHBondContact O-N 3.41Å; G312-A314 VanDerWaalsContact C-N 3.26Å; G312-A314 PolarHBondContact O-N 3.13Å; G312-L315 PolarHBondContact O-N 3.29Å; G312-L316 WeakPolarHBondContact O-CB 3.4Å; G312-L316 PolarHBondContact O-N 2.96Å
313P97.8Very high96.2Very high14 Ų1452.4 Ų52.49%0.09130%0.303CS..Hα-helixtrans-56.1-38.9173.7-28.235.6000113.1L129 I154 A308 S310 L316 C317L129-P313 HydrophobicContact CD2-CB 4.45Å; L129-P313 WeakPolarHBondContact CD2-O 3.02Å; I154-P313 HydrophobicContact CG2-CB 4.04Å; I154-P313 HydrophobicContact CG2-CG 3.87Å; A308-P313 VanDerWaalsContact O-CD 3.22Å; A308-P313 WeakPolarHBondContact O-CD 3.44Å; A308-P313 WeakPolarHBondContact O-CG 3.37Å; S310-P313 WeakPolarHBondContact O-CD 3.06Å; P313-L316 PolarHBondContact O-N 2.63Å; P313-C317 VanDerWaalsContact O-CB 3.27Å; P313-C317 WeakPolarHBondContact O-CB 3.45Å; P313-C317 PolarHBondContact O-N 2.82Å
314A97.4Very high96.5Very high7 Ų749.6 Ų49.66%0.05829%0.29CS..Hα-helixtrans-62.7-48.1177.100000112.3V87 F126 S310 L311 G312 C317 V318V87-A314 HydrophobicContact CB-CB 4.43Å; V87-A314 HydrophobicContact CG1-CB 3.59Å; V87-A314 HydrophobicContact CG2-CB 3.91Å; F126-A314 HydrophobicContact CE2-CB 3.85Å; F126-A314 HydrophobicContact CZ-CB 4.27Å; S310-A314 PolarHBondContact O-N 3.16Å; L311-A314 WeakPolarHBondContact O-CB 3.42Å; L311-A314 PolarHBondContact O-N 2.93Å; G312-A314 VanDerWaalsContact C-N 3.26Å; G312-A314 PolarHBondContact O-N 3.13Å; A314-C317 WeakPolarHBondContact O-CB 3.35Å; A314-C317 PolarHBondContact O-N 3.35Å; A314-V318 WeakPolarHBondContact O-CG2 3.18Å; A314-V318 PolarHBondContact O-N 2.96Å
315L97.7Very high96.7Very high100 Ų10044.8 Ų44.852%0.52426%0.258SS..Hα-helixtrans-62.2-44.5176.3-75.4163.3000111.7F307 L311 G312 C317 V318 V319F307-L315 HydrophobicContact CE2-CD1 3.84Å; F307-L315 HydrophobicContact CZ-CD1 3.53Å; L311-L315 WeakPolarHBondContact O-CG 3.22Å; L311-L315 PolarHBondContact O-N 3.06Å; G312-L315 PolarHBondContact O-N 3.29Å; L315-C317 VanDerWaalsContact C-N 3.32Å; L315-C317 PolarHBondContact O-N 2.03Å; L315-V318 PolarHBondContact O-N 2.93Å; L315-V319 WeakPolarHBondContact O-CG2 3.46Å; L315-V319 PolarHBondContact O-N 3.4Å
316L97.5Very high96.6Very high97 Ų9747.8 Ų47.851%0.50828%0.279SS..Hα-helixtrans-58.8-45.8176.2179.962.8000111T158 G312 P313 V318 V319 V320T158-L316 HydrophobicContact CG2-CD2 4.21Å; G312-L316 WeakPolarHBondContact O-CB 3.4Å; G312-L316 PolarHBondContact O-N 2.96Å; P313-L316 PolarHBondContact O-N 2.63Å; L316-V318 PolarHBondContact O-N 2.78Å; L316-V319 PolarHBondContact O-N 3.32Å; L316-V320 HydrophobicContact CD1-CG2 3.82Å; L316-V320 HydrophobicContact CG-CG2 4.24Å; L316-V320 WeakPolarHBondContact O-CB 3.46Å; L316-V320 VanDerWaalsContact O-CG2 3.26Å; L316-V320 WeakPolarHBondContact O-CG2 3.47Å; L316-V320 PolarHBondContact O-N 3.34Å
317C97.5Very high96.5Very high2 Ų249.8 Ų49.81%0.01428%0.282CS..Hα-helixtrans-58.6-46.3177.6-178.10000111.9F126 L129 T161 P313 A314 L315 V320 N321F126-C317 HydrophobicContact CD2-CB 4.23Å; L129-C317 HydrophobicContact CD2-CB 3.38Å; T161-C317 PolarHBondContact OG1-SG 3.41Å; T161-C317 VanDerWaalsContact OG1-SG 3.38Å; P313-C317 VanDerWaalsContact O-CB 3.27Å; P313-C317 WeakPolarHBondContact O-CB 3.45Å; P313-C317 PolarHBondContact O-N 2.82Å; A314-C317 WeakPolarHBondContact O-CB 3.35Å; A314-C317 PolarHBondContact O-N 3.35Å; L315-C317 VanDerWaalsContact C-N 3.32Å; L315-C317 PolarHBondContact O-N 2.03Å; C317-V320 PolarHBondContact O-N 3.37Å; C317-N321 WeakPolarHBondContact O-CB 3.25Å; C317-N321 VanDerWaalsContact O-CG 3.29Å; C317-N321 PolarHBondContact O-N 2.83Å; C317-N321 PolarHBondContact O-ND2 3.15Å; C317-N321 PolarHBondContact SG-ND2 2.85Å; C317-N321 VanDerWaalsContact SG-ND2 3.42Å
318V97.1Very high96.2Very high58 Ų5844.8 Ų44.835%0.35226%0.26SS..Hα-helixtrans-60.3-49.7176.7172.30000111.1F126 A314 L315 L316 V320 N321 L322F126-V318 HydrophobicContact CD2-CG2 3.97Å; F126-V318 HydrophobicContact CE2-CG2 3.8Å; F126-V318 HydrophobicContact CG-CG2 4.45Å; F126-V318 HydrophobicContact CZ-CG2 4.14Å; A314-V318 WeakPolarHBondContact O-CG2 3.18Å; A314-V318 PolarHBondContact O-N 2.96Å; L315-V318 PolarHBondContact O-N 2.93Å; L316-V318 PolarHBondContact O-N 2.78Å; V318-V320 PolarHBondContact O-N 2.79Å; V318-N321 PolarHBondContact O-N 3.48Å; V318-L322 HydrophobicContact CG1-CD1 3.99Å; V318-L322 HydrophobicContact CG1-CG 4.48Å; V318-L322 WeakPolarHBondContact O-CB 3.41Å; V318-L322 VanDerWaalsContact O-CG 3.26Å; V318-L322 WeakPolarHBondContact O-CG 3.49Å; V318-L322 PolarHBondContact O-N 2.93Å
319V97.9Very high96Very high80 Ų8041.4 Ų41.449%0.48523%0.232SC..Hα-helixtrans-60.9-48.5-179.3171.70000111L315 L316 L322 I323L315-V319 WeakPolarHBondContact O-CG2 3.46Å; L315-V319 PolarHBondContact O-N 3.4Å; L316-V319 PolarHBondContact O-N 3.32Å; V319-L322 PolarHBondContact O-N 3.17Å; V319-I323 HydrophobicContact CG1-CD1 3.91Å; V319-I323 WeakPolarHBondContact O-CG1 3.49Å; V319-I323 PolarHBondContact O-N 3.39Å
320V97.6Very high95.7Very high37 Ų3744.4 Ų44.422%0.22425%0.247CC..Hα-helixtrans-65.5-42.6-178.8174.20000111.1V162 L316 C317 V318 L322 I323 I324V162-V320 HydrophobicContact CG1-CG1 4.36Å; V162-V320 HydrophobicContact CG2-CG1 3.72Å; L316-V320 HydrophobicContact CD1-CG2 3.82Å; L316-V320 HydrophobicContact CG-CG2 4.24Å; L316-V320 WeakPolarHBondContact O-CB 3.46Å; L316-V320 VanDerWaalsContact O-CG2 3.26Å; L316-V320 WeakPolarHBondContact O-CG2 3.47Å; L316-V320 PolarHBondContact O-N 3.34Å; C317-V320 PolarHBondContact O-N 3.37Å; V318-V320 PolarHBondContact O-N 2.79Å; V320-L322 VanDerWaalsContact C-N 3.33Å; V320-L322 PolarHBondContact O-N 3.16Å; V320-I323 PolarHBondContact O-N 3.29Å; V320-I324 HydrophobicContact CG1-CD1 3.78Å; V320-I324 HydrophobicContact CG1-CG1 4.39Å; V320-I324 WeakPolarHBondContact O-CD1 3.32Å; V320-I324 VanDerWaalsContact O-CG1 3.28Å; V320-I324 WeakPolarHBondContact O-CG1 3.41Å; V320-I324 PolarHBondContact O-N 3.26Å
321N97.3Very high95Very high6 Ų645.6 Ų45.63%0.03226%0.255CS..Hα-helixtrans-60.1-42.9175.1-81.6-24.8000111.8G122 S125 T165 C317 V318 I323 I324 I325G122-N321 PolarHBondContact O-ND2 3.36Å; G122-N321 VanDerWaalsContact O-ND2 3.15Å; S125-N321 PolarHBondContact OG-ND2 2.79Å; S125-N321 PolarHBondContact OG-OD1 3.31Å; T165-N321 VanDerWaalsContact CB-OD1 3.28Å; T165-N321 WeakPolarHBondContact CB-OD1 3.46Å; T165-N321 WeakPolarHBondContact CG2-OD1 3.2Å; T165-N321 PolarHBondContact OG1-OD1 3Å; C317-N321 WeakPolarHBondContact O-CB 3.25Å; C317-N321 VanDerWaalsContact O-CG 3.29Å; C317-N321 PolarHBondContact O-N 2.83Å; C317-N321 PolarHBondContact O-ND2 3.15Å; C317-N321 PolarHBondContact SG-ND2 2.85Å; C317-N321 VanDerWaalsContact SG-ND2 3.42Å; V318-N321 PolarHBondContact O-N 3.48Å; N321-I323 PolarHBondContact O-N 3.31Å; N321-I324 PolarHBondContact O-N 3.23Å; N321-I325 WeakPolarHBondContact O-CB 3.36Å; N321-I325 WeakPolarHBondContact O-CD1 3.17Å; N321-I325 WeakPolarHBondContact O-CG1 3.46Å; N321-I325 PolarHBondContact O-N 2.87Å
322L97.3Very high94.3Very high80 Ų8044.8 Ų44.842%0.41925%0.251SS..Hα-helixtrans-63-40.9175.8-70.4173.9000111.9F119 V318 V319 V320 I325 C326F119-L322 HydrophobicContact CE1-CD2 3.84Å; V318-L322 HydrophobicContact CG1-CD1 3.99Å; V318-L322 HydrophobicContact CG1-CG 4.48Å; V318-L322 WeakPolarHBondContact O-CB 3.41Å; V318-L322 VanDerWaalsContact O-CG 3.26Å; V318-L322 WeakPolarHBondContact O-CG 3.49Å; V318-L322 PolarHBondContact O-N 2.93Å; V319-L322 PolarHBondContact O-N 3.17Å; V320-L322 VanDerWaalsContact C-N 3.33Å; V320-L322 PolarHBondContact O-N 3.16Å; L322-I325 PolarHBondContact O-N 3.35Å; L322-C326 VanDerWaalsContact O-CB 3.3Å; L322-C326 WeakPolarHBondContact O-CB 3.4Å; L322-C326 PolarHBondContact O-N 3.43Å; L322-C326 PolarHBondContact O-SG 2.88Å
323I97.6Very high93.5Very high108 Ų10849.5 Ų49.555%0.55427%0.272SS*.Hα-helixtrans-60.8-46.3174.9-68.6165.9000110.7V319 V320 N321 C326 F327V319-I323 HydrophobicContact CG1-CD1 3.91Å; V319-I323 WeakPolarHBondContact O-CG1 3.49Å; V319-I323 PolarHBondContact O-N 3.39Å; V320-I323 PolarHBondContact O-N 3.29Å; N321-I323 PolarHBondContact O-N 3.31Å; I323-C326 PolarHBondContact O-N 3.3Å; I323-F327 WeakPolarHBondContact O-CB 3.48Å; I323-F327 PolarHBondContact O-N 3.43Å
324I95.9Very high92.2Very high16 Ų1653.3 Ų53.38%0.08230%0.298CS..Hα-helixtrans-61.3-48.7177.5-65.3159.8000110.3V162 T165 V166 V320 N321 C326 F327 F328V162-I324 HydrophobicContact CG1-CD1 4.15Å; T165-I324 HydrophobicContact CG2-CB 4.23Å; T165-I324 HydrophobicContact CG2-CD1 4.32Å; T165-I324 HydrophobicContact CG2-CG2 3.82Å; V166-I324 HydrophobicContact CG2-CD1 3.9Å; V166-I324 HydrophobicContact CG2-CG1 4.12Å; V166-I324 HydrophobicContact CG2-CG2 3.98Å; V320-I324 HydrophobicContact CG1-CD1 3.78Å; V320-I324 HydrophobicContact CG1-CG1 4.39Å; V320-I324 WeakPolarHBondContact O-CD1 3.32Å; V320-I324 VanDerWaalsContact O-CG1 3.28Å; V320-I324 WeakPolarHBondContact O-CG1 3.41Å; V320-I324 PolarHBondContact O-N 3.26Å; N321-I324 PolarHBondContact O-N 3.23Å; I324-C326 VanDerWaalsContact C-N 3.33Å; I324-C326 PolarHBondContact O-N 2.86Å; I324-F327 WeakPolarHBondContact O-CB 3.41Å; I324-F327 PolarHBondContact O-N 3.41Å; I324-F328 HydrophobicContact CG2-CD2 3.76Å; I324-F328 HydrophobicContact CG2-CE2 3.86Å; I324-F328 WeakPolarHBondContact O-CD2 3.49Å; I324-F328 PolarHBondContact O-N 3.49Å
325I95.2Very high90.4Very high6 Ų653.2 Ų53.23%0.03130%0.298CS..Hα-helixtrans-59.8-45.2179.2-68.2163.6000110.4F118 F119 N321 L322 F328 S329F118-I325 HydrophobicContact CB-CG1 4.11Å; F118-I325 HydrophobicContact CB-CG2 4.01Å; F119-I325 HydrophobicContact CD1-CD1 3.91Å; F119-I325 HydrophobicContact CD2-CG2 4.28Å; F119-I325 HydrophobicContact CE1-CD1 4.25Å; F119-I325 HydrophobicContact CE1-CG2 4.24Å; F119-I325 HydrophobicContact CE2-CG2 3.99Å; F119-I325 HydrophobicContact CG-CD1 4.38Å; F119-I325 HydrophobicContact CZ-CG2 3.96Å; N321-I325 WeakPolarHBondContact O-CB 3.36Å; N321-I325 WeakPolarHBondContact O-CD1 3.17Å; N321-I325 WeakPolarHBondContact O-CG1 3.46Å; N321-I325 PolarHBondContact O-N 2.87Å; L322-I325 PolarHBondContact O-N 3.35Å; I325-F328 PolarHBondContact O-N 2.98Å; I325-S329 WeakPolarHBondContact O-CB 3.46Å; I325-S329 PolarHBondContact O-N 2.94Å; I325-S329 PolarHBondContact O-OG 3.36Å
326C94.6Very high88.2Confident78 Ų7853.4 Ų53.453%0.52731%0.305SS..Hα-helixtrans-58.4-48.3175-76.10000111.2L322 I323 I324 F328 S329 L330L322-C326 VanDerWaalsContact O-CB 3.3Å; L322-C326 WeakPolarHBondContact O-CB 3.4Å; L322-C326 PolarHBondContact O-N 3.43Å; L322-C326 PolarHBondContact O-SG 2.88Å; I323-C326 PolarHBondContact O-N 3.3Å; I324-C326 VanDerWaalsContact C-N 3.33Å; I324-C326 PolarHBondContact O-N 2.86Å; C326-F328 PolarHBondContact O-N 3.29Å; C326-S329 PolarHBondContact O-N 2.96Å; C326-L330 WeakPolarHBondContact O-CG 3.5Å; C326-L330 PolarHBondContact O-N 3.29Å
327F92.6Very high85.6Confident88 Ų8852.5 Ų52.539%0.38631%0.312SS..Hα-helixtrans-56.8-47.3178.4177.5-95.4000112.7P176 F177 I323 I324 S329P176-F327 HydrophobicContact CG-CD1 4.4Å; P176-F327 HydrophobicContact CG-CE1 4Å; F177-F327 HydrophobicContact CD2-CE1 4.33Å; F177-F327 AromaticContact CD2-CE2 3.99Å; F177-F327 HydrophobicContact CD2-CE2 3.99Å; F177-F327 AromaticContact CD2-CZ 3.59Å; F177-F327 HydrophobicContact CD2-CZ 3.59Å; F177-F327 HydrophobicContact CE2-CD2 4.09Å; F177-F327 HydrophobicContact CE2-CE1 4.09Å; F177-F327 AromaticContact CE2-CE2 3.36Å; F177-F327 HydrophobicContact CE2-CE2 3.36Å; F177-F327 AromaticContact CE2-CZ 3.37Å; F177-F327 HydrophobicContact CE2-CZ 3.37Å; F177-F327 HydrophobicContact CZ-CE2 4.27Å; I323-F327 WeakPolarHBondContact O-CB 3.48Å; I323-F327 PolarHBondContact O-N 3.43Å; I324-F327 WeakPolarHBondContact O-CB 3.41Å; I324-F327 PolarHBondContact O-N 3.41Å; F327-S329 VanDerWaalsContact C-N 3.29Å; F327-S329 PolarHBondContact O-N 3.12Å
328F90.4Very high82.6Confident5 Ų557.6 Ų57.62%0.02235%0.346CS..Hα-helixtrans-71.4-22.7176.3-81.9-86.9000113.3F118 C169 L173 P176 I324 I325 C326F118-F328 HydrophobicContact CD2-CB 4.23Å; F118-F328 HydrophobicContact CE2-CB 3.8Å; F118-F328 HydrophobicContact CZ-CB 4.06Å; C169-F328 HydrophobicContact CB-CB 4.31Å; C169-F328 HydrophobicContact CB-CD1 3.87Å; C169-F328 HydrophobicContact CB-CD2 3.58Å; C169-F328 HydrophobicContact CB-CE1 4.01Å; C169-F328 HydrophobicContact CB-CE2 3.74Å; C169-F328 HydrophobicContact CB-CG 3.65Å; C169-F328 HydrophobicContact CB-CZ 3.95Å; L173-F328 HydrophobicContact CD2-CD1 4.45Å; L173-F328 VanDerWaalsContact CD2-O 3.29Å; L173-F328 WeakPolarHBondContact CD2-O 3.33Å; P176-F328 HydrophobicContact CG-CD1 3.72Å; P176-F328 HydrophobicContact CG-CE1 4Å; P176-F328 HydrophobicContact CG-CG 4.33Å; I324-F328 HydrophobicContact CG2-CD2 3.76Å; I324-F328 HydrophobicContact CG2-CE2 3.86Å; I324-F328 WeakPolarHBondContact O-CD2 3.49Å; I324-F328 PolarHBondContact O-N 3.49Å; I325-F328 PolarHBondContact O-N 2.98Å; C326-F328 PolarHBondContact O-N 3.29Å
329S90.5Very high79.5Confident9 Ų962.9 Ų62.96%0.06337%0.367CS..Hα-helixtrans-85.1-29.4-180-59.80000113.5I325 C326 F327 L332 L333I325-S329 WeakPolarHBondContact O-CB 3.46Å; I325-S329 PolarHBondContact O-N 2.94Å; I325-S329 PolarHBondContact O-OG 3.36Å; C326-S329 PolarHBondContact O-N 2.96Å; F327-S329 VanDerWaalsContact C-N 3.29Å; F327-S329 PolarHBondContact O-N 3.12Å; S329-L332 WeakPolarHBondContact O-CB 3.37Å; S329-L332 PolarHBondContact O-N 3.19Å; S329-L333 PolarHBondContact O-N 3.2Å
330L88.1Confident76.3Confident93 Ų9368.5 Ų68.549%0.48739%0.385SS..Hα-helixtrans-48.2-54.2-177.2-82169.6000113.7C326 L332 L333 S334C326-L330 WeakPolarHBondContact O-CG 3.5Å; C326-L330 PolarHBondContact O-N 3.29Å; L330-L332 VanDerWaalsContact C-N 3.25Å; L330-L332 PolarHBondContact O-N 3.23Å; L330-L333 PolarHBondContact O-N 2.64Å; L330-S334 PolarHBondContact O-N 2.88Å; L330-S334 PolarHBondContact O-OG 3.16Å; L330-S334 VanDerWaalsContact O-OG 3.14Å
331P81.3Confident73.2Confident25 Ų2571.1 Ų71.116%0.16241%0.405CS..Hα-helixtrans-67.4-23.3-179.811.7-15.6000114.2P176 L333 G335P176-P331 HydrophobicContact CB-CG 3.43Å; P176-P331 VanDerWaalsContact CB-CG 3.43Å; P176-P331 HydrophobicContact CG-CG 4.48Å; P331-L333 VanDerWaalsContact C-N 3.3Å; P331-G335 PolarHBondContact O-N 3.03Å
332L81.7Confident70.1Confident15 Ų1578.3 Ų78.38%0.07944%0.436CS..Hα-helixtrans-70.1-30.5173-61.3174.6000111.8R111 H114 I115 F118 L173 S329 L330R111-L332 VanDerWaalsContact CD-O 3.28Å; R111-L332 WeakPolarHBondContact CD-O 3.21Å; R111-L332 PolarHBondContact NE-O 2.85Å; H114-L332 HydrophobicContact CB-CD1 3.56Å; I115-L332 HydrophobicContact CG1-CD1 4.08Å; F118-L332 HydrophobicContact CE2-CD1 3.96Å; L173-L332 HydrophobicContact CD1-CD2 3.88Å; L173-L332 HydrophobicContact CD2-CD1 4.25Å; L173-L332 HydrophobicContact CD2-CD2 4.32Å; L173-L332 HydrophobicContact CD2-CG 4.17Å; S329-L332 WeakPolarHBondContact O-CB 3.37Å; S329-L332 PolarHBondContact O-N 3.19Å; L330-L332 VanDerWaalsContact C-N 3.25Å; L330-L332 PolarHBondContact O-N 3.23Å
333L81.1Confident67.1Low116 Ų11682.1 Ų82.161%0.60745%0.452SS*.Hα-helixtrans-83-37.5178.2-62.1174.9000112I115 S329 L330 P331 G335I115-L333 HydrophobicContact CD1-CD2 4.17Å; S329-L333 PolarHBondContact O-N 3.2Å; L330-L333 PolarHBondContact O-N 2.64Å; P331-L333 VanDerWaalsContact C-N 3.3Å; L333-G335 VanDerWaalsContact C-N 3.33Å; L333-G335 PolarHBondContact O-N 3.06Å
334S70.7Confident64Low93 Ų9379 Ų7965%0.6545%0.447SS*.Hα-helixtrans-78-12.3-178.4-55.70000114.5L330L330-S334 PolarHBondContact O-N 2.88Å; L330-S334 PolarHBondContact O-OG 3.16Å; L330-S334 VanDerWaalsContact O-OG 3.14Å
335G60Low61Low6 Ų685 Ų856%0.06247%0.474CS..SBendtrans-68.2139.8178.500000112.7R111 P331 L333 A337R111-G335 PolarHBondContact NH2-O 3.39Å; R111-G335 VanDerWaalsContact NH2-O 3.13Å; P331-G335 PolarHBondContact O-N 3.03Å; L333-G335 VanDerWaalsContact C-N 3.33Å; L333-G335 PolarHBondContact O-N 3.06Å; G335-A337 PolarHBondContact O-N 3.11Å; G335-A337 VanDerWaalsContact O-N 3.14Å
336P50.9Low58.1Low103 Ų10390.3 Ų90.367%0.66950%0.503SS*.PPolyproline II helixtrans-51.2125.3-176.117.3-28.8000110.5R111 C338R111-P336 PolarHBondContact NH2-O 3.14Å; P336-C338 PolarHBondContact O-N 3.41Å; P336-C338 VanDerWaalsContact O-N 3.16Å
337A42.2Very low55.5Low78 Ų7894.4 Ų94.465%0.64551%0.512SS*.PPolyproline II helixtrans-55.312317100000107.1G335 Q339G335-A337 PolarHBondContact O-N 3.11Å; G335-A337 VanDerWaalsContact O-N 3.14Å; A337-Q339 PolarHBondContact O-N 2.74Å
338C35.7Very low52.8Low109 Ų10998 Ų9874%0.73653%0.527SS*.  trans-34.2106.7179.6-170.10000110.2P336 K340P336-C338 PolarHBondContact O-N 3.41Å; P336-C338 VanDerWaalsContact O-N 3.16Å; C338-K340 PolarHBondContact O-N 3.07Å
339Q30.6Very low50.2Low169 Ų169105.5 Ų105.579%0.7956%0.56SS**  trans-55.9119.5174-81.5-177.7-1600106.6A337 S341A337-Q339 PolarHBondContact O-N 2.74Å; Q339-S341 PolarHBondContact O-N 3.4Å; Q339-S341 VanDerWaalsContact O-N 3.17Å
340K31.2Very low47.6Very low198 Ų198108.3 Ų108.386%0.86158%0.584SS**  trans-41.1125.8163.1-79.2176.8174.11760107.6C338 K342C338-K340 PolarHBondContact O-N 3.07Å; K340-K342 PolarHBondContact O-N 3.44Å
341S32.6Very low45.1Very low93 Ų93107.8 Ų107.865%0.6559%0.593SS**  trans-47.997.5-173.755.50000112.7Q339 E343 G344Q339-S341 PolarHBondContact O-N 3.4Å; Q339-S341 VanDerWaalsContact O-N 3.17Å; S341-E343 PolarHBondContact O-N 3.35Å; S341-G344 PolarHBondContact O-N 3.18Å
342K32.4Very low42.8Very low156 Ų156112.3 Ų112.368%0.67862%0.62SS**THydrogen-bonded Turntrans-73.8-7.4162.8-82.7-171.8175.1-179.90112.2K340 G344 N346K340-K342 PolarHBondContact O-N 3.44Å; K342-G344 VanDerWaalsContact C-N 3.32Å; K342-N346 PolarHBondContact O-N 3.02Å
343E34.9Very low40.5Very low161 Ų161120.7 Ų120.775%0.75266%0.656SS**Hα-helixtrans-72.3-21.9171-79.8-172.8133.100113.8S341S341-E343 PolarHBondContact O-N 3.35Å
344G32.3Very low38.2Very low43 Ų43121.1 Ų121.144%0.44366%0.663SS.*Hα-helixtrans-80.9-25.9175.700000114.2S341 K342S341-G344 PolarHBondContact O-N 3.18Å; K342-G344 VanDerWaalsContact C-N 3.32Å
345Q33Very low36.6Very low141 Ų141123 Ų12366%0.65967%0.674SS**Hα-helixtrans-90-31.6178.7-83.8-175.8-12.300112.9K349Q345-K349 PolarHBondContact O-N 3.27Å; Q345-K349 VanDerWaalsContact O-N 3.16Å
346N34.2Very low34.9Very low118 Ų118127.8 Ų127.863%0.63171%0.707SS**Hα-helixtrans-75.1-30.2176.8-86.4-1000113.3K342 A350K342-N346 PolarHBondContact O-N 3.02Å; N346-A350 WeakPolarHBondContact O-CB 3.48Å; N346-A350 PolarHBondContact O-N 3.28Å; N346-A350 VanDerWaalsContact O-N 3.15Å
347K38.5Very low33.8Very low164 Ų164127.9 Ų127.971%0.71371%0.709SS**Hα-helixtrans-72.3-31.6172.6-75.2-173.6177.1179.90113.2A351K347-A351 PolarHBondContact O-N 3.07Å
348K36.4Very low33.4Very low163 Ų163138.7 Ų138.771%0.70974%0.735SS**Hα-helixtrans-73.2-34.2173.9-82-171.9175.2-175.10113.1T352K348-T352 PolarHBondContact O-OG1 3.16Å
349K36.4Very low33.2Very low163 Ų163140.2 Ų140.271%0.70974%0.735SS**Hα-helixtrans-76.5-25175.6-82.2-174.9173.4-177.80114.3Q345Q345-K349 PolarHBondContact O-N 3.27Å; Q345-K349 VanDerWaalsContact O-N 3.16Å
350A36.4Very low33.4Very low68 Ų68138.7 Ų138.756%0.56273%0.732SS**Hα-helixtrans-79.4-30.6175.400000112.8N346N346-A350 WeakPolarHBondContact O-CB 3.48Å; N346-A350 PolarHBondContact O-N 3.28Å; N346-A350 VanDerWaalsContact O-N 3.15Å
351A35.3Very low33.5Very low82 Ų82135.4 Ų135.468%0.67873%0.725SS**Hα-helixtrans-78-15.9-179.900000114.4K347K347-A351 PolarHBondContact O-N 3.07Å
352T33.3Very low33.6Very low120 Ų120137.9 Ų137.974%0.73673%0.73SS**THydrogen-bonded Turntrans-93.42.4179.9-10.70000114.3K348K348-T352 PolarHBondContact O-OG1 3.16Å
353K32.7Very low33.6Very low190 Ų190136.8 Ų136.883%0.82673%0.733SS**SBendtrans-1113-178.1-90.8-169.1173.9-170.80115.3
354V33.4Very low33.5Very low126 Ų126135.1 Ų135.176%0.76473%0.731SS**SBendtrans-122.261.4177.3-167.10000109.8
355C35.3Very low33.6Very low131 Ų131141.7 Ų141.789%0.88575%0.752SS**  trans-163.679.4161-101.20000107.3
356S26.2Very low33.7Very low107 Ų107141.8 Ų141.875%0.74876%0.759SS**  trans-162.5116.7159.3-163.30000110.2
357C26.8Very low33.6Very low105 Ų105143.8 Ų143.871%0.70977%0.77SS**  trans78.6110.1151.1-60.60000119.5
358Y33Very low33.2Very low306 Ų306141.9 Ų141.9100%1.278%0.775SS**  trans48.80135-71.6-80000120.2

Retrieved 358 of 358 residues in 128.7 ms (Link to these results)

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