A0A096MA66_POEFO Loading...

Neuromedin U receptor 1

Receptor for the neuromedin-U and neuromedin-S neuropeptides.

AlphaFold DB , UniProt , Accession A0A096MA66, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 403 aa.

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

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39Very low50.2Low191 Ų191109 Ų10994%0.94163%0.626SS**  0102.70-77.9151.9155.800106.7
2N35Very low52Low168 Ų168109.9 Ų109.990%0.89864%0.641SS**  trans-76.4145.3169.2-99.60.6000108
3G40.6Very low54Low69 Ų69107.1 Ų107.171%0.71162%0.622SS**  trans-47.2136.1-17500000113.4H5G3-H5 PolarHBondContact O-N 3.04Å; G3-H5 VanDerWaalsContact O-N 3.08Å
4S44.6Very low56.2Low59 Ų59106.5 Ų106.541%0.41362%0.621SS.*  trans-60.7100179.738.30000111.5I6S4-I6 PolarHBondContact O-N 2.76Å
5H43.4Very low57.8Low187 Ų187105.9 Ų105.987%0.86661%0.61SS**PPolyproline II helixtrans-67.8118154-97.3-82.6000107.8G3 G7G3-H5 PolarHBondContact O-N 3.04Å; G3-H5 VanDerWaalsContact O-N 3.08Å; H5-G7 PolarHBondContact O-N 2.82Å
6I53.3Low59.4Low61 Ų61108.6 Ų108.631%0.31362%0.615SS.*PPolyproline II helixtrans-74.8120.1176.3-66.9175.1000107.9S4 D10 I178 H179S4-I6 PolarHBondContact O-N 2.76Å; I6-D10 HydrophobicContact CG2-CB 4.1Å; I6-I178 HydrophobicContact CD1-CG2 3.98Å; I6-H179 HydrophobicContact CD1-CB 3.94Å; I6-H179 VanDerWaalsContact CD1-O 3.3Å; I6-H179 WeakPolarHBondContact CD1-O 3.46Å
7G55.3Low60.8Low34 Ų34103.3 Ų103.335%0.35159%0.59SS.*PPolyproline II helixtrans-76.4149.4167.200000109.5H5 D9 D10H5-G7 PolarHBondContact O-N 2.82Å; G7-D9 PolarHBondContact O-N 3Å; G7-D10 PolarHBondContact N-OD2 2.81Å; G7-D10 WeakPolarHBondContact O-CB 3.39Å; G7-D10 PolarHBondContact O-N 2.83Å
8M50.9Low62.1Low176 Ų17698.2 Ų98.287%0.86756%0.56SS**G310 helixtrans-52.9-27.7175.7-79.9170.980.100112.4D10 S11M8-D10 VanDerWaalsContact C-N 3.31Å; M8-D10 PolarHBondContact O-N 2.89Å; M8-S11 PolarHBondContact O-OG 3.01Å
9D60.3Low63.5Low138 Ų13893.4 Ų93.474%0.73853%0.532SS*.G310 helixtrans-67.4-21.2176.7-64-19.4000114.9G7 S11G7-D9 PolarHBondContact O-N 3Å; D9-S11 VanDerWaalsContact C-N 3.33Å
10D65.9Low64.6Low13 Ų1394.5 Ų94.57%0.0753%0.533CS..G310 helixtrans-78.7-20.3-177.1-62.9-39.7000112.5I6 G7 M8 C12 L13 Y18 K21 Y22I6-D10 HydrophobicContact CG2-CB 4.1Å; G7-D10 PolarHBondContact N-OD2 2.81Å; G7-D10 WeakPolarHBondContact O-CB 3.39Å; G7-D10 PolarHBondContact O-N 2.83Å; M8-D10 VanDerWaalsContact C-N 3.31Å; M8-D10 PolarHBondContact O-N 2.89Å; D10-C12 PolarHBondContact O-N 2.76Å; D10-L13 PolarHBondContact O-N 3.36Å; D10-Y18 HydrophobicContact CB-CE2 4.22Å; D10-K21 IonicContact OD1-NZ 2.63Å; D10-K21 PolarHBondContact OD1-NZ 2.74Å; D10-Y22 PolarHBondContact OD2-OH 3.01Å
11S63.7Low65.6Low103 Ų10395.6 Ų95.672%0.7253%0.532SS*.G310 helixtrans-71-14.4-178.865.70000114M8 D9M8-S11 PolarHBondContact O-OG 3.01Å; D9-S11 VanDerWaalsContact C-N 3.33Å
12C71.9Confident67.8Low120 Ų12090.2 Ų90.281%0.81150%0.501SS*.G310 helixtrans-97.8-5.6-179.5-153.50000113.2D10D10-C12 PolarHBondContact O-N 2.76Å
13L78.3Confident70.2Confident73 Ų7383.9 Ų83.938%0.38247%0.467SS..SBendtrans-80.6142.5-179.6-68.8168.6000111D10 K21D10-L13 PolarHBondContact O-N 3.36Å; L13-K21 HydrophobicContact CD1-CD 3.75Å
14T83.9Confident72.4Confident99 Ų9981.6 Ų81.661%0.60744%0.444SS*.  trans-64.1157.7163.956.30000109.7E16 G17 Y18T14-E16 PolarHBondContact O-N 3.37Å; T14-G17 PolarHBondContact O-N 3.26Å; T14-G17 PolarHBondContact OG1-N 3.13Å; T14-Y18 PolarHBondContact O-N 2.72Å
15E81.1Confident74.5Confident98 Ų9881.9 Ų81.946%0.45844%0.444SS..Hα-helixtrans-53.4-43.5176.6-172.4179.8154.800111.7Y18 L19 I191 P192E15-Y18 WeakPolarHBondContact O-CB 3.38Å; E15-Y18 PolarHBondContact O-N 3.15Å; E15-L19 WeakPolarHBondContact O-CG 3.43Å; E15-L19 PolarHBondContact O-N 3.14Å; E15-I191 HydrophobicContact CG-CG2 3.82Å; E15-P192 WeakPolarHBondContact OE1-CB 3.28Å; E15-P192 VanDerWaalsContact OE1-CD 3.25Å; E15-P192 WeakPolarHBondContact OE1-CD 3.39Å; E15-P192 VanDerWaalsContact OE1-CG 3.23Å; E15-P192 WeakPolarHBondContact OE1-CG 3.43Å
16E82.6Confident76.8Confident148 Ų14877 Ų7769%0.69242%0.418SS*.Hα-helixtrans-62.7-43.4175.4-64.3-173161.600112.6T14 Y18 L19 E20T14-E16 PolarHBondContact O-N 3.37Å; E16-Y18 VanDerWaalsContact C-N 3.29Å; E16-Y18 PolarHBondContact O-N 3.4Å; E16-L19 PolarHBondContact O-N 3.04Å; E16-E20 WeakPolarHBondContact O-CB 3.36Å; E16-E20 PolarHBondContact O-N 2.77Å
17G84Confident78.6Confident19 Ų1979.5 Ų79.520%0.19642%0.424CS..Hα-helixtrans-66.3-31.8176.900000112.7T14 K21T14-G17 PolarHBondContact O-N 3.26Å; T14-G17 PolarHBondContact OG1-N 3.13Å; G17-K21 WeakPolarHBondContact O-CB 3.23Å; G17-K21 PolarHBondContact O-N 2.66Å
18Y84.8Confident80.2Confident12 Ų1278.8 Ų78.85%0.04741%0.414CS..Hα-helixtrans-68.2-48.7173-170.4-84.7000111D10 T14 E15 E16 E20 K21 Y22 L176 I191D10-Y18 HydrophobicContact CB-CE2 4.22Å; T14-Y18 PolarHBondContact O-N 2.72Å; E15-Y18 WeakPolarHBondContact O-CB 3.38Å; E15-Y18 PolarHBondContact O-N 3.15Å; E16-Y18 VanDerWaalsContact C-N 3.29Å; E16-Y18 PolarHBondContact O-N 3.4Å; Y18-E20 VanDerWaalsContact C-N 3.3Å; Y18-E20 PolarHBondContact O-N 3.08Å; Y18-K21 PolarHBondContact O-N 2.81Å; Y18-Y22 AromaticContact CD1-CD2 3.84Å; Y18-Y22 HydrophobicContact CD1-CD2 3.84Å; Y18-Y22 HydrophobicContact CD1-CE2 4.25Å; Y18-Y22 HydrophobicContact CD2-CD2 4.14Å; Y18-Y22 AromaticContact CD2-CE2 3.76Å; Y18-Y22 HydrophobicContact CD2-CE2 3.76Å; Y18-Y22 AromaticContact CE1-CD2 3.55Å; Y18-Y22 HydrophobicContact CE1-CD2 3.55Å; Y18-Y22 AromaticContact CE1-CE2 3.82Å; Y18-Y22 HydrophobicContact CE1-CE2 3.82Å; Y18-Y22 HydrophobicContact CE1-CG 4.41Å; Y18-Y22 AromaticContact CE2-CD2 3.9Å; Y18-Y22 HydrophobicContact CE2-CD2 3.9Å; Y18-Y22 AromaticContact CE2-CE2 3.3Å; Y18-Y22 HydrophobicContact CE2-CE2 3.3Å; Y18-Y22 HydrophobicContact CG-CD2 4.11Å; Y18-Y22 HydrophobicContact CG-CE2 4.21Å; Y18-Y22 AromaticContact CZ-CD2 3.59Å; Y18-Y22 AromaticContact CZ-CE2 3.33Å; Y18-Y22 VanDerWaalsContact O-CD2 3.32Å; Y18-Y22 WeakPolarHBondContact O-CD2 3.45Å; Y18-Y22 PolarHBondContact O-N 3.07Å; Y18-Y22 VanDerWaalsContact O-N 3.17Å; Y18-L176 HydrophobicContact CD1-CD1 4.34Å; Y18-L176 HydrophobicContact CE1-CB 4.47Å; Y18-L176 HydrophobicContact CE1-CD1 4.06Å; Y18-I191 HydrophobicContact CD1-CD1 3.3Å; Y18-I191 HydrophobicContact CE1-CD1 3.15Å; Y18-I191 HydrophobicContact CG-CD1 4.3Å
19L87Confident82.1Confident6 Ų675.2 Ų75.23%0.03141%0.406CS..Hα-helixtrans-58.7-43.3176-67.8173.6000111.3E15 E16 K21 Y22 L23 Y96 L176 I191E15-L19 WeakPolarHBondContact O-CG 3.43Å; E15-L19 PolarHBondContact O-N 3.14Å; E16-L19 PolarHBondContact O-N 3.04Å; L19-K21 PolarHBondContact O-N 3.46Å; L19-Y22 PolarHBondContact O-N 3.49Å; L19-L23 HydrophobicContact CD2-CD1 3.94Å; L19-L23 WeakPolarHBondContact O-CA 3.4Å; L19-L23 VanDerWaalsContact O-CB 3.28Å; L19-L23 WeakPolarHBondContact O-CB 3.3Å; L19-L23 PolarHBondContact O-N 3.27Å; L19-Y96 HydrophobicContact CB-CE2 3.65Å; L19-Y96 HydrophobicContact CD1-CD2 4.34Å; L19-Y96 HydrophobicContact CD1-CE2 3.92Å; L19-Y96 HydrophobicContact CG-CE2 4.24Å; L19-L176 HydrophobicContact CD2-CD1 4.06Å; L19-I191 HydrophobicContact CD2-CG2 4.08Å
20E86.1Confident83.5Confident116 Ų11670 Ų7054%0.54238%0.379SS..Hα-helixtrans-64.4-39178.4-171.6170-165.300112.7E16 Y18 G24E16-E20 WeakPolarHBondContact O-CB 3.36Å; E16-E20 PolarHBondContact O-N 2.77Å; Y18-E20 VanDerWaalsContact C-N 3.3Å; Y18-E20 PolarHBondContact O-N 3.08Å; E20-G24 WeakPolarHBondContact CA-O 3.47Å; E20-G24 CarbonylContact O-C 3.57Å; E20-G24 WeakPolarHBondContact O-CA 3.4Å; E20-G24 PolarHBondContact O-N 3.34Å
21K85.6Confident84.7Confident118 Ų11870.5 Ų70.551%0.51338%0.381SS..Hα-helixtrans-64.2-41.2178.1-176.4176.2-179.3179.70113.1D10 L13 G17 Y18 L19D10-K21 IonicContact OD1-NZ 2.63Å; D10-K21 PolarHBondContact OD1-NZ 2.74Å; L13-K21 HydrophobicContact CD1-CD 3.75Å; G17-K21 WeakPolarHBondContact O-CB 3.23Å; G17-K21 PolarHBondContact O-N 2.66Å; Y18-K21 PolarHBondContact O-N 2.81Å; L19-K21 PolarHBondContact O-N 3.46Å
22Y84.7Confident86.1Confident77 Ų7770.9 Ų70.930%0.30237%0.374SS..Hα-helixtrans-98.4-29.2-173.4-71.4-80.3000114.5D10 Y18 L19D10-Y22 PolarHBondContact OD2-OH 3.01Å; Y18-Y22 AromaticContact CD1-CD2 3.84Å; Y18-Y22 HydrophobicContact CD1-CD2 3.84Å; Y18-Y22 HydrophobicContact CD1-CE2 4.25Å; Y18-Y22 HydrophobicContact CD2-CD2 4.14Å; Y18-Y22 AromaticContact CD2-CE2 3.76Å; Y18-Y22 HydrophobicContact CD2-CE2 3.76Å; Y18-Y22 AromaticContact CE1-CD2 3.55Å; Y18-Y22 HydrophobicContact CE1-CD2 3.55Å; Y18-Y22 AromaticContact CE1-CE2 3.82Å; Y18-Y22 HydrophobicContact CE1-CE2 3.82Å; Y18-Y22 HydrophobicContact CE1-CG 4.41Å; Y18-Y22 AromaticContact CE2-CD2 3.9Å; Y18-Y22 HydrophobicContact CE2-CD2 3.9Å; Y18-Y22 AromaticContact CE2-CE2 3.3Å; Y18-Y22 HydrophobicContact CE2-CE2 3.3Å; Y18-Y22 HydrophobicContact CG-CD2 4.11Å; Y18-Y22 HydrophobicContact CG-CE2 4.21Å; Y18-Y22 AromaticContact CZ-CD2 3.59Å; Y18-Y22 AromaticContact CZ-CE2 3.33Å; Y18-Y22 VanDerWaalsContact O-CD2 3.32Å; Y18-Y22 WeakPolarHBondContact O-CD2 3.45Å; Y18-Y22 PolarHBondContact O-N 3.07Å; Y18-Y22 VanDerWaalsContact O-N 3.17Å; L19-Y22 PolarHBondContact O-N 3.49Å
23L86Confident87.1Confident35 Ų3569 Ų6918%0.18336%0.36CS..Hα-helixtrans-111-8-178.1-54.7179.8000113L19 Y96 L176 I196L19-L23 HydrophobicContact CD2-CD1 3.94Å; L19-L23 WeakPolarHBondContact O-CA 3.4Å; L19-L23 VanDerWaalsContact O-CB 3.28Å; L19-L23 WeakPolarHBondContact O-CB 3.3Å; L19-L23 PolarHBondContact O-N 3.27Å; L23-Y96 HydrophobicContact CB-CD1 3.55Å; L23-Y96 HydrophobicContact CB-CE1 3.45Å; L23-Y96 VanDerWaalsContact CB-CE1 3.45Å; L23-Y96 HydrophobicContact CB-CG 4.34Å; L23-Y96 HydrophobicContact CD1-CD1 3.79Å; L23-Y96 HydrophobicContact CD1-CD2 4.1Å; L23-Y96 HydrophobicContact CD1-CE1 4.23Å; L23-Y96 HydrophobicContact CD1-CG 3.71Å; L23-Y96 HydrophobicContact CG-CD1 4.32Å; L23-Y96 HydrophobicContact CG-CE1 4.48Å; L23-L176 HydrophobicContact CD1-CD1 3.83Å; L23-L176 HydrophobicContact CD2-CD1 3.99Å; L23-L176 HydrophobicContact CD2-CG 4.31Å; L23-L176 HydrophobicContact CG-CD1 3.7Å; L23-I196 HydrophobicContact CD1-CG2 4.37Å; L23-I196 HydrophobicContact CD2-CD1 4.1Å; L23-I196 HydrophobicContact CD2-CG2 4.48Å
24G87.1Confident87.9Confident22 Ų2266 Ų6623%0.22735%0.345CS..  trans80-170.9-174.500000112.8E20 Y96E20-G24 WeakPolarHBondContact CA-O 3.47Å; E20-G24 CarbonylContact O-C 3.57Å; E20-G24 WeakPolarHBondContact O-CA 3.4Å; E20-G24 PolarHBondContact O-N 3.34Å; G24-Y96 WeakPolarHBondContact O-CE1 3.46Å; G24-Y96 PolarHBondContact O-OH 3.07Å
25P89.6Confident88.4Confident64 Ų6463 Ų6342%0.41633%0.328SS..  trans-65.8140.7-178.128.7-35.3000110.6R27 N95P25-R27 PolarHBondContact O-N 3.01Å; P25-N95 PolarHBondContact O-ND2 3.47Å
26R89.8Confident89.1Confident85 Ų8563.6 Ų63.632%0.32133%0.334SS..SBendtrans-59.7-32.7-180-167.3170.8-177.2146.73.4112.6Q94 N95 Y96 D193R26-Q94 VanDerWaalsContact CG-OE1 3.26Å; R26-Q94 CarbonylContact O-C 3.09Å; R26-Q94 WeakPolarHBondContact O-CA 3.43Å; R26-N95 PolarHBondContact O-N 3.27Å; R26-Y96 HydrophobicContact CB-CE1 4.42Å; R26-Y96 HydrophobicContact CB-CE2 4.13Å; R26-Y96 HydrophobicContact CG-CD2 4.35Å; R26-Y96 HydrophobicContact CG-CE2 4.05Å; R26-Y96 WeakPolarHBondContact CG-O 3.46Å; R26-Y96 PolarHBondContact NE-O 2.89Å; R26-D193 IonicContact CZ-OD2 3.03Å; R26-D193 IonicContact NH1-OD2 3.41Å; R26-D193 PolarHBondContact NH1-OD2 2.85Å; R26-D193 IonicContact NH2-OD2 3.58Å; R26-D193 PolarHBondContact NH2-OD2 3.48Å
27R92Very high89.7Confident113 Ų11358.3 Ų58.343%0.42631%0.313SS..SBendtrans-118.8133.3172.6179.6171176.9-171.5-1.6109.8P25 W93P25-R27 PolarHBondContact O-N 3.01Å; R27-W93 WeakPolarHBondContact CA-O 3.35Å; R27-W93 WeakPolarHBondContact CB-O 3.29Å; R27-W93 WeakPolarHBondContact CG-O 3.34Å; R27-W93 VanDerWaalsContact CZ-CE3 3.49Å; R27-W93 VanDerWaalsContact NH1-CZ3 3.33Å
28S89.4Confident90.3Very high20 Ų2057.6 Ų57.614%0.1430%0.304CS..  trans-67.5136.1178.5-177.80000112.1V30 F31 L92S28-V30 PolarHBondContact O-N 3.33Å; S28-V30 WeakPolarHBondContact OG-CG2 3.4Å; S28-V30 PolarHBondContact OG-N 3.36Å; S28-F31 VanDerWaalsContact O-CB 3.23Å; S28-F31 WeakPolarHBondContact O-CB 3.37Å; S28-F31 PolarHBondContact O-N 3.07Å; S28-F31 VanDerWaalsContact O-N 3.13Å; S28-L92 WeakPolarHBondContact CB-O 3.33Å; S28-L92 PolarHBondContact N-O 3.23Å; S28-L92 WeakPolarHBondContact OG-CD1 3.49Å
29S89.5Confident90.8Very high100 Ų10061.6 Ų61.670%0.69933%0.326SS*.THydrogen-bonded Turntrans-62.4-27.7176.658.30000112.4F31S29-F31 VanDerWaalsContact C-N 3.34Å
30V89.9Confident91.2Very high30 Ų3066.9 Ų66.918%0.18235%0.353CS..THydrogen-bonded Turntrans-90.76.5179.2-60.40000113.3S28 L32 P33 V34 L92 I315S28-V30 PolarHBondContact O-N 3.33Å; S28-V30 WeakPolarHBondContact OG-CG2 3.4Å; S28-V30 PolarHBondContact OG-N 3.36Å; V30-L32 PolarHBondContact O-N 3.49Å; V30-P33 HydrophobicContact CB-CG 4.43Å; V30-P33 VanDerWaalsContact O-CD 3.23Å; V30-P33 WeakPolarHBondContact O-CD 3.42Å; V30-P33 VanDerWaalsContact O-CG 3.29Å; V30-P33 WeakPolarHBondContact O-CG 3.38Å; V30-V34 HydrophobicContact CB-CG2 4.35Å; V30-V34 HydrophobicContact CG2-CG2 4.27Å; V30-V34 WeakPolarHBondContact O-CB 3.43Å; V30-V34 VanDerWaalsContact O-CG2 3.28Å; V30-V34 WeakPolarHBondContact O-CG2 3.16Å; V30-V34 PolarHBondContact O-N 2.84Å; V30-V34 VanDerWaalsContact O-N 3.15Å; V30-L92 HydrophobicContact CG2-CD1 4.33Å; V30-I315 HydrophobicContact CB-CD1 4.15Å; V30-I315 HydrophobicContact CG1-CD1 3.86Å; V30-I315 HydrophobicContact CG2-CD1 3.84Å; V30-I315 HydrophobicContact CG2-CG1 4.18Å
31F92.5Very high91.7Very high23 Ų2362 Ų6210%0.10133%0.331CS..Hα-helixtrans-53.2-51-178.5171.8-91000112.8S28 S29 V34 C35 L92 W93S28-F31 VanDerWaalsContact O-CB 3.23Å; S28-F31 WeakPolarHBondContact O-CB 3.37Å; S28-F31 PolarHBondContact O-N 3.07Å; S28-F31 VanDerWaalsContact O-N 3.13Å; S29-F31 VanDerWaalsContact C-N 3.34Å; F31-V34 PolarHBondContact O-N 3.13Å; F31-C35 HydrophobicContact CE1-CB 4.08Å; F31-C35 HydrophobicContact CE2-CB 4.38Å; F31-C35 HydrophobicContact CZ-CB 3.99Å; F31-C35 WeakPolarHBondContact O-CB 3.18Å; F31-C35 PolarHBondContact O-N 3.43Å; F31-L92 HydrophobicContact CB-CD2 4.36Å; F31-L92 HydrophobicContact CB-CG 4.21Å; F31-L92 HydrophobicContact CD2-CB 4.09Å; F31-L92 HydrophobicContact CD2-CD2 4.14Å; F31-L92 HydrophobicContact CD2-CG 4.04Å; F31-W93 HydrophobicContact CD1-CE3 4.04Å; F31-W93 HydrophobicContact CD1-CZ3 4.4Å; F31-W93 HydrophobicContact CD2-CB 4.04Å; F31-W93 HydrophobicContact CD2-CE3 4.32Å; F31-W93 AromaticContact CE1-CE3 3.54Å; F31-W93 HydrophobicContact CE1-CE3 3.54Å; F31-W93 AromaticContact CE1-CZ3 3.83Å; F31-W93 HydrophobicContact CE1-CZ3 3.83Å; F31-W93 HydrophobicContact CE2-CB 3.76Å; F31-W93 AromaticContact CE2-CE3 3.88Å; F31-W93 HydrophobicContact CE2-CE3 3.88Å; F31-W93 HydrophobicContact CG-CE3 4.4Å; F31-W93 HydrophobicContact CZ-CB 4.47Å; F31-W93 HydrophobicContact CZ-CD2 4.46Å; F31-W93 AromaticContact CZ-CE3 3.47Å; F31-W93 HydrophobicContact CZ-CE3 3.47Å; F31-W93 VanDerWaalsContact CZ-CE3 3.47Å; F31-W93 HydrophobicContact CZ-CZ3 4.12Å
32L92.8Very high92.2Very high111 Ų11159 Ų5958%0.58132%0.318SS*.Hα-helixtrans-62.8-52.3-173.8-170.870.1000112.8V30 V34 C35 L36V30-L32 PolarHBondContact O-N 3.49Å; L32-V34 PolarHBondContact O-N 3.34Å; L32-C35 PolarHBondContact O-N 2.95Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.1Å
33P93.2Very high92.7Very high79 Ų7960.3 Ų60.351%0.51333%0.329SS..Hα-helixtrans-63.3-39.417822.9-32.8000112.8V30 L36 S37V30-P33 HydrophobicContact CB-CG 4.43Å; V30-P33 VanDerWaalsContact O-CD 3.23Å; V30-P33 WeakPolarHBondContact O-CD 3.42Å; V30-P33 VanDerWaalsContact O-CG 3.29Å; V30-P33 WeakPolarHBondContact O-CG 3.38Å; P33-L36 PolarHBondContact O-N 3.16Å; P33-S37 PolarHBondContact O-N 3.01Å; P33-S37 VanDerWaalsContact O-N 3.08Å
34V94Very high93.1Very high11 Ų1160.9 Ų60.97%0.06734%0.335CS..Hα-helixtrans-64.3-46.5176.6174.40000110.7V30 F31 L32 L36 S37 Y38 L92 I315V30-V34 HydrophobicContact CB-CG2 4.35Å; V30-V34 HydrophobicContact CG2-CG2 4.27Å; V30-V34 WeakPolarHBondContact O-CB 3.43Å; V30-V34 VanDerWaalsContact O-CG2 3.28Å; V30-V34 WeakPolarHBondContact O-CG2 3.16Å; V30-V34 PolarHBondContact O-N 2.84Å; V30-V34 VanDerWaalsContact O-N 3.15Å; F31-V34 PolarHBondContact O-N 3.13Å; L32-V34 PolarHBondContact O-N 3.34Å; V34-L36 VanDerWaalsContact C-N 3.34Å; V34-L36 PolarHBondContact O-N 2.94Å; V34-S37 PolarHBondContact O-N 3.48Å; V34-S37 VanDerWaalsContact O-N 3.13Å; V34-S37 PolarHBondContact O-OG 3.41Å; V34-Y38 HydrophobicContact CG1-CD1 4Å; V34-Y38 HydrophobicContact CG1-CD2 4.12Å; V34-Y38 HydrophobicContact CG1-CE1 3.72Å; V34-Y38 HydrophobicContact CG1-CE2 3.85Å; V34-Y38 HydrophobicContact CG1-CG 4.18Å; V34-Y38 WeakPolarHBondContact O-CB 3.49Å; V34-Y38 WeakPolarHBondContact O-CD1 3.43Å; V34-Y38 PolarHBondContact O-N 2.88Å; V34-L92 HydrophobicContact CB-CD2 3.65Å; V34-L92 HydrophobicContact CG1-CD2 3.62Å; V34-L92 HydrophobicContact CG2-CD2 4.2Å; V34-I315 HydrophobicContact CG2-CG2 4.09Å
35C95.1Very high93.6Very high37 Ų3759.9 Ų59.925%0.2532%0.324CS..Hα-helixtrans-58-43.1178-175.50000112.4F31 L32 Y38 L39 L89F31-C35 HydrophobicContact CE1-CB 4.08Å; F31-C35 HydrophobicContact CE2-CB 4.38Å; F31-C35 HydrophobicContact CZ-CB 3.99Å; F31-C35 WeakPolarHBondContact O-CB 3.18Å; F31-C35 PolarHBondContact O-N 3.43Å; L32-C35 PolarHBondContact O-N 2.95Å; C35-Y38 PolarHBondContact O-N 2.77Å; C35-L39 WeakPolarHBondContact O-CB 3.48Å; C35-L39 PolarHBondContact O-N 2.94Å; C35-L89 HydrophobicContact CB-CD2 4.16Å
36L95.2Very high93.9Very high110 Ų11057.9 Ų57.958%0.57631%0.31SS*.Hα-helixtrans-64.1-42.5176.5-70.1173.7000111.7L32 P33 V34 L39 L40L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.1Å; P33-L36 PolarHBondContact O-N 3.16Å; V34-L36 VanDerWaalsContact C-N 3.34Å; V34-L36 PolarHBondContact O-N 2.94Å; L36-L39 PolarHBondContact O-N 3.35Å; L36-L40 PolarHBondContact O-N 3.07Å
37S95.4Very high94.1Very high36 Ų3660.1 Ų60.125%0.25233%0.326SS..Hα-helixtrans-64-42.5176.5770000112P33 V34 L40 I41P33-S37 PolarHBondContact O-N 3.01Å; P33-S37 VanDerWaalsContact O-N 3.08Å; V34-S37 PolarHBondContact O-N 3.48Å; V34-S37 VanDerWaalsContact O-N 3.13Å; V34-S37 PolarHBondContact O-OG 3.41Å; S37-L40 PolarHBondContact O-N 3Å; S37-I41 VanDerWaalsContact O-CG1 3.32Å; S37-I41 WeakPolarHBondContact O-CG1 3.48Å; S37-I41 PolarHBondContact O-N 3.17Å; S37-I41 VanDerWaalsContact O-N 3.07Å
38Y96Very high94.1Very high5 Ų555.1 Ų55.12%0.0231%0.31CS..Hα-helixtrans-69.1-37.6-179.5-80.419.7000111.3V34 C35 L40 I41 F42 M85 E88 L89 G318 V319 Y322V34-Y38 HydrophobicContact CG1-CD1 4Å; V34-Y38 HydrophobicContact CG1-CD2 4.12Å; V34-Y38 HydrophobicContact CG1-CE1 3.72Å; V34-Y38 HydrophobicContact CG1-CE2 3.85Å; V34-Y38 HydrophobicContact CG1-CG 4.18Å; V34-Y38 WeakPolarHBondContact O-CB 3.49Å; V34-Y38 WeakPolarHBondContact O-CD1 3.43Å; V34-Y38 PolarHBondContact O-N 2.88Å; C35-Y38 PolarHBondContact O-N 2.77Å; Y38-L40 VanDerWaalsContact C-N 3.33Å; Y38-L40 PolarHBondContact O-N 3.01Å; Y38-I41 HydrophobicContact CD1-CD1 4.49Å; Y38-I41 PolarHBondContact O-N 3.25Å; Y38-F42 WeakPolarHBondContact O-CB 3.24Å; Y38-F42 PolarHBondContact O-N 2.87Å; Y38-M85 HydrophobicContact CD2-CE 4.42Å; Y38-M85 HydrophobicContact CD2-CG 3.59Å; Y38-M85 HydrophobicContact CD2-SD 4.23Å; Y38-M85 HydrophobicContact CE2-CG 4.33Å; Y38-M85 HydrophobicContact CG-CE 4.19Å; Y38-M85 HydrophobicContact CG-CG 4.17Å; Y38-M85 HydrophobicContact CG-SD 4.21Å; Y38-E88 PolarHBondContact OH-OE1 3.42Å; Y38-E88 VanDerWaalsContact OH-OE1 3.08Å; Y38-L89 HydrophobicContact CD2-CD1 4.28Å; Y38-L89 HydrophobicContact CD2-CD2 3.67Å; Y38-L89 HydrophobicContact CD2-CG 3.84Å; Y38-L89 HydrophobicContact CE2-CD2 4.32Å; Y38-L89 HydrophobicContact CG-CD2 4.37Å; Y38-G318 VanDerWaalsContact OH-C 3.31Å; Y38-G318 WeakPolarHBondContact OH-CA 3.5Å; Y38-V319 HydrophobicContact CE1-CG2 3.95Å; Y38-Y322 HydrophobicContact CD1-CD2 4.36Å; Y38-Y322 HydrophobicContact CD2-CD2 4.26Å; Y38-Y322 HydrophobicContact CD2-CE2 4.24Å; Y38-Y322 AromaticContact CE1-CD2 3.8Å; Y38-Y322 HydrophobicContact CE1-CD2 3.8Å; Y38-Y322 HydrophobicContact CE1-CE2 4.34Å; Y38-Y322 AromaticContact CE2-CD2 3.67Å; Y38-Y322 HydrophobicContact CE2-CD2 3.67Å; Y38-Y322 AromaticContact CE2-CE2 3.43Å; Y38-Y322 HydrophobicContact CE2-CE2 3.43Å; Y38-Y322 VanDerWaalsContact CE2-CE2 3.43Å; Y38-Y322 AromaticContact CZ-CD2 3.42Å; Y38-Y322 VanDerWaalsContact CZ-CD2 3.42Å; Y38-Y322 AromaticContact CZ-CE2 3.51Å
39L95.9Very high94.4Very high96 Ų9654.2 Ų54.250%0.50330%0.304SS..Hα-helixtrans-58.8-44.6174.1-179.663000111.6C35 L36 F42 L43C35-L39 WeakPolarHBondContact O-CB 3.48Å; C35-L39 PolarHBondContact O-N 2.94Å; L36-L39 PolarHBondContact O-N 3.35Å; L39-F42 PolarHBondContact O-N 2.94Å; L39-L43 HydrophobicContact CD1-CD1 4.43Å; L39-L43 HydrophobicContact CD1-CG 4.4Å; L39-L43 HydrophobicContact CG-CD1 4.35Å; L39-L43 VanDerWaalsContact O-CG 3.28Å; L39-L43 WeakPolarHBondContact O-CG 3.26Å; L39-L43 PolarHBondContact O-N 3.04Å
40L95.4Very high94.7Very high116 Ų11652.7 Ų52.761%0.60729%0.29SS*.Hα-helixtrans-62.8-47.7176.6179.363.6000111.4L36 S37 Y38 F42 L43 V44L36-L40 PolarHBondContact O-N 3.07Å; S37-L40 PolarHBondContact O-N 3Å; Y38-L40 VanDerWaalsContact C-N 3.33Å; Y38-L40 PolarHBondContact O-N 3.01Å; L40-F42 VanDerWaalsContact C-N 3.32Å; L40-F42 PolarHBondContact O-N 3.19Å; L40-L43 PolarHBondContact O-N 3.24Å; L40-V44 HydrophobicContact CD1-CG2 4.36Å; L40-V44 WeakPolarHBondContact O-CG2 3.32Å; L40-V44 PolarHBondContact O-N 2.66Å; L40-V44 VanDerWaalsContact O-N 3.15Å
41I96.6Very high94.7Very high13 Ų1353 Ų537%0.06729%0.29CS..Hα-helixtrans-61.1-42.9178.4-66.9168.2000110.6S37 Y38 G45 L81 M85 V319 Y322 L323 A326S37-I41 VanDerWaalsContact O-CG1 3.32Å; S37-I41 WeakPolarHBondContact O-CG1 3.48Å; S37-I41 PolarHBondContact O-N 3.17Å; S37-I41 VanDerWaalsContact O-N 3.07Å; Y38-I41 HydrophobicContact CD1-CD1 4.49Å; Y38-I41 PolarHBondContact O-N 3.25Å; I41-G45 WeakPolarHBondContact O-CA 3.44Å; I41-G45 PolarHBondContact O-N 3.36Å; I41-L81 HydrophobicContact CG2-CD2 4.21Å; I41-M85 HydrophobicContact CB-CE 4.3Å; I41-M85 HydrophobicContact CG2-CE 4.02Å; I41-V319 HydrophobicContact CD1-CG1 4.29Å; I41-Y322 WeakPolarHBondContact CG2-O 3.42Å; I41-L323 HydrophobicContact CD1-CB 4.34Å; I41-L323 HydrophobicContact CG1-CD1 4.43Å; I41-A326 HydrophobicContact CG2-CB 3.88Å
42F96.9Very high94.7Very high57 Ų5752.1 Ų52.125%0.2529%0.287CS..Hα-helixtrans-59.6-53178-176.8-91.9000111.1Y38 L39 L40 V44 G45 V46 L81 M82 M85Y38-F42 WeakPolarHBondContact O-CB 3.24Å; Y38-F42 PolarHBondContact O-N 2.87Å; L39-F42 PolarHBondContact O-N 2.94Å; L40-F42 VanDerWaalsContact C-N 3.32Å; L40-F42 PolarHBondContact O-N 3.19Å; F42-V44 PolarHBondContact O-N 2.96Å; F42-G45 PolarHBondContact O-N 3.42Å; F42-V46 HydrophobicContact CD1-CG2 4.13Å; F42-V46 HydrophobicContact CD2-CG2 3.89Å; F42-V46 HydrophobicContact CE1-CG2 4.06Å; F42-V46 HydrophobicContact CE2-CG2 3.83Å; F42-V46 HydrophobicContact CG-CG2 4.05Å; F42-V46 HydrophobicContact CZ-CG2 3.93Å; F42-V46 WeakPolarHBondContact O-CB 3.42Å; F42-V46 WeakPolarHBondContact O-CG2 3.04Å; F42-V46 PolarHBondContact O-N 2.84Å; F42-L81 HydrophobicContact CD2-CB 4.42Å; F42-L81 WeakPolarHBondContact CD2-O 3.04Å; F42-L81 VanDerWaalsContact CE2-O 3.26Å; F42-L81 WeakPolarHBondContact CE2-O 3.38Å; F42-M82 HydrophobicContact CE1-CE 4.15Å; F42-M82 HydrophobicContact CE2-CE 3.68Å; F42-M82 HydrophobicContact CE2-SD 4.4Å; F42-M82 HydrophobicContact CZ-CE 3.32Å; F42-M82 HydrophobicContact CZ-SD 4.17Å; F42-M85 HydrophobicContact CB-CE 4.41Å; F42-M85 HydrophobicContact CB-SD 3.76Å; F42-M85 HydrophobicContact CD2-SD 3.94Å; F42-M85 HydrophobicContact CG-SD 4.31Å
43L95.5Very high94.7Very high103 Ų10347.7 Ų47.754%0.53927%0.265SS..Hα-helixtrans-58.1-48.1-178.8-70.5173.3000111.7L39 L40 M47L39-L43 HydrophobicContact CD1-CD1 4.43Å; L39-L43 HydrophobicContact CD1-CG 4.4Å; L39-L43 HydrophobicContact CG-CD1 4.35Å; L39-L43 VanDerWaalsContact O-CG 3.28Å; L39-L43 WeakPolarHBondContact O-CG 3.26Å; L39-L43 PolarHBondContact O-N 3.04Å; L40-L43 PolarHBondContact O-N 3.24Å; L43-M47 WeakPolarHBondContact O-CB 3Å; L43-M47 PolarHBondContact O-N 3.17Å
44V94.3Very high94.6Very high48 Ų4845.8 Ų45.829%0.29125%0.252SS..Hα-helixtrans-68.1-48.1-179.2176.10000111.2L40 F42 G48 A326 I330L40-V44 HydrophobicContact CD1-CG2 4.36Å; L40-V44 WeakPolarHBondContact O-CG2 3.32Å; L40-V44 PolarHBondContact O-N 2.66Å; L40-V44 VanDerWaalsContact O-N 3.15Å; F42-V44 PolarHBondContact O-N 2.96Å; V44-G48 PolarHBondContact O-N 3.47Å; V44-A326 HydrophobicContact CG1-CB 4.44Å; V44-I330 HydrophobicContact CG1-CD1 3.92Å; V44-I330 HydrophobicContact CG1-CG1 4.27Å
45G95.8Very high94.4Very high0 Ų045.3 Ų45.30%025%0.249CC..Hα-helixtrans-69-43-17500000113I41 F42 N49 L81I41-G45 WeakPolarHBondContact O-CA 3.44Å; I41-G45 PolarHBondContact O-N 3.36Å; F42-G45 PolarHBondContact O-N 3.42Å; G45-N49 VanDerWaalsContact O-CB 3.29Å; G45-N49 WeakPolarHBondContact O-CB 3.49Å; G45-N49 PolarHBondContact O-N 3.4Å; G45-N49 PolarHBondContact O-ND2 2.93Å; G45-L81 VanDerWaalsContact C-CD1 3.49Å
46V96.3Very high94.2Very high22 Ų2243.9 Ų43.913%0.13324%0.239CC..Hα-helixtrans-65.5-52.3177.9169.80000110.3F42 G48 N49 V50 L78 L81 M82F42-V46 HydrophobicContact CD1-CG2 4.13Å; F42-V46 HydrophobicContact CD2-CG2 3.89Å; F42-V46 HydrophobicContact CE1-CG2 4.06Å; F42-V46 HydrophobicContact CE2-CG2 3.83Å; F42-V46 HydrophobicContact CG-CG2 4.05Å; F42-V46 HydrophobicContact CZ-CG2 3.93Å; F42-V46 WeakPolarHBondContact O-CB 3.42Å; F42-V46 WeakPolarHBondContact O-CG2 3.04Å; F42-V46 PolarHBondContact O-N 2.84Å; V46-G48 VanDerWaalsContact C-N 3.3Å; V46-G48 PolarHBondContact O-N 2.9Å; V46-N49 PolarHBondContact O-N 3.36Å; V46-V50 HydrophobicContact CG1-CG2 4.15Å; V46-V50 VanDerWaalsContact O-CB 3.32Å; V46-V50 WeakPolarHBondContact O-CB 3.49Å; V46-V50 VanDerWaalsContact O-CG2 3.27Å; V46-V50 WeakPolarHBondContact O-CG2 3.38Å; V46-V50 PolarHBondContact O-N 3.28Å; V46-L78 HydrophobicContact CG1-CD2 4.49Å; V46-L81 HydrophobicContact CG2-CB 4.02Å; V46-L81 HydrophobicContact CG2-CD1 4.2Å; V46-M82 HydrophobicContact CB-CE 3.79Å; V46-M82 HydrophobicContact CG1-CE 3.25Å; V46-M82 HydrophobicContact CG2-CE 3.13Å
47M93.9Very high94Very high132 Ų13241.4 Ų41.465%0.6523%0.234SC*.Hα-helixtrans-56.5-47.6179.2179.5-179.456.600110.8L43 L51L43-M47 WeakPolarHBondContact O-CB 3Å; L43-M47 PolarHBondContact O-N 3.17Å; M47-L51 WeakPolarHBondContact O-CB 3.29Å; M47-L51 PolarHBondContact O-N 2.88Å; M47-L51 VanDerWaalsContact O-N 3.08Å
48G92.9Very high93.7Very high9 Ų948.2 Ų48.29%0.09325%0.254CS..Hα-helixtrans-65.2-42.6-179.100000113.8V44 V46 T52 P329V44-G48 PolarHBondContact O-N 3.47Å; V46-G48 VanDerWaalsContact C-N 3.3Å; V46-G48 PolarHBondContact O-N 2.9Å; G48-T52 WeakPolarHBondContact O-CB 3.38Å; G48-T52 PolarHBondContact O-N 2.75Å; G48-T52 PolarHBondContact O-OG1 3.44Å; G48-P329 VanDerWaalsContact CA-CB 3.48Å
49N95.3Very high93.2Very high1 Ų149.4 Ų49.41%0.00526%0.261CS..Hα-helixtrans-77.4-39.4-178-73.7-59.7000112.4G45 V46 L51 T52 C53 A74 L78 S325 P329G45-N49 VanDerWaalsContact O-CB 3.29Å; G45-N49 WeakPolarHBondContact O-CB 3.49Å; G45-N49 PolarHBondContact O-N 3.4Å; G45-N49 PolarHBondContact O-ND2 2.93Å; V46-N49 PolarHBondContact O-N 3.36Å; N49-L51 VanDerWaalsContact C-N 3.27Å; N49-L51 PolarHBondContact O-N 3.47Å; N49-T52 WeakPolarHBondContact O-CB 3.35Å; N49-T52 PolarHBondContact O-N 2.97Å; N49-T52 VanDerWaalsContact O-N 3.16Å; N49-C53 PolarHBondContact O-N 3.2Å; N49-C53 PolarHBondContact O-SG 2.95Å; N49-A74 HydrophobicContact CB-CB 4.21Å; N49-L78 HydrophobicContact CB-CD1 4.23Å; N49-L78 HydrophobicContact CB-CD2 3.81Å; N49-L78 HydrophobicContact CB-CG 3.7Å; N49-S325 PolarHBondContact ND2-O 3.3Å; N49-P329 HydrophobicContact CB-CG 4.37Å; N49-P329 VanDerWaalsContact OD1-CG 3.31Å; N49-P329 WeakPolarHBondContact OD1-CG 3.3Å
50V94.9Very high92.7Very high68 Ų6852.2 Ų52.241%0.41227%0.269SS..Hα-helixtrans-57.4-44.9171.5168.30000110.4V46 C53 T54 L78V46-V50 HydrophobicContact CG1-CG2 4.15Å; V46-V50 VanDerWaalsContact O-CB 3.32Å; V46-V50 WeakPolarHBondContact O-CB 3.49Å; V46-V50 VanDerWaalsContact O-CG2 3.27Å; V46-V50 WeakPolarHBondContact O-CG2 3.38Å; V46-V50 PolarHBondContact O-N 3.28Å; V50-C53 PolarHBondContact O-N 3.2Å; V50-T54 WeakPolarHBondContact O-CB 3.47Å; V50-T54 PolarHBondContact O-N 3.17Å; V50-T54 PolarHBondContact O-OG1 2.63Å; V50-L78 HydrophobicContact CG2-CD1 4.25Å; V50-L78 HydrophobicContact CG2-CD2 3.77Å
51L91.1Very high92.2Very high35 Ų3551.1 Ų51.118%0.18327%0.267CS..Hα-helixtrans-62.6-44.9176.5173.674.2000111.9M47 N49 C53 T54 V55 F343 V346M47-L51 WeakPolarHBondContact O-CB 3.29Å; M47-L51 PolarHBondContact O-N 2.88Å; M47-L51 VanDerWaalsContact O-N 3.08Å; N49-L51 VanDerWaalsContact C-N 3.27Å; N49-L51 PolarHBondContact O-N 3.47Å; L51-C53 VanDerWaalsContact C-N 3.31Å; L51-C53 PolarHBondContact O-N 3.24Å; L51-T54 PolarHBondContact O-N 3.33Å; L51-T54 VanDerWaalsContact O-N 3.14Å; L51-V55 HydrophobicContact CD1-CG2 4.11Å; L51-V55 HydrophobicContact CG-CG2 4.33Å; L51-V55 WeakPolarHBondContact O-CB 3.12Å; L51-V55 WeakPolarHBondContact O-CG2 3.41Å; L51-V55 PolarHBondContact O-N 3.48Å; L51-F343 HydrophobicContact CD1-CD2 3.48Å; L51-F343 VanDerWaalsContact CD1-CD2 3.48Å; L51-F343 HydrophobicContact CD1-CE2 3.68Å; L51-F343 HydrophobicContact CD2-CD2 3.15Å; L51-F343 HydrophobicContact CD2-CE2 3.13Å; L51-F343 HydrophobicContact CD2-CG 4.21Å; L51-F343 HydrophobicContact CD2-CZ 4.21Å; L51-F343 HydrophobicContact CG-CD2 3.73Å; L51-F343 HydrophobicContact CG-CE2 3.93Å; L51-V346 HydrophobicContact CD1-CG1 4.46Å
52T91.7Very high91.7Very high5 Ų550.6 Ų50.63%0.03126%0.264CS..Hα-helixtrans-56.5-47.9177-64.10000110.6G48 N49 T54 I56 A74 Y332 F339G48-T52 WeakPolarHBondContact O-CB 3.38Å; G48-T52 PolarHBondContact O-N 2.75Å; G48-T52 PolarHBondContact O-OG1 3.44Å; N49-T52 WeakPolarHBondContact O-CB 3.35Å; N49-T52 PolarHBondContact O-N 2.97Å; N49-T52 VanDerWaalsContact O-N 3.16Å; T52-T54 PolarHBondContact O-N 3.45Å; T52-I56 HydrophobicContact CG2-CD1 3.88Å; T52-I56 WeakPolarHBondContact O-CD1 3.48Å; T52-I56 VanDerWaalsContact O-CG1 3.26Å; T52-I56 WeakPolarHBondContact O-CG1 3.49Å; T52-I56 PolarHBondContact O-N 2.7Å; T52-I56 VanDerWaalsContact O-N 3.17Å; T52-A74 HydrophobicContact CG2-CB 4.03Å; T52-Y332 HydrophobicContact CG2-CD2 4.16Å; T52-Y332 HydrophobicContact CG2-CE2 4.21Å; T52-F339 HydrophobicContact CG2-CE1 4.13Å
53C94.1Very high91.4Very high18 Ų1852.1 Ų52.112%0.12227%0.269CS..Hα-helixtrans-58-47.8173.9-70.60000111.8N49 V50 L51 I56 A57 F71N49-C53 PolarHBondContact O-N 3.2Å; N49-C53 PolarHBondContact O-SG 2.95Å; V50-C53 PolarHBondContact O-N 3.2Å; L51-C53 VanDerWaalsContact C-N 3.31Å; L51-C53 PolarHBondContact O-N 3.24Å; C53-I56 PolarHBondContact O-N 2.91Å; C53-A57 VanDerWaalsContact O-CB 3.26Å; C53-A57 WeakPolarHBondContact O-CB 3.29Å; C53-A57 PolarHBondContact O-N 3.05Å; C53-F71 HydrophobicContact CB-CD2 4.15Å; C53-F71 HydrophobicContact CB-CE2 3.7Å; C53-F71 HydrophobicContact CB-CZ 4.43Å
54T90.9Very high91.1Very high39 Ų3949.2 Ų49.224%0.23926%0.255CS..Hα-helixtrans-62-47.3-178.4-59.70000112.3V50 L51 T52 I56 A57 R58 V346V50-T54 WeakPolarHBondContact O-CB 3.47Å; V50-T54 PolarHBondContact O-N 3.17Å; V50-T54 PolarHBondContact O-OG1 2.63Å; L51-T54 PolarHBondContact O-N 3.33Å; L51-T54 VanDerWaalsContact O-N 3.14Å; T52-T54 PolarHBondContact O-N 3.45Å; T54-I56 VanDerWaalsContact C-N 3.32Å; T54-I56 PolarHBondContact O-N 3.45Å; T54-A57 PolarHBondContact O-N 3Å; T54-R58 HydrophobicContact CG2-CG 4.31Å; T54-R58 WeakPolarHBondContact O-CB 3.2Å; T54-R58 WeakPolarHBondContact O-CG 3.42Å; T54-R58 PolarHBondContact O-N 3.24Å; T54-V346 HydrophobicContact CG2-CG1 4.26Å
55V89.6Confident90.9Very high1 Ų147.9 Ų47.91%0.00625%0.247CC..Hα-helixtrans-60.9-42.1179.4164.60000110.9L51 N59 M62 F339 M342 V346L51-V55 HydrophobicContact CD1-CG2 4.11Å; L51-V55 HydrophobicContact CG-CG2 4.33Å; L51-V55 WeakPolarHBondContact O-CB 3.12Å; L51-V55 WeakPolarHBondContact O-CG2 3.41Å; L51-V55 PolarHBondContact O-N 3.48Å; V55-N59 WeakPolarHBondContact O-CB 3.37Å; V55-N59 PolarHBondContact O-N 3.03Å; V55-N59 PolarHBondContact O-ND2 3.46Å; V55-M62 HydrophobicContact CG1-CE 4.12Å; V55-M62 HydrophobicContact CG1-CG 4.36Å; V55-F339 HydrophobicContact CG1-CD1 4.27Å; V55-F339 HydrophobicContact CG1-CE1 4.36Å; V55-M342 HydrophobicContact CG1-CB 3.59Å; V55-M342 HydrophobicContact CG1-CG 4.37Å; V55-V346 HydrophobicContact CG2-CG2 4.03Å
56I90.6Very high90.6Very high8 Ų848.2 Ų48.24%0.04125%0.25CC..Hα-helixtrans-72.6-41.2-179.7-63.3165.3000110.9T52 C53 T54 W63 N67 L70 F71 F339T52-I56 HydrophobicContact CG2-CD1 3.88Å; T52-I56 WeakPolarHBondContact O-CD1 3.48Å; T52-I56 VanDerWaalsContact O-CG1 3.26Å; T52-I56 WeakPolarHBondContact O-CG1 3.49Å; T52-I56 PolarHBondContact O-N 2.7Å; T52-I56 VanDerWaalsContact O-N 3.17Å; C53-I56 PolarHBondContact O-N 2.91Å; T54-I56 VanDerWaalsContact C-N 3.32Å; T54-I56 PolarHBondContact O-N 3.45Å; I56-W63 VanDerWaalsContact O-CD1 3.28Å; I56-W63 PolarHBondContact O-NE1 3.35Å; I56-W63 VanDerWaalsContact O-NE1 3.07Å; I56-N67 HydrophobicContact CD1-CB 4.38Å; I56-N67 HydrophobicContact CG1-CB 4.39Å; I56-N67 HydrophobicContact CG2-CB 4.29Å; I56-L70 HydrophobicContact CD1-CB 4.33Å; I56-F71 HydrophobicContact CB-CD2 4.14Å; I56-F71 HydrophobicContact CD1-CB 4Å; I56-F71 HydrophobicContact CD1-CD2 4.46Å; I56-F71 HydrophobicContact CG2-CB 4.32Å; I56-F71 HydrophobicContact CG2-CD2 4.14Å; I56-F339 HydrophobicContact CD1-CE1 4.26Å; I56-F339 HydrophobicContact CD1-CZ 4Å; I56-F339 HydrophobicContact CG1-CE1 4.16Å; I56-F339 HydrophobicContact CG1-CZ 4.07Å
57A91.3Very high90.4Very high57 Ų5747.8 Ų47.847%0.47125%0.246SC..Hα-helixtrans-67-45.4-178.300000112.4C53 T54C53-A57 VanDerWaalsContact O-CB 3.26Å; C53-A57 WeakPolarHBondContact O-CB 3.29Å; C53-A57 PolarHBondContact O-N 3.05Å; T54-A57 PolarHBondContact O-N 3Å
58R88.8Confident90.4Very high180 Ų18044 Ų4468%0.67923%0.225SC*.Hα-helixtrans-75.6-28.1-175.1-69.2-172.2176.4-172.9-0.2113.8T54T54-R58 HydrophobicContact CG2-CG 4.31Å; T54-R58 WeakPolarHBondContact O-CB 3.2Å; T54-R58 WeakPolarHBondContact O-CG 3.42Å; T54-R58 PolarHBondContact O-N 3.24Å
59N85.3Confident90.4Very high29 Ų2944 Ų4416%0.15522%0.222CC..  trans-107.2105.7-170.3-61.6-69.5000111.8V55 V61 M62 M342V55-N59 WeakPolarHBondContact O-CB 3.37Å; V55-N59 PolarHBondContact O-N 3.03Å; V55-N59 PolarHBondContact O-ND2 3.46Å; N59-V61 PolarHBondContact O-N 3.42Å; N59-V61 VanDerWaalsContact O-N 3.08Å; N59-M62 HydrophobicContact CB-CB 4.26Å; N59-M62 HydrophobicContact CB-CG 3.86Å; N59-M62 WeakPolarHBondContact O-CA 3.5Å; N59-M62 VanDerWaalsContact O-CB 3.3Å; N59-M62 WeakPolarHBondContact O-CB 3.38Å; N59-M62 PolarHBondContact O-N 3.05Å; N59-M342 HydrophobicContact CB-CE 3.99Å; N59-M342 WeakPolarHBondContact ND2-CE 3.38Å; N59-M342 WeakPolarHBondContact OD1-CE 3.47Å
60K85.8Confident90.2Very high156 Ų15644 Ų4468%0.67822%0.223SC*.G310 helixtrans-55.1-31.8177.3-66.6-175.3-179.9176.70113.1M62 W63K60-M62 PolarHBondContact O-N 2.87Å; K60-W63 HydrophobicContact CB-CD2 4.44Å; K60-W63 HydrophobicContact CB-CE3 4.41Å; K60-W63 HydrophobicContact CD-CZ3 4.47Å; K60-W63 HydrophobicContact CG-CD2 4.45Å; K60-W63 HydrophobicContact CG-CE3 4.27Å; K60-W63 HydrophobicContact CG-CH2 3.93Å; K60-W63 HydrophobicContact CG-CZ2 4.09Å; K60-W63 HydrophobicContact CG-CZ3 4.01Å; K60-W63 WeakPolarHBondContact O-CB 3.42Å; K60-W63 PolarHBondContact O-N 3.32Å
61V85.6Confident90.2Very high93 Ų9344.4 Ų44.456%0.56422%0.219SC*.G310 helixtrans-59.4-30.5174.4172.90000111N59 W63 R338N59-V61 PolarHBondContact O-N 3.42Å; N59-V61 VanDerWaalsContact O-N 3.08Å; V61-W63 VanDerWaalsContact C-N 3.31Å; V61-W63 PolarHBondContact O-N 2.74Å; V61-R338 PolarHBondContact O-NH2 3.05Å
62M85.4Confident90.4Very high1 Ų143 Ų431%0.00521%0.212CC..G310 helixtrans-81.8-2.3177.3-64-63.7-81.600113.6V55 N59 K60 T64 N67 R338 F339 M342V55-M62 HydrophobicContact CG1-CE 4.12Å; V55-M62 HydrophobicContact CG1-CG 4.36Å; N59-M62 HydrophobicContact CB-CB 4.26Å; N59-M62 HydrophobicContact CB-CG 3.86Å; N59-M62 WeakPolarHBondContact O-CA 3.5Å; N59-M62 VanDerWaalsContact O-CB 3.3Å; N59-M62 WeakPolarHBondContact O-CB 3.38Å; N59-M62 PolarHBondContact O-N 3.05Å; K60-M62 PolarHBondContact O-N 2.87Å; M62-T64 PolarHBondContact O-N 2.98Å; M62-N67 WeakPolarHBondContact CE-ND2 3.41Å; M62-N67 WeakPolarHBondContact O-CB 3.36Å; M62-N67 PolarHBondContact O-ND2 2.86Å; M62-R338 HydrophobicContact SD-CG 3.86Å; M62-R338 PolarHBondContact SD-NE 2.88Å; M62-F339 HydrophobicContact CE-CD1 4.03Å; M62-F339 HydrophobicContact CE-CD2 3.73Å; M62-F339 HydrophobicContact CE-CE1 3.82Å; M62-F339 HydrophobicContact CE-CE2 3.51Å; M62-F339 HydrophobicContact CE-CG 3.99Å; M62-F339 HydrophobicContact CE-CZ 3.56Å; M62-M342 HydrophobicContact CG-CG 4.13Å; M62-M342 HydrophobicContact SD-CG 4.09Å
63W90Very high90.5Very high90 Ų9042.9 Ų42.934%0.34121%0.211SC..  trans-78.272.7178.1-61.8-5.8000111.6I56 K60 V61 Y68 R146I56-W63 VanDerWaalsContact O-CD1 3.28Å; I56-W63 PolarHBondContact O-NE1 3.35Å; I56-W63 VanDerWaalsContact O-NE1 3.07Å; K60-W63 HydrophobicContact CB-CD2 4.44Å; K60-W63 HydrophobicContact CB-CE3 4.41Å; K60-W63 HydrophobicContact CD-CZ3 4.47Å; K60-W63 HydrophobicContact CG-CD2 4.45Å; K60-W63 HydrophobicContact CG-CE3 4.27Å; K60-W63 HydrophobicContact CG-CH2 3.93Å; K60-W63 HydrophobicContact CG-CZ2 4.09Å; K60-W63 HydrophobicContact CG-CZ3 4.01Å; K60-W63 WeakPolarHBondContact O-CB 3.42Å; K60-W63 PolarHBondContact O-N 3.32Å; V61-W63 VanDerWaalsContact C-N 3.31Å; V61-W63 PolarHBondContact O-N 2.74Å; W63-Y68 HydrophobicContact CB-CE2 4.45Å; W63-R146 VanDerWaalsContact O-CZ 3.22Å; W63-R146 PolarHBondContact O-NE 3.38Å; W63-R146 PolarHBondContact O-NH2 3.45Å
64T89.9Confident90.5Very high41 Ų4142 Ų4225%0.25221%0.205SC..  trans-113.7151.9174.365.90000109.5M62 T66 N67 Y68M62-T64 PolarHBondContact O-N 2.98Å; T64-T66 PolarHBondContact O-N 3.19Å; T64-N67 PolarHBondContact O-N 3.11Å; T64-N67 VanDerWaalsContact OG1-CG 3.25Å; T64-N67 PolarHBondContact OG1-ND2 3.33Å; T64-Y68 WeakPolarHBondContact O-CD2 3.43Å; T64-Y68 PolarHBondContact O-N 3.07Å
65P89.6Confident90.8Very high21 Ų2142.3 Ų42.314%0.13621%0.207CC..Hα-helixtrans-50.1-43.8-179.4-29.437000113.2N67 Y68 Y69 V144 R146 A149P65-N67 PolarHBondContact O-N 3.13Å; P65-Y68 WeakPolarHBondContact O-CB 3.3Å; P65-Y68 PolarHBondContact O-N 2.84Å; P65-Y69 WeakPolarHBondContact O-CD2 3.43Å; P65-Y69 PolarHBondContact O-N 2.97Å; P65-V144 HydrophobicContact CB-CG1 3.86Å; P65-V144 HydrophobicContact CG-CG1 3.97Å; P65-V144 WeakPolarHBondContact CG-O 3.36Å; P65-R146 HydrophobicContact CG-CG 4.45Å; P65-A149 HydrophobicContact CB-CB 4.07Å
66T89.4Confident91.1Very high7 Ų742.3 Ų42.34%0.04321%0.207CC..Hα-helixtrans-59-46.1175.7-45.40000113T64 Y68 Y69 L70 L126 E129 R130T64-T66 PolarHBondContact O-N 3.19Å; T66-Y68 PolarHBondContact O-N 3.33Å; T66-Y69 WeakPolarHBondContact O-CB 3.13Å; T66-Y69 PolarHBondContact O-N 2.89Å; T66-L70 HydrophobicContact CG2-CG 4.45Å; T66-L70 PolarHBondContact O-N 2.96Å; T66-L126 HydrophobicContact CG2-CD1 3.44Å; T66-L126 VanDerWaalsContact CG2-CD1 3.44Å; T66-E129 WeakPolarHBondContact CB-OE2 3.29Å; T66-E129 PolarHBondContact OG1-OE1 2.99Å; T66-E129 PolarHBondContact OG1-OE2 3.26Å; T66-R130 PolarHBondContact OG1-NH1 3.46Å; T66-R130 PolarHBondContact OG1-NH2 2.99Å
67N91.6Very high91.3Very high13 Ų1342 Ų427%0.0721%0.205CC..Hα-helixtrans-68.3-22.6-177.5-69-8.8000111.7I56 M62 T64 P65 L70 F71I56-N67 HydrophobicContact CD1-CB 4.38Å; I56-N67 HydrophobicContact CG1-CB 4.39Å; I56-N67 HydrophobicContact CG2-CB 4.29Å; M62-N67 WeakPolarHBondContact CE-ND2 3.41Å; M62-N67 WeakPolarHBondContact O-CB 3.36Å; M62-N67 PolarHBondContact O-ND2 2.86Å; T64-N67 PolarHBondContact O-N 3.11Å; T64-N67 VanDerWaalsContact OG1-CG 3.25Å; T64-N67 PolarHBondContact OG1-ND2 3.33Å; P65-N67 PolarHBondContact O-N 3.13Å; N67-L70 PolarHBondContact O-N 3.46Å; N67-F71 VanDerWaalsContact O-CB 3.29Å; N67-F71 WeakPolarHBondContact O-CB 3.42Å; N67-F71 PolarHBondContact O-N 2.84Å
68Y94.2Very high91.6Very high51 Ų5140.7 Ų40.720%0.219%0.191CC..Hα-helixtrans-65-40.6168.1-80.9-83.1000111.9W63 T64 P65 T66 F71 S72 R146 K150 I153W63-Y68 HydrophobicContact CB-CE2 4.45Å; T64-Y68 WeakPolarHBondContact O-CD2 3.43Å; T64-Y68 PolarHBondContact O-N 3.07Å; P65-Y68 WeakPolarHBondContact O-CB 3.3Å; P65-Y68 PolarHBondContact O-N 2.84Å; T66-Y68 PolarHBondContact O-N 3.33Å; Y68-F71 PolarHBondContact O-N 3.3Å; Y68-S72 WeakPolarHBondContact O-CB 3.34Å; Y68-S72 PolarHBondContact O-N 3.41Å; Y68-R146 HydrophobicContact CE2-CB 4.24Å; Y68-R146 HydrophobicContact CE2-CG 4.13Å; Y68-K150 HydrophobicContact CD1-CG 4.33Å; Y68-K150 VanDerWaalsContact CE1-CE 3.47Å; Y68-K150 HydrophobicContact CE1-CG 4.26Å; Y68-K150 WeakPolarHBondContact OH-CE 3.44Å; Y68-I153 WeakPolarHBondContact O-CD1 3.47Å
69Y93.2Very high92Very high9 Ų934.6 Ų34.64%0.03517%0.171CC..Hα-helixtrans-66.6-41.1173.8-62.9-71.2000111.9P65 T66 F71 S72 L73 A125 E129 A149 V152 I153P65-Y69 WeakPolarHBondContact O-CD2 3.43Å; P65-Y69 PolarHBondContact O-N 2.97Å; T66-Y69 WeakPolarHBondContact O-CB 3.13Å; T66-Y69 PolarHBondContact O-N 2.89Å; Y69-F71 VanDerWaalsContact C-N 3.3Å; Y69-F71 PolarHBondContact O-N 3.16Å; Y69-S72 WeakPolarHBondContact O-CB 3.48Å; Y69-S72 PolarHBondContact O-N 3.46Å; Y69-L73 WeakPolarHBondContact O-CB 3.45Å; Y69-L73 PolarHBondContact O-N 2.83Å; Y69-A125 HydrophobicContact CD1-CB 4.16Å; Y69-A125 HydrophobicContact CE1-CB 3.84Å; Y69-E129 HydrophobicContact CE2-CB 4.02Å; Y69-E129 HydrophobicContact CE2-CG 4.05Å; Y69-A149 HydrophobicContact CE2-CB 3.94Å; Y69-V152 HydrophobicContact CE1-CB 4.11Å; Y69-V152 HydrophobicContact CE1-CG1 3.78Å; Y69-I153 HydrophobicContact CD1-CD1 4.19Å; Y69-I153 HydrophobicContact CD1-CG1 3.85Å; Y69-I153 HydrophobicContact CE1-CG1 3.99Å
70L91.6Very high92.4Very high2 Ų233.4 Ų33.41%0.0117%0.165CC..Hα-helixtrans-63.2-37.6175.3-59.8-178.2000111.9I56 T66 N67 A74 L126 Y332 F339I56-L70 HydrophobicContact CD1-CB 4.33Å; T66-L70 HydrophobicContact CG2-CG 4.45Å; T66-L70 PolarHBondContact O-N 2.96Å; N67-L70 PolarHBondContact O-N 3.46Å; L70-A74 WeakPolarHBondContact O-CB 3.4Å; L70-A74 PolarHBondContact O-N 2.78Å; L70-L126 HydrophobicContact CD2-CD2 3.68Å; L70-Y332 HydrophobicContact CD2-CE1 3.75Å; L70-Y332 HydrophobicContact CD2-CE2 4.46Å; L70-Y332 WeakPolarHBondContact CD2-OH 3.35Å; L70-F339 HydrophobicContact CD1-CE2 3.74Å; L70-F339 HydrophobicContact CD1-CZ 3.88Å
71F94.4Very high93Very high76 Ų7626 Ų2633%0.33313%0.133SC..Hα-helixtrans-64.9-46.3173.6-174.8-84.9000111.4C53 I56 N67 Y68 Y69 L73 A74 V75C53-F71 HydrophobicContact CB-CD2 4.15Å; C53-F71 HydrophobicContact CB-CE2 3.7Å; C53-F71 HydrophobicContact CB-CZ 4.43Å; I56-F71 HydrophobicContact CB-CD2 4.14Å; I56-F71 HydrophobicContact CD1-CB 4Å; I56-F71 HydrophobicContact CD1-CD2 4.46Å; I56-F71 HydrophobicContact CG2-CB 4.32Å; I56-F71 HydrophobicContact CG2-CD2 4.14Å; N67-F71 VanDerWaalsContact O-CB 3.29Å; N67-F71 WeakPolarHBondContact O-CB 3.42Å; N67-F71 PolarHBondContact O-N 2.84Å; Y68-F71 PolarHBondContact O-N 3.3Å; Y69-F71 VanDerWaalsContact C-N 3.3Å; Y69-F71 PolarHBondContact O-N 3.16Å; F71-L73 VanDerWaalsContact C-N 3.31Å; F71-L73 PolarHBondContact O-N 2.93Å; F71-A74 PolarHBondContact O-N 3.21Å; F71-V75 HydrophobicContact CD1-CG2 4.1Å; F71-V75 HydrophobicContact CE1-CG2 3.77Å; F71-V75 HydrophobicContact CZ-CG2 4.35Å; F71-V75 WeakPolarHBondContact O-CG2 3.47Å; F71-V75 PolarHBondContact O-N 3.34Å
72S96Very high93.5Very high6 Ų625.3 Ų25.34%0.04212%0.124CC..Hα-helixtrans-58-43.2176.2-175.80000111.9Y68 Y69 V75 S76 N122 I153 W157Y68-S72 WeakPolarHBondContact O-CB 3.34Å; Y68-S72 PolarHBondContact O-N 3.41Å; Y69-S72 WeakPolarHBondContact O-CB 3.48Å; Y69-S72 PolarHBondContact O-N 3.46Å; S72-V75 PolarHBondContact O-N 3.07Å; S72-S76 PolarHBondContact O-N 3.31Å; S72-S76 VanDerWaalsContact O-N 3.11Å; S72-N122 WeakPolarHBondContact CB-OD1 3.22Å; S72-N122 PolarHBondContact OG-ND2 3.4Å; S72-N122 PolarHBondContact OG-OD1 3.35Å; S72-I153 WeakPolarHBondContact OG-CG2 3.49Å; S72-W157 PolarHBondContact OG-NE1 3.32Å; S72-W157 VanDerWaalsContact OG-NE1 3.08Å
73L93.2Very high94Very high2 Ų228.7 Ų28.71%0.0114%0.142CC..Hα-helixtrans-65.9-42.5176.4-174.161.6000112.2Y69 F71 V75 S76 D77 N122 V123 Y332Y69-L73 WeakPolarHBondContact O-CB 3.45Å; Y69-L73 PolarHBondContact O-N 2.83Å; F71-L73 VanDerWaalsContact C-N 3.31Å; F71-L73 PolarHBondContact O-N 2.93Å; L73-V75 PolarHBondContact O-N 3.04Å; L73-S76 PolarHBondContact O-N 3.34Å; L73-S76 PolarHBondContact O-OG 3.2Å; L73-D77 WeakPolarHBondContact O-CB 3.38Å; L73-D77 PolarHBondContact O-N 3.26Å; L73-N122 HydrophobicContact CB-CB 4.43Å; L73-N122 HydrophobicContact CD1-CB 4.26Å; L73-V123 HydrophobicContact CD1-CG2 4.12Å; L73-V123 HydrophobicContact CD2-CG2 3.98Å; L73-Y332 WeakPolarHBondContact CD2-OH 3.26Å
74A94.8Very high94.2Very high0 Ų024.4 Ų24.40%013%0.126CC..Hα-helixtrans-62.7-32.5175.300000112.3N49 T52 L70 F71 L78N49-A74 HydrophobicContact CB-CB 4.21Å; T52-A74 HydrophobicContact CG2-CB 4.03Å; L70-A74 WeakPolarHBondContact O-CB 3.4Å; L70-A74 PolarHBondContact O-N 2.78Å; F71-A74 PolarHBondContact O-N 3.21Å; A74-L78 WeakPolarHBondContact O-CB 3.34Å; A74-L78 WeakPolarHBondContact O-CG 3.4Å; A74-L78 PolarHBondContact O-N 3.4Å
75V96.3Very high94.5Very high46 Ų4622.6 Ų22.628%0.27911%0.114SC..Hα-helixtrans-68.4-44.6173.8171.50000111.5F71 S72 L73 D77 L78 L79 W157F71-V75 HydrophobicContact CD1-CG2 4.1Å; F71-V75 HydrophobicContact CE1-CG2 3.77Å; F71-V75 HydrophobicContact CZ-CG2 4.35Å; F71-V75 WeakPolarHBondContact O-CG2 3.47Å; F71-V75 PolarHBondContact O-N 3.34Å; S72-V75 PolarHBondContact O-N 3.07Å; L73-V75 PolarHBondContact O-N 3.04Å; V75-D77 VanDerWaalsContact C-N 3.34Å; V75-L78 PolarHBondContact O-N 2.88Å; V75-L79 HydrophobicContact CG1-CD1 4.49Å; V75-L79 WeakPolarHBondContact O-CG 3.26Å; V75-L79 PolarHBondContact O-N 3.14Å; V75-W157 HydrophobicContact CG1-CH2 4.2Å; V75-W157 HydrophobicContact CG1-CZ2 4.1Å
76S95.9Very high94.7Very high0 Ų024.5 Ų24.50%013%0.127CC..Hα-helixtrans-64.4-40.1176.559.10000111.9S72 L73 L78 L79 V80 S119S72-S76 PolarHBondContact O-N 3.31Å; S72-S76 VanDerWaalsContact O-N 3.11Å; L73-S76 PolarHBondContact O-N 3.34Å; L73-S76 PolarHBondContact O-OG 3.2Å; S76-L78 PolarHBondContact O-N 2.83Å; S76-L79 PolarHBondContact O-N 3.48Å; S76-V80 PolarHBondContact O-N 3.12Å; S76-S119 WeakPolarHBondContact CB-OG 3.17Å; S76-S119 PolarHBondContact OG-OG 3.27Å
77D95.3Very high94.9Very high2 Ų225.5 Ų25.51%0.01113%0.132CC..Hα-helixtrans-61.4-41.7174.2-75-23.5000112.3L73 V75 V80 L81 S325 N328L73-D77 WeakPolarHBondContact O-CB 3.38Å; L73-D77 PolarHBondContact O-N 3.26Å; V75-D77 VanDerWaalsContact C-N 3.34Å; D77-V80 PolarHBondContact O-N 3.09Å; D77-L81 VanDerWaalsContact O-CG 3.27Å; D77-L81 WeakPolarHBondContact O-CG 3.5Å; D77-L81 PolarHBondContact O-N 3.42Å; D77-S325 WeakPolarHBondContact OD1-CA 3.33Å; D77-S325 VanDerWaalsContact OD1-CB 3.31Å; D77-S325 WeakPolarHBondContact OD1-CB 3.28Å; D77-S325 PolarHBondContact OD1-OG 3.04Å; D77-N328 PolarHBondContact OD2-ND2 2.79Å
78L97.1Very high95Very high30 Ų3026.9 Ų26.916%0.15714%0.138CC..Hα-helixtrans-64.9-38.9175.6-74.9168.1000112.4V46 N49 V50 A74 V75 S76 L81 M82V46-L78 HydrophobicContact CG1-CD2 4.49Å; N49-L78 HydrophobicContact CB-CD1 4.23Å; N49-L78 HydrophobicContact CB-CD2 3.81Å; N49-L78 HydrophobicContact CB-CG 3.7Å; V50-L78 HydrophobicContact CG2-CD1 4.25Å; V50-L78 HydrophobicContact CG2-CD2 3.77Å; A74-L78 WeakPolarHBondContact O-CB 3.34Å; A74-L78 WeakPolarHBondContact O-CG 3.4Å; A74-L78 PolarHBondContact O-N 3.4Å; V75-L78 PolarHBondContact O-N 2.88Å; S76-L78 PolarHBondContact O-N 2.83Å; L78-L81 PolarHBondContact O-N 2.79Å; L78-M82 WeakPolarHBondContact O-CB 3.36Å; L78-M82 VanDerWaalsContact O-CG 3.27Å; L78-M82 WeakPolarHBondContact O-CG 3.47Å; L78-M82 PolarHBondContact O-N 3.41Å
79L96.9Very high95Very high52 Ų5226 Ų2627%0.27214%0.136SC..Hα-helixtrans-63.6-43176-69.2172.8000111.4V75 S76 L83 G84 V115 W157V75-L79 HydrophobicContact CG1-CD1 4.49Å; V75-L79 WeakPolarHBondContact O-CG 3.26Å; V75-L79 PolarHBondContact O-N 3.14Å; S76-L79 PolarHBondContact O-N 3.48Å; L79-L83 HydrophobicContact CD2-CD1 3.88Å; L79-L83 WeakPolarHBondContact O-CB 3.37Å; L79-L83 PolarHBondContact O-N 3.06Å; L79-G84 PolarHBondContact O-N 3.49Å; L79-V115 HydrophobicContact CB-CG1 3.75Å; L79-V115 HydrophobicContact CD1-CG1 4.08Å; L79-W157 HydrophobicContact CD1-CH2 3.78Å; L79-W157 HydrophobicContact CD1-CZ3 4.01Å
80V95.1Very high95Very high4 Ų428.2 Ų28.22%0.02415%0.145CC..Iπ-helixtrans-58.7-48.8174.6166.90000111.2S76 D77 G84 M85 V115 F321 Y322S76-V80 PolarHBondContact O-N 3.12Å; D77-V80 PolarHBondContact O-N 3.09Å; V80-G84 CarbonylContact O-C 3.25Å; V80-G84 WeakPolarHBondContact O-CA 3.39Å; V80-G84 PolarHBondContact O-N 3.49Å; V80-M85 PolarHBondContact O-N 3.43Å; V80-V115 HydrophobicContact CB-CG2 4.5Å; V80-V115 HydrophobicContact CG2-CB 3.73Å; V80-V115 HydrophobicContact CG2-CG2 3.19Å; V80-F321 HydrophobicContact CG1-CD1 4.5Å; V80-F321 HydrophobicContact CG1-CE1 3.76Å; V80-F321 HydrophobicContact CG1-CZ 4.34Å; V80-F321 HydrophobicContact CG2-CZ 4.41Å; V80-Y322 HydrophobicContact CG1-CD1 3.52Å; V80-Y322 HydrophobicContact CG1-CE1 3.55Å
81L96.9Very high95Very high0 Ų029.9 Ų29.90%015%0.153CC..Iπ-helixtrans-73.9-40.3-175.2-65.5172.9000112.8I41 F42 G45 V46 D77 L78 M85 Y322I41-L81 HydrophobicContact CG2-CD2 4.21Å; F42-L81 HydrophobicContact CD2-CB 4.42Å; F42-L81 WeakPolarHBondContact CD2-O 3.04Å; F42-L81 VanDerWaalsContact CE2-O 3.26Å; F42-L81 WeakPolarHBondContact CE2-O 3.38Å; G45-L81 VanDerWaalsContact C-CD1 3.49Å; V46-L81 HydrophobicContact CG2-CB 4.02Å; V46-L81 HydrophobicContact CG2-CD1 4.2Å; D77-L81 VanDerWaalsContact O-CG 3.27Å; D77-L81 WeakPolarHBondContact O-CG 3.5Å; D77-L81 PolarHBondContact O-N 3.42Å; L78-L81 PolarHBondContact O-N 2.79Å; L81-M85 HydrophobicContact CD2-CE 3.64Å; L81-Y322 HydrophobicContact CD2-CD1 4.26Å
82M96.6Very high94.9Very high79 Ų7928 Ų2839%0.38915%0.146SC..Iπ-helixtrans-80-33.5-176.1-73.1-77.4136.800113.5F42 V46 L78 P86F42-M82 HydrophobicContact CE1-CE 4.15Å; F42-M82 HydrophobicContact CE2-CE 3.68Å; F42-M82 HydrophobicContact CE2-SD 4.4Å; F42-M82 HydrophobicContact CZ-CE 3.32Å; F42-M82 HydrophobicContact CZ-SD 4.17Å; V46-M82 HydrophobicContact CB-CE 3.79Å; V46-M82 HydrophobicContact CG1-CE 3.25Å; V46-M82 HydrophobicContact CG2-CE 3.13Å; L78-M82 WeakPolarHBondContact O-CB 3.36Å; L78-M82 VanDerWaalsContact O-CG 3.27Å; L78-M82 WeakPolarHBondContact O-CG 3.47Å; L78-M82 PolarHBondContact O-N 3.41Å; M82-P86 WeakPolarHBondContact O-CG 3.42Å
83L95.8Very high94.7Very high71 Ų7133.7 Ų33.737%0.37217%0.166SC..Iπ-helixtrans-115.2-43.8-172.6-56.4177.8000111.8L79 L87 L111L79-L83 HydrophobicContact CD2-CD1 3.88Å; L79-L83 WeakPolarHBondContact O-CB 3.37Å; L79-L83 PolarHBondContact O-N 3.06Å; L83-L87 VanDerWaalsContact O-CD1 3.31Å; L83-L87 WeakPolarHBondContact O-CD1 3.44Å; L83-L87 VanDerWaalsContact O-CG 3.24Å; L83-L87 WeakPolarHBondContact O-CG 3.49Å; L83-L111 HydrophobicContact CB-CD2 3.45Å; L83-L111 VanDerWaalsContact CB-CD2 3.45Å; L83-L111 HydrophobicContact CD1-CD1 4.23Å; L83-L111 HydrophobicContact CD1-CD2 4.37Å
84G94.3Very high94.7Very high0 Ų035.6 Ų35.60%018%0.175CC..Iπ-helixtrans-67.7-56.7-179.700000112.5L79 V80 L87 E88 F112L79-G84 PolarHBondContact O-N 3.49Å; V80-G84 CarbonylContact O-C 3.25Å; V80-G84 WeakPolarHBondContact O-CA 3.39Å; V80-G84 PolarHBondContact O-N 3.49Å; G84-L87 WeakPolarHBondContact O-CB 3.27Å; G84-L87 PolarHBondContact O-N 3.14Å; G84-E88 PolarHBondContact O-N 2.89Å; G84-E88 VanDerWaalsContact O-N 3.08Å; G84-F112 VanDerWaalsContact C-CZ 3.46Å; G84-F112 VanDerWaalsContact CA-CZ 3.41Å; G84-F112 VanDerWaalsContact O-CZ 3.25Å; G84-F112 WeakPolarHBondContact O-CZ 3.43Å
85M95.5Very high94.4Very high4 Ų438.3 Ų38.32%0.0219%0.19CC..Hα-helixtrans-57.4-44.1-174.6-176-171.9-77.100114Y38 I41 F42 V80 L81 L87 E88 L89 Y322Y38-M85 HydrophobicContact CD2-CE 4.42Å; Y38-M85 HydrophobicContact CD2-CG 3.59Å; Y38-M85 HydrophobicContact CD2-SD 4.23Å; Y38-M85 HydrophobicContact CE2-CG 4.33Å; Y38-M85 HydrophobicContact CG-CE 4.19Å; Y38-M85 HydrophobicContact CG-CG 4.17Å; Y38-M85 HydrophobicContact CG-SD 4.21Å; I41-M85 HydrophobicContact CB-CE 4.3Å; I41-M85 HydrophobicContact CG2-CE 4.02Å; F42-M85 HydrophobicContact CB-CE 4.41Å; F42-M85 HydrophobicContact CB-SD 3.76Å; F42-M85 HydrophobicContact CD2-SD 3.94Å; F42-M85 HydrophobicContact CG-SD 4.31Å; V80-M85 PolarHBondContact O-N 3.43Å; L81-M85 HydrophobicContact CD2-CE 3.64Å; M85-L87 VanDerWaalsContact C-N 3.32Å; M85-L87 PolarHBondContact O-N 3.47Å; M85-E88 PolarHBondContact O-N 3.32Å; M85-L89 HydrophobicContact CG-CD1 4.29Å; M85-L89 WeakPolarHBondContact O-CG 3.43Å; M85-L89 PolarHBondContact O-N 3.42Å; M85-Y322 WeakPolarHBondContact CA-OH 3.37Å; M85-Y322 HydrophobicContact CB-CD1 4.12Å; M85-Y322 HydrophobicContact CB-CE1 3.64Å; M85-Y322 HydrophobicContact CE-CD1 3.74Å; M85-Y322 HydrophobicContact CE-CD2 4.18Å; M85-Y322 HydrophobicContact CE-CE1 4.41Å; M85-Y322 HydrophobicContact CE-CG 3.62Å; M85-Y322 HydrophobicContact CG-CE1 4.35Å; M85-Y322 PolarHBondContact N-OH 3.04Å
86P94.9Very high94.2Very high61 Ų6136.6 Ų36.640%0.39618%0.178SC..Hα-helixtrans-64.6-34.5176.6-2537.5000113.5M82 Y90M82-P86 WeakPolarHBondContact O-CG 3.42Å; P86-Y90 WeakPolarHBondContact O-CB 3.4Å; P86-Y90 PolarHBondContact O-N 2.94Å
87L94Very high94.1Very high27 Ų2737 Ų3714%0.14118%0.181CC..Hα-helixtrans-65.8-41.1176.4-71.9170.9000111.4L83 G84 M85 Y90 E91 L100 F107 K108 L111L83-L87 VanDerWaalsContact O-CD1 3.31Å; L83-L87 WeakPolarHBondContact O-CD1 3.44Å; L83-L87 VanDerWaalsContact O-CG 3.24Å; L83-L87 WeakPolarHBondContact O-CG 3.49Å; G84-L87 WeakPolarHBondContact O-CB 3.27Å; G84-L87 PolarHBondContact O-N 3.14Å; M85-L87 VanDerWaalsContact C-N 3.32Å; M85-L87 PolarHBondContact O-N 3.47Å; L87-Y90 WeakPolarHBondContact O-CB 3.25Å; L87-Y90 PolarHBondContact O-N 3.11Å; L87-E91 PolarHBondContact O-N 2.95Å; L87-E91 VanDerWaalsContact O-N 3.17Å; L87-L100 HydrophobicContact CD2-CD1 3.47Å; L87-L100 VanDerWaalsContact CD2-CD1 3.47Å; L87-F107 HydrophobicContact CD1-CD1 4.3Å; L87-F107 HydrophobicContact CD1-CE1 4.12Å; L87-K108 HydrophobicContact CB-CG 4.46Å; L87-K108 HydrophobicContact CD1-CB 4.34Å; L87-K108 HydrophobicContact CD1-CG 4.23Å; L87-L111 HydrophobicContact CD1-CD2 4.32Å
88E92.6Very high94.1Very high43 Ų4337.5 Ų37.520%0.20118%0.183CC..Hα-helixtrans-69.2-40.5176.8-172.4172.3159.300112.2Y38 G84 M85 Y90 E91 L92 F112 Y322Y38-E88 PolarHBondContact OH-OE1 3.42Å; Y38-E88 VanDerWaalsContact OH-OE1 3.08Å; G84-E88 PolarHBondContact O-N 2.89Å; G84-E88 VanDerWaalsContact O-N 3.08Å; M85-E88 PolarHBondContact O-N 3.32Å; E88-Y90 VanDerWaalsContact C-N 3.28Å; E88-Y90 PolarHBondContact O-N 3.26Å; E88-E91 PolarHBondContact O-N 3Å; E88-L92 WeakPolarHBondContact O-CB 3.35Å; E88-L92 PolarHBondContact O-N 3.27Å; E88-F112 HydrophobicContact CB-CZ 4.31Å; E88-Y322 WeakPolarHBondContact OE2-CE2 3.25Å; E88-Y322 PolarHBondContact OE2-OH 2.91Å
89L94.3Very high93.9Very high33 Ų3341.8 Ų41.817%0.17321%0.206CC..Hα-helixtrans-63.7-34.9173.9-74.5175.7000112.5C35 Y38 M85 L92 W93C35-L89 HydrophobicContact CB-CD2 4.16Å; Y38-L89 HydrophobicContact CD2-CD1 4.28Å; Y38-L89 HydrophobicContact CD2-CD2 3.67Å; Y38-L89 HydrophobicContact CD2-CG 3.84Å; Y38-L89 HydrophobicContact CE2-CD2 4.32Å; Y38-L89 HydrophobicContact CG-CD2 4.37Å; M85-L89 HydrophobicContact CG-CD1 4.29Å; M85-L89 WeakPolarHBondContact O-CG 3.43Å; M85-L89 PolarHBondContact O-N 3.42Å; L89-L92 PolarHBondContact O-N 2.91Å; L89-W93 WeakPolarHBondContact O-CB 3.38Å; L89-W93 PolarHBondContact O-N 3.3Å
90Y93.8Very high93.7Very high54 Ų5443.4 Ų43.421%0.21221%0.214CC..Hα-helixtrans-60.5-46.6172.9158.1-107.4000111.2P86 L87 E88 L92 W93 Q94 P97 F98 L99P86-Y90 WeakPolarHBondContact O-CB 3.4Å; P86-Y90 PolarHBondContact O-N 2.94Å; L87-Y90 WeakPolarHBondContact O-CB 3.25Å; L87-Y90 PolarHBondContact O-N 3.11Å; E88-Y90 VanDerWaalsContact C-N 3.28Å; E88-Y90 PolarHBondContact O-N 3.26Å; Y90-L92 VanDerWaalsContact C-N 3.34Å; Y90-L92 PolarHBondContact O-N 2.99Å; Y90-W93 PolarHBondContact O-N 3.25Å; Y90-Q94 HydrophobicContact CE2-CB 4.18Å; Y90-Q94 PolarHBondContact O-N 3.45Å; Y90-P97 PolarHBondContact OH-O 3.21Å; Y90-F98 HydrophobicContact CE1-CD2 4.16Å; Y90-F98 HydrophobicContact CE1-CE2 4.25Å; Y90-L99 HydrophobicContact CE2-CD1 4.48Å; Y90-L99 WeakPolarHBondContact OH-CB 3.11Å; Y90-L99 WeakPolarHBondContact OH-CG 3.44Å; Y90-L99 PolarHBondContact OH-N 3.38Å
91E90.9Very high93.6Very high38 Ų3844.7 Ų44.718%0.17823%0.228CC..Hα-helixtrans-67.4-35.9177.9-70.6-178.9114.600112L87 E88 W93 Q94 N95 F98 K108L87-E91 PolarHBondContact O-N 2.95Å; L87-E91 VanDerWaalsContact O-N 3.17Å; E88-E91 PolarHBondContact O-N 3Å; E91-W93 VanDerWaalsContact C-N 3.29Å; E91-W93 PolarHBondContact O-N 2.85Å; E91-Q94 CarbonylContact O-C 3.58Å; E91-Q94 PolarHBondContact O-N 3.26Å; E91-N95 VanDerWaalsContact O-CA 3.3Å; E91-N95 WeakPolarHBondContact O-CA 3.09Å; E91-N95 PolarHBondContact O-N 3.47Å; E91-N95 PolarHBondContact O-OD1 3.08Å; E91-F98 HydrophobicContact CG-CD2 4.46Å; E91-F98 HydrophobicContact CG-CE2 4.43Å; E91-K108 IonicContact OE1-NZ 3.27Å; E91-K108 PolarHBondContact OE1-NZ 2.8Å; E91-K108 WeakPolarHBondContact OE2-CD 3.41Å; E91-K108 WeakPolarHBondContact OE2-CE 3.32Å; E91-K108 IonicContact OE2-NZ 3.81Å; E91-K108 PolarHBondContact OE2-NZ 3.45Å
92L91.3Very high93.5Very high35 Ų3551.6 Ų51.618%0.18326%0.258CS..Hα-helixtrans-67.6-31.9175.5-16368.5000112.6S28 V30 F31 V34 E88 L89 Y90S28-L92 WeakPolarHBondContact CB-O 3.33Å; S28-L92 PolarHBondContact N-O 3.23Å; S28-L92 WeakPolarHBondContact OG-CD1 3.49Å; V30-L92 HydrophobicContact CG2-CD1 4.33Å; F31-L92 HydrophobicContact CB-CD2 4.36Å; F31-L92 HydrophobicContact CB-CG 4.21Å; F31-L92 HydrophobicContact CD2-CB 4.09Å; F31-L92 HydrophobicContact CD2-CD2 4.14Å; F31-L92 HydrophobicContact CD2-CG 4.04Å; V34-L92 HydrophobicContact CB-CD2 3.65Å; V34-L92 HydrophobicContact CG1-CD2 3.62Å; V34-L92 HydrophobicContact CG2-CD2 4.2Å; E88-L92 WeakPolarHBondContact O-CB 3.35Å; E88-L92 PolarHBondContact O-N 3.27Å; L89-L92 PolarHBondContact O-N 2.91Å; Y90-L92 VanDerWaalsContact C-N 3.34Å; Y90-L92 PolarHBondContact O-N 2.99Å
93W93.9Very high93.4Very high126 Ų12650.4 Ų50.448%0.47727%0.266SS..Hα-helixtrans-74.6-41.3173.7177-89.9000112.1R27 F31 L89 Y90 E91R27-W93 WeakPolarHBondContact CA-O 3.35Å; R27-W93 WeakPolarHBondContact CB-O 3.29Å; R27-W93 WeakPolarHBondContact CG-O 3.34Å; R27-W93 VanDerWaalsContact CZ-CE3 3.49Å; R27-W93 VanDerWaalsContact NH1-CZ3 3.33Å; F31-W93 HydrophobicContact CD1-CE3 4.04Å; F31-W93 HydrophobicContact CD1-CZ3 4.4Å; F31-W93 HydrophobicContact CD2-CB 4.04Å; F31-W93 HydrophobicContact CD2-CE3 4.32Å; F31-W93 AromaticContact CE1-CE3 3.54Å; F31-W93 HydrophobicContact CE1-CE3 3.54Å; F31-W93 AromaticContact CE1-CZ3 3.83Å; F31-W93 HydrophobicContact CE1-CZ3 3.83Å; F31-W93 HydrophobicContact CE2-CB 3.76Å; F31-W93 AromaticContact CE2-CE3 3.88Å; F31-W93 HydrophobicContact CE2-CE3 3.88Å; F31-W93 HydrophobicContact CG-CE3 4.4Å; F31-W93 HydrophobicContact CZ-CB 4.47Å; F31-W93 HydrophobicContact CZ-CD2 4.46Å; F31-W93 AromaticContact CZ-CE3 3.47Å; F31-W93 HydrophobicContact CZ-CE3 3.47Å; F31-W93 VanDerWaalsContact CZ-CE3 3.47Å; F31-W93 HydrophobicContact CZ-CZ3 4.12Å; L89-W93 WeakPolarHBondContact O-CB 3.38Å; L89-W93 PolarHBondContact O-N 3.3Å; Y90-W93 PolarHBondContact O-N 3.25Å; E91-W93 VanDerWaalsContact C-N 3.29Å; E91-W93 PolarHBondContact O-N 2.85Å
94Q92.1Very high93.4Very high42 Ų4247.7 Ų47.720%0.19626%0.255CS..  trans-137.190-176.2-172.494.5-69.700109.3R26 Y90 E91 Y96R26-Q94 VanDerWaalsContact CG-OE1 3.26Å; R26-Q94 CarbonylContact O-C 3.09Å; R26-Q94 WeakPolarHBondContact O-CA 3.43Å; Y90-Q94 HydrophobicContact CE2-CB 4.18Å; Y90-Q94 PolarHBondContact O-N 3.45Å; E91-Q94 CarbonylContact O-C 3.58Å; E91-Q94 PolarHBondContact O-N 3.26Å; Q94-Y96 WeakPolarHBondContact CG-O 3.34Å; Q94-Y96 PolarHBondContact O-N 2.95Å
95N89.6Confident93.5Very high58 Ų5847.7 Ų47.731%0.3126%0.255SS..  trans-62.3-34.2179.4-78.9-29000111.7P25 R26 E91P25-N95 PolarHBondContact O-ND2 3.47Å; R26-N95 PolarHBondContact O-N 3.27Å; E91-N95 VanDerWaalsContact O-CA 3.3Å; E91-N95 WeakPolarHBondContact O-CA 3.09Å; E91-N95 PolarHBondContact O-N 3.47Å; E91-N95 PolarHBondContact O-OD1 3.08Å
96Y92.1Very high93.5Very high9 Ų952.5 Ų52.54%0.03527%0.274CS..SBendtrans-153.2152.6174.853.4-90000110.8L19 L23 G24 R26 Q94 D193L19-Y96 HydrophobicContact CB-CE2 3.65Å; L19-Y96 HydrophobicContact CD1-CD2 4.34Å; L19-Y96 HydrophobicContact CD1-CE2 3.92Å; L19-Y96 HydrophobicContact CG-CE2 4.24Å; L23-Y96 HydrophobicContact CB-CD1 3.55Å; L23-Y96 HydrophobicContact CB-CE1 3.45Å; L23-Y96 VanDerWaalsContact CB-CE1 3.45Å; L23-Y96 HydrophobicContact CB-CG 4.34Å; L23-Y96 HydrophobicContact CD1-CD1 3.79Å; L23-Y96 HydrophobicContact CD1-CD2 4.1Å; L23-Y96 HydrophobicContact CD1-CE1 4.23Å; L23-Y96 HydrophobicContact CD1-CG 3.71Å; L23-Y96 HydrophobicContact CG-CD1 4.32Å; L23-Y96 HydrophobicContact CG-CE1 4.48Å; G24-Y96 WeakPolarHBondContact O-CE1 3.46Å; G24-Y96 PolarHBondContact O-OH 3.07Å; R26-Y96 HydrophobicContact CB-CE1 4.42Å; R26-Y96 HydrophobicContact CB-CE2 4.13Å; R26-Y96 HydrophobicContact CG-CD2 4.35Å; R26-Y96 HydrophobicContact CG-CE2 4.05Å; R26-Y96 WeakPolarHBondContact CG-O 3.46Å; R26-Y96 PolarHBondContact NE-O 2.89Å; Q94-Y96 WeakPolarHBondContact CG-O 3.34Å; Q94-Y96 PolarHBondContact O-N 2.95Å; Y96-D193 WeakPolarHBondContact CD2-O 3.08Å
97P92.9Very high93.6Very high9 Ų954.6 Ų54.66%0.05828%0.277CS..SBendcis-74.2152.8-10.428.9-32.2000112.3Y90 L99 D193 A195Y90-P97 PolarHBondContact OH-O 3.21Å; P97-L99 HydrophobicContact CG-CD2 3.88Å; P97-L99 PolarHBondContact O-N 3.43Å; P97-D193 WeakPolarHBondContact CA-O 3.37Å; P97-D193 HydrophobicContact CB-CB 4.47Å; P97-D193 WeakPolarHBondContact CB-O 3.32Å; P97-D193 HydrophobicContact CG-CB 4.03Å; P97-A195 CarbonylContact C-O 3.54Å; P97-A195 VanDerWaalsContact CA-O 3.23Å; P97-A195 WeakPolarHBondContact CA-O 3.27Å; P97-A195 HydrophobicContact CB-CB 4.25Å
98F94.4Very high93.6Very high12 Ų1254.7 Ų54.75%0.05328%0.276CS..  trans-76.5100.4171.2-172.9-94.8000110.3Y90 E91 L100 G101 C105 I173 A195 C197Y90-F98 HydrophobicContact CE1-CD2 4.16Å; Y90-F98 HydrophobicContact CE1-CE2 4.25Å; E91-F98 HydrophobicContact CG-CD2 4.46Å; E91-F98 HydrophobicContact CG-CE2 4.43Å; F98-L100 HydrophobicContact CD1-CB 4.39Å; F98-L100 HydrophobicContact CE1-CB 3.64Å; F98-L100 HydrophobicContact CZ-CB 3.83Å; F98-L100 HydrophobicContact CZ-CD1 4.07Å; F98-L100 HydrophobicContact CZ-CG 4.34Å; F98-L100 PolarHBondContact O-N 3.31Å; F98-G101 VanDerWaalsContact CE1-O 3.29Å; F98-G101 WeakPolarHBondContact CE1-O 3.2Å; F98-C105 HydrophobicContact CD1-CB 4.49Å; F98-C105 HydrophobicContact CE1-CB 3.86Å; F98-C105 HydrophobicContact CZ-CB 4.31Å; F98-I173 HydrophobicContact CB-CD1 4.47Å; F98-I173 HydrophobicContact CD1-CD1 3.62Å; F98-I173 HydrophobicContact CE1-CD1 4.29Å; F98-I173 HydrophobicContact CG-CD1 4.34Å; F98-A195 PolarHBondContact N-O 3.12Å; F98-C197 HydrophobicContact CD1-CB 4.12Å; F98-C197 HydrophobicContact CD2-CB 3.85Å; F98-C197 HydrophobicContact CE1-CB 4.22Å; F98-C197 HydrophobicContact CE2-CB 3.96Å; F98-C197 HydrophobicContact CG-CB 3.92Å; F98-C197 HydrophobicContact CZ-CB 4.14Å
99L92.9Very high93.8Very high120 Ų12053.1 Ų53.163%0.62827%0.269SS*.THydrogen-bonded Turntrans-78.2-17.5-168.9-62.4175.7000114.1Y90 P97 G101Y90-L99 HydrophobicContact CE2-CD1 4.48Å; Y90-L99 WeakPolarHBondContact OH-CB 3.11Å; Y90-L99 WeakPolarHBondContact OH-CG 3.44Å; Y90-L99 PolarHBondContact OH-N 3.38Å; P97-L99 HydrophobicContact CG-CD2 3.88Å; P97-L99 PolarHBondContact O-N 3.43Å; L99-G101 PolarHBondContact O-N 3Å
100L93.2Very high93.9Very high87 Ų8754.2 Ų54.246%0.45527%0.273SS..THydrogen-bonded Turntrans-79.6-0.8-178.9-55.1172.4000113.1L87 F98 G104L87-L100 HydrophobicContact CD2-CD1 3.47Å; L87-L100 VanDerWaalsContact CD2-CD1 3.47Å; F98-L100 HydrophobicContact CD1-CB 4.39Å; F98-L100 HydrophobicContact CE1-CB 3.64Å; F98-L100 HydrophobicContact CZ-CB 3.83Å; F98-L100 HydrophobicContact CZ-CD1 4.07Å; F98-L100 HydrophobicContact CZ-CG 4.34Å; F98-L100 PolarHBondContact O-N 3.31Å; L100-G104 WeakPolarHBondContact O-CA 3.41Å; L100-G104 PolarHBondContact O-N 3.31Å
101G93.1Very high94Very high30 Ų3052 Ų5231%0.30927%0.265SS..Hα-helixtrans61.7-165.4176.800000114.4F98 L99 G103 G104 C105F98-G101 VanDerWaalsContact CE1-O 3.29Å; F98-G101 WeakPolarHBondContact CE1-O 3.2Å; L99-G101 PolarHBondContact O-N 3Å; G101-G103 PolarHBondContact O-N 2.97Å; G101-G104 PolarHBondContact O-N 2.88Å; G101-C105 PolarHBondContact O-N 3.02Å; G101-C105 VanDerWaalsContact O-N 3.07Å
102K94.6Very high94.1Very high146 Ų14651.8 Ų51.864%0.63526%0.263SS*.Hα-helixtrans-60.3-42.7-176.6-65.4179.4-177.6177.10112.7C105 Y106 I173K102-C105 PolarHBondContact O-N 3.35Å; K102-Y106 VanDerWaalsContact O-CD2 3.31Å; K102-Y106 WeakPolarHBondContact O-CD2 3.42Å; K102-Y106 PolarHBondContact O-N 3.48Å; K102-Y106 VanDerWaalsContact O-N 3.09Å; K102-I173 HydrophobicContact CB-CG1 4.46Å; K102-I173 HydrophobicContact CG-CB 4.4Å; K102-I173 HydrophobicContact CG-CG1 3.77Å
103G96Very high94.3Very high54 Ų5450.4 Ų50.456%0.55726%0.256SS*.Hα-helixtrans-62-44.1178.700000112.6G101 C105 Y106 F107G101-G103 PolarHBondContact O-N 2.97Å; G103-C105 PolarHBondContact O-N 3.46Å; G103-Y106 PolarHBondContact O-N 3.35Å; G103-F107 WeakPolarHBondContact O-CB 3.43Å; G103-F107 PolarHBondContact O-N 2.91Å
104G95.1Very high94.4Very high13 Ų1345.2 Ų45.213%0.13424%0.237CC..Hα-helixtrans-63.6-38.5175.200000113.5L100 G101 F107 K108L100-G104 WeakPolarHBondContact O-CA 3.41Å; L100-G104 PolarHBondContact O-N 3.31Å; G101-G104 PolarHBondContact O-N 2.88Å; G104-F107 PolarHBondContact O-N 3.43Å; G104-K108 VanDerWaalsContact O-CB 3.26Å; G104-K108 WeakPolarHBondContact O-CB 3.46Å; G104-K108 PolarHBondContact O-N 3.42Å
105C95.9Very high94.5Very high0 Ų043.3 Ų43.30%023%0.228CC..Hα-helixtrans-63.6-46.5177.4-176.90000111.2F98 G101 K102 G103 T109 G172 I173 C197F98-C105 HydrophobicContact CD1-CB 4.49Å; F98-C105 HydrophobicContact CE1-CB 3.86Å; F98-C105 HydrophobicContact CZ-CB 4.31Å; G101-C105 PolarHBondContact O-N 3.02Å; G101-C105 VanDerWaalsContact O-N 3.07Å; K102-C105 PolarHBondContact O-N 3.35Å; G103-C105 PolarHBondContact O-N 3.46Å; C105-T109 PolarHBondContact O-N 3.4Å; C105-T109 VanDerWaalsContact O-N 3.09Å; C105-T109 PolarHBondContact O-OG1 3.26Å; C105-T109 VanDerWaalsContact O-OG1 3.14Å; C105-G172 PolarHBondContact SG-O 3Å; C105-I173 HydrophobicContact CB-CD1 3.97Å; C105-C197 WeakPolarHBondContact CA-SG 3.27Å; C105-C197 HydrophobicContact CB-CB 3.74Å; C105-C197 WeakPolarHBondContact CB-SG 3.33Å; C105-C197 VanDerWaalsContact SG-CA 3.59Å; C105-C197 WeakPolarHBondContact SG-CB 3.29Å; C105-C197 CovalentContact SG-SG 2.04Å; C105-C197 PolarHBondContact SG-SG 2.69Å
106Y96.8Very high94.6Very high105 Ų10540.6 Ų40.641%0.41221%0.214SC..Hα-helixtrans-64.1-44.8174.6-64.9-41000112.6K102 G103 K108 F110 T168 H171K102-Y106 VanDerWaalsContact O-CD2 3.31Å; K102-Y106 WeakPolarHBondContact O-CD2 3.42Å; K102-Y106 PolarHBondContact O-N 3.48Å; K102-Y106 VanDerWaalsContact O-N 3.09Å; G103-Y106 PolarHBondContact O-N 3.35Å; Y106-K108 PolarHBondContact O-N 3.34Å; Y106-F110 WeakPolarHBondContact O-CB 3.44Å; Y106-F110 PolarHBondContact O-N 3.46Å; Y106-T168 HydrophobicContact CD1-CG2 4.05Å; Y106-T168 HydrophobicContact CG-CG2 4.48Å; Y106-T168 WeakPolarHBondContact O-CG2 3.31Å; Y106-H171 VanDerWaalsContact CE1-O 3.23Å; Y106-H171 WeakPolarHBondContact CE1-O 3.19Å
107F96.3Very high94.7Very high105 Ų10540.3 Ų40.346%0.46121%0.213SC..Hα-helixtrans-59.3-47.5178.3174.5-102.3000111.5L87 G103 G104 F110 L111L87-F107 HydrophobicContact CD1-CD1 4.3Å; L87-F107 HydrophobicContact CD1-CE1 4.12Å; G103-F107 WeakPolarHBondContact O-CB 3.43Å; G103-F107 PolarHBondContact O-N 2.91Å; G104-F107 PolarHBondContact O-N 3.43Å; F107-F110 PolarHBondContact O-N 2.86Å; F107-L111 HydrophobicContact CE1-CD2 4.09Å; F107-L111 HydrophobicContact CZ-CD2 4.15Å; F107-L111 WeakPolarHBondContact O-CB 3.35Å; F107-L111 PolarHBondContact O-N 2.89Å
108K94.7Very high94.8Very high30 Ų3039.9 Ų39.913%0.1321%0.21CC..Hα-helixtrans-56.3-59.5177.7-174.6-16883.41620110.5L87 E91 G104 Y106 F110 L111 F112L87-K108 HydrophobicContact CB-CG 4.46Å; L87-K108 HydrophobicContact CD1-CB 4.34Å; L87-K108 HydrophobicContact CD1-CG 4.23Å; E91-K108 IonicContact OE1-NZ 3.27Å; E91-K108 PolarHBondContact OE1-NZ 2.8Å; E91-K108 WeakPolarHBondContact OE2-CD 3.41Å; E91-K108 WeakPolarHBondContact OE2-CE 3.32Å; E91-K108 IonicContact OE2-NZ 3.81Å; E91-K108 PolarHBondContact OE2-NZ 3.45Å; G104-K108 VanDerWaalsContact O-CB 3.26Å; G104-K108 WeakPolarHBondContact O-CB 3.46Å; G104-K108 PolarHBondContact O-N 3.42Å; Y106-K108 PolarHBondContact O-N 3.34Å; K108-F110 VanDerWaalsContact C-N 3.31Å; K108-F110 PolarHBondContact O-N 3.35Å; K108-L111 PolarHBondContact O-N 3.07Å; K108-F112 HydrophobicContact CD-CE2 4.49Å; K108-F112 HydrophobicContact CG-CD2 3.81Å; K108-F112 HydrophobicContact CG-CE2 3.83Å; K108-F112 VanDerWaalsContact O-CD2 3.31Å; K108-F112 WeakPolarHBondContact O-CD2 3.44Å; K108-F112 PolarHBondContact O-N 2.9Å
109T95.1Very high94.7Very high10 Ų1039.4 Ų39.46%0.06121%0.208CC..Hα-helixtrans-60.9-41.5-176.2-57.40000111.8C105 E113 H171C105-T109 PolarHBondContact O-N 3.4Å; C105-T109 VanDerWaalsContact O-N 3.09Å; C105-T109 PolarHBondContact O-OG1 3.26Å; C105-T109 VanDerWaalsContact O-OG1 3.14Å; T109-E113 WeakPolarHBondContact O-CB 3.48Å; T109-E113 PolarHBondContact O-N 3.03Å; T109-E113 VanDerWaalsContact O-N 3.1Å; T109-H171 HydrophobicContact CG2-CB 4.32Å
110F97.3Very high94.7Very high56 Ų5633.7 Ų33.725%0.24618%0.178CC..Hα-helixtrans-64.1-48177.3178-96.2000112Y106 F107 K108 E113 M114 V161 A164 V165 T168Y106-F110 WeakPolarHBondContact O-CB 3.44Å; Y106-F110 PolarHBondContact O-N 3.46Å; F107-F110 PolarHBondContact O-N 2.86Å; K108-F110 VanDerWaalsContact C-N 3.31Å; K108-F110 PolarHBondContact O-N 3.35Å; F110-E113 PolarHBondContact O-N 2.99Å; F110-M114 HydrophobicContact CE1-CB 4.26Å; F110-M114 HydrophobicContact CE1-CG 4.37Å; F110-M114 HydrophobicContact CZ-CB 4.34Å; F110-M114 HydrophobicContact CZ-CG 4.32Å; F110-M114 WeakPolarHBondContact O-CB 3.32Å; F110-M114 PolarHBondContact O-N 3.09Å; F110-V161 HydrophobicContact CE2-CG1 4.38Å; F110-V161 HydrophobicContact CZ-CB 4.34Å; F110-V161 HydrophobicContact CZ-CG1 3.98Å; F110-V161 HydrophobicContact CZ-CG2 4.18Å; F110-A164 HydrophobicContact CD2-CB 3.85Å; F110-A164 HydrophobicContact CE2-CB 3.85Å; F110-V165 HydrophobicContact CE2-CG2 4.23Å; F110-T168 WeakPolarHBondContact CA-OG1 3.44Å; F110-T168 HydrophobicContact CB-CG2 3.93Å; F110-T168 WeakPolarHBondContact CB-OG1 3.47Å; F110-T168 PolarHBondContact N-OG1 3.45Å
111L95.9Very high94.8Very high7 Ų731.4 Ų31.44%0.03717%0.166CC..Hα-helixtrans-57.1-54.7-179.8174.170.6000110.1L83 L87 F107 K108 E113 M114 V115L83-L111 HydrophobicContact CB-CD2 3.45Å; L83-L111 VanDerWaalsContact CB-CD2 3.45Å; L83-L111 HydrophobicContact CD1-CD1 4.23Å; L83-L111 HydrophobicContact CD1-CD2 4.37Å; L87-L111 HydrophobicContact CD1-CD2 4.32Å; F107-L111 HydrophobicContact CE1-CD2 4.09Å; F107-L111 HydrophobicContact CZ-CD2 4.15Å; F107-L111 WeakPolarHBondContact O-CB 3.35Å; F107-L111 PolarHBondContact O-N 2.89Å; K108-L111 PolarHBondContact O-N 3.07Å; L111-E113 PolarHBondContact O-N 3.08Å; L111-M114 HydrophobicContact CD1-CE 4.4Å; L111-M114 PolarHBondContact O-N 2.9Å; L111-V115 HydrophobicContact CD1-CG1 3.95Å; L111-V115 WeakPolarHBondContact O-CG1 3.5Å; L111-V115 WeakPolarHBondContact O-CG2 3.27Å; L111-V115 PolarHBondContact O-N 3.25Å
112F93.5Very high94.8Very high34 Ų3430 Ų3015%0.14915%0.152CC..Hα-helixtrans-58.8-45.4-178.7-87.3-74.3000112.5G84 E88 K108 V115 C116 F321 Y322G84-F112 VanDerWaalsContact C-CZ 3.46Å; G84-F112 VanDerWaalsContact CA-CZ 3.41Å; G84-F112 VanDerWaalsContact O-CZ 3.25Å; G84-F112 WeakPolarHBondContact O-CZ 3.43Å; E88-F112 HydrophobicContact CB-CZ 4.31Å; K108-F112 HydrophobicContact CD-CE2 4.49Å; K108-F112 HydrophobicContact CG-CD2 3.81Å; K108-F112 HydrophobicContact CG-CE2 3.83Å; K108-F112 VanDerWaalsContact O-CD2 3.31Å; K108-F112 WeakPolarHBondContact O-CD2 3.44Å; K108-F112 PolarHBondContact O-N 2.9Å; F112-V115 WeakPolarHBondContact O-CG2 3.36Å; F112-C116 WeakPolarHBondContact O-CB 3.45Å; F112-C116 PolarHBondContact O-N 3.41Å; F112-C116 VanDerWaalsContact O-N 3.16Å; F112-F321 HydrophobicContact CD1-CE1 4.11Å; F112-F321 HydrophobicContact CD1-CZ 4.26Å; F112-F321 HydrophobicContact CE1-CE1 4.08Å; F112-Y322 HydrophobicContact CE1-CE1 4.44Å; F112-Y322 WeakPolarHBondContact CE1-OH 3.23Å; F112-Y322 VanDerWaalsContact CZ-OH 3.25Å; F112-Y322 WeakPolarHBondContact CZ-OH 3.23Å
113E94.4Very high94.7Very high6 Ų623 Ų233%0.02812%0.121CC..Hα-helixtrans-67.9-45.5179.3-167.769.3-17100110.9T109 F110 L111 C116 L117 A164 N167 R293T109-E113 WeakPolarHBondContact O-CB 3.48Å; T109-E113 PolarHBondContact O-N 3.03Å; T109-E113 VanDerWaalsContact O-N 3.1Å; F110-E113 PolarHBondContact O-N 2.99Å; L111-E113 PolarHBondContact O-N 3.08Å; E113-C116 WeakPolarHBondContact O-CB 3.47Å; E113-C116 PolarHBondContact O-N 3.03Å; E113-L117 HydrophobicContact CG-CD1 4.11Å; E113-L117 HydrophobicContact CG-CG 4.47Å; E113-L117 WeakPolarHBondContact O-CG 3.27Å; E113-L117 PolarHBondContact O-N 2.85Å; E113-A164 HydrophobicContact CB-CB 3.95Å; E113-A164 HydrophobicContact CG-CB 3.98Å; E113-N167 HydrophobicContact CG-CB 4.18Å; E113-N167 PolarHBondContact OE2-ND2 2.88Å; E113-R293 IonicContact OE1-NH1 3.57Å; E113-R293 IonicContact OE1-NH2 3.81Å; E113-R293 PolarHBondContact OE1-NH2 3.36Å; E113-R293 IonicContact OE2-CZ 3.64Å; E113-R293 VanDerWaalsContact OE2-CZ 3.32Å; E113-R293 IonicContact OE2-NH1 2.62Å; E113-R293 PolarHBondContact OE2-NH1 2.93Å; E113-R293 IonicContact OE2-NH2 2.66Å; E113-R293 PolarHBondContact OE2-NH2 3.26Å
114M96.1Very high94.6Very high17 Ų1721.3 Ų21.38%0.08410%0.1CC..Hα-helixtrans-62.3-49.4-177.9179.5-81.6-67.500112.3F110 L111 C116 L117 A118 W157 S160 V161 A164F110-M114 HydrophobicContact CE1-CB 4.26Å; F110-M114 HydrophobicContact CE1-CG 4.37Å; F110-M114 HydrophobicContact CZ-CB 4.34Å; F110-M114 HydrophobicContact CZ-CG 4.32Å; F110-M114 WeakPolarHBondContact O-CB 3.32Å; F110-M114 PolarHBondContact O-N 3.09Å; L111-M114 HydrophobicContact CD1-CE 4.4Å; L111-M114 PolarHBondContact O-N 2.9Å; M114-C116 VanDerWaalsContact C-N 3.27Å; M114-C116 PolarHBondContact O-N 2.92Å; M114-L117 PolarHBondContact O-N 3.42Å; M114-A118 WeakPolarHBondContact O-CB 3.12Å; M114-A118 PolarHBondContact O-N 3.43Å; M114-W157 HydrophobicContact CE-CZ3 4.15Å; M114-W157 HydrophobicContact SD-CE3 3.76Å; M114-W157 HydrophobicContact SD-CZ3 3.47Å; M114-W157 WeakPolarHBondContact SD-CZ3 3.01Å; M114-S160 WeakPolarHBondContact O-CB 3.49Å; M114-V161 HydrophobicContact CG-CG2 3.88Å; M114-A164 HydrophobicContact CB-CB 3.86Å
115V94.3Very high94.6Very high1 Ų121.3 Ų21.31%0.00610%0.099CC..Hα-helixtrans-66.8-33.8-179.8-620000111.5L79 V80 L111 F112 A118 S119L79-V115 HydrophobicContact CB-CG1 3.75Å; L79-V115 HydrophobicContact CD1-CG1 4.08Å; V80-V115 HydrophobicContact CB-CG2 4.5Å; V80-V115 HydrophobicContact CG2-CB 3.73Å; V80-V115 HydrophobicContact CG2-CG2 3.19Å; L111-V115 HydrophobicContact CD1-CG1 3.95Å; L111-V115 WeakPolarHBondContact O-CG1 3.5Å; L111-V115 WeakPolarHBondContact O-CG2 3.27Å; L111-V115 PolarHBondContact O-N 3.25Å; F112-V115 WeakPolarHBondContact O-CG2 3.36Å; V115-A118 PolarHBondContact O-N 3.34Å; V115-S119 WeakPolarHBondContact O-CB 3.1Å; V115-S119 PolarHBondContact O-N 2.99Å; V115-S119 PolarHBondContact O-OG 2.97Å
116C91.8Very high94.4Very high2 Ų221.5 Ų21.51%0.01410%0.1CC..Hα-helixtrans-61.3-53.6175.3156.50000111.4F112 E113 M114 A118 S119 I120 W286 F321F112-C116 WeakPolarHBondContact O-CB 3.45Å; F112-C116 PolarHBondContact O-N 3.41Å; F112-C116 VanDerWaalsContact O-N 3.16Å; E113-C116 WeakPolarHBondContact O-CB 3.47Å; E113-C116 PolarHBondContact O-N 3.03Å; M114-C116 VanDerWaalsContact C-N 3.27Å; M114-C116 PolarHBondContact O-N 2.92Å; C116-A118 VanDerWaalsContact C-N 3.3Å; C116-A118 PolarHBondContact O-N 3.15Å; C116-S119 PolarHBondContact O-N 3.47Å; C116-I120 WeakPolarHBondContact O-CG1 3.21Å; C116-I120 PolarHBondContact O-N 3.25Å; C116-I120 VanDerWaalsContact O-N 3.15Å; C116-W286 HydrophobicContact CB-CH2 3.78Å; C116-W286 HydrophobicContact CB-CZ3 4.04Å; C116-W286 WeakPolarHBondContact SG-CZ3 3.26Å; C116-F321 HydrophobicContact CB-CE2 4.49Å
117L93.9Very high94.1Very high2 Ų216.5 Ų16.51%0.018%0.08CC..Hα-helixtrans-60.9-40.5176.9-64.1178000111.4E113 M114 L121 C163 F217E113-L117 HydrophobicContact CG-CD1 4.11Å; E113-L117 HydrophobicContact CG-CG 4.47Å; E113-L117 WeakPolarHBondContact O-CG 3.27Å; E113-L117 PolarHBondContact O-N 2.85Å; M114-L117 PolarHBondContact O-N 3.42Å; L117-L121 WeakPolarHBondContact O-CB 3.39Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.43Å; L117-L121 PolarHBondContact O-N 3.41Å; L117-C163 HydrophobicContact CD1-CB 3.58Å; L117-F217 HydrophobicContact CD2-CB 3.63Å; L117-F217 HydrophobicContact CD2-CD1 3.67Å; L117-F217 HydrophobicContact CD2-CD2 3.44Å; L117-F217 VanDerWaalsContact CD2-CD2 3.44Å; L117-F217 HydrophobicContact CD2-CE1 4.14Å; L117-F217 HydrophobicContact CD2-CE2 3.94Å; L117-F217 HydrophobicContact CD2-CG 3.29Å; L117-F217 HydrophobicContact CD2-CZ 4.27Å
118A95.5Very high94Very high0 Ų015.1 Ų15.10%08%0.077CC..Hα-helixtrans-62.2-45.4177.400000112.1M114 V115 C116 L121 N122 W157 S160M114-A118 WeakPolarHBondContact O-CB 3.12Å; M114-A118 PolarHBondContact O-N 3.43Å; V115-A118 PolarHBondContact O-N 3.34Å; C116-A118 VanDerWaalsContact C-N 3.3Å; C116-A118 PolarHBondContact O-N 3.15Å; A118-L121 PolarHBondContact O-N 3.47Å; A118-N122 VanDerWaalsContact O-CB 3.27Å; A118-N122 WeakPolarHBondContact O-CB 3.03Å; A118-N122 VanDerWaalsContact O-CG 3.3Å; A118-N122 PolarHBondContact O-N 3.07Å; A118-N122 PolarHBondContact O-ND2 2.89Å; A118-W157 HydrophobicContact CB-CE3 4.36Å; A118-W157 HydrophobicContact CB-CH2 4.42Å; A118-W157 HydrophobicContact CB-CZ3 4.32Å; A118-S160 WeakPolarHBondContact CA-OG 3.24Å; A118-S160 WeakPolarHBondContact CB-OG 3.34Å; A118-S160 PolarHBondContact N-OG 3.1Å
119S93Very high93.8Very high2 Ų214.1 Ų14.11%0.0147%0.073CC..Hα-helixtrans-61.4-47.7178.9-73.70000111.8S76 V115 C116 N122 V123S76-S119 WeakPolarHBondContact CB-OG 3.17Å; S76-S119 PolarHBondContact OG-OG 3.27Å; V115-S119 WeakPolarHBondContact O-CB 3.1Å; V115-S119 PolarHBondContact O-N 2.99Å; V115-S119 PolarHBondContact O-OG 2.97Å; C116-S119 PolarHBondContact O-N 3.47Å; S119-N122 PolarHBondContact O-N 2.88Å; S119-V123 WeakPolarHBondContact O-CG2 3.4Å; S119-V123 PolarHBondContact O-N 3.47Å
120I92.7Very high93.6Very high1 Ų115.4 Ų15.41%0.0058%0.076CC..Hα-helixtrans-56.7-55.2176.2-66162.8000110.5C116 N122 V123 T124 F217 P221 F282 W286C116-I120 WeakPolarHBondContact O-CG1 3.21Å; C116-I120 PolarHBondContact O-N 3.25Å; C116-I120 VanDerWaalsContact O-N 3.15Å; I120-N122 VanDerWaalsContact C-N 3.3Å; I120-N122 PolarHBondContact O-N 3.43Å; I120-V123 PolarHBondContact O-N 3Å; I120-V123 VanDerWaalsContact O-N 3.11Å; I120-T124 PolarHBondContact O-N 3.25Å; I120-T124 PolarHBondContact O-OG1 2.97Å; I120-F217 HydrophobicContact CD1-CB 4.22Å; I120-F217 WeakPolarHBondContact CD1-O 3.42Å; I120-F217 WeakPolarHBondContact CG2-O 3.33Å; I120-P221 HydrophobicContact CG2-CB 3.83Å; I120-P221 HydrophobicContact CG2-CG 3.86Å; I120-F282 HydrophobicContact CB-CZ 4.22Å; I120-F282 HydrophobicContact CG1-CE1 4.05Å; I120-F282 HydrophobicContact CG1-CZ 3.59Å; I120-W286 HydrophobicContact CD1-CE3 4.14Å; I120-W286 HydrophobicContact CD1-CZ3 3.94Å; I120-W286 HydrophobicContact CG1-CE3 4.31Å; I120-W286 HydrophobicContact CG1-CZ3 4.25Å
121L94.9Very high93.3Very high38 Ų3815 Ų1520%0.1997%0.074CC..Hα-helixtrans-63.5-35.5-176-71.5177.1000112.1L117 A118 T124 A125 V156 M159 F217L117-L121 WeakPolarHBondContact O-CB 3.39Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.43Å; L117-L121 PolarHBondContact O-N 3.41Å; A118-L121 PolarHBondContact O-N 3.47Å; L121-T124 PolarHBondContact O-N 3.47Å; L121-A125 VanDerWaalsContact O-CB 3.25Å; L121-A125 WeakPolarHBondContact O-CB 3.44Å; L121-A125 PolarHBondContact O-N 3.11Å; L121-V156 HydrophobicContact CB-CB 4.35Å; L121-V156 HydrophobicContact CB-CG1 3.6Å; L121-V156 HydrophobicContact CB-CG2 4.04Å; L121-V156 HydrophobicContact CD1-CG1 4.33Å; L121-M159 HydrophobicContact CD1-CB 4.17Å; L121-F217 HydrophobicContact CD1-CE1 4.13Å; L121-F217 HydrophobicContact CD2-CD1 4.18Å; L121-F217 HydrophobicContact CD2-CE1 4.11Å; L121-F217 HydrophobicContact CG-CD1 4.32Å; L121-F217 HydrophobicContact CG-CE1 4.29Å
122N94Very high93.1Very high1 Ų116.4 Ų16.41%0.0058%0.081CC..Hα-helixtrans-62.8-44.8172.9-82.9-55.7000111.5S72 L73 A118 S119 I120 A125 L126S72-N122 WeakPolarHBondContact CB-OD1 3.22Å; S72-N122 PolarHBondContact OG-ND2 3.4Å; S72-N122 PolarHBondContact OG-OD1 3.35Å; L73-N122 HydrophobicContact CB-CB 4.43Å; L73-N122 HydrophobicContact CD1-CB 4.26Å; A118-N122 VanDerWaalsContact O-CB 3.27Å; A118-N122 WeakPolarHBondContact O-CB 3.03Å; A118-N122 VanDerWaalsContact O-CG 3.3Å; A118-N122 PolarHBondContact O-N 3.07Å; A118-N122 PolarHBondContact O-ND2 2.89Å; S119-N122 PolarHBondContact O-N 2.88Å; I120-N122 VanDerWaalsContact C-N 3.3Å; I120-N122 PolarHBondContact O-N 3.43Å; N122-A125 PolarHBondContact O-N 3.16Å; N122-L126 VanDerWaalsContact O-CB 3.25Å; N122-L126 WeakPolarHBondContact O-CB 3.48Å; N122-L126 PolarHBondContact O-N 3.05Å
123V91.5Very high92.8Very high0 Ų015.4 Ų15.40%08%0.079CC..Hα-helixtrans-65.6-40.2177.7174.50000111.1L73 S119 I120 S127 I225 L278 F282L73-V123 HydrophobicContact CD1-CG2 4.12Å; L73-V123 HydrophobicContact CD2-CG2 3.98Å; S119-V123 WeakPolarHBondContact O-CG2 3.4Å; S119-V123 PolarHBondContact O-N 3.47Å; I120-V123 PolarHBondContact O-N 3Å; I120-V123 VanDerWaalsContact O-N 3.11Å; V123-S127 WeakPolarHBondContact O-CB 3.18Å; V123-S127 PolarHBondContact O-N 3.32Å; V123-S127 PolarHBondContact O-OG 3.34Å; V123-I225 HydrophobicContact CG1-CD1 4.11Å; V123-L278 HydrophobicContact CG1-CD2 4.16Å; V123-L278 HydrophobicContact CG2-CD2 4.21Å; V123-F282 HydrophobicContact CG1-CG 4.47Å; V123-F282 HydrophobicContact CG2-CD2 4.01Å; V123-F282 HydrophobicContact CG2-CE2 4Å
124T94.2Very high92.3Very high18 Ų1815.7 Ų15.711%0.118%0.081CC..Hα-helixtrans-62.5-49.1173.7-50.70000111.4I120 L121 L126 S127 I128 I225I120-T124 PolarHBondContact O-N 3.25Å; I120-T124 PolarHBondContact O-OG1 2.97Å; L121-T124 PolarHBondContact O-N 3.47Å; T124-L126 VanDerWaalsContact C-N 3.34Å; T124-L126 PolarHBondContact O-N 3.49Å; T124-S127 WeakPolarHBondContact O-CB 3.22Å; T124-S127 PolarHBondContact O-N 2.98Å; T124-S127 VanDerWaalsContact O-N 3.09Å; T124-I128 HydrophobicContact CG2-CD1 4.1Å; T124-I128 WeakPolarHBondContact O-CG1 3.29Å; T124-I128 PolarHBondContact O-N 2.95Å; T124-I225 HydrophobicContact CG2-CG1 4.4Å
125A94.4Very high91.9Very high13 Ų1316.1 Ų16.111%0.1079%0.085CC..Hα-helixtrans-61.2-42.2179.500000112.1Y69 L121 N122 S127 I128 E129 V152Y69-A125 HydrophobicContact CD1-CB 4.16Å; Y69-A125 HydrophobicContact CE1-CB 3.84Å; L121-A125 VanDerWaalsContact O-CB 3.25Å; L121-A125 WeakPolarHBondContact O-CB 3.44Å; L121-A125 PolarHBondContact O-N 3.11Å; N122-A125 PolarHBondContact O-N 3.16Å; A125-S127 VanDerWaalsContact C-N 3.31Å; A125-S127 PolarHBondContact O-N 3.08Å; A125-I128 PolarHBondContact O-N 3.38Å; A125-E129 PolarHBondContact O-N 3.26Å; A125-V152 HydrophobicContact CB-CG1 3.96Å
126L91.6Very high91.6Very high3 Ų319.2 Ų19.22%0.01610%0.099CC..Hα-helixtrans-59.9-41.4173.4175.859.5000111.7T66 L70 N122 T124 E129 R130 L275T66-L126 HydrophobicContact CG2-CD1 3.44Å; T66-L126 VanDerWaalsContact CG2-CD1 3.44Å; L70-L126 HydrophobicContact CD2-CD2 3.68Å; N122-L126 VanDerWaalsContact O-CB 3.25Å; N122-L126 WeakPolarHBondContact O-CB 3.48Å; N122-L126 PolarHBondContact O-N 3.05Å; T124-L126 VanDerWaalsContact C-N 3.34Å; T124-L126 PolarHBondContact O-N 3.49Å; L126-E129 PolarHBondContact O-N 3.27Å; L126-R130 HydrophobicContact CD1-CG 4.24Å; L126-R130 VanDerWaalsContact O-CB 3.32Å; L126-R130 WeakPolarHBondContact O-CB 3.26Å; L126-R130 WeakPolarHBondContact O-CG 3.27Å; L126-R130 PolarHBondContact O-N 3.05Å; L126-L275 HydrophobicContact CD1-CD2 4.4Å; L126-L275 HydrophobicContact CD2-CD2 3.59Å; L126-L275 HydrophobicContact CG-CD2 4.03Å
127S91.3Very high91.2Very high0 Ų023 Ų230%012%0.124CC..Hα-helixtrans-67.1-40.1178.5-58.20000112.1V123 T124 A125 R130 Y131 Y229V123-S127 WeakPolarHBondContact O-CB 3.18Å; V123-S127 PolarHBondContact O-N 3.32Å; V123-S127 PolarHBondContact O-OG 3.34Å; T124-S127 WeakPolarHBondContact O-CB 3.22Å; T124-S127 PolarHBondContact O-N 2.98Å; T124-S127 VanDerWaalsContact O-N 3.09Å; A125-S127 VanDerWaalsContact C-N 3.31Å; A125-S127 PolarHBondContact O-N 3.08Å; S127-R130 PolarHBondContact O-N 3.22Å; S127-Y131 WeakPolarHBondContact O-CB 3.42Å; S127-Y131 PolarHBondContact O-N 2.8Å; S127-Y229 WeakPolarHBondContact OG-CE2 3.31Å; S127-Y229 PolarHBondContact OG-OH 3.4Å
128I93.5Very high90.9Very high76 Ų7629.4 Ų29.439%0.3916%0.157SC..Hα-helixtrans-64.8-46.8173.9-67.1167.1000111T124 A125 R130 Y131 I132 L228T124-I128 HydrophobicContact CG2-CD1 4.1Å; T124-I128 WeakPolarHBondContact O-CG1 3.29Å; T124-I128 PolarHBondContact O-N 2.95Å; A125-I128 PolarHBondContact O-N 3.38Å; I128-R130 PolarHBondContact O-N 2.93Å; I128-Y131 PolarHBondContact O-N 2.91Å; I128-I132 HydrophobicContact CG2-CD1 3.9Å; I128-I132 WeakPolarHBondContact O-CG1 3.11Å; I128-I132 PolarHBondContact O-N 3.09Å; I128-L228 HydrophobicContact CG1-CD1 3.66Å
129E91.9Very high90.5Very high9 Ų936.4 Ų36.44%0.04218%0.183CC..Hα-helixtrans-53.6-44.6175.6178.9-92123.300110.6T66 Y69 A125 L126 I132 A133 V144T66-E129 WeakPolarHBondContact CB-OE2 3.29Å; T66-E129 PolarHBondContact OG1-OE1 2.99Å; T66-E129 PolarHBondContact OG1-OE2 3.26Å; Y69-E129 HydrophobicContact CE2-CB 4.02Å; Y69-E129 HydrophobicContact CE2-CG 4.05Å; A125-E129 PolarHBondContact O-N 3.26Å; L126-E129 PolarHBondContact O-N 3.27Å; E129-I132 PolarHBondContact O-N 2.98Å; E129-A133 VanDerWaalsContact O-CB 3.29Å; E129-A133 WeakPolarHBondContact O-CB 3.41Å; E129-A133 PolarHBondContact O-N 2.9Å; E129-V144 HydrophobicContact CG-CG1 3.85Å; E129-V144 HydrophobicContact CG-CG2 4.35Å
130R89.8Confident90.3Very high37 Ų3737.1 Ų37.114%0.1419%0.189CC..Hα-helixtrans-71.1-38.8-176.7-73.5-83.2177.9-116.916.5113T66 L126 S127 I128 A133 V134 L275T66-R130 PolarHBondContact OG1-NH1 3.46Å; T66-R130 PolarHBondContact OG1-NH2 2.99Å; L126-R130 HydrophobicContact CD1-CG 4.24Å; L126-R130 VanDerWaalsContact O-CB 3.32Å; L126-R130 WeakPolarHBondContact O-CB 3.26Å; L126-R130 WeakPolarHBondContact O-CG 3.27Å; L126-R130 PolarHBondContact O-N 3.05Å; S127-R130 PolarHBondContact O-N 3.22Å; I128-R130 PolarHBondContact O-N 2.93Å; R130-A133 PolarHBondContact O-N 3.32Å; R130-V134 WeakPolarHBondContact O-CB 3.47Å; R130-V134 WeakPolarHBondContact O-CG2 3.16Å; R130-V134 PolarHBondContact O-N 2.91Å; R130-L275 HydrophobicContact CB-CD1 4.16Å; R130-L275 HydrophobicContact CG-CD1 3.34Å; R130-L275 VanDerWaalsContact NE-CD1 3.33Å
131Y90.9Very high89.9Confident49 Ų4945.4 Ų45.419%0.19223%0.225CC..Hα-helixtrans-57.4-51.1169.8170.4-98.2000111.1S127 I128 A133 V134 V135 H136 L228 L231 I232S127-Y131 WeakPolarHBondContact O-CB 3.42Å; S127-Y131 PolarHBondContact O-N 2.8Å; I128-Y131 PolarHBondContact O-N 2.91Å; Y131-A133 VanDerWaalsContact C-N 3.34Å; Y131-A133 PolarHBondContact O-N 2.88Å; Y131-V134 PolarHBondContact O-N 2.98Å; Y131-V135 HydrophobicContact CD2-CB 4.17Å; Y131-V135 HydrophobicContact CD2-CG2 3.64Å; Y131-V135 HydrophobicContact CE2-CB 3.89Å; Y131-V135 HydrophobicContact CE2-CG1 4Å; Y131-V135 HydrophobicContact CE2-CG2 3.62Å; Y131-V135 HydrophobicContact CG-CG2 4.45Å; Y131-V135 WeakPolarHBondContact O-CB 3.27Å; Y131-V135 PolarHBondContact O-N 3.4Å; Y131-H136 AromaticContact CE1-CD2 3.61Å; Y131-H136 AromaticContact CE1-NE2 3.7Å; Y131-H136 AromaticContact CZ-CD2 3.89Å; Y131-H136 AromaticContact CZ-NE2 3.6Å; Y131-H136 PolarHBondContact OH-NE2 3.27Å; Y131-H136 VanDerWaalsContact OH-NE2 3.07Å; Y131-L228 HydrophobicContact CD1-CD2 3.9Å; Y131-L228 HydrophobicContact CD2-CD2 3.78Å; Y131-L228 HydrophobicContact CE1-CD2 4.39Å; Y131-L228 HydrophobicContact CE2-CD2 4.28Å; Y131-L228 HydrophobicContact CG-CD2 3.58Å; Y131-L231 HydrophobicContact CD2-CB 4.37Å; Y131-L231 HydrophobicContact CE2-CB 3.92Å; Y131-L231 HydrophobicContact CE2-CD1 3.87Å; Y131-I232 HydrophobicContact CD2-CG1 4.1Å
132I91.3Very high89.5Confident35 Ų3550.3 Ų50.318%0.17924%0.242CC..Hα-helixtrans-61.4-44.4179.4-63.5168.1000110.5I128 E129 V134 H136 R139 A140 V143 V144I128-I132 HydrophobicContact CG2-CD1 3.9Å; I128-I132 WeakPolarHBondContact O-CG1 3.11Å; I128-I132 PolarHBondContact O-N 3.09Å; E129-I132 PolarHBondContact O-N 2.98Å; I132-V134 VanDerWaalsContact C-N 3.3Å; I132-V134 PolarHBondContact O-N 3.41Å; I132-H136 CarbonylContact O-C 3.49Å; I132-H136 VanDerWaalsContact O-C 3.25Å; I132-H136 WeakPolarHBondContact O-CA 3.14Å; I132-H136 PolarHBondContact O-N 2.89Å; I132-H136 VanDerWaalsContact O-O 3.13Å; I132-R139 HydrophobicContact CG2-CB 4.4Å; I132-A140 HydrophobicContact CG2-CB 4.38Å; I132-V143 HydrophobicContact CD1-CG1 4.26Å; I132-V143 HydrophobicContact CG2-CB 4.45Å; I132-V144 HydrophobicContact CB-CG2 4.49Å; I132-V144 HydrophobicContact CG2-CG2 4.08Å
133A87.6Confident89.2Confident14 Ų1452 Ų5212%0.11625%0.252CS..Hα-helixtrans-63.5-30.3-178.600000114.3E129 R130 Y131E129-A133 VanDerWaalsContact O-CB 3.29Å; E129-A133 WeakPolarHBondContact O-CB 3.41Å; E129-A133 PolarHBondContact O-N 2.9Å; R130-A133 PolarHBondContact O-N 3.32Å; Y131-A133 VanDerWaalsContact C-N 3.34Å; Y131-A133 PolarHBondContact O-N 2.88Å
134V84.9Confident89.1Confident12 Ų1253.6 Ų53.67%0.07326%0.262CS..Hα-helixtrans-99.1-46.5-176.4178.70000112.2R130 Y131 I132 I232 L236R130-V134 WeakPolarHBondContact O-CB 3.47Å; R130-V134 WeakPolarHBondContact O-CG2 3.16Å; R130-V134 PolarHBondContact O-N 2.91Å; Y131-V134 PolarHBondContact O-N 2.98Å; I132-V134 VanDerWaalsContact C-N 3.3Å; I132-V134 PolarHBondContact O-N 3.41Å; V134-I232 HydrophobicContact CB-CG2 4.18Å; V134-I232 HydrophobicContact CG1-CG2 3.76Å; V134-L236 HydrophobicContact CG1-CD2 3.88Å; V134-L236 HydrophobicContact CG1-CG 4.4Å
135V87.9Confident89Confident26 Ų2655.2 Ų55.216%0.15827%0.272CS..Hα-helixtrans-83.4-33.6-173.9-1770000111.7Y131 P137 I232 Q235Y131-V135 HydrophobicContact CD2-CB 4.17Å; Y131-V135 HydrophobicContact CD2-CG2 3.64Å; Y131-V135 HydrophobicContact CE2-CB 3.89Å; Y131-V135 HydrophobicContact CE2-CG1 4Å; Y131-V135 HydrophobicContact CE2-CG2 3.62Å; Y131-V135 HydrophobicContact CG-CG2 4.45Å; Y131-V135 WeakPolarHBondContact O-CB 3.27Å; Y131-V135 PolarHBondContact O-N 3.4Å; V135-P137 VanDerWaalsContact C-CD 3.48Å; V135-P137 VanDerWaalsContact O-CD 3.3Å; V135-P137 WeakPolarHBondContact O-CD 3.24Å; V135-I232 HydrophobicContact CG2-CG1 4.09Å; V135-Q235 HydrophobicContact CG2-CB 4.19Å; V135-Q235 HydrophobicContact CG2-CG 4.35Å
136H87.4Confident88.9Confident65 Ų6560.8 Ų60.830%0.30129%0.29SS..  trans-123.366.6-173.9-63.3-68.9000112.3Y131 I132 L138 R139 A140Y131-H136 AromaticContact CE1-CD2 3.61Å; Y131-H136 AromaticContact CE1-NE2 3.7Å; Y131-H136 AromaticContact CZ-CD2 3.89Å; Y131-H136 AromaticContact CZ-NE2 3.6Å; Y131-H136 PolarHBondContact OH-NE2 3.27Å; Y131-H136 VanDerWaalsContact OH-NE2 3.07Å; I132-H136 CarbonylContact O-C 3.49Å; I132-H136 VanDerWaalsContact O-C 3.25Å; I132-H136 WeakPolarHBondContact O-CA 3.14Å; I132-H136 PolarHBondContact O-N 2.89Å; I132-H136 VanDerWaalsContact O-O 3.13Å; H136-L138 VanDerWaalsContact C-N 3.29Å; H136-L138 PolarHBondContact O-N 2.91Å; H136-R139 HydrophobicContact CB-CB 3.89Å; H136-R139 HydrophobicContact CB-CG 3.97Å; H136-R139 WeakPolarHBondContact O-CA 3.32Å; H136-R139 PolarHBondContact O-N 3.4Å; H136-A140 PolarHBondContact O-N 3.38Å
137P84.1Confident89Confident83 Ų8365 Ų6554%0.53932%0.316SS..Hα-helixtrans-63-29.5-170.325.1-35.5000114.4V135V135-P137 VanDerWaalsContact C-CD 3.48Å; V135-P137 VanDerWaalsContact O-CD 3.3Å; V135-P137 WeakPolarHBondContact O-CD 3.24Å
138L86Confident89.1Confident135 Ų13568.9 Ų68.971%0.70733%0.334SS*.Hα-helixtrans-69.9-39.4173.2-64.5177.7000111.1H136 Y142H136-L138 VanDerWaalsContact C-N 3.29Å; H136-L138 PolarHBondContact O-N 2.91Å; L138-Y142 WeakPolarHBondContact O-CD1 3.16Å; L138-Y142 WeakPolarHBondContact O-CE1 3.31Å
139R88.1Confident89.2Confident148 Ų14865.2 Ų65.256%0.55832%0.316SS*.Hα-helixtrans-67.9-38.4175.3-54.1-153.2171.2175.7-3.3112.8I132 H136 K141 Y142 V143I132-R139 HydrophobicContact CG2-CB 4.4Å; H136-R139 HydrophobicContact CB-CB 3.89Å; H136-R139 HydrophobicContact CB-CG 3.97Å; H136-R139 WeakPolarHBondContact O-CA 3.32Å; H136-R139 PolarHBondContact O-N 3.4Å; R139-K141 PolarHBondContact O-N 3.27Å; R139-K141 VanDerWaalsContact O-N 3.17Å; R139-Y142 HydrophobicContact CB-CE1 4.12Å; R139-Y142 HydrophobicContact CB-CE2 4.19Å; R139-Y142 WeakPolarHBondContact CB-OH 3.21Å; R139-Y142 VanDerWaalsContact CD-OH 3.24Å; R139-Y142 WeakPolarHBondContact CD-OH 3.29Å; R139-Y142 HydrophobicContact CG-CE1 4.34Å; R139-Y142 WeakPolarHBondContact CG-OH 3.45Å; R139-Y142 WeakPolarHBondContact O-CD2 3.27Å; R139-Y142 PolarHBondContact O-N 2.89Å; R139-Y142 VanDerWaalsContact O-N 3.13Å; R139-V143 WeakPolarHBondContact O-CG2 3.4Å; R139-V143 PolarHBondContact O-N 3.46Å
140A87.4Confident89.4Confident17 Ų1770.3 Ų70.314%0.1434%0.337CS..Hα-helixtrans-56.9-33.3179.100000113.3I132 H136 Y142 V144I132-A140 HydrophobicContact CG2-CB 4.38Å; H136-A140 PolarHBondContact O-N 3.38Å; A140-Y142 PolarHBondContact O-N 3.03Å; A140-V144 HydrophobicContact CB-CG2 4.05Å; A140-V144 WeakPolarHBondContact O-CB 3.43Å; A140-V144 PolarHBondContact O-N 2.86Å
141K84.7Confident89.8Confident174 Ų17477.1 Ų77.176%0.75736%0.363SS*.Hα-helixtrans-59.7-32179.4-72.7-174.6178.5-177.90113.4R139R139-K141 PolarHBondContact O-N 3.27Å; R139-K141 VanDerWaalsContact O-N 3.17Å
142Y87Confident90.1Very high142 Ų14276.5 Ų76.556%0.55736%0.364SS*.Hα-helixtrans-106.3-29-178.357.7-105000113.7L138 R139 A140 T145L138-Y142 WeakPolarHBondContact O-CD1 3.16Å; L138-Y142 WeakPolarHBondContact O-CE1 3.31Å; R139-Y142 HydrophobicContact CB-CE1 4.12Å; R139-Y142 HydrophobicContact CB-CE2 4.19Å; R139-Y142 WeakPolarHBondContact CB-OH 3.21Å; R139-Y142 VanDerWaalsContact CD-OH 3.24Å; R139-Y142 WeakPolarHBondContact CD-OH 3.29Å; R139-Y142 HydrophobicContact CG-CE1 4.34Å; R139-Y142 WeakPolarHBondContact CG-OH 3.45Å; R139-Y142 WeakPolarHBondContact O-CD2 3.27Å; R139-Y142 PolarHBondContact O-N 2.89Å; R139-Y142 VanDerWaalsContact O-N 3.13Å; A140-Y142 PolarHBondContact O-N 3.03Å; Y142-T145 WeakPolarHBondContact O-CG2 3.33Å
143V87.1Confident90.4Very high36 Ų3676 Ų7622%0.21836%0.362CS..Hα-helixtrans-86.4-40.3179.8-1750000112.6I132 R139 T145 H148I132-V143 HydrophobicContact CD1-CG1 4.26Å; I132-V143 HydrophobicContact CG2-CB 4.45Å; R139-V143 WeakPolarHBondContact O-CG2 3.4Å; R139-V143 PolarHBondContact O-N 3.46Å; V143-T145 PolarHBondContact O-N 3.04Å; V143-H148 WeakPolarHBondContact O-CB 3.46Å
144V89Confident90.9Very high34 Ų3481 Ų8121%0.20639%0.386CS..SBendtrans-8667.3-171.7-173.80000109.3P65 E129 I132 A140P65-V144 HydrophobicContact CB-CG1 3.86Å; P65-V144 HydrophobicContact CG-CG1 3.97Å; P65-V144 WeakPolarHBondContact CG-O 3.36Å; E129-V144 HydrophobicContact CG-CG1 3.85Å; E129-V144 HydrophobicContact CG-CG2 4.35Å; I132-V144 HydrophobicContact CB-CG2 4.49Å; I132-V144 HydrophobicContact CG2-CG2 4.08Å; A140-V144 HydrophobicContact CB-CG2 4.05Å; A140-V144 WeakPolarHBondContact O-CB 3.43Å; A140-V144 PolarHBondContact O-N 2.86Å
145T92.7Very high91.5Very high51 Ų5184.5 Ų84.531%0.31341%0.407SS..  trans-111.7159179.669.50000111.4Y142 V143 H148 A149Y142-T145 WeakPolarHBondContact O-CG2 3.33Å; V143-T145 PolarHBondContact O-N 3.04Å; T145-H148 PolarHBondContact O-N 2.96Å; T145-H148 VanDerWaalsContact OG1-CB 3.23Å; T145-H148 WeakPolarHBondContact OG1-CB 3.26Å; T145-H148 PolarHBondContact OG1-N 3.43Å; T145-A149 PolarHBondContact O-N 3.33Å
146R92.4Very high92Very high130 Ų13083.9 Ų83.949%0.49140%0.403SS..Hα-helixtrans-65.2-41.1179.7-62.1173.6-176.9159.3-0.4111.5W63 P65 Y68 A149 K150W63-R146 VanDerWaalsContact O-CZ 3.22Å; W63-R146 PolarHBondContact O-NE 3.38Å; W63-R146 PolarHBondContact O-NH2 3.45Å; P65-R146 HydrophobicContact CG-CG 4.45Å; Y68-R146 HydrophobicContact CE2-CB 4.24Å; Y68-R146 HydrophobicContact CE2-CG 4.13Å; R146-A149 PolarHBondContact O-N 3.14Å; R146-K150 WeakPolarHBondContact O-CG 3.31Å; R146-K150 PolarHBondContact O-N 3.44Å
147T93.9Very high92.5Very high93 Ų9383.4 Ų83.457%0.57140%0.399SS*.Hα-helixtrans-64.6-42.7-179.9-26.90000110.8K150 R151T147-K150 PolarHBondContact O-N 3.31Å; T147-R151 WeakPolarHBondContact O-CG 3.36Å; T147-R151 PolarHBondContact O-N 2.97Å; T147-R151 VanDerWaalsContact O-N 3.16Å
148H94.6Very high93.2Very high80 Ų8082.7 Ų82.737%0.3740%0.396SS..Hα-helixtrans-62.1-47.9173.5-176.1-87.2000111.4V143 T145 K150 R151 V152V143-H148 WeakPolarHBondContact O-CB 3.46Å; T145-H148 PolarHBondContact O-N 2.96Å; T145-H148 VanDerWaalsContact OG1-CB 3.23Å; T145-H148 WeakPolarHBondContact OG1-CB 3.26Å; T145-H148 PolarHBondContact OG1-N 3.43Å; H148-K150 VanDerWaalsContact C-N 3.33Å; H148-K150 PolarHBondContact O-N 3.48Å; H148-R151 WeakPolarHBondContact O-CB 3.45Å; H148-R151 PolarHBondContact O-N 3.38Å; H148-R151 VanDerWaalsContact O-N 3.1Å; H148-V152 VanDerWaalsContact CE1-CG2 3.41Å; H148-V152 WeakPolarHBondContact CE1-CG2 3.31Å; H148-V152 WeakPolarHBondContact O-CG2 3.12Å; H148-V152 PolarHBondContact O-N 3.5Å
149A95.4Very high93.7Very high0 Ų080.1 Ų80.10%038%0.381CS..Hα-helixtrans-57.3-43.2178.300000112.8P65 Y69 T145 R146 R151 V152 I153P65-A149 HydrophobicContact CB-CB 4.07Å; Y69-A149 HydrophobicContact CE2-CB 3.94Å; T145-A149 PolarHBondContact O-N 3.33Å; R146-A149 PolarHBondContact O-N 3.14Å; A149-R151 VanDerWaalsContact C-N 3.35Å; A149-R151 PolarHBondContact O-N 3.27Å; A149-V152 PolarHBondContact O-N 2.89Å; A149-I153 WeakPolarHBondContact O-CD1 3.22Å; A149-I153 VanDerWaalsContact O-CG1 3.29Å; A149-I153 WeakPolarHBondContact O-CG1 3.09Å; A149-I153 PolarHBondContact O-N 3.5Å
150K95.9Very high94.1Very high115 Ų11573 Ų7350%0.536%0.355SS..Hα-helixtrans-60.6-41.8175.3-71.6179.3179-171.70112.6Y68 R146 T147 H148 I153 L154Y68-K150 HydrophobicContact CD1-CG 4.33Å; Y68-K150 VanDerWaalsContact CE1-CE 3.47Å; Y68-K150 HydrophobicContact CE1-CG 4.26Å; Y68-K150 WeakPolarHBondContact OH-CE 3.44Å; R146-K150 WeakPolarHBondContact O-CG 3.31Å; R146-K150 PolarHBondContact O-N 3.44Å; T147-K150 PolarHBondContact O-N 3.31Å; H148-K150 VanDerWaalsContact C-N 3.33Å; H148-K150 PolarHBondContact O-N 3.48Å; K150-I153 PolarHBondContact O-N 3.02Å; K150-L154 PolarHBondContact O-N 3.44Å
151R97.1Very high94.6Very high181 Ų18175.3 Ų75.368%0.68337%0.366SS*.Hα-helixtrans-64-45.7176.3-71.6178.5-179.8-177.3-0.8111.6T147 H148 A149 I153 L154 T155T147-R151 WeakPolarHBondContact O-CG 3.36Å; T147-R151 PolarHBondContact O-N 2.97Å; T147-R151 VanDerWaalsContact O-N 3.16Å; H148-R151 WeakPolarHBondContact O-CB 3.45Å; H148-R151 PolarHBondContact O-N 3.38Å; H148-R151 VanDerWaalsContact O-N 3.1Å; A149-R151 VanDerWaalsContact C-N 3.35Å; A149-R151 PolarHBondContact O-N 3.27Å; R151-I153 VanDerWaalsContact C-N 3.34Å; R151-I153 PolarHBondContact O-N 3.01Å; R151-L154 PolarHBondContact O-N 3.15Å; R151-T155 PolarHBondContact O-N 2.9Å; R151-T155 PolarHBondContact O-OG1 3.34Å; R151-T155 VanDerWaalsContact O-OG1 3.13Å
152V97.6Very high95.2Very high35 Ų3572.4 Ų72.421%0.21236%0.359CS..Hα-helixtrans-59.8-45.8176.9175.90000110.8Y69 A125 H148 A149 L154 T155 V156Y69-V152 HydrophobicContact CE1-CB 4.11Å; Y69-V152 HydrophobicContact CE1-CG1 3.78Å; A125-V152 HydrophobicContact CB-CG1 3.96Å; H148-V152 VanDerWaalsContact CE1-CG2 3.41Å; H148-V152 WeakPolarHBondContact CE1-CG2 3.31Å; H148-V152 WeakPolarHBondContact O-CG2 3.12Å; H148-V152 PolarHBondContact O-N 3.5Å; A149-V152 PolarHBondContact O-N 2.89Å; V152-L154 PolarHBondContact O-N 2.75Å; V152-T155 WeakPolarHBondContact O-CB 3.39Å; V152-T155 PolarHBondContact O-N 3.43Å; V152-V156 HydrophobicContact CG1-CG2 4.36Å; V152-V156 WeakPolarHBondContact O-CG2 3.19Å; V152-V156 PolarHBondContact O-N 3.03Å
153I97.9Very high95.7Very high25 Ų2567.1 Ų67.113%0.12834%0.342CS..Hα-helixtrans-59.7-46.6177.5-70.4163.3000110.7Y68 Y69 S72 A149 K150 R151 T155 V156 W157Y68-I153 WeakPolarHBondContact O-CD1 3.47Å; Y69-I153 HydrophobicContact CD1-CD1 4.19Å; Y69-I153 HydrophobicContact CD1-CG1 3.85Å; Y69-I153 HydrophobicContact CE1-CG1 3.99Å; S72-I153 WeakPolarHBondContact OG-CG2 3.49Å; A149-I153 WeakPolarHBondContact O-CD1 3.22Å; A149-I153 VanDerWaalsContact O-CG1 3.29Å; A149-I153 WeakPolarHBondContact O-CG1 3.09Å; A149-I153 PolarHBondContact O-N 3.5Å; K150-I153 PolarHBondContact O-N 3.02Å; R151-I153 VanDerWaalsContact C-N 3.34Å; R151-I153 PolarHBondContact O-N 3.01Å; I153-T155 VanDerWaalsContact C-N 3.29Å; I153-T155 PolarHBondContact O-N 2.84Å; I153-V156 WeakPolarHBondContact O-CB 3.45Å; I153-V156 PolarHBondContact O-N 2.9Å; I153-V156 VanDerWaalsContact O-N 3.11Å; I153-W157 VanDerWaalsContact O-CD1 3.22Å; I153-W157 PolarHBondContact O-N 3.11Å
154L97.8Very high96.1Very high120 Ų12065.4 Ų65.463%0.62833%0.332SS*.Hα-helixtrans-57.6-42.8176.5-178.464.7000112K150 R151 V152 S158K150-L154 PolarHBondContact O-N 3.44Å; R151-L154 PolarHBondContact O-N 3.15Å; V152-L154 PolarHBondContact O-N 2.75Å; L154-S158 WeakPolarHBondContact O-CB 3.4Å; L154-S158 PolarHBondContact O-N 3.2Å; L154-S158 PolarHBondContact O-OG 2.85Å
155T97.8Very high96.5Very high84 Ų8467.5 Ų67.552%0.51534%0.344SS..Hα-helixtrans-63.3-42.6174.7-56.90000111.8R151 V152 I153 S158 M159R151-T155 PolarHBondContact O-N 2.9Å; R151-T155 PolarHBondContact O-OG1 3.34Å; R151-T155 VanDerWaalsContact O-OG1 3.13Å; V152-T155 WeakPolarHBondContact O-CB 3.39Å; V152-T155 PolarHBondContact O-N 3.43Å; I153-T155 VanDerWaalsContact C-N 3.29Å; I153-T155 PolarHBondContact O-N 2.84Å; T155-S158 PolarHBondContact O-N 2.94Å; T155-M159 HydrophobicContact CG2-CG 4.21Å; T155-M159 WeakPolarHBondContact O-CB 3.42Å; T155-M159 VanDerWaalsContact O-CG 3.27Å; T155-M159 WeakPolarHBondContact O-CG 3.15Å; T155-M159 PolarHBondContact O-N 3.42Å
156V97.9Very high96.6Very high13 Ų1368.1 Ų68.18%0.07935%0.349CS..Hα-helixtrans-56.7-53.2176.7163.80000110.5L121 V152 I153 S158 M159 S160L121-V156 HydrophobicContact CB-CB 4.35Å; L121-V156 HydrophobicContact CB-CG1 3.6Å; L121-V156 HydrophobicContact CB-CG2 4.04Å; L121-V156 HydrophobicContact CD1-CG1 4.33Å; V152-V156 HydrophobicContact CG1-CG2 4.36Å; V152-V156 WeakPolarHBondContact O-CG2 3.19Å; V152-V156 PolarHBondContact O-N 3.03Å; I153-V156 WeakPolarHBondContact O-CB 3.45Å; I153-V156 PolarHBondContact O-N 2.9Å; I153-V156 VanDerWaalsContact O-N 3.11Å; V156-S158 PolarHBondContact O-N 3.4Å; V156-M159 PolarHBondContact O-N 3.44Å; V156-S160 PolarHBondContact O-N 2.99Å; V156-S160 PolarHBondContact O-OG 3.43Å
157W98.3Very high96.7Very high56 Ų5662.3 Ų62.321%0.21233%0.328CS..Hα-helixtrans-63.6-40.4180-76.595000112.6S72 V75 L79 M114 A118 I153 S160 V161S72-W157 PolarHBondContact OG-NE1 3.32Å; S72-W157 VanDerWaalsContact OG-NE1 3.08Å; V75-W157 HydrophobicContact CG1-CH2 4.2Å; V75-W157 HydrophobicContact CG1-CZ2 4.1Å; L79-W157 HydrophobicContact CD1-CH2 3.78Å; L79-W157 HydrophobicContact CD1-CZ3 4.01Å; M114-W157 HydrophobicContact CE-CZ3 4.15Å; M114-W157 HydrophobicContact SD-CE3 3.76Å; M114-W157 HydrophobicContact SD-CZ3 3.47Å; M114-W157 WeakPolarHBondContact SD-CZ3 3.01Å; A118-W157 HydrophobicContact CB-CE3 4.36Å; A118-W157 HydrophobicContact CB-CH2 4.42Å; A118-W157 HydrophobicContact CB-CZ3 4.32Å; I153-W157 VanDerWaalsContact O-CD1 3.22Å; I153-W157 PolarHBondContact O-N 3.11Å; W157-S160 PolarHBondContact O-N 3.37Å; W157-V161 WeakPolarHBondContact O-CG2 3.48Å; W157-V161 PolarHBondContact O-N 3.22Å
158S98.1Very high96.8Very high67 Ų6758.4 Ų58.447%0.46930%0.304SS..Hα-helixtrans-63-43.5177.6-55.50000111.6L154 T155 V156 V161 L162L154-S158 WeakPolarHBondContact O-CB 3.4Å; L154-S158 PolarHBondContact O-N 3.2Å; L154-S158 PolarHBondContact O-OG 2.85Å; T155-S158 PolarHBondContact O-N 2.94Å; V156-S158 PolarHBondContact O-N 3.4Å; S158-V161 PolarHBondContact O-N 3.42Å; S158-L162 WeakPolarHBondContact O-CB 3.21Å; S158-L162 PolarHBondContact O-N 3.49Å
159M97.1Very high96.9Very high81 Ų8157.6 Ų57.640%0.39931%0.308SS..Hα-helixtrans-64.5-43.6175.8-75.2-62.7-58.600111.6L121 T155 V156 V161 L162 C163L121-M159 HydrophobicContact CD1-CB 4.17Å; T155-M159 HydrophobicContact CG2-CG 4.21Å; T155-M159 WeakPolarHBondContact O-CB 3.42Å; T155-M159 VanDerWaalsContact O-CG 3.27Å; T155-M159 WeakPolarHBondContact O-CG 3.15Å; T155-M159 PolarHBondContact O-N 3.42Å; V156-M159 PolarHBondContact O-N 3.44Å; M159-V161 PolarHBondContact O-N 2.92Å; M159-L162 PolarHBondContact O-N 3Å; M159-C163 VanDerWaalsContact O-CB 3.29Å; M159-C163 WeakPolarHBondContact O-CB 3.45Å; M159-C163 PolarHBondContact O-N 2.95Å; M159-C163 PolarHBondContact O-SG 3.33Å; M159-C163 VanDerWaalsContact O-SG 3.36Å
160S97.8Very high96.9Very high0 Ų057.8 Ų57.80%031%0.308CS..Hα-helixtrans-60.3-44.1177.1-620000112.5M114 A118 V156 W157 A164M114-S160 WeakPolarHBondContact O-CB 3.49Å; A118-S160 WeakPolarHBondContact CA-OG 3.24Å; A118-S160 WeakPolarHBondContact CB-OG 3.34Å; A118-S160 PolarHBondContact N-OG 3.1Å; V156-S160 PolarHBondContact O-N 2.99Å; V156-S160 PolarHBondContact O-OG 3.43Å; W157-S160 PolarHBondContact O-N 3.37Å; S160-A164 VanDerWaalsContact O-CB 3.27Å; S160-A164 WeakPolarHBondContact O-CB 3.23Å; S160-A164 PolarHBondContact O-N 3.35Å
161V97.6Very high96.8Very high64 Ų6453.5 Ų53.539%0.38829%0.29SS..Hα-helixtrans-61-50.3175.6164.20000110.6F110 M114 W157 S158 M159 C163 A164F110-V161 HydrophobicContact CE2-CG1 4.38Å; F110-V161 HydrophobicContact CZ-CB 4.34Å; F110-V161 HydrophobicContact CZ-CG1 3.98Å; F110-V161 HydrophobicContact CZ-CG2 4.18Å; M114-V161 HydrophobicContact CG-CG2 3.88Å; W157-V161 WeakPolarHBondContact O-CG2 3.48Å; W157-V161 PolarHBondContact O-N 3.22Å; S158-V161 PolarHBondContact O-N 3.42Å; M159-V161 PolarHBondContact O-N 2.92Å; V161-C163 PolarHBondContact O-N 3.31Å; V161-A164 PolarHBondContact O-N 3.02Å
162L97.3Very high96.8Very high114 Ų11445 Ų4560%0.59726%0.259SS*.Hα-helixtrans-61.4-44.4-178.2-179.561.6000112S158 M159 A164 V165 P166S158-L162 WeakPolarHBondContact O-CB 3.21Å; S158-L162 PolarHBondContact O-N 3.49Å; M159-L162 PolarHBondContact O-N 3Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-A164 PolarHBondContact O-N 2.91Å; L162-V165 PolarHBondContact O-N 3.33Å; L162-P166 WeakPolarHBondContact O-CD 3.48Å
163C96.2Very high96.7Very high30 Ų3045.5 Ų45.520%0.20326%0.26CS..Hα-helixtrans-76.6-16.8-177.9-68.30000113.7L117 M159 V161 P166 F217L117-C163 HydrophobicContact CD1-CB 3.58Å; M159-C163 VanDerWaalsContact O-CB 3.29Å; M159-C163 WeakPolarHBondContact O-CB 3.45Å; M159-C163 PolarHBondContact O-N 2.95Å; M159-C163 PolarHBondContact O-SG 3.33Å; M159-C163 VanDerWaalsContact O-SG 3.36Å; V161-C163 PolarHBondContact O-N 3.31Å; C163-P166 WeakPolarHBondContact O-CD 3.21Å; C163-F217 HydrophobicContact CB-CE2 4.12Å; C163-F217 HydrophobicContact CB-CZ 3.9Å
164A96.8Very high96.5Very high0 Ų047.8 Ų47.80%027%0.269CS..Hα-helixtrans-76-25173.700000113.4F110 E113 M114 S160 V161 L162 T168F110-A164 HydrophobicContact CD2-CB 3.85Å; F110-A164 HydrophobicContact CE2-CB 3.85Å; E113-A164 HydrophobicContact CB-CB 3.95Å; E113-A164 HydrophobicContact CG-CB 3.98Å; M114-A164 HydrophobicContact CB-CB 3.86Å; S160-A164 VanDerWaalsContact O-CB 3.27Å; S160-A164 WeakPolarHBondContact O-CB 3.23Å; S160-A164 PolarHBondContact O-N 3.35Å; V161-A164 PolarHBondContact O-N 3.02Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-A164 PolarHBondContact O-N 2.91Å; A164-T168 WeakPolarHBondContact O-CB 3.4Å; A164-T168 PolarHBondContact O-N 2.92Å; A164-T168 VanDerWaalsContact O-N 3.13Å; A164-T168 PolarHBondContact O-OG1 2.95Å
165V96.4Very high96.2Very high78 Ų7843.5 Ų43.547%0.47325%0.248SC..Hα-helixtrans-61.4-48.1-175.6174.30000113.1F110 L162 N167 T168 S169F110-V165 HydrophobicContact CE2-CG2 4.23Å; L162-V165 PolarHBondContact O-N 3.33Å; V165-N167 PolarHBondContact O-N 2.93Å; V165-T168 WeakPolarHBondContact O-CB 3.31Å; V165-T168 PolarHBondContact O-N 3Å; V165-S169 PolarHBondContact O-N 3.37Å
166P95.3Very high95.7Very high65 Ų6540 Ų4042%0.42223%0.227SC..Hα-helixtrans-55.5-50.6-179.7-27.435.6000112.7L162 C163 T168 S169 L170 T209L162-P166 WeakPolarHBondContact O-CD 3.48Å; C163-P166 WeakPolarHBondContact O-CD 3.21Å; P166-T168 VanDerWaalsContact C-N 3.32Å; P166-T168 PolarHBondContact O-N 2.93Å; P166-S169 PolarHBondContact O-N 3Å; P166-S169 PolarHBondContact O-OG 2.83Å; P166-L170 WeakPolarHBondContact O-CG 3.47Å; P166-T209 HydrophobicContact CB-CG2 4.49Å
167N94.2Very high95Very high7 Ų742.9 Ų42.94%0.03724%0.239CC..Hα-helixtrans-61.3-41.4178.5-174.857.8000112E113 V165 S169 L170 H171 T209E113-N167 HydrophobicContact CG-CB 4.18Å; E113-N167 PolarHBondContact OE2-ND2 2.88Å; V165-N167 PolarHBondContact O-N 2.93Å; N167-S169 VanDerWaalsContact C-N 3.33Å; N167-S169 PolarHBondContact O-N 3Å; N167-L170 PolarHBondContact O-N 3.42Å; N167-H171 PolarHBondContact O-ND1 2.94Å; N167-T209 HydrophobicContact CB-CG2 4.1Å
168T96.4Very high94.1Very high12 Ų1243.3 Ų43.37%0.07424%0.244CC..Hα-helixtrans-60.4-42.1177.2-550000111.9Y106 F110 A164 V165 P166 L170 H171Y106-T168 HydrophobicContact CD1-CG2 4.05Å; Y106-T168 HydrophobicContact CG-CG2 4.48Å; Y106-T168 WeakPolarHBondContact O-CG2 3.31Å; F110-T168 WeakPolarHBondContact CA-OG1 3.44Å; F110-T168 HydrophobicContact CB-CG2 3.93Å; F110-T168 WeakPolarHBondContact CB-OG1 3.47Å; F110-T168 PolarHBondContact N-OG1 3.45Å; A164-T168 WeakPolarHBondContact O-CB 3.4Å; A164-T168 PolarHBondContact O-N 2.92Å; A164-T168 VanDerWaalsContact O-N 3.13Å; A164-T168 PolarHBondContact O-OG1 2.95Å; V165-T168 WeakPolarHBondContact O-CB 3.31Å; V165-T168 PolarHBondContact O-N 3Å; P166-T168 VanDerWaalsContact C-N 3.32Å; P166-T168 PolarHBondContact O-N 2.93Å; T168-L170 PolarHBondContact O-N 3.22Å; T168-L170 VanDerWaalsContact O-N 3.14Å; T168-H171 PolarHBondContact O-N 2.84Å; T168-H171 VanDerWaalsContact O-N 3.12Å
169S95.8Very high93Very high63 Ų6343.8 Ų43.844%0.44124%0.239SC..Hα-helixtrans-65.2-17.1-178.376.70000114.3V165 P166 N167V165-S169 PolarHBondContact O-N 3.37Å; P166-S169 PolarHBondContact O-N 3Å; P166-S169 PolarHBondContact O-OG 2.83Å; N167-S169 VanDerWaalsContact C-N 3.33Å; N167-S169 PolarHBondContact O-N 3Å
170L95.3Very high91.7Very high3 Ų343.1 Ų43.12%0.01624%0.243CC..THydrogen-bonded Turntrans-83.5-18.3178.1-58.4178.5000113.3P166 N167 T168 V200 K201 M205 Y206 T209P166-L170 WeakPolarHBondContact O-CG 3.47Å; N167-L170 PolarHBondContact O-N 3.42Å; T168-L170 PolarHBondContact O-N 3.22Å; T168-L170 VanDerWaalsContact O-N 3.14Å; L170-V200 PolarHBondContact O-N 3.4Å; L170-K201 HydrophobicContact CB-CB 4.32Å; L170-K201 HydrophobicContact CB-CG 4.47Å; L170-K201 HydrophobicContact CD2-CB 3.7Å; L170-K201 HydrophobicContact CD2-CG 3.96Å; L170-K201 PolarHBondContact O-N 3Å; L170-M205 HydrophobicContact CD2-CB 3.83Å; L170-M205 HydrophobicContact CD2-CE 3.96Å; L170-M205 HydrophobicContact CD2-SD 4.45Å; L170-Y206 HydrophobicContact CD1-CD2 4.19Å; L170-T209 HydrophobicContact CD1-CG2 4.33Å
171H95.3Very high90.4Very high25 Ų2548.3 Ų48.312%0.11627%0.274CS..EExtended strand (participates in β ladder)trans-91.9161.1-178.5-67.471.3000111.2Y106 T109 N167 T168 T198 Y206Y106-H171 VanDerWaalsContact CE1-O 3.23Å; Y106-H171 WeakPolarHBondContact CE1-O 3.19Å; T109-H171 HydrophobicContact CG2-CB 4.32Å; N167-H171 PolarHBondContact O-ND1 2.94Å; T168-H171 PolarHBondContact O-N 2.84Å; T168-H171 VanDerWaalsContact O-N 3.12Å; H171-T198 CarbonylContact C-O 3.42Å; H171-T198 VanDerWaalsContact CA-O 3.28Å; H171-T198 WeakPolarHBondContact CA-O 3.42Å; H171-Y206 AromaticContact CE1-CE2 3.8Å
172G95.8Very high89.1Confident4 Ų446.7 Ų46.74%0.04127%0.271CS..EExtended strand (participates in β ladder)trans-177.9-174.7178.500000111.2C105 C197 T198C105-G172 PolarHBondContact SG-O 3Å; G172-C197 WeakPolarHBondContact O-CA 2.91Å; G172-T198 PolarHBondContact N-O 3.38Å; G172-T198 PolarHBondContact O-N 2.87Å; G172-T198 VanDerWaalsContact O-O 3.1Å
173I95.4Very high87.7Confident45 Ų4548.6 Ų48.623%0.23129%0.29CS..EExtended strand (participates in β ladder)trans-87.5127.6174.2-59.9-61.3000109F98 K102 C105 T175 A195 I196 C197F98-I173 HydrophobicContact CB-CD1 4.47Å; F98-I173 HydrophobicContact CD1-CD1 3.62Å; F98-I173 HydrophobicContact CE1-CD1 4.29Å; F98-I173 HydrophobicContact CG-CD1 4.34Å; K102-I173 HydrophobicContact CB-CG1 4.46Å; K102-I173 HydrophobicContact CG-CB 4.4Å; K102-I173 HydrophobicContact CG-CG1 3.77Å; C105-I173 HydrophobicContact CB-CD1 3.97Å; I173-T175 HydrophobicContact CG2-CG2 4.37Å; I173-A195 HydrophobicContact CG2-CB 3.98Å; I173-I196 WeakPolarHBondContact CA-O 3.16Å; I173-C197 HydrophobicContact CD1-CB 4.42Å
174F93.3Very high86.6Confident72 Ų7252.1 Ų52.132%0.31632%0.321SS..EExtended strand (participates in β ladder)trans-110.8139.6169.6176-95.2000109.2L176 A195 I196 T198F174-L176 HydrophobicContact CE1-CD2 3.92Å; F174-L176 HydrophobicContact CE1-CG 4.43Å; F174-L176 HydrophobicContact CZ-CD2 4.37Å; F174-A195 CarbonylContact O-C 3.38Å; F174-A195 WeakPolarHBondContact O-CA 3.32Å; F174-I196 HydrophobicContact CB-CG1 4.01Å; F174-I196 HydrophobicContact CD1-CD1 4Å; F174-I196 HydrophobicContact CD1-CG1 3.99Å; F174-I196 PolarHBondContact N-O 3.48Å; F174-I196 PolarHBondContact O-N 3.43Å; F174-T198 HydrophobicContact CB-CG2 3.45Å; F174-T198 VanDerWaalsContact CB-CG2 3.45Å; F174-T198 HydrophobicContact CG-CG2 4.19Å
175T91.5Very high85.6Confident30 Ų3053.9 Ų53.918%0.18434%0.339CS..  trans-127.8146.9177.145.10000109.5I173 H177 A195I173-T175 HydrophobicContact CG2-CG2 4.37Å; T175-H177 PolarHBondContact O-CE1 2.96Å; T175-H177 PolarHBondContact O-ND1 3.28Å; T175-H177 PolarHBondContact OG1-CE1 2.84Å; T175-A195 HydrophobicContact CG2-CB 3.99Å
176L87.8Confident84.5Confident12 Ų1255.3 Ų55.36%0.06334%0.344CS..  trans-78.7142.6173.7-70.5171.6000110Y18 L19 L23 F174 I191 S194Y18-L176 HydrophobicContact CD1-CD1 4.34Å; Y18-L176 HydrophobicContact CE1-CB 4.47Å; Y18-L176 HydrophobicContact CE1-CD1 4.06Å; L19-L176 HydrophobicContact CD2-CD1 4.06Å; L23-L176 HydrophobicContact CD1-CD1 3.83Å; L23-L176 HydrophobicContact CD2-CD1 3.99Å; L23-L176 HydrophobicContact CD2-CG 4.31Å; L23-L176 HydrophobicContact CG-CD1 3.7Å; F174-L176 HydrophobicContact CE1-CD2 3.92Å; F174-L176 HydrophobicContact CE1-CG 4.43Å; F174-L176 HydrophobicContact CZ-CD2 4.37Å; L176-I191 HydrophobicContact CB-CB 4.38Å; L176-I191 HydrophobicContact CB-CD1 3.78Å; L176-I191 HydrophobicContact CB-CG1 4.21Å; L176-I191 PolarHBondContact O-N 3.38Å; L176-S194 PolarHBondContact N-OG 3.5Å
177H84.4Confident83.7Confident73 Ų7356 Ų5634%0.33835%0.347SS..EExtended strand (participates in β ladder)trans-126.3135.4179.8-63.670.4000109.2T175 L189 E190T175-H177 PolarHBondContact O-CE1 2.96Å; T175-H177 PolarHBondContact O-ND1 3.28Å; T175-H177 PolarHBondContact OG1-CE1 2.84Å; H177-L189 CarbonylContact C-O 3.54Å; H177-L189 WeakPolarHBondContact CA-O 3.33Å; H177-E190 IonicContact NE2-OE1 2.91Å
178I78.4Confident83Confident64 Ų6461 Ų6133%0.32837%0.373SS..EExtended strand (participates in β ladder)trans-98.2125.7171-60.9172.9000107.6I6 N188 L189 I191I6-I178 HydrophobicContact CD1-CG2 3.98Å; I178-N188 WeakPolarHBondContact O-CA 3.16Å; I178-L189 PolarHBondContact N-O 3.07Å; I178-L189 PolarHBondContact O-N 3.32Å; I178-I191 HydrophobicContact CD1-CD1 3.67Å; I178-I191 HydrophobicContact CD1-CG1 3.69Å; I178-I191 HydrophobicContact CG1-CD1 3.5Å; I178-I191 HydrophobicContact CG1-CG1 3.59Å
179H75.3Confident82.3Confident78 Ų7865.9 Ų65.936%0.36140%0.399SS..EExtended strand (participates in β ladder)trans-86.9114169.1-170.874.5000109I6 D186 N188I6-H179 HydrophobicContact CD1-CB 3.94Å; I6-H179 VanDerWaalsContact CD1-O 3.3Å; I6-H179 WeakPolarHBondContact CD1-O 3.46Å; H179-D186 IonicContact CE1-OD2 3.64Å; H179-D186 IonicContact NE2-OD1 3.93Å; H179-D186 IonicContact NE2-OD2 3.77Å; H179-N188 PolarHBondContact ND1-OD1 2.97Å
180S70.4Confident81.7Confident67 Ų6768.8 Ų68.847%0.46941%0.405SS..EExtended strand (participates in β ladder)trans-113.9124.6176.6-166.60000109.6V187S180-V187 PolarHBondContact N-O 3.26Å; S180-V187 PolarHBondContact O-N 3.15Å
181V70.2Confident81.2Confident108 Ų10869.2 Ų69.266%0.65541%0.407SS*.EExtended strand (participates in β ladder)trans-93.1104.5175.6-176.10000107.8
182G69.3Low80.8Confident31 Ų3171.7 Ų71.732%0.3243%0.425SS..EExtended strand (participates in β ladder)trans-106.7170.4178.100000112.6A184 G185G182-A184 PolarHBondContact O-N 3.41Å; G182-A184 VanDerWaalsContact O-N 3.09Å; G182-G185 PolarHBondContact N-O 3.37Å; G182-G185 PolarHBondContact O-N 2.92Å
183P67.3Low80.5Confident154 Ų15475.1 Ų75.1100%144%0.443SS*.THydrogen-bonded Turntrans-63.1-14.1174.424-31.7000113.8
184A73.2Confident80.3Confident104 Ų10473 Ų7386%0.8643%0.432SS*.THydrogen-bonded Turntrans-95.25.317600000113.9G182G182-A184 PolarHBondContact O-N 3.41Å; G182-A184 VanDerWaalsContact O-N 3.09Å
185G75.7Confident80.2Confident36 Ų3670.7 Ų70.737%0.37143%0.426SS..EExtended strand (participates in β ladder)trans106-173.8-175.700000113.3G182G182-G185 PolarHBondContact N-O 3.37Å; G182-G185 PolarHBondContact O-N 2.92Å
186D75.1Confident80.4Confident109 Ų10970.5 Ų70.558%0.58342%0.424SS*.EExtended strand (participates in β ladder)trans-75.5122.4-178.4-68.6-9.1000111.1H179H179-D186 IonicContact CE1-OD2 3.64Å; H179-D186 IonicContact NE2-OD1 3.93Å; H179-D186 IonicContact NE2-OD2 3.77Å
187V78.3Confident80.7Confident79 Ų7970.8 Ų70.848%0.47943%0.427SS..EExtended strand (participates in β ladder)trans-115.4123.2176-176.60000109.2S180S180-V187 PolarHBondContact N-O 3.26Å; S180-V187 PolarHBondContact O-N 3.15Å
188N78.8Confident81.1Confident111 Ų11168.9 Ų68.959%0.59442%0.42SS*.EExtended strand (participates in β ladder)trans-94.5109.9169.4-67.6-39.8000108.7I178 H179I178-N188 WeakPolarHBondContact O-CA 3.16Å; H179-N188 PolarHBondContact ND1-OD1 2.97Å
189L81.6Confident81.8Confident116 Ų11667.1 Ų67.161%0.60741%0.412SS*.EExtended strand (participates in β ladder)trans-102.2128.8178.8-17365.5000110.2H177 I178H177-L189 CarbonylContact C-O 3.54Å; H177-L189 WeakPolarHBondContact CA-O 3.33Å; I178-L189 PolarHBondContact N-O 3.07Å; I178-L189 PolarHBondContact O-N 3.32Å
190E84.2Confident82.6Confident124 Ų12466.6 Ų66.658%0.57941%0.414SS*.EExtended strand (participates in β ladder)trans-71.4132.6172.9-69.5-175.7-178.700110.4H177H177-E190 IonicContact NE2-OE1 2.91Å
191I84.7Confident83.7Confident11 Ų1168.7 Ų68.76%0.05642%0.415CS..PPolyproline II helixtrans-79.4128175.4-52.6-177.4000108.8E15 Y18 L19 L176 I178 S194E15-I191 HydrophobicContact CG-CG2 3.82Å; Y18-I191 HydrophobicContact CD1-CD1 3.3Å; Y18-I191 HydrophobicContact CE1-CD1 3.15Å; Y18-I191 HydrophobicContact CG-CD1 4.3Å; L19-I191 HydrophobicContact CD2-CG2 4.08Å; L176-I191 HydrophobicContact CB-CB 4.38Å; L176-I191 HydrophobicContact CB-CD1 3.78Å; L176-I191 HydrophobicContact CB-CG1 4.21Å; L176-I191 PolarHBondContact O-N 3.38Å; I178-I191 HydrophobicContact CD1-CD1 3.67Å; I178-I191 HydrophobicContact CD1-CG1 3.69Å; I178-I191 HydrophobicContact CG1-CD1 3.5Å; I178-I191 HydrophobicContact CG1-CG1 3.59Å; I191-S194 WeakPolarHBondContact O-CB 3.31Å; I191-S194 PolarHBondContact O-OG 2.89Å
192P86.8Confident84.7Confident77 Ų7766.7 Ų66.750%0.540%0.404SS..THydrogen-bonded Turntrans-52.6154171.6-1523.6000111.6E15 S194E15-P192 WeakPolarHBondContact OE1-CB 3.28Å; E15-P192 VanDerWaalsContact OE1-CD 3.25Å; E15-P192 WeakPolarHBondContact OE1-CD 3.39Å; E15-P192 VanDerWaalsContact OE1-CG 3.23Å; E15-P192 WeakPolarHBondContact OE1-CG 3.43Å; P192-S194 PolarHBondContact O-N 3.4Å
193D88.3Confident85.6Confident77 Ų7769.2 Ų69.241%0.41240%0.404SS..THydrogen-bonded Turntrans57.39.5173.5-79.810.2000117R26 Y96 P97R26-D193 IonicContact CZ-OD2 3.03Å; R26-D193 IonicContact NH1-OD2 3.41Å; R26-D193 PolarHBondContact NH1-OD2 2.85Å; R26-D193 IonicContact NH2-OD2 3.58Å; R26-D193 PolarHBondContact NH2-OD2 3.48Å; Y96-D193 WeakPolarHBondContact CD2-O 3.08Å; P97-D193 WeakPolarHBondContact CA-O 3.37Å; P97-D193 HydrophobicContact CB-CB 4.47Å; P97-D193 WeakPolarHBondContact CB-O 3.32Å; P97-D193 HydrophobicContact CG-CB 4.03Å
194S90.9Very high86.8Confident1 Ų170.1 Ų70.11%0.00739%0.388CS..  trans-89.70.7-177.269.50000114.9L176 I191 P192 I196L176-S194 PolarHBondContact N-OG 3.5Å; I191-S194 WeakPolarHBondContact O-CB 3.31Å; I191-S194 PolarHBondContact O-OG 2.89Å; P192-S194 PolarHBondContact O-N 3.4Å; S194-I196 PolarHBondContact O-N 2.83Å
195A93Very high87.8Confident22 Ų2268.2 Ų68.218%0.18236%0.362CS..  trans-68.1126-174.300000111.8P97 F98 I173 F174 T175P97-A195 CarbonylContact C-O 3.54Å; P97-A195 VanDerWaalsContact CA-O 3.23Å; P97-A195 WeakPolarHBondContact CA-O 3.27Å; P97-A195 HydrophobicContact CB-CB 4.25Å; F98-A195 PolarHBondContact N-O 3.12Å; I173-A195 HydrophobicContact CG2-CB 3.98Å; F174-A195 CarbonylContact O-C 3.38Å; F174-A195 WeakPolarHBondContact O-CA 3.32Å; T175-A195 HydrophobicContact CG2-CB 3.99Å
196I94Very high88.5Confident27 Ų2767.5 Ų67.514%0.13835%0.348CS..EExtended strand (participates in β ladder)trans-130.9150.3174.959.3167.4000111.5L23 I173 F174 S194 T198L23-I196 HydrophobicContact CD1-CG2 4.37Å; L23-I196 HydrophobicContact CD2-CD1 4.1Å; L23-I196 HydrophobicContact CD2-CG2 4.48Å; I173-I196 WeakPolarHBondContact CA-O 3.16Å; F174-I196 HydrophobicContact CB-CG1 4.01Å; F174-I196 HydrophobicContact CD1-CD1 4Å; F174-I196 HydrophobicContact CD1-CG1 3.99Å; F174-I196 PolarHBondContact N-O 3.48Å; F174-I196 PolarHBondContact O-N 3.43Å; S194-I196 PolarHBondContact O-N 2.83Å; I196-T198 HydrophobicContact CD1-CG2 3.96Å; I196-T198 HydrophobicContact CG1-CG2 4.1Å
197C94.7Very high89.3Confident18 Ų1863.9 Ų63.912%0.12233%0.329CS..EExtended strand (participates in β ladder)trans-89.1105.7172.2176.70000109.9F98 C105 G172 I173F98-C197 HydrophobicContact CD1-CB 4.12Å; F98-C197 HydrophobicContact CD2-CB 3.85Å; F98-C197 HydrophobicContact CE1-CB 4.22Å; F98-C197 HydrophobicContact CE2-CB 3.96Å; F98-C197 HydrophobicContact CG-CB 3.92Å; F98-C197 HydrophobicContact CZ-CB 4.14Å; C105-C197 WeakPolarHBondContact CA-SG 3.27Å; C105-C197 HydrophobicContact CB-CB 3.74Å; C105-C197 WeakPolarHBondContact CB-SG 3.33Å; C105-C197 VanDerWaalsContact SG-CA 3.59Å; C105-C197 WeakPolarHBondContact SG-CB 3.29Å; C105-C197 CovalentContact SG-SG 2.04Å; C105-C197 PolarHBondContact SG-SG 2.69Å; G172-C197 WeakPolarHBondContact O-CA 2.91Å; I173-C197 HydrophobicContact CD1-CB 4.42Å
198T93Very high90Very high33 Ų3364.8 Ų64.820%0.20233%0.33CS..EExtended strand (participates in β ladder)trans-145.5178.6-174.8-166.90000112.1H171 G172 F174 I196 V200H171-T198 CarbonylContact C-O 3.42Å; H171-T198 VanDerWaalsContact CA-O 3.28Å; H171-T198 WeakPolarHBondContact CA-O 3.42Å; G172-T198 PolarHBondContact N-O 3.38Å; G172-T198 PolarHBondContact O-N 2.87Å; G172-T198 VanDerWaalsContact O-O 3.1Å; F174-T198 HydrophobicContact CB-CG2 3.45Å; F174-T198 VanDerWaalsContact CB-CG2 3.45Å; F174-T198 HydrophobicContact CG-CG2 4.19Å; I196-T198 HydrophobicContact CD1-CG2 3.96Å; I196-T198 HydrophobicContact CG1-CG2 4.1Å; T198-V200 PolarHBondContact O-N 2.79Å
199V92.8Very high90.7Very high26 Ų2660.8 Ų60.816%0.15831%0.31CS..EExtended strand (participates in β ladder)trans-71.2116.7175.6-177.30000109.4Y206 W296V199-Y206 HydrophobicContact CB-CD2 4.42Å; V199-Y206 HydrophobicContact CG1-CD2 3.98Å; V199-Y206 HydrophobicContact CG1-CG 4.15Å; V199-Y206 HydrophobicContact CG2-CD2 3.49Å; V199-Y206 VanDerWaalsContact CG2-CD2 3.49Å; V199-Y206 HydrophobicContact CG2-CE2 3.52Å; V199-Y206 HydrophobicContact CG2-CG 4.16Å; V199-W296 HydrophobicContact CB-CH2 4.23Å; V199-W296 HydrophobicContact CB-CZ2 4.49Å; V199-W296 HydrophobicContact CG1-CH2 4.45Å; V199-W296 HydrophobicContact CG2-CH2 4.11Å; V199-W296 HydrophobicContact CG2-CZ2 4.26Å
200V93.6Very high91.2Very high67 Ų6755.2 Ų55.241%0.40628%0.281SS..  trans-106.3-10.3-178.5-62.20000113.1L170 T198L170-V200 PolarHBondContact O-N 3.4Å; T198-V200 PolarHBondContact O-N 2.79Å
201K92.7Very high91.6Very high111 Ų11152.9 Ų52.948%0.48327%0.27SS..SBendtrans-92.4163.5178.1-65.5-58-174.8-178.50111.5L170 R203L170-K201 HydrophobicContact CB-CB 4.32Å; L170-K201 HydrophobicContact CB-CG 4.47Å; L170-K201 HydrophobicContact CD2-CB 3.7Å; L170-K201 HydrophobicContact CD2-CG 3.96Å; L170-K201 PolarHBondContact O-N 3Å; K201-R203 PolarHBondContact O-N 3.28Å
202P91.8Very high92.1Very high66 Ų6655.9 Ų55.943%0.42929%0.288SS..  trans-52.1135.4-179.9-28.335.5000112.7W204 M205P202-W204 VanDerWaalsContact CB-CD1 3.42Å; P202-W204 HydrophobicContact CB-CG 4.32Å; P202-W204 VanDerWaalsContact CB-NE1 3.27Å; P202-W204 PolarHBondContact O-N 2.84Å; P202-W204 VanDerWaalsContact O-N 3.1Å; P202-M205 HydrophobicContact CB-CG 4.48Å; P202-M205 HydrophobicContact CG-SD 4.32Å; P202-M205 WeakPolarHBondContact O-CB 3.23Å; P202-M205 PolarHBondContact O-N 3.44Å
203R88.3Confident92.3Very high84 Ų8452.8 Ų52.832%0.31727%0.268SS..Hα-helixtrans-56.8-31.8-174.7-166.8172.5-174.5178.2-1.7113.2K201 M205 Y206 N207 W296 I299K201-R203 PolarHBondContact O-N 3.28Å; R203-M205 VanDerWaalsContact C-N 3.33Å; R203-M205 PolarHBondContact O-N 3.35Å; R203-Y206 PolarHBondContact O-N 3.43Å; R203-N207 WeakPolarHBondContact O-CB 3.16Å; R203-N207 PolarHBondContact O-N 3.09Å; R203-N207 PolarHBondContact O-OD1 2.88Å; R203-W296 HydrophobicContact CG-CH2 4.29Å; R203-W296 HydrophobicContact CG-CZ3 3.99Å; R203-W296 PolarHBondContact NH2-O 3.38Å; R203-I299 PolarHBondContact NH2-O 3.26Å
204W90.9Very high92.5Very high173 Ų17349.3 Ų49.366%0.65525%0.25SC*.Hα-helixtrans-62.6-36.4177.270-98.7000112.9P202 L208P202-W204 VanDerWaalsContact CB-CD1 3.42Å; P202-W204 HydrophobicContact CB-CG 4.32Å; P202-W204 VanDerWaalsContact CB-NE1 3.27Å; P202-W204 PolarHBondContact O-N 2.84Å; P202-W204 VanDerWaalsContact O-N 3.1Å; W204-L208 WeakPolarHBondContact O-CB 3.39Å; W204-L208 PolarHBondContact O-N 3.33Å
205M93.8Very high92.6Very high64 Ų6455.3 Ų55.332%0.31528%0.276SS..Hα-helixtrans-67.7-42177.1-64.6179.97000110.8L170 P202 R203 T209L170-M205 HydrophobicContact CD2-CB 3.83Å; L170-M205 HydrophobicContact CD2-CE 3.96Å; L170-M205 HydrophobicContact CD2-SD 4.45Å; P202-M205 HydrophobicContact CB-CG 4.48Å; P202-M205 HydrophobicContact CG-SD 4.32Å; P202-M205 WeakPolarHBondContact O-CB 3.23Å; P202-M205 PolarHBondContact O-N 3.44Å; R203-M205 VanDerWaalsContact C-N 3.33Å; R203-M205 PolarHBondContact O-N 3.35Å; M205-T209 WeakPolarHBondContact O-CB 3.28Å; M205-T209 PolarHBondContact O-N 3.16Å; M205-T209 PolarHBondContact O-OG1 3.25Å
206Y91.1Very high92.7Very high21 Ų2157 Ų578%0.08228%0.284CS..Hα-helixtrans-63.4-51.2175.2-178.7-88.2000111.2L170 H171 V199 R203 L208 T209 I210 W296L170-Y206 HydrophobicContact CD1-CD2 4.19Å; H171-Y206 AromaticContact CE1-CE2 3.8Å; V199-Y206 HydrophobicContact CB-CD2 4.42Å; V199-Y206 HydrophobicContact CG1-CD2 3.98Å; V199-Y206 HydrophobicContact CG1-CG 4.15Å; V199-Y206 HydrophobicContact CG2-CD2 3.49Å; V199-Y206 VanDerWaalsContact CG2-CD2 3.49Å; V199-Y206 HydrophobicContact CG2-CE2 3.52Å; V199-Y206 HydrophobicContact CG2-CG 4.16Å; R203-Y206 PolarHBondContact O-N 3.43Å; Y206-L208 VanDerWaalsContact C-N 3.32Å; Y206-L208 PolarHBondContact O-N 3.44Å; Y206-T209 PolarHBondContact O-N 3.32Å; Y206-T209 VanDerWaalsContact O-N 3.07Å; Y206-I210 HydrophobicContact CD1-CG1 3.71Å; Y206-I210 HydrophobicContact CD2-CG1 4.25Å; Y206-I210 HydrophobicContact CE1-CB 4.5Å; Y206-I210 HydrophobicContact CE1-CD1 4.11Å; Y206-I210 HydrophobicContact CE1-CG1 3.35Å; Y206-I210 HydrophobicContact CE2-CD1 3.89Å; Y206-I210 HydrophobicContact CE2-CG1 3.91Å; Y206-I210 HydrophobicContact CG-CG1 4.19Å; Y206-I210 VanDerWaalsContact CZ-CG1 3.48Å; Y206-I210 VanDerWaalsContact O-CG1 3.32Å; Y206-I210 WeakPolarHBondContact O-CG1 3.42Å; Y206-I210 PolarHBondContact O-N 3.47Å; Y206-W296 AromaticContact CD1-CE3 3.42Å; Y206-W296 HydrophobicContact CD1-CE3 3.42Å; Y206-W296 VanDerWaalsContact CD1-CE3 3.42Å; Y206-W296 AromaticContact CD1-CH2 3.91Å; Y206-W296 HydrophobicContact CD1-CH2 3.91Å; Y206-W296 AromaticContact CD1-CZ3 3.04Å; Y206-W296 HydrophobicContact CD1-CZ3 3.04Å; Y206-W296 AromaticContact CE1-CD2 3.87Å; Y206-W296 HydrophobicContact CE1-CD2 3.87Å; Y206-W296 AromaticContact CE1-CE3 3.06Å; Y206-W296 HydrophobicContact CE1-CE3 3.06Å; Y206-W296 HydrophobicContact CE1-CH2 4.07Å; Y206-W296 AromaticContact CE1-CZ3 3.21Å; Y206-W296 HydrophobicContact CE1-CZ3 3.21Å; Y206-W296 HydrophobicContact CG-CH2 4.33Å; Y206-W296 AromaticContact CG-CZ3 3.85Å; Y206-W296 HydrophobicContact CG-CZ3 3.85Å
207N92.1Very high92.5Very high34 Ų3456.6 Ų56.618%0.18228%0.281CS..Hα-helixtrans-56-47.3179.1-71.11.6000111.7R203 T209 I210 Q211 S297R203-N207 WeakPolarHBondContact O-CB 3.16Å; R203-N207 PolarHBondContact O-N 3.09Å; R203-N207 PolarHBondContact O-OD1 2.88Å; N207-T209 PolarHBondContact O-N 2.81Å; N207-I210 PolarHBondContact O-N 3.03Å; N207-Q211 WeakPolarHBondContact O-CB 3.29Å; N207-Q211 WeakPolarHBondContact O-CG 3.35Å; N207-Q211 PolarHBondContact O-N 3.41Å; N207-S297 WeakPolarHBondContact CA-OG 3.38Å; N207-S297 WeakPolarHBondContact CB-OG 3.24Å; N207-S297 VanDerWaalsContact CG-O 3.3Å; N207-S297 VanDerWaalsContact CG-OG 3.31Å; N207-S297 PolarHBondContact ND2-O 3.1Å; N207-S297 WeakPolarHBondContact OD1-CA 3.41Å; N207-S297 PolarHBondContact OD1-O 3.09Å; N207-S297 PolarHBondContact OD1-OG 3.03Å
208L93.4Very high92.2Very high97 Ų9757 Ų5751%0.50828%0.281SS..Hα-helixtrans-59.9-46.5176.1-178.665.5000111.5W204 Y206 Q211 V212W204-L208 WeakPolarHBondContact O-CB 3.39Å; W204-L208 PolarHBondContact O-N 3.33Å; Y206-L208 VanDerWaalsContact C-N 3.32Å; Y206-L208 PolarHBondContact O-N 3.44Å; L208-Q211 PolarHBondContact O-N 2.93Å; L208-V212 HydrophobicContact CD1-CG2 4.16Å; L208-V212 HydrophobicContact CG-CG2 4.47Å; L208-V212 WeakPolarHBondContact O-CB 3.28Å; L208-V212 VanDerWaalsContact O-CG2 3.24Å; L208-V212 WeakPolarHBondContact O-CG2 3.41Å; L208-V212 PolarHBondContact O-N 3.21Å
209T93.3Very high92.2Very high27 Ų2758.6 Ų58.617%0.16629%0.288CS..Hα-helixtrans-60.3-49.1179.6-59.90000111P166 N167 L170 M205 Y206 N207 Q211 V212 T213P166-T209 HydrophobicContact CB-CG2 4.49Å; N167-T209 HydrophobicContact CB-CG2 4.1Å; L170-T209 HydrophobicContact CD1-CG2 4.33Å; M205-T209 WeakPolarHBondContact O-CB 3.28Å; M205-T209 PolarHBondContact O-N 3.16Å; M205-T209 PolarHBondContact O-OG1 3.25Å; Y206-T209 PolarHBondContact O-N 3.32Å; Y206-T209 VanDerWaalsContact O-N 3.07Å; N207-T209 PolarHBondContact O-N 2.81Å; T209-Q211 PolarHBondContact O-N 3.42Å; T209-V212 PolarHBondContact O-N 3.12Å; T209-T213 HydrophobicContact CG2-CG2 4.41Å; T209-T213 WeakPolarHBondContact O-CG2 3.26Å; T209-T213 PolarHBondContact O-N 3.4Å; T209-T213 PolarHBondContact O-OG1 3.18Å
210I91.9Very high92.2Very high0 Ų061.3 Ų61.30%030%0.301CS..Hα-helixtrans-64.1-41.3-179.7-63.9-54.5000112.4Y206 N207 T213 T214 R293 L294Y206-I210 HydrophobicContact CD1-CG1 3.71Å; Y206-I210 HydrophobicContact CD2-CG1 4.25Å; Y206-I210 HydrophobicContact CE1-CB 4.5Å; Y206-I210 HydrophobicContact CE1-CD1 4.11Å; Y206-I210 HydrophobicContact CE1-CG1 3.35Å; Y206-I210 HydrophobicContact CE2-CD1 3.89Å; Y206-I210 HydrophobicContact CE2-CG1 3.91Å; Y206-I210 HydrophobicContact CG-CG1 4.19Å; Y206-I210 VanDerWaalsContact CZ-CG1 3.48Å; Y206-I210 VanDerWaalsContact O-CG1 3.32Å; Y206-I210 WeakPolarHBondContact O-CG1 3.42Å; Y206-I210 PolarHBondContact O-N 3.47Å; N207-I210 PolarHBondContact O-N 3.03Å; I210-T213 WeakPolarHBondContact CA-OG1 3.41Å; I210-T213 PolarHBondContact O-OG1 2.77Å; I210-T214 WeakPolarHBondContact O-CB 3.31Å; I210-T214 PolarHBondContact O-N 3.3Å; I210-T214 PolarHBondContact O-OG1 3.21Å; I210-R293 HydrophobicContact CG2-CB 3.86Å; I210-L294 HydrophobicContact CG2-CD2 4.42Å
211Q93.2Very high92.1Very high74 Ų7458.4 Ų58.435%0.34628%0.283SS..Hα-helixtrans-65.8-45.6178-73172.813.800111.1N207 L208 T209 T214 F215 F298N207-Q211 WeakPolarHBondContact O-CB 3.29Å; N207-Q211 WeakPolarHBondContact O-CG 3.35Å; N207-Q211 PolarHBondContact O-N 3.41Å; L208-Q211 PolarHBondContact O-N 2.93Å; T209-Q211 PolarHBondContact O-N 3.42Å; Q211-T214 PolarHBondContact O-N 3.13Å; Q211-F215 WeakPolarHBondContact O-CB 3.18Å; Q211-F215 PolarHBondContact O-N 2.84Å; Q211-F298 HydrophobicContact CG-CZ 4.18Å
212V93.8Very high92.1Very high74 Ų7455 Ų5545%0.44827%0.269SS..Hα-helixtrans-62.9-48.1177.6170.60000110.5L208 T209 T214 F215 V216L208-V212 HydrophobicContact CD1-CG2 4.16Å; L208-V212 HydrophobicContact CG-CG2 4.47Å; L208-V212 WeakPolarHBondContact O-CB 3.28Å; L208-V212 VanDerWaalsContact O-CG2 3.24Å; L208-V212 WeakPolarHBondContact O-CG2 3.41Å; L208-V212 PolarHBondContact O-N 3.21Å; T209-V212 PolarHBondContact O-N 3.12Å; V212-T214 PolarHBondContact O-N 3.39Å; V212-F215 PolarHBondContact O-N 3.14Å; V212-V216 HydrophobicContact CG1-CG2 4.18Å; V212-V216 VanDerWaalsContact O-CB 3.31Å; V212-V216 WeakPolarHBondContact O-CB 3.39Å; V212-V216 VanDerWaalsContact O-CG2 3.28Å; V212-V216 WeakPolarHBondContact O-CG2 3.43Å; V212-V216 PolarHBondContact O-N 2.96Å
213T92.1Very high92Very high13 Ų1356.7 Ų56.78%0.0827%0.274CS..Hα-helixtrans-65.1-40.2179.7560000111.8T209 I210 F217T209-T213 HydrophobicContact CG2-CG2 4.41Å; T209-T213 WeakPolarHBondContact O-CG2 3.26Å; T209-T213 PolarHBondContact O-N 3.4Å; T209-T213 PolarHBondContact O-OG1 3.18Å; I210-T213 WeakPolarHBondContact CA-OG1 3.41Å; I210-T213 PolarHBondContact O-OG1 2.77Å; T213-F217 HydrophobicContact CG2-CD2 4.48Å; T213-F217 WeakPolarHBondContact O-CA 3.4Å; T213-F217 VanDerWaalsContact O-CB 3.28Å; T213-F217 WeakPolarHBondContact O-CB 3.48Å; T213-F217 PolarHBondContact O-N 3.47Å
214T92.3Very high92.2Very high4 Ų455 Ų553%0.02527%0.273CS..Iπ-helixtrans-64.5-42.2176-60.50000111.5I210 Q211 V212 F218 I219 H290 L294I210-T214 WeakPolarHBondContact O-CB 3.31Å; I210-T214 PolarHBondContact O-N 3.3Å; I210-T214 PolarHBondContact O-OG1 3.21Å; Q211-T214 PolarHBondContact O-N 3.13Å; V212-T214 PolarHBondContact O-N 3.39Å; T214-F218 HydrophobicContact CG2-CB 4.38Å; T214-F218 HydrophobicContact CG2-CD1 4.39Å; T214-F218 WeakPolarHBondContact O-CA 3.42Å; T214-F218 WeakPolarHBondContact O-CB 3.25Å; T214-F218 PolarHBondContact O-N 3.49Å; T214-I219 PolarHBondContact O-N 3.01Å; T214-H290 HydrophobicContact CG2-CB 4.1Å; T214-H290 PolarHBondContact OG1-ND1 3.24Å; T214-L294 HydrophobicContact CG2-CD1 4.07Å; T214-L294 HydrophobicContact CG2-CD2 4.2Å; T214-L294 HydrophobicContact CG2-CG 4.26Å
215F93.4Very high92.2Very high127 Ų12746.9 Ų46.956%0.55724%0.242SC*.Iπ-helixtrans-65.6-51177.1-177.9-97.9000112.1Q211 V212 I219 L220Q211-F215 WeakPolarHBondContact O-CB 3.18Å; Q211-F215 PolarHBondContact O-N 2.84Å; V212-F215 PolarHBondContact O-N 3.14Å; F215-I219 HydrophobicContact CD2-CB 4.41Å; F215-I219 HydrophobicContact CD2-CG2 4.47Å; F215-I219 PolarHBondContact O-N 3.26Å; F215-L220 WeakPolarHBondContact O-CB 3.25Å; F215-L220 PolarHBondContact O-N 3.14Å
216V93.4Very high92Very high56 Ų5646.9 Ų46.934%0.33925%0.249SC..Iπ-helixtrans-73.4-36.7-173.2173.80000112.6V212 P221V212-V216 HydrophobicContact CG1-CG2 4.18Å; V212-V216 VanDerWaalsContact O-CB 3.31Å; V212-V216 WeakPolarHBondContact O-CB 3.39Å; V212-V216 VanDerWaalsContact O-CG2 3.28Å; V212-V216 WeakPolarHBondContact O-CG2 3.43Å; V212-V216 PolarHBondContact O-N 2.96Å; V216-P221 WeakPolarHBondContact O-CD 3.28Å
217F90.3Very high92Very high20 Ų2048.9 Ų48.99%0.08826%0.263CS..Iπ-helixtrans-108.2-13.3-173.9-63.1-77.6000114L117 I120 L121 C163 T213 P221L117-F217 HydrophobicContact CD2-CB 3.63Å; L117-F217 HydrophobicContact CD2-CD1 3.67Å; L117-F217 HydrophobicContact CD2-CD2 3.44Å; L117-F217 VanDerWaalsContact CD2-CD2 3.44Å; L117-F217 HydrophobicContact CD2-CE1 4.14Å; L117-F217 HydrophobicContact CD2-CE2 3.94Å; L117-F217 HydrophobicContact CD2-CG 3.29Å; L117-F217 HydrophobicContact CD2-CZ 4.27Å; I120-F217 HydrophobicContact CD1-CB 4.22Å; I120-F217 WeakPolarHBondContact CD1-O 3.42Å; I120-F217 WeakPolarHBondContact CG2-O 3.33Å; L121-F217 HydrophobicContact CD1-CE1 4.13Å; L121-F217 HydrophobicContact CD2-CD1 4.18Å; L121-F217 HydrophobicContact CD2-CE1 4.11Å; L121-F217 HydrophobicContact CG-CD1 4.32Å; L121-F217 HydrophobicContact CG-CE1 4.29Å; C163-F217 HydrophobicContact CB-CE2 4.12Å; C163-F217 HydrophobicContact CB-CZ 3.9Å; T213-F217 HydrophobicContact CG2-CD2 4.48Å; T213-F217 WeakPolarHBondContact O-CA 3.4Å; T213-F217 VanDerWaalsContact O-CB 3.28Å; T213-F217 WeakPolarHBondContact O-CB 3.48Å; T213-F217 PolarHBondContact O-N 3.47Å; F217-P221 VanDerWaalsContact O-CG 3.31Å; F217-P221 WeakPolarHBondContact O-CG 3.31Å
218F89.9Confident92Very high26 Ų2648.4 Ų48.411%0.11426%0.261CS..Iπ-helixtrans-111.9-62.5172.8-178.3-115.4000111.9T214 M222 W286 A287 H290T214-F218 HydrophobicContact CG2-CB 4.38Å; T214-F218 HydrophobicContact CG2-CD1 4.39Å; T214-F218 WeakPolarHBondContact O-CA 3.42Å; T214-F218 WeakPolarHBondContact O-CB 3.25Å; T214-F218 PolarHBondContact O-N 3.49Å; F218-M222 HydrophobicContact CD2-CG 4Å; F218-M222 HydrophobicContact CE2-CG 3.85Å; F218-M222 HydrophobicContact CE2-SD 4.47Å; F218-M222 HydrophobicContact CZ-CG 4.32Å; F218-M222 VanDerWaalsContact O-CB 3.27Å; F218-M222 WeakPolarHBondContact O-CB 3.4Å; F218-M222 WeakPolarHBondContact O-CG 3.29Å; F218-M222 PolarHBondContact O-N 2.97Å; F218-W286 HydrophobicContact CD2-CB 4.37Å; F218-W286 HydrophobicContact CE2-CB 3.86Å; F218-A287 HydrophobicContact CZ-CB 4.02Å; F218-H290 WeakPolarHBondContact CB-NE2 3.37Å; F218-H290 HydrophobicContact CD1-CB 3.96Å; F218-H290 AromaticContact CD1-CD2 3.83Å; F218-H290 AromaticContact CD1-CG 3.82Å; F218-H290 AromaticContact CD2-CD2 3.35Å; F218-H290 WeakPolarHBondContact CD2-CD2 3.38Å; F218-H290 AromaticContact CD2-NE2 3.73Å; F218-H290 HydrophobicContact CE1-CB 4.22Å; F218-H290 AromaticContact CE2-CD2 3.92Å; F218-H290 HydrophobicContact CG-CB 4.33Å; F218-H290 AromaticContact CG-CD2 3.31Å; F218-H290 WeakPolarHBondContact CG-CD2 3.41Å; F218-H290 AromaticContact CG-CG 3.69Å; F218-H290 AromaticContact CG-NE2 3.7Å
219I91.8Very high91.7Very high67 Ų6744.3 Ų44.334%0.34424%0.238SC..Iπ-helixtrans-63.7-50.9-172.6-57.6-61.2000111.7T214 F215 M222 I223T214-I219 PolarHBondContact O-N 3.01Å; F215-I219 HydrophobicContact CD2-CB 4.41Å; F215-I219 HydrophobicContact CD2-CG2 4.47Å; F215-I219 PolarHBondContact O-N 3.26Å; I219-M222 PolarHBondContact O-N 2.95Å; I219-I223 HydrophobicContact CG2-CD1 3.73Å; I219-I223 HydrophobicContact CG2-CG1 4.45Å; I219-I223 VanDerWaalsContact O-CG1 3.29Å; I219-I223 WeakPolarHBondContact O-CG1 3.14Å; I219-I223 PolarHBondContact O-N 3.3Å
220L93.3Very high91.4Very high82 Ų8248.1 Ų48.143%0.42926%0.255SS..Hα-helixtrans-63.3-48.1-179.4-179.4160.6000112F215 M222 I223 T224F215-L220 WeakPolarHBondContact O-CB 3.25Å; F215-L220 PolarHBondContact O-N 3.14Å; L220-M222 PolarHBondContact O-N 2.68Å; L220-I223 PolarHBondContact O-N 3.34Å; L220-T224 HydrophobicContact CD2-CG2 3.94Å; L220-T224 HydrophobicContact CG-CG2 4.46Å; L220-T224 WeakPolarHBondContact O-CB 3.04Å; L220-T224 VanDerWaalsContact O-CG2 3.26Å; L220-T224 WeakPolarHBondContact O-CG2 3.4Å; L220-T224 PolarHBondContact O-N 3.42Å; L220-T224 PolarHBondContact O-OG1 3.23Å
221P91.9Very high91.3Very high7 Ų751.1 Ų51.15%0.04527%0.271CS..Hα-helixtrans-56.4-45.4171.7-3643.5000113.1I120 V216 F217 I223 T224 I225I120-P221 HydrophobicContact CG2-CB 3.83Å; I120-P221 HydrophobicContact CG2-CG 3.86Å; V216-P221 WeakPolarHBondContact O-CD 3.28Å; F217-P221 VanDerWaalsContact O-CG 3.31Å; F217-P221 WeakPolarHBondContact O-CG 3.31Å; P221-I223 PolarHBondContact O-N 2.69Å; P221-T224 VanDerWaalsContact CA-OG1 3.32Å; P221-T224 WeakPolarHBondContact CA-OG1 3.18Å; P221-T224 PolarHBondContact O-N 2.81Å; P221-T224 PolarHBondContact O-OG1 2.88Å; P221-I225 HydrophobicContact CB-CD1 4.4Å; P221-I225 WeakPolarHBondContact O-CB 3.1Å; P221-I225 WeakPolarHBondContact O-CD1 3.33Å; P221-I225 WeakPolarHBondContact O-CG1 3.19Å; P221-I225 PolarHBondContact O-N 3.44Å
222M90.9Very high91.1Very high38 Ų3847.6 Ų47.619%0.18726%0.255CS..Hα-helixtrans-62.6-42.1179.1-73.3-57-62.300112.5F218 I219 L220 S226 F282 G283F218-M222 HydrophobicContact CD2-CG 4Å; F218-M222 HydrophobicContact CE2-CG 3.85Å; F218-M222 HydrophobicContact CE2-SD 4.47Å; F218-M222 HydrophobicContact CZ-CG 4.32Å; F218-M222 VanDerWaalsContact O-CB 3.27Å; F218-M222 WeakPolarHBondContact O-CB 3.4Å; F218-M222 WeakPolarHBondContact O-CG 3.29Å; F218-M222 PolarHBondContact O-N 2.97Å; I219-M222 PolarHBondContact O-N 2.95Å; L220-M222 PolarHBondContact O-N 2.68Å; M222-S226 VanDerWaalsContact O-CB 3.23Å; M222-S226 WeakPolarHBondContact O-CB 3.31Å; M222-S226 PolarHBondContact O-N 2.95Å; M222-S226 PolarHBondContact O-OG 3.44Å; M222-F282 HydrophobicContact SD-CD1 4.27Å; M222-G283 VanDerWaalsContact CE-CA 3.44Å
223I91.7Very high90.6Very high102 Ų10246 Ų4652%0.52325%0.253SS..Hα-helixtrans-64-51.5175.4-68.3168000110.4I219 L220 P221 I225 S226 V227I219-I223 HydrophobicContact CG2-CD1 3.73Å; I219-I223 HydrophobicContact CG2-CG1 4.45Å; I219-I223 VanDerWaalsContact O-CG1 3.29Å; I219-I223 WeakPolarHBondContact O-CG1 3.14Å; I219-I223 PolarHBondContact O-N 3.3Å; L220-I223 PolarHBondContact O-N 3.34Å; P221-I223 PolarHBondContact O-N 2.69Å; I223-I225 PolarHBondContact O-N 3.41Å; I223-S226 PolarHBondContact O-N 3.32Å; I223-V227 HydrophobicContact CG2-CG2 4.42Å; I223-V227 WeakPolarHBondContact O-CG2 3.33Å; I223-V227 PolarHBondContact O-N 2.87Å
224T92Very high90.4Very high50 Ų5050 Ų5031%0.30727%0.274SS..Hα-helixtrans-59.2-48.8-178.354.60000111L220 P221 S226 V227 L228L220-T224 HydrophobicContact CD2-CG2 3.94Å; L220-T224 HydrophobicContact CG-CG2 4.46Å; L220-T224 WeakPolarHBondContact O-CB 3.04Å; L220-T224 VanDerWaalsContact O-CG2 3.26Å; L220-T224 WeakPolarHBondContact O-CG2 3.4Å; L220-T224 PolarHBondContact O-N 3.42Å; L220-T224 PolarHBondContact O-OG1 3.23Å; P221-T224 VanDerWaalsContact CA-OG1 3.32Å; P221-T224 WeakPolarHBondContact CA-OG1 3.18Å; P221-T224 PolarHBondContact O-N 2.81Å; P221-T224 PolarHBondContact O-OG1 2.88Å; T224-S226 PolarHBondContact O-N 2.88Å; T224-V227 PolarHBondContact O-N 2.86Å; T224-L228 WeakPolarHBondContact O-CB 3.28Å; T224-L228 WeakPolarHBondContact O-CG 3.49Å; T224-L228 PolarHBondContact O-N 3.32Å
225I90.9Very high90.1Very high1 Ų152.4 Ų52.41%0.00529%0.285CS..Hα-helixtrans-58.1-48.6177.2-68.8169000110.3V123 T124 P221 I223 V227 L228 Y229 V279V123-I225 HydrophobicContact CG1-CD1 4.11Å; T124-I225 HydrophobicContact CG2-CG1 4.4Å; P221-I225 HydrophobicContact CB-CD1 4.4Å; P221-I225 WeakPolarHBondContact O-CB 3.1Å; P221-I225 WeakPolarHBondContact O-CD1 3.33Å; P221-I225 WeakPolarHBondContact O-CG1 3.19Å; P221-I225 PolarHBondContact O-N 3.44Å; I223-I225 PolarHBondContact O-N 3.41Å; I225-V227 PolarHBondContact O-N 3.19Å; I225-L228 PolarHBondContact O-N 2.96Å; I225-Y229 HydrophobicContact CG2-CD2 3.67Å; I225-Y229 HydrophobicContact CG2-CE2 3.64Å; I225-Y229 VanDerWaalsContact O-CD2 3.22Å; I225-Y229 WeakPolarHBondContact O-CD2 3.35Å; I225-Y229 PolarHBondContact O-N 2.88Å; I225-V279 HydrophobicContact CG2-CB 4Å; I225-V279 HydrophobicContact CG2-CG1 3.27Å; I225-V279 HydrophobicContact CG2-CG2 3.53Å
226S89.4Confident89.6Confident64 Ų6447.7 Ų47.745%0.44827%0.265SS..Hα-helixtrans-58.7-45.9179.8-62.30000112.1M222 I223 T224 Y229 M230M222-S226 VanDerWaalsContact O-CB 3.23Å; M222-S226 WeakPolarHBondContact O-CB 3.31Å; M222-S226 PolarHBondContact O-N 2.95Å; M222-S226 PolarHBondContact O-OG 3.44Å; I223-S226 PolarHBondContact O-N 3.32Å; T224-S226 PolarHBondContact O-N 2.88Å; S226-Y229 PolarHBondContact O-N 3.34Å; S226-M230 WeakPolarHBondContact O-CB 3.37Å; S226-M230 PolarHBondContact O-N 2.79Å
227V91.3Very high89.1Confident64 Ų6452 Ų5239%0.38828%0.279SS..Hα-helixtrans-61.6-46.3176171.70000110.8I223 T224 I225 Y229 M230 L231I223-V227 HydrophobicContact CG2-CG2 4.42Å; I223-V227 WeakPolarHBondContact O-CG2 3.33Å; I223-V227 PolarHBondContact O-N 2.87Å; T224-V227 PolarHBondContact O-N 2.86Å; I225-V227 PolarHBondContact O-N 3.19Å; V227-Y229 PolarHBondContact O-N 2.92Å; V227-M230 HydrophobicContact CG1-CE 4.36Å; V227-M230 PolarHBondContact O-N 3.38Å; V227-L231 HydrophobicContact CG1-CD1 4.02Å; V227-L231 HydrophobicContact CG1-CG 4.36Å; V227-L231 VanDerWaalsContact O-CG 3.27Å; V227-L231 WeakPolarHBondContact O-CG 3.24Å; V227-L231 PolarHBondContact O-N 3.15Å
228L91.5Very high88.8Confident24 Ų2460 Ų6013%0.12631%0.309CS..Hα-helixtrans-59.7-45.8179.3-68.3172.1000111.6I128 Y131 T224 I225 L231 I232I128-L228 HydrophobicContact CG1-CD1 3.66Å; Y131-L228 HydrophobicContact CD1-CD2 3.9Å; Y131-L228 HydrophobicContact CD2-CD2 3.78Å; Y131-L228 HydrophobicContact CE1-CD2 4.39Å; Y131-L228 HydrophobicContact CE2-CD2 4.28Å; Y131-L228 HydrophobicContact CG-CD2 3.58Å; T224-L228 WeakPolarHBondContact O-CB 3.28Å; T224-L228 WeakPolarHBondContact O-CG 3.49Å; T224-L228 PolarHBondContact O-N 3.32Å; I225-L228 PolarHBondContact O-N 2.96Å; L228-L231 PolarHBondContact O-N 2.94Å; L228-I232 WeakPolarHBondContact O-CG1 3.31Å; L228-I232 PolarHBondContact O-N 3.43Å
229Y87.1Confident88.5Confident11 Ų1160.5 Ų60.54%0.04331%0.312CS..Hα-helixtrans-69.6-36178.5-79.7-74.6000113.6S127 I225 S226 V227 L231 I232 G233 T272 L275 F276 V279S127-Y229 WeakPolarHBondContact OG-CE2 3.31Å; S127-Y229 PolarHBondContact OG-OH 3.4Å; I225-Y229 HydrophobicContact CG2-CD2 3.67Å; I225-Y229 HydrophobicContact CG2-CE2 3.64Å; I225-Y229 VanDerWaalsContact O-CD2 3.22Å; I225-Y229 WeakPolarHBondContact O-CD2 3.35Å; I225-Y229 PolarHBondContact O-N 2.88Å; S226-Y229 PolarHBondContact O-N 3.34Å; V227-Y229 PolarHBondContact O-N 2.92Å; Y229-L231 VanDerWaalsContact C-N 3.35Å; Y229-I232 HydrophobicContact CD1-CD1 4.09Å; Y229-I232 HydrophobicContact CE1-CD1 4.27Å; Y229-I232 PolarHBondContact O-N 3Å; Y229-G233 PolarHBondContact O-N 2.92Å; Y229-T272 HydrophobicContact CD1-CG2 4.44Å; Y229-T272 HydrophobicContact CE1-CG2 4.45Å; Y229-L275 HydrophobicContact CE1-CB 3.89Å; Y229-L275 VanDerWaalsContact OH-CB 3.26Å; Y229-L275 WeakPolarHBondContact OH-CB 3.08Å; Y229-F276 HydrophobicContact CD1-CB 4.02Å; Y229-F276 HydrophobicContact CD1-CD2 4.38Å; Y229-F276 HydrophobicContact CE1-CB 4.4Å; Y229-F276 HydrophobicContact CG-CD2 4.19Å; Y229-V279 HydrophobicContact CD2-CB 4.44Å; Y229-V279 HydrophobicContact CD2-CG1 4.4Å; Y229-V279 HydrophobicContact CD2-CG2 3.87Å; Y229-V279 HydrophobicContact CE2-CB 4.27Å; Y229-V279 HydrophobicContact CE2-CG2 3.26Å
230M87.2Confident88Confident106 Ų10664.1 Ų64.152%0.52233%0.325SS..Hα-helixtrans-58.5-48.7171.2177.8-163.35900110.4S226 V227 I232 G233 L234S226-M230 WeakPolarHBondContact O-CB 3.37Å; S226-M230 PolarHBondContact O-N 2.79Å; V227-M230 HydrophobicContact CG1-CE 4.36Å; V227-M230 PolarHBondContact O-N 3.38Å; M230-I232 VanDerWaalsContact C-N 3.32Å; M230-I232 PolarHBondContact O-N 3.46Å; M230-G233 PolarHBondContact O-N 3.3Å; M230-G233 VanDerWaalsContact O-N 3.1Å; M230-L234 HydrophobicContact CG-CD1 4.41Å; M230-L234 WeakPolarHBondContact O-CG 3.3Å; M230-L234 PolarHBondContact O-N 2.96Å
231L90.1Very high87.3Confident63 Ų6366.3 Ų66.333%0.3333%0.334SS..Hα-helixtrans-61-40177.6-68.5174.7000112.1Y131 V227 L228 Y229 L234 Q235Y131-L231 HydrophobicContact CD2-CB 4.37Å; Y131-L231 HydrophobicContact CE2-CB 3.92Å; Y131-L231 HydrophobicContact CE2-CD1 3.87Å; V227-L231 HydrophobicContact CG1-CD1 4.02Å; V227-L231 HydrophobicContact CG1-CG 4.36Å; V227-L231 VanDerWaalsContact O-CG 3.27Å; V227-L231 WeakPolarHBondContact O-CG 3.24Å; V227-L231 PolarHBondContact O-N 3.15Å; L228-L231 PolarHBondContact O-N 2.94Å; Y229-L231 VanDerWaalsContact C-N 3.35Å; L231-L234 PolarHBondContact O-N 2.97Å; L231-Q235 PolarHBondContact O-N 3.33Å
232I87.8Confident86.9Confident0 Ų072.7 Ų72.70%036%0.357CS..Hα-helixtrans-62.8-45173.9-62.1162.1000110.3Y131 V134 V135 L228 Y229 M230 L234 Q235 L236 T272Y131-I232 HydrophobicContact CD2-CG1 4.1Å; V134-I232 HydrophobicContact CB-CG2 4.18Å; V134-I232 HydrophobicContact CG1-CG2 3.76Å; V135-I232 HydrophobicContact CG2-CG1 4.09Å; L228-I232 WeakPolarHBondContact O-CG1 3.31Å; L228-I232 PolarHBondContact O-N 3.43Å; Y229-I232 HydrophobicContact CD1-CD1 4.09Å; Y229-I232 HydrophobicContact CE1-CD1 4.27Å; Y229-I232 PolarHBondContact O-N 3Å; M230-I232 VanDerWaalsContact C-N 3.32Å; M230-I232 PolarHBondContact O-N 3.46Å; I232-L234 VanDerWaalsContact C-N 3.34Å; I232-L234 PolarHBondContact O-N 3.43Å; I232-Q235 PolarHBondContact O-N 2.75Å; I232-L236 HydrophobicContact CG2-CD1 4.04Å; I232-L236 HydrophobicContact CG2-CG 4.16Å; I232-L236 VanDerWaalsContact O-CG 3.29Å; I232-L236 WeakPolarHBondContact O-CG 3.34Å; I232-L236 PolarHBondContact O-N 3.45Å; I232-T272 HydrophobicContact CB-CG2 4.25Å; I232-T272 HydrophobicContact CD1-CG2 4.4Å; I232-T272 HydrophobicContact CG2-CG2 3.35Å
233G84.3Confident86.3Confident40 Ų4073.6 Ų73.641%0.41236%0.361SS..Hα-helixtrans-57.5-44.517700000112.7Y229 M230 L236 K237Y229-G233 PolarHBondContact O-N 2.92Å; M230-G233 PolarHBondContact O-N 3.3Å; M230-G233 VanDerWaalsContact O-N 3.1Å; G233-L236 PolarHBondContact O-N 3.43Å; G233-K237 PolarHBondContact O-N 3.06Å
234L86.9Confident85.7Confident99 Ų9971.3 Ų71.352%0.51836%0.357SS..Hα-helixtrans-61.9-44.6175.6-69175.1000111.9M230 L231 I232 L236 K237 R238M230-L234 HydrophobicContact CG-CD1 4.41Å; M230-L234 WeakPolarHBondContact O-CG 3.3Å; M230-L234 PolarHBondContact O-N 2.96Å; L231-L234 PolarHBondContact O-N 2.97Å; I232-L234 VanDerWaalsContact C-N 3.34Å; I232-L234 PolarHBondContact O-N 3.43Å; L234-L236 PolarHBondContact O-N 3.45Å; L234-K237 PolarHBondContact O-N 3.05Å; L234-R238 PolarHBondContact O-N 3.07Å
235Q86.4Confident85.2Confident54 Ų5476 Ų7625%0.25238%0.378SS..Hα-helixtrans-62.7-43.5177.5-177.663.88.100111.7V135 L231 I232 K237 R238 E239V135-Q235 HydrophobicContact CG2-CB 4.19Å; V135-Q235 HydrophobicContact CG2-CG 4.35Å; L231-Q235 PolarHBondContact O-N 3.33Å; I232-Q235 PolarHBondContact O-N 2.75Å; Q235-K237 VanDerWaalsContact C-N 3.32Å; Q235-K237 PolarHBondContact O-N 3.49Å; Q235-R238 PolarHBondContact O-N 3.08Å; Q235-E239 WeakPolarHBondContact O-CG 3.32Å; Q235-E239 PolarHBondContact O-N 3.3Å
236L82.4Confident84.6Confident28 Ų2880.1 Ų80.115%0.14740%0.397CS..Hα-helixtrans-64.9-36.4178.4-68.5-178.4000112.4V134 I232 G233 L234 K240 R269 T272V134-L236 HydrophobicContact CG1-CD2 3.88Å; V134-L236 HydrophobicContact CG1-CG 4.4Å; I232-L236 HydrophobicContact CG2-CD1 4.04Å; I232-L236 HydrophobicContact CG2-CG 4.16Å; I232-L236 VanDerWaalsContact O-CG 3.29Å; I232-L236 WeakPolarHBondContact O-CG 3.34Å; I232-L236 PolarHBondContact O-N 3.45Å; G233-L236 PolarHBondContact O-N 3.43Å; L234-L236 PolarHBondContact O-N 3.45Å; L236-K240 PolarHBondContact O-N 3.23Å; L236-K240 VanDerWaalsContact O-N 3.07Å; L236-R269 HydrophobicContact CD1-CG 4.04Å; L236-R269 HydrophobicContact CD2-CG 3.52Å; L236-R269 HydrophobicContact CG-CG 4.33Å; L236-R269 PolarHBondContact O-NH1 3.27Å; L236-R269 PolarHBondContact O-NH2 3.42Å; L236-R269 VanDerWaalsContact O-NH2 3.08Å; L236-T272 HydrophobicContact CD1-CG2 4.25Å
237K83Confident83.8Confident147 Ų14781.1 Ų81.164%0.63941%0.409SS*.Hα-helixtrans-64-48.2172.5-173.9-179179-177.30110.6G233 L234 Q235 E239 K240 M241G233-K237 PolarHBondContact O-N 3.06Å; L234-K237 PolarHBondContact O-N 3.05Å; Q235-K237 VanDerWaalsContact C-N 3.32Å; Q235-K237 PolarHBondContact O-N 3.49Å; K237-E239 VanDerWaalsContact C-N 3.35Å; K237-E239 PolarHBondContact O-N 2.5Å; K237-K240 PolarHBondContact O-N 3.24Å; K237-K240 VanDerWaalsContact O-N 3.15Å; K237-M241 WeakPolarHBondContact O-CG 3.48Å; K237-M241 PolarHBondContact O-N 3.39Å
238R85.5Confident83Confident188 Ų18887.1 Ų87.171%0.70943%0.43SS*.Hα-helixtrans-58.1-45.4177.7-172.7178.1-176.3174.42.7112L234 Q235 K240 M241 R242L234-R238 PolarHBondContact O-N 3.07Å; Q235-R238 PolarHBondContact O-N 3.08Å; R238-K240 PolarHBondContact O-N 3.32Å; R238-M241 PolarHBondContact O-N 3.12Å; R238-R242 PolarHBondContact O-N 2.66Å
239E82.2Confident82.1Confident36 Ų3689.9 Ų89.917%0.16845%0.452CS..Hα-helixtrans-62.3-40.3175.9-77.1-172.5163.400112.9Q235 K237 M241 R242 Q243 R269Q235-E239 WeakPolarHBondContact O-CG 3.32Å; Q235-E239 PolarHBondContact O-N 3.3Å; K237-E239 VanDerWaalsContact C-N 3.35Å; K237-E239 PolarHBondContact O-N 2.5Å; E239-M241 VanDerWaalsContact C-N 3.34Å; E239-R242 PolarHBondContact O-N 3Å; E239-Q243 WeakPolarHBondContact O-CG 3.18Å; E239-Q243 PolarHBondContact O-N 3.12Å; E239-R269 IonicContact OE2-CZ 3.89Å; E239-R269 IonicContact OE2-NE 2.85Å; E239-R269 IonicContact OE2-NH2 3.76Å; E239-R269 PolarHBondContact OE2-NH2 3.4Å
240K81.4Confident80.8Confident143 Ų14392.8 Ų92.862%0.62248%0.484SS*.Hα-helixtrans-64.4-41.9178.1-169.2-177.7178.9-174.80110.8L236 K237 R238 Q243 A244L236-K240 PolarHBondContact O-N 3.23Å; L236-K240 VanDerWaalsContact O-N 3.07Å; K237-K240 PolarHBondContact O-N 3.24Å; K237-K240 VanDerWaalsContact O-N 3.15Å; R238-K240 PolarHBondContact O-N 3.32Å; K240-Q243 PolarHBondContact O-N 3.06Å; K240-A244 PolarHBondContact O-N 2.93Å
241M80.3Confident79.4Confident127 Ų12796 Ų9663%0.62650%0.496SS*.Hα-helixtrans-62.5-43.8175.3-69.3-60.6-65.200111.5K237 R238 E239 Q243 A244 M245K237-M241 WeakPolarHBondContact O-CG 3.48Å; K237-M241 PolarHBondContact O-N 3.39Å; R238-M241 PolarHBondContact O-N 3.12Å; E239-M241 VanDerWaalsContact C-N 3.34Å; M241-Q243 PolarHBondContact O-N 3.48Å; M241-A244 PolarHBondContact O-N 3.31Å; M241-M245 PolarHBondContact O-N 3.48Å
242R82.3Confident78.1Confident141 Ų14196.2 Ų96.253%0.53251%0.513SS..Hα-helixtrans-62-42.8177.5-158.6-170.575.3145.920.3112R238 E239 M245 E246R238-R242 PolarHBondContact O-N 2.66Å; E239-R242 PolarHBondContact O-N 3Å; R242-M245 PolarHBondContact O-N 3.32Å; R242-E246 IonicContact CZ-OE1 3.03Å; R242-E246 IonicContact NE-OE1 2.96Å; R242-E246 PolarHBondContact NE-OE1 2.04Å; R242-E246 IonicContact NH1-OE1 3.49Å; R242-E246 IonicContact NH2-OE1 2.89Å; R242-E246 PolarHBondContact NH2-OE1 3.14Å; R242-E246 IonicContact NH2-OE2 3.59Å; R242-E246 WeakPolarHBondContact O-CB 3.36Å; R242-E246 WeakPolarHBondContact O-CG 3.45Å; R242-E246 PolarHBondContact O-N 3.26Å
243Q79.2Confident76.8Confident57 Ų57101.4 Ų101.427%0.26654%0.541SS..Hα-helixtrans-63.5-39.9175.6-74.3176.9-16.100112.6E239 K240 M241 M245 E246 A247E239-Q243 WeakPolarHBondContact O-CG 3.18Å; E239-Q243 PolarHBondContact O-N 3.12Å; K240-Q243 PolarHBondContact O-N 3.06Å; M241-Q243 PolarHBondContact O-N 3.48Å; Q243-M245 VanDerWaalsContact C-N 3.29Å; Q243-M245 PolarHBondContact O-N 2.85Å; Q243-E246 PolarHBondContact O-N 3.45Å; Q243-A247 WeakPolarHBondContact O-CB 3.33Å; Q243-A247 PolarHBondContact O-N 3.12Å
244A79.6Confident75.3Confident54 Ų54105.8 Ų105.845%0.44656%0.555SS.*Hα-helixtrans-66.4-32.8176.100000112.4K240 M241 K248K240-A244 PolarHBondContact O-N 2.93Å; M241-A244 PolarHBondContact O-N 3.31Å; A244-K248 PolarHBondContact O-N 3.3Å
245M79.8Confident74.1Confident148 Ų148105.2 Ų105.273%0.72956%0.559SS**Hα-helixtrans-73.3-45174.9-167.2174.8-177.700111.8M241 R242 Q243 A247 K248 S249M241-M245 PolarHBondContact O-N 3.48Å; R242-M245 PolarHBondContact O-N 3.32Å; Q243-M245 VanDerWaalsContact C-N 3.29Å; Q243-M245 PolarHBondContact O-N 2.85Å; M245-A247 VanDerWaalsContact C-N 3.31Å; M245-A247 PolarHBondContact O-N 3.27Å; M245-K248 PolarHBondContact O-N 2.85Å; M245-K248 VanDerWaalsContact O-N 3.11Å; M245-S249 PolarHBondContact O-N 2.88Å
246E78.8Confident72.7Confident88 Ų88110.1 Ų110.141%0.41158%0.58SS.*Hα-helixtrans-59.2-41.1175.5-74.3167.6-173.400111.2R242 Q243 K248 S249R242-E246 IonicContact CZ-OE1 3.03Å; R242-E246 IonicContact NE-OE1 2.96Å; R242-E246 PolarHBondContact NE-OE1 2.04Å; R242-E246 IonicContact NH1-OE1 3.49Å; R242-E246 IonicContact NH2-OE1 2.89Å; R242-E246 PolarHBondContact NH2-OE1 3.14Å; R242-E246 IonicContact NH2-OE2 3.59Å; R242-E246 WeakPolarHBondContact O-CB 3.36Å; R242-E246 WeakPolarHBondContact O-CG 3.45Å; R242-E246 PolarHBondContact O-N 3.26Å; Q243-E246 PolarHBondContact O-N 3.45Å; E246-K248 VanDerWaalsContact C-N 3.28Å; E246-K248 PolarHBondContact O-N 2.99Å; E246-S249 WeakPolarHBondContact CA-OG 3.21Å; E246-S249 PolarHBondContact O-N 2.95Å; E246-S249 VanDerWaalsContact O-N 3.16Å; E246-S249 PolarHBondContact O-OG 3.36Å
247A73.1Confident71.7Confident85 Ų85112.9 Ų112.970%0.70260%0.601SS**Hα-helixtrans-64.4-28176.400000113.9Q243 M245Q243-A247 WeakPolarHBondContact O-CB 3.33Å; Q243-A247 PolarHBondContact O-N 3.12Å; M245-A247 VanDerWaalsContact C-N 3.31Å; M245-A247 PolarHBondContact O-N 3.27Å
248K74.8Confident71Confident190 Ų190110.5 Ų110.583%0.82660%0.595SS**Hα-helixtrans-80-24.3174.8-75.2-178.4177.3-172.50113.1A244 M245 E246 G250A244-K248 PolarHBondContact O-N 3.3Å; M245-K248 PolarHBondContact O-N 2.85Å; M245-K248 VanDerWaalsContact O-N 3.11Å; E246-K248 VanDerWaalsContact C-N 3.28Å; E246-K248 PolarHBondContact O-N 2.99Å; K248-G250 VanDerWaalsContact C-N 3.33Å; K248-G250 PolarHBondContact O-N 3.25Å
249S73.1Confident70.1Confident83 Ų83105.7 Ų105.758%0.5858%0.582SS**THydrogen-bonded Turntrans-83.31.4-176.759.80000115.4M245 E246 F251M245-S249 PolarHBondContact O-N 2.88Å; E246-S249 WeakPolarHBondContact CA-OG 3.21Å; E246-S249 PolarHBondContact O-N 2.95Å; E246-S249 VanDerWaalsContact O-N 3.16Å; E246-S249 PolarHBondContact O-OG 3.36Å; S249-F251 PolarHBondContact O-N 3.41Å
250G57.9Low69.4Low71 Ų71112.4 Ų112.473%0.73261%0.606SS**THydrogen-bonded Turntrans67.65.8166.500000117.2K248 G252K248-G250 VanDerWaalsContact C-N 3.33Å; K248-G250 PolarHBondContact O-N 3.25Å; G250-G252 PolarHBondContact O-N 3.42Å; G250-G252 VanDerWaalsContact O-N 3.07Å
251F58.3Low68.7Low173 Ų173108.2 Ų108.276%0.75959%0.593SS**  trans-82.593-175.5-146.1-98.5000111.6S249 N253S249-F251 PolarHBondContact O-N 3.41Å; F251-N253 PolarHBondContact O-N 3.47Å
252G64.1Low68.2Low68 Ų68107.6 Ų107.670%0.70159%0.588SS**  trans-68.2116.2171.900000110.9G250G250-G252 PolarHBondContact O-N 3.42Å; G250-G252 VanDerWaalsContact O-N 3.07Å
253N58.6Low67.6Low110 Ų110106.4 Ų106.459%0.58859%0.589SS**  trans-145.2129166-116.3-10.7000111.7F251 N258F251-N253 PolarHBondContact O-N 3.47Å; N253-N258 PolarHBondContact O-ND2 3.17Å
254N54.6Low67.1Low132 Ų132108.5 Ų108.571%0.70660%0.599SS**  trans30.579.5176.9-78-4.5000117.2F256 C257 N258N254-F256 VanDerWaalsContact C-N 3.28Å; N254-F256 PolarHBondContact O-N 2.98Å; N254-F256 VanDerWaalsContact O-N 3.14Å; N254-C257 PolarHBondContact O-N 3Å; N254-N258 PolarHBondContact O-N 3.38Å
255S61.3Low66.6Low86 Ų86108.5 Ų108.560%0.60159%0.588SS**Hα-helixtrans-43.4-45.3176.91730000114N258 I259S255-N258 PolarHBondContact O-N 3.34Å; S255-I259 WeakPolarHBondContact O-CD1 3.41Å; S255-I259 WeakPolarHBondContact O-CG1 3.37Å; S255-I259 PolarHBondContact O-N 3.03Å; S255-I259 WeakPolarHBondContact OG-CD1 3.39Å
256F57.5Low66.1Low157 Ų157104 Ų10469%0.68958%0.575SS**Hα-helixtrans-69.7-40-171.5-163.8-101.6000114.5N254 R260N254-F256 VanDerWaalsContact C-N 3.28Å; N254-F256 PolarHBondContact O-N 2.98Å; N254-F256 VanDerWaalsContact O-N 3.14Å; F256-R260 PolarHBondContact O-N 2.75Å
257C60.4Low65.5Low86 Ų86105.9 Ų105.958%0.58158%0.578SS**Hα-helixtrans-73-35.6177.7-168.20000111.4N254 T261N254-C257 PolarHBondContact O-N 3Å; C257-T261 WeakPolarHBondContact O-CB 3.37Å; C257-T261 PolarHBondContact O-N 2.86Å; C257-T261 VanDerWaalsContact O-N 3.13Å; C257-T261 PolarHBondContact O-OG1 3Å
258N68.1Low65.2Low97 Ų97106.1 Ų106.152%0.51956%0.561SS.*Hα-helixtrans-65.8-41.9175-89.4-32.3000112.1N253 N254 S255 R260 T261 Q262N253-N258 PolarHBondContact O-ND2 3.17Å; N254-N258 PolarHBondContact O-N 3.38Å; S255-N258 PolarHBondContact O-N 3.34Å; N258-R260 PolarHBondContact O-N 2.89Å; N258-T261 PolarHBondContact O-N 3.4Å; N258-Q262 WeakPolarHBondContact O-CB 3.36Å; N258-Q262 PolarHBondContact O-N 2.88Å
259I67.9Low65.1Low87 Ų8799.9 Ų99.945%0.44653%0.532SS..Hα-helixtrans-60-48.5176.6-70.4162.2000111.3S255 T261 Q262 Q263S255-I259 WeakPolarHBondContact O-CD1 3.41Å; S255-I259 WeakPolarHBondContact O-CG1 3.37Å; S255-I259 PolarHBondContact O-N 3.03Å; S255-I259 WeakPolarHBondContact OG-CD1 3.39Å; I259-T261 VanDerWaalsContact C-N 3.35Å; I259-T261 PolarHBondContact O-N 3.45Å; I259-Q262 PolarHBondContact O-N 3.47Å; I259-Q263 WeakPolarHBondContact O-CB 3.48Å; I259-Q263 PolarHBondContact O-N 3Å
260R65.9Low65Low178 Ų17899.5 Ų99.567%0.67252%0.521SS*.Hα-helixtrans-61.8-42.7179.8-121.2177.1169179.2-2.8112F256 N258 Q264F256-R260 PolarHBondContact O-N 2.75Å; N258-R260 PolarHBondContact O-N 2.89Å; R260-Q264 PolarHBondContact O-N 3.43Å; R260-Q264 VanDerWaalsContact O-N 3.07Å
261T67.8Low65.4Low55 Ų5597.5 Ų97.534%0.33750%0.495SS..Hα-helixtrans-68.3-40.1178.9-51.80000111.6C257 N258 I259 Q264 K265C257-T261 WeakPolarHBondContact O-CB 3.37Å; C257-T261 PolarHBondContact O-N 2.86Å; C257-T261 VanDerWaalsContact O-N 3.13Å; C257-T261 PolarHBondContact O-OG1 3Å; N258-T261 PolarHBondContact O-N 3.4Å; I259-T261 VanDerWaalsContact C-N 3.35Å; I259-T261 PolarHBondContact O-N 3.45Å; T261-Q264 PolarHBondContact O-N 3.41Å; T261-K265 WeakPolarHBondContact O-CG 3.43Å; T261-K265 PolarHBondContact O-N 3.07Å
262Q70.1Confident66Low114 Ų11489.6 Ų89.653%0.53346%0.461SS..Hα-helixtrans-66.3-42.2176.3-173.6174.7-3.500111.7N258 I259 Q264 K265 A266N258-Q262 WeakPolarHBondContact O-CB 3.36Å; N258-Q262 PolarHBondContact O-N 2.88Å; I259-Q262 PolarHBondContact O-N 3.47Å; Q262-Q264 VanDerWaalsContact C-N 3.35Å; Q262-Q264 PolarHBondContact O-N 2.98Å; Q262-K265 PolarHBondContact O-N 2.97Å; Q262-A266 WeakPolarHBondContact O-CB 3.49Å; Q262-A266 PolarHBondContact O-N 3.46Å
263Q69.3Low66.5Low116 Ų11693.2 Ų93.254%0.54246%0.457SS..Hα-helixtrans-65-37.2176.1-161.8-178.714.900111.9I259 R267I259-Q263 WeakPolarHBondContact O-CB 3.48Å; I259-Q263 PolarHBondContact O-N 3Å; Q263-R267 WeakPolarHBondContact O-CB 3.32Å; Q263-R267 PolarHBondContact O-N 3.28Å
264Q67.9Low67.2Low100 Ų10088.2 Ų88.247%0.46743%0.431SS..Hα-helixtrans-68.2-36.8174.5-160.2-176.4-2.500112.2R260 T261 Q262 R268R260-Q264 PolarHBondContact O-N 3.43Å; R260-Q264 VanDerWaalsContact O-N 3.07Å; T261-Q264 PolarHBondContact O-N 3.41Å; Q262-Q264 VanDerWaalsContact C-N 3.35Å; Q262-Q264 PolarHBondContact O-N 2.98Å; Q264-R268 VanDerWaalsContact CG-NH2 3.34Å; Q264-R268 PolarHBondContact O-N 2.75Å
265K69.8Low67.9Low54 Ų5482 Ų8224%0.23540%0.397CS..Hα-helixtrans-67-44.4173.3-74.7178.3178.6-1770112.3T261 Q262 R267 R268 R269T261-K265 WeakPolarHBondContact O-CG 3.43Å; T261-K265 PolarHBondContact O-N 3.07Å; Q262-K265 PolarHBondContact O-N 2.97Å; K265-R267 VanDerWaalsContact C-N 3.31Å; K265-R267 PolarHBondContact O-N 3.33Å; K265-R268 PolarHBondContact O-N 2.96Å; K265-R269 WeakPolarHBondContact O-CG 3.43Å; K265-R269 PolarHBondContact O-N 2.9Å
266A69.6Low68.7Low54 Ų5483 Ų8345%0.44639%0.391SS..Hα-helixtrans-59.4-42.8175.600000111.7Q262 R269 Q270Q262-A266 WeakPolarHBondContact O-CB 3.49Å; Q262-A266 PolarHBondContact O-N 3.46Å; A266-R269 WeakPolarHBondContact O-CB 3.36Å; A266-R269 PolarHBondContact O-N 3.5Å; A266-Q270 PolarHBondContact O-N 3.47Å
267R66.2Low69.8Low127 Ų12777.8 Ų77.848%0.47937%0.372SS..Hα-helixtrans-61.9-43.4174.9-161.8-173.8-44.3-132.23.1112.5Q263 K265 Q270 V271Q263-R267 WeakPolarHBondContact O-CB 3.32Å; Q263-R267 PolarHBondContact O-N 3.28Å; K265-R267 VanDerWaalsContact C-N 3.31Å; K265-R267 PolarHBondContact O-N 3.33Å; R267-Q270 PolarHBondContact O-N 2.97Å; R267-V271 WeakPolarHBondContact O-CG2 3.44Å; R267-V271 PolarHBondContact O-N 3.4Å; R267-V271 VanDerWaalsContact O-N 3.12Å
268R67.1Low70.4Confident91 Ų9173.8 Ų73.834%0.34335%0.345SS..Hα-helixtrans-60-44.2174.2-84.4-175-88.4-108.3-0.2111.8Q264 K265 Q270 V271 T272Q264-R268 VanDerWaalsContact CG-NH2 3.34Å; Q264-R268 PolarHBondContact O-N 2.75Å; K265-R268 PolarHBondContact O-N 2.96Å; R268-Q270 PolarHBondContact O-N 3.5Å; R268-V271 PolarHBondContact O-N 3.44Å; R268-T272 PolarHBondContact O-N 2.95Å; R268-T272 PolarHBondContact O-OG1 2.9Å; R268-T272 VanDerWaalsContact O-OG1 3.07Å
269R70.8Confident70.9Confident58 Ų5869.6 Ų69.622%0.21932%0.322CS..Hα-helixtrans-59.3-44.9176.4-73.1173-177.5-128.4-7112.9L236 E239 K265 A266 V271 T272 K273L236-R269 HydrophobicContact CD1-CG 4.04Å; L236-R269 HydrophobicContact CD2-CG 3.52Å; L236-R269 HydrophobicContact CG-CG 4.33Å; L236-R269 PolarHBondContact O-NH1 3.27Å; L236-R269 PolarHBondContact O-NH2 3.42Å; L236-R269 VanDerWaalsContact O-NH2 3.08Å; E239-R269 IonicContact OE2-CZ 3.89Å; E239-R269 IonicContact OE2-NE 2.85Å; E239-R269 IonicContact OE2-NH2 3.76Å; E239-R269 PolarHBondContact OE2-NH2 3.4Å; K265-R269 WeakPolarHBondContact O-CG 3.43Å; K265-R269 PolarHBondContact O-N 2.9Å; A266-R269 WeakPolarHBondContact O-CB 3.36Å; A266-R269 PolarHBondContact O-N 3.5Å; R269-V271 VanDerWaalsContact C-N 3.34Å; R269-V271 PolarHBondContact O-N 3.07Å; R269-T272 PolarHBondContact O-N 3.28Å; R269-K273 PolarHBondContact O-N 2.88Å
270Q72.4Confident71.6Confident75 Ų7568.6 Ų68.635%0.3532%0.32SS..Hα-helixtrans-59.7-46.6176.9-179.5-178.1-3.100111.3A266 R267 R268 T272 K273 M274 M335A266-Q270 PolarHBondContact O-N 3.47Å; R267-Q270 PolarHBondContact O-N 2.97Å; R268-Q270 PolarHBondContact O-N 3.5Å; Q270-T272 PolarHBondContact O-N 3.33Å; Q270-K273 PolarHBondContact O-N 3.15Å; Q270-M274 PolarHBondContact O-N 3.17Å; Q270-M335 PolarHBondContact NE2-O 3.46Å
271V66.7Low72.6Confident29 Ų2961.7 Ų61.718%0.17630%0.298CS..Hα-helixtrans-64.6-40.4178.1175.90000111.3R267 R268 R269 M274 L275R267-V271 WeakPolarHBondContact O-CG2 3.44Å; R267-V271 PolarHBondContact O-N 3.4Å; R267-V271 VanDerWaalsContact O-N 3.12Å; R268-V271 PolarHBondContact O-N 3.44Å; R269-V271 VanDerWaalsContact C-N 3.34Å; R269-V271 PolarHBondContact O-N 3.07Å; V271-M274 WeakPolarHBondContact O-CB 3.12Å; V271-M274 PolarHBondContact O-N 3.25Å; V271-L275 HydrophobicContact CG1-CD1 3.99Å; V271-L275 WeakPolarHBondContact O-CD1 3.17Å; V271-L275 WeakPolarHBondContact O-CG 3.36Å; V271-L275 PolarHBondContact O-N 2.84Å
272T69.3Low73.2Confident8 Ų859.4 Ų59.45%0.04928%0.283CS..Hα-helixtrans-62.4-43.8173.5-59.50000112.2Y229 I232 L236 R268 R269 Q270 M274 L275 F276Y229-T272 HydrophobicContact CD1-CG2 4.44Å; Y229-T272 HydrophobicContact CE1-CG2 4.45Å; I232-T272 HydrophobicContact CB-CG2 4.25Å; I232-T272 HydrophobicContact CD1-CG2 4.4Å; I232-T272 HydrophobicContact CG2-CG2 3.35Å; L236-T272 HydrophobicContact CD1-CG2 4.25Å; R268-T272 PolarHBondContact O-N 2.95Å; R268-T272 PolarHBondContact O-OG1 2.9Å; R268-T272 VanDerWaalsContact O-OG1 3.07Å; R269-T272 PolarHBondContact O-N 3.28Å; Q270-T272 PolarHBondContact O-N 3.33Å; T272-M274 VanDerWaalsContact C-N 3.32Å; T272-M274 PolarHBondContact O-N 3.49Å; T272-L275 PolarHBondContact O-N 3.41Å; T272-L275 VanDerWaalsContact O-N 3.14Å; T272-F276 PolarHBondContact O-N 3.22Å
273K75.1Confident73.9Confident144 Ų14454.5 Ų54.563%0.62626%0.263SS*.Hα-helixtrans-60.7-43177.3-176.4-176.8176.2-176.70111.1R269 Q270 L275 F276 V277 M335R269-K273 PolarHBondContact O-N 2.88Å; Q270-K273 PolarHBondContact O-N 3.15Å; K273-L275 VanDerWaalsContact C-N 3.29Å; K273-L275 PolarHBondContact O-N 3.39Å; K273-F276 PolarHBondContact O-N 3.21Å; K273-V277 WeakPolarHBondContact O-CG2 3.33Å; K273-V277 PolarHBondContact O-N 3.41Å; K273-M335 HydrophobicContact CG-CE 4.23Å
274M73.4Confident74.9Confident5 Ų553.6 Ų53.63%0.02526%0.261CS..Hα-helixtrans-55.1-46.6173177.1179.392.600111.6Q270 V271 T272 V277 L278 Y332 M335Q270-M274 PolarHBondContact O-N 3.17Å; V271-M274 WeakPolarHBondContact O-CB 3.12Å; V271-M274 PolarHBondContact O-N 3.25Å; T272-M274 VanDerWaalsContact C-N 3.32Å; T272-M274 PolarHBondContact O-N 3.49Å; M274-V277 PolarHBondContact O-N 2.92Å; M274-L278 PolarHBondContact O-N 2.85Å; M274-Y332 HydrophobicContact CE-CD1 3.97Å; M274-Y332 HydrophobicContact CE-CE1 4.43Å; M274-Y332 HydrophobicContact SD-CD1 4.28Å; M274-M335 HydrophobicContact CB-CB 3.62Å; M274-M335 HydrophobicContact CB-CE 4.3Å; M274-M335 HydrophobicContact CB-CG 4.33Å; M274-M335 HydrophobicContact CG-CB 3.41Å; M274-M335 VanDerWaalsContact CG-CB 3.41Å; M274-M335 HydrophobicContact CG-CG 4.09Å; M274-M335 HydrophobicContact SD-CB 3.73Å
275L70.3Confident76Confident1 Ų149.1 Ų49.11%0.00524%0.24CC..Hα-helixtrans-73.8-30.8-176-66.8167.6000113.4L126 R130 Y229 V271 T272 K273 V277 L278 V279L126-L275 HydrophobicContact CD1-CD2 4.4Å; L126-L275 HydrophobicContact CD2-CD2 3.59Å; L126-L275 HydrophobicContact CG-CD2 4.03Å; R130-L275 HydrophobicContact CB-CD1 4.16Å; R130-L275 HydrophobicContact CG-CD1 3.34Å; R130-L275 VanDerWaalsContact NE-CD1 3.33Å; Y229-L275 HydrophobicContact CE1-CB 3.89Å; Y229-L275 VanDerWaalsContact OH-CB 3.26Å; Y229-L275 WeakPolarHBondContact OH-CB 3.08Å; V271-L275 HydrophobicContact CG1-CD1 3.99Å; V271-L275 WeakPolarHBondContact O-CD1 3.17Å; V271-L275 WeakPolarHBondContact O-CG 3.36Å; V271-L275 PolarHBondContact O-N 2.84Å; T272-L275 PolarHBondContact O-N 3.41Å; T272-L275 VanDerWaalsContact O-N 3.14Å; K273-L275 VanDerWaalsContact C-N 3.29Å; K273-L275 PolarHBondContact O-N 3.39Å; L275-V277 VanDerWaalsContact C-N 3.33Å; L275-L278 WeakPolarHBondContact O-CB 3.46Å; L275-L278 PolarHBondContact O-N 2.72Å; L275-V279 WeakPolarHBondContact O-CG2 3.46Å; L275-V279 PolarHBondContact O-N 3.08Å
276F76.9Confident76.9Confident108 Ų10846.7 Ų46.747%0.47423%0.23SC..Hα-helixtrans-59.9-44.5169.3175-99.9000111.4Y229 T272 K273 L278 V279 V280Y229-F276 HydrophobicContact CD1-CB 4.02Å; Y229-F276 HydrophobicContact CD1-CD2 4.38Å; Y229-F276 HydrophobicContact CE1-CB 4.4Å; Y229-F276 HydrophobicContact CG-CD2 4.19Å; T272-F276 PolarHBondContact O-N 3.22Å; K273-F276 PolarHBondContact O-N 3.21Å; F276-L278 VanDerWaalsContact C-N 3.32Å; F276-L278 PolarHBondContact O-N 2.66Å; F276-V279 PolarHBondContact O-N 3.08Å; F276-V280 HydrophobicContact CE1-CG2 4.05Å; F276-V280 HydrophobicContact CE2-CG2 4.33Å; F276-V280 HydrophobicContact CZ-CG2 3.94Å; F276-V280 PolarHBondContact O-N 2.95Å; F276-V280 VanDerWaalsContact O-N 3.14Å
277V80Confident77.9Confident47 Ų4745.8 Ų45.829%0.28522%0.222SC..Hα-helixtrans-61.7-43.3175.2175.50000110.6K273 M274 L275 V279 V280 V281 L331 M335K273-V277 WeakPolarHBondContact O-CG2 3.33Å; K273-V277 PolarHBondContact O-N 3.41Å; M274-V277 PolarHBondContact O-N 2.92Å; L275-V277 VanDerWaalsContact C-N 3.33Å; V277-V279 VanDerWaalsContact C-N 3.25Å; V277-V279 PolarHBondContact O-N 2.84Å; V277-V280 PolarHBondContact O-N 3.41Å; V277-V281 HydrophobicContact CG1-CG2 4.32Å; V277-V281 WeakPolarHBondContact O-CG2 3.36Å; V277-V281 PolarHBondContact O-N 3.44Å; V277-L331 HydrophobicContact CG1-CD1 4.39Å; V277-L331 HydrophobicContact CG1-CD2 3.72Å; V277-M335 HydrophobicContact CG2-CE 4.06Å
278L74.9Confident79.2Confident2 Ų240.9 Ų40.91%0.0121%0.207CC..Hα-helixtrans-57.6-39.2177.6-170.3150.6000112.1V123 M274 L275 F276 F282 L331 Y332V123-L278 HydrophobicContact CG1-CD2 4.16Å; V123-L278 HydrophobicContact CG2-CD2 4.21Å; M274-L278 PolarHBondContact O-N 2.85Å; L275-L278 WeakPolarHBondContact O-CB 3.46Å; L275-L278 PolarHBondContact O-N 2.72Å; F276-L278 VanDerWaalsContact C-N 3.32Å; F276-L278 PolarHBondContact O-N 2.66Å; L278-F282 WeakPolarHBondContact O-CB 3.22Å; L278-F282 PolarHBondContact O-N 2.62Å; L278-L331 HydrophobicContact CB-CD1 4.01Å; L278-L331 HydrophobicContact CG-CD1 4.26Å; L278-Y332 HydrophobicContact CD1-CE1 3.54Å
279V77.6Confident80.4Confident8 Ų838.1 Ų38.15%0.04820%0.198CC..Hα-helixtrans-69.2-42.7179.4164.10000112.7I225 Y229 L275 F276 V277 V281 F282 G283I225-V279 HydrophobicContact CG2-CB 4Å; I225-V279 HydrophobicContact CG2-CG1 3.27Å; I225-V279 HydrophobicContact CG2-CG2 3.53Å; Y229-V279 HydrophobicContact CD2-CB 4.44Å; Y229-V279 HydrophobicContact CD2-CG1 4.4Å; Y229-V279 HydrophobicContact CD2-CG2 3.87Å; Y229-V279 HydrophobicContact CE2-CB 4.27Å; Y229-V279 HydrophobicContact CE2-CG2 3.26Å; L275-V279 WeakPolarHBondContact O-CG2 3.46Å; L275-V279 PolarHBondContact O-N 3.08Å; F276-V279 PolarHBondContact O-N 3.08Å; V277-V279 VanDerWaalsContact C-N 3.25Å; V277-V279 PolarHBondContact O-N 2.84Å; V279-V281 VanDerWaalsContact C-N 3.33Å; V279-F282 PolarHBondContact O-N 2.92Å; V279-G283 PolarHBondContact O-N 3.18Å
280V83.3Confident81.3Confident67 Ų6735.6 Ų35.641%0.40619%0.188SC..Hα-helixtrans-62.9-46.4177.2172.20000109.6F276 V277 F282 G283 I284F276-V280 HydrophobicContact CE1-CG2 4.05Å; F276-V280 HydrophobicContact CE2-CG2 4.33Å; F276-V280 HydrophobicContact CZ-CG2 3.94Å; F276-V280 PolarHBondContact O-N 2.95Å; F276-V280 VanDerWaalsContact O-N 3.14Å; V277-V280 PolarHBondContact O-N 3.41Å; V280-F282 VanDerWaalsContact C-N 3.34Å; V280-F282 PolarHBondContact O-N 3.35Å; V280-G283 PolarHBondContact O-N 2.91Å; V280-I284 HydrophobicContact CG1-CD1 3.8Å; V280-I284 VanDerWaalsContact O-CG1 3.3Å; V280-I284 WeakPolarHBondContact O-CG1 3.39Å; V280-I284 PolarHBondContact O-N 2.99Å
281V85.2Confident82.3Confident32 Ų3235.2 Ų35.219%0.19419%0.191CC..Hα-helixtrans-59.8-46.2175.1170.10000110.7V277 V279 G283 I284 C285 V327 L331V277-V281 HydrophobicContact CG1-CG2 4.32Å; V277-V281 WeakPolarHBondContact O-CG2 3.36Å; V277-V281 PolarHBondContact O-N 3.44Å; V279-V281 VanDerWaalsContact C-N 3.33Å; V281-G283 PolarHBondContact O-N 3.45Å; V281-I284 PolarHBondContact O-N 3.34Å; V281-C285 WeakPolarHBondContact O-CB 3.4Å; V281-C285 PolarHBondContact O-N 3.44Å; V281-C285 PolarHBondContact O-SG 3.35Å; V281-V327 HydrophobicContact CG1-CB 4.06Å; V281-V327 HydrophobicContact CG1-CG1 3.6Å; V281-V327 HydrophobicContact CG1-CG2 4.5Å; V281-L331 HydrophobicContact CB-CD1 4.45Å; V281-L331 HydrophobicContact CG2-CD1 4.29Å
282F81.4Confident83.5Confident8 Ų834.6 Ų34.64%0.03519%0.187CC..Hα-helixtrans-57.1-50.2177.6-172.7-93.3000111.1I120 V123 M222 L278 V279 V280 I284 C285 W286I120-F282 HydrophobicContact CB-CZ 4.22Å; I120-F282 HydrophobicContact CG1-CE1 4.05Å; I120-F282 HydrophobicContact CG1-CZ 3.59Å; V123-F282 HydrophobicContact CG1-CG 4.47Å; V123-F282 HydrophobicContact CG2-CD2 4.01Å; V123-F282 HydrophobicContact CG2-CE2 4Å; M222-F282 HydrophobicContact SD-CD1 4.27Å; L278-F282 WeakPolarHBondContact O-CB 3.22Å; L278-F282 PolarHBondContact O-N 2.62Å; V279-F282 PolarHBondContact O-N 2.92Å; V280-F282 VanDerWaalsContact C-N 3.34Å; V280-F282 PolarHBondContact O-N 3.35Å; F282-I284 PolarHBondContact O-N 2.85Å; F282-C285 PolarHBondContact O-N 3.32Å; F282-W286 HydrophobicContact CD1-CG 4.37Å; F282-W286 AromaticContact CD2-CD1 3.67Å; F282-W286 HydrophobicContact CD2-CG 4.48Å; F282-W286 AromaticContact CD2-NE1 3.55Å; F282-W286 HydrophobicContact CE1-CD2 4.28Å; F282-W286 HydrophobicContact CE1-CG 4.04Å; F282-W286 AromaticContact CE2-CD1 3.62Å; F282-W286 HydrophobicContact CE2-CD2 4.14Å; F282-W286 AromaticContact CE2-CE2 3.55Å; F282-W286 HydrophobicContact CE2-CG 4.18Å; F282-W286 HydrophobicContact CE2-CZ2 4.15Å; F282-W286 AromaticContact CE2-NE1 3.18Å; F282-W286 AromaticContact CG-CD1 3.96Å; F282-W286 AromaticContact CZ-CD1 3.83Å; F282-W286 AromaticContact CZ-CD2 3.8Å; F282-W286 HydrophobicContact CZ-CD2 3.8Å; F282-W286 AromaticContact CZ-CE2 3.62Å; F282-W286 AromaticContact CZ-CG 3.93Å; F282-W286 HydrophobicContact CZ-CG 3.93Å; F282-W286 HydrophobicContact CZ-CZ2 4.24Å; F282-W286 AromaticContact CZ-NE1 3.64Å; F282-W286 VanDerWaalsContact O-CB 3.24Å; F282-W286 WeakPolarHBondContact O-CB 3.42Å; F282-W286 PolarHBondContact O-N 3.45Å
283G85.5Confident84.6Confident10 Ų1035 Ų3510%0.10319%0.187CC..Hα-helixtrans-58.3-43.8177.100000113.5M222 V279 V280 V281 W286 A287M222-G283 VanDerWaalsContact CE-CA 3.44Å; V279-G283 PolarHBondContact O-N 3.18Å; V280-G283 PolarHBondContact O-N 2.91Å; V281-G283 PolarHBondContact O-N 3.45Å; G283-W286 PolarHBondContact O-N 3.48Å; G283-A287 VanDerWaalsContact O-CB 3.31Å; G283-A287 WeakPolarHBondContact O-CB 3.47Å; G283-A287 PolarHBondContact O-N 2.95Å
284I90.2Very high85.3Confident97 Ų9730.3 Ų30.350%0.49717%0.169SC..Hα-helixtrans-66.3-44.6179-68.9168000111.1V280 V281 F282 W286 P288 F320V280-I284 HydrophobicContact CG1-CD1 3.8Å; V280-I284 VanDerWaalsContact O-CG1 3.3Å; V280-I284 WeakPolarHBondContact O-CG1 3.39Å; V280-I284 PolarHBondContact O-N 2.99Å; V281-I284 PolarHBondContact O-N 3.34Å; F282-I284 PolarHBondContact O-N 2.85Å; I284-W286 VanDerWaalsContact C-N 3.28Å; I284-W286 PolarHBondContact O-N 3.3Å; I284-P288 WeakPolarHBondContact O-CD 3.37Å; I284-F320 HydrophobicContact CG2-CD1 4.28Å; I284-F320 HydrophobicContact CG2-CE1 3.93Å
285C90.6Very high86.1Confident6 Ų631.6 Ų31.64%0.04118%0.175CC..Hα-helixtrans-68.2-28.3-179.7-70.60000113.1V281 F282 F320V281-C285 WeakPolarHBondContact O-CB 3.4Å; V281-C285 PolarHBondContact O-N 3.44Å; V281-C285 PolarHBondContact O-SG 3.35Å; F282-C285 PolarHBondContact O-N 3.32Å; C285-F320 WeakPolarHBondContact CB-O 3.12Å; C285-F320 CarbonylContact O-C 3.56Å; C285-F320 WeakPolarHBondContact O-CB 3.27Å
286W88.9Confident86.9Confident4 Ų434.9 Ų34.92%0.01519%0.188CC..Hα-helixtrans-96.8-22.6-174.6-77.969.9000114.1C116 I120 F218 F282 G283 I284 F289 H290 F321 S324C116-W286 HydrophobicContact CB-CH2 3.78Å; C116-W286 HydrophobicContact CB-CZ3 4.04Å; C116-W286 WeakPolarHBondContact SG-CZ3 3.26Å; I120-W286 HydrophobicContact CD1-CE3 4.14Å; I120-W286 HydrophobicContact CD1-CZ3 3.94Å; I120-W286 HydrophobicContact CG1-CE3 4.31Å; I120-W286 HydrophobicContact CG1-CZ3 4.25Å; F218-W286 HydrophobicContact CD2-CB 4.37Å; F218-W286 HydrophobicContact CE2-CB 3.86Å; F282-W286 HydrophobicContact CD1-CG 4.37Å; F282-W286 AromaticContact CD2-CD1 3.67Å; F282-W286 HydrophobicContact CD2-CG 4.48Å; F282-W286 AromaticContact CD2-NE1 3.55Å; F282-W286 HydrophobicContact CE1-CD2 4.28Å; F282-W286 HydrophobicContact CE1-CG 4.04Å; F282-W286 AromaticContact CE2-CD1 3.62Å; F282-W286 HydrophobicContact CE2-CD2 4.14Å; F282-W286 AromaticContact CE2-CE2 3.55Å; F282-W286 HydrophobicContact CE2-CG 4.18Å; F282-W286 HydrophobicContact CE2-CZ2 4.15Å; F282-W286 AromaticContact CE2-NE1 3.18Å; F282-W286 AromaticContact CG-CD1 3.96Å; F282-W286 AromaticContact CZ-CD1 3.83Å; F282-W286 AromaticContact CZ-CD2 3.8Å; F282-W286 HydrophobicContact CZ-CD2 3.8Å; F282-W286 AromaticContact CZ-CE2 3.62Å; F282-W286 AromaticContact CZ-CG 3.93Å; F282-W286 HydrophobicContact CZ-CG 3.93Å; F282-W286 HydrophobicContact CZ-CZ2 4.24Å; F282-W286 AromaticContact CZ-NE1 3.64Å; F282-W286 VanDerWaalsContact O-CB 3.24Å; F282-W286 WeakPolarHBondContact O-CB 3.42Å; F282-W286 PolarHBondContact O-N 3.45Å; G283-W286 PolarHBondContact O-N 3.48Å; I284-W286 VanDerWaalsContact C-N 3.28Å; I284-W286 PolarHBondContact O-N 3.3Å; W286-F289 HydrophobicContact CE3-CD1 4.33Å; W286-F289 HydrophobicContact CZ3-CD1 4.23Å; W286-F289 HydrophobicContact CZ3-CE1 4.4Å; W286-F289 PolarHBondContact O-N 3.26Å; W286-H290 AromaticContact CE3-NE2 3.87Å; W286-H290 PolarHBondContact O-CD2 3.39Å; W286-H290 PolarHBondContact O-N 2.75Å; W286-F321 HydrophobicContact CH2-CD2 4.05Å; W286-F321 AromaticContact CH2-CE2 3.5Å; W286-F321 HydrophobicContact CH2-CE2 3.5Å; W286-F321 VanDerWaalsContact CH2-CE2 3.5Å; W286-F321 HydrophobicContact CH2-CZ 4.48Å; W286-F321 HydrophobicContact CZ2-CD2 4.34Å; W286-F321 HydrophobicContact CZ2-CE2 4.05Å; W286-F321 HydrophobicContact CZ3-CD2 4.24Å; W286-F321 AromaticContact CZ3-CE2 3.92Å; W286-F321 HydrophobicContact CZ3-CE2 3.92Å; W286-S324 PolarHBondContact NE1-OG 3.41Å; W286-S324 VanDerWaalsContact NE1-OG 3.12Å
287A90.7Very high87.4Confident35 Ų3529.9 Ų29.929%0.28917%0.166SC..Hα-helixtrans-58.7-45.518000000113.6F218 G283 F289 H290 T291F218-A287 HydrophobicContact CZ-CB 4.02Å; G283-A287 VanDerWaalsContact O-CB 3.31Å; G283-A287 WeakPolarHBondContact O-CB 3.47Å; G283-A287 PolarHBondContact O-N 2.95Å; A287-F289 VanDerWaalsContact C-N 3.3Å; A287-F289 PolarHBondContact O-N 2.88Å; A287-H290 PolarHBondContact O-N 2.93Å; A287-T291 WeakPolarHBondContact O-CB 3.47Å; A287-T291 PolarHBondContact O-N 3.34Å; A287-T291 PolarHBondContact O-OG1 3.21Å
288P93.8Very high87.7Confident24 Ų2433.9 Ų33.916%0.15618%0.18CC..Hα-helixtrans-58.9-39.6177-2838.5000113I284 T291 D292 I316 F320I284-P288 WeakPolarHBondContact O-CD 3.37Å; P288-T291 WeakPolarHBondContact O-CB 3.19Å; P288-T291 PolarHBondContact O-N 3.47Å; P288-T291 VanDerWaalsContact O-N 3.16Å; P288-D292 PolarHBondContact O-N 3.35Å; P288-I316 HydrophobicContact CB-CG2 4.15Å; P288-I316 HydrophobicContact CG-CG2 4.27Å; P288-F320 HydrophobicContact CG-CB 4.17Å; P288-F320 HydrophobicContact CG-CD1 4.17Å; P288-F320 HydrophobicContact CG-CG 4.19Å
289F91.3Very high88.2Confident33 Ų3335.3 Ų35.315%0.14519%0.187CC..Hα-helixtrans-62.8-45.6177.8176.8-101.7000113.6W286 A287 T291 R293 S317 F321W286-F289 HydrophobicContact CE3-CD1 4.33Å; W286-F289 HydrophobicContact CZ3-CD1 4.23Å; W286-F289 HydrophobicContact CZ3-CE1 4.4Å; W286-F289 PolarHBondContact O-N 3.26Å; A287-F289 VanDerWaalsContact C-N 3.3Å; A287-F289 PolarHBondContact O-N 2.88Å; F289-T291 VanDerWaalsContact C-N 3.29Å; F289-T291 PolarHBondContact O-N 3.16Å; F289-R293 WeakPolarHBondContact O-CG 3.39Å; F289-R293 PolarHBondContact O-N 3.1Å; F289-S317 VanDerWaalsContact CA-OG 3.22Å; F289-S317 WeakPolarHBondContact CA-OG 3.35Å; F289-F321 HydrophobicContact CB-CD2 4.43Å; F289-F321 HydrophobicContact CD1-CD2 4.37Å; F289-F321 AromaticContact CD2-CD2 3.98Å; F289-F321 HydrophobicContact CD2-CD2 3.98Å; F289-F321 HydrophobicContact CD2-CG 4.38Å; F289-F321 HydrophobicContact CE2-CD2 4.3Å; F289-F321 HydrophobicContact CE2-CE2 4.43Å; F289-F321 HydrophobicContact CG-CD2 4Å; F289-F321 HydrophobicContact CZ-CE2 4.42Å
290H90.6Very high88.4Confident5 Ų538.5 Ų38.52%0.02321%0.21CC..Hα-helixtrans-68.8-31.8173.9-74.7-74.2000111.9T214 F218 W286 A287 R293 L294T214-H290 HydrophobicContact CG2-CB 4.1Å; T214-H290 PolarHBondContact OG1-ND1 3.24Å; F218-H290 WeakPolarHBondContact CB-NE2 3.37Å; F218-H290 HydrophobicContact CD1-CB 3.96Å; F218-H290 AromaticContact CD1-CD2 3.83Å; F218-H290 AromaticContact CD1-CG 3.82Å; F218-H290 AromaticContact CD2-CD2 3.35Å; F218-H290 WeakPolarHBondContact CD2-CD2 3.38Å; F218-H290 AromaticContact CD2-NE2 3.73Å; F218-H290 HydrophobicContact CE1-CB 4.22Å; F218-H290 AromaticContact CE2-CD2 3.92Å; F218-H290 HydrophobicContact CG-CB 4.33Å; F218-H290 AromaticContact CG-CD2 3.31Å; F218-H290 WeakPolarHBondContact CG-CD2 3.41Å; F218-H290 AromaticContact CG-CG 3.69Å; F218-H290 AromaticContact CG-NE2 3.7Å; W286-H290 AromaticContact CE3-NE2 3.87Å; W286-H290 PolarHBondContact O-CD2 3.39Å; W286-H290 PolarHBondContact O-N 2.75Å; A287-H290 PolarHBondContact O-N 2.93Å; H290-R293 PolarHBondContact O-N 3.27Å; H290-L294 WeakPolarHBondContact O-CB 3.13Å; H290-L294 WeakPolarHBondContact O-CG 3.36Å; H290-L294 PolarHBondContact O-N 2.96Å
291T92.3Very high88.4Confident66 Ų6641.2 Ų41.241%0.40522%0.222SC..Hα-helixtrans-64.6-46176.7-56.50000111.3A287 P288 F289 R293 L294 M295 V313A287-T291 WeakPolarHBondContact O-CB 3.47Å; A287-T291 PolarHBondContact O-N 3.34Å; A287-T291 PolarHBondContact O-OG1 3.21Å; P288-T291 WeakPolarHBondContact O-CB 3.19Å; P288-T291 PolarHBondContact O-N 3.47Å; P288-T291 VanDerWaalsContact O-N 3.16Å; F289-T291 VanDerWaalsContact C-N 3.29Å; F289-T291 PolarHBondContact O-N 3.16Å; T291-R293 PolarHBondContact O-N 2.85Å; T291-L294 PolarHBondContact O-N 2.82Å; T291-M295 HydrophobicContact CG2-CG 4.42Å; T291-M295 HydrophobicContact CG2-SD 4.33Å; T291-M295 WeakPolarHBondContact O-CB 3.23Å; T291-M295 WeakPolarHBondContact O-CG 3.42Å; T291-M295 PolarHBondContact O-N 3.05Å; T291-V313 HydrophobicContact CG2-CG1 4.3Å
292D92.6Very high88.5Confident16 Ų1643 Ų439%0.08623%0.225CC..Hα-helixtrans-53.5-51.5174.8178.778.1000111.9P288 L294 M295 W296 F310 V313 H314P288-D292 PolarHBondContact O-N 3.35Å; D292-L294 PolarHBondContact O-N 2.96Å; D292-M295 PolarHBondContact O-N 3.02Å; D292-W296 PolarHBondContact O-N 3.48Å; D292-W296 VanDerWaalsContact O-N 3.07Å; D292-F310 VanDerWaalsContact OD1-CE2 3.32Å; D292-F310 WeakPolarHBondContact OD1-CE2 3.43Å; D292-V313 HydrophobicContact CB-CG1 4.01Å; D292-H314 VanDerWaalsContact OD1-CA 3.24Å; D292-H314 WeakPolarHBondContact OD1-CA 3.2Å; D292-H314 WeakPolarHBondContact OD1-CB 3.34Å; D292-H314 IonicContact OD1-CG 2.96Å; D292-H314 IonicContact OD1-ND1 3.32Å; D292-H314 PolarHBondContact OD1-ND1 3.39Å; D292-H314 IonicContact OD2-ND1 2.84Å; D292-H314 PolarHBondContact OD2-ND1 2.77Å
293R90.9Very high88.9Confident16 Ų1645.8 Ų45.86%0.0624%0.243CC..Hα-helixtrans-63.5-40178.8-64.3176.975.8172.47.5112.6E113 I210 F289 H290 T291 W296 S297E113-R293 IonicContact OE1-NH1 3.57Å; E113-R293 IonicContact OE1-NH2 3.81Å; E113-R293 PolarHBondContact OE1-NH2 3.36Å; E113-R293 IonicContact OE2-CZ 3.64Å; E113-R293 VanDerWaalsContact OE2-CZ 3.32Å; E113-R293 IonicContact OE2-NH1 2.62Å; E113-R293 PolarHBondContact OE2-NH1 2.93Å; E113-R293 IonicContact OE2-NH2 2.66Å; E113-R293 PolarHBondContact OE2-NH2 3.26Å; I210-R293 HydrophobicContact CG2-CB 3.86Å; F289-R293 WeakPolarHBondContact O-CG 3.39Å; F289-R293 PolarHBondContact O-N 3.1Å; H290-R293 PolarHBondContact O-N 3.27Å; T291-R293 PolarHBondContact O-N 2.85Å; R293-W296 PolarHBondContact O-N 3.31Å; R293-S297 WeakPolarHBondContact O-CB 3.21Å; R293-S297 PolarHBondContact O-N 3.28Å
294L90.5Very high89Confident47 Ų4751.5 Ų51.525%0.24627%0.272CS..Hα-helixtrans-69.1-38.5177.8-71.8179.4000111.8I210 T214 H290 T291 D292 W296 S297 F298I210-L294 HydrophobicContact CG2-CD2 4.42Å; T214-L294 HydrophobicContact CG2-CD1 4.07Å; T214-L294 HydrophobicContact CG2-CD2 4.2Å; T214-L294 HydrophobicContact CG2-CG 4.26Å; H290-L294 WeakPolarHBondContact O-CB 3.13Å; H290-L294 WeakPolarHBondContact O-CG 3.36Å; H290-L294 PolarHBondContact O-N 2.96Å; T291-L294 PolarHBondContact O-N 2.82Å; D292-L294 PolarHBondContact O-N 2.96Å; L294-W296 VanDerWaalsContact C-N 3.35Å; L294-S297 PolarHBondContact O-N 3.47Å; L294-S297 VanDerWaalsContact O-N 3.14Å; L294-F298 HydrophobicContact CB-CD2 4.12Å; L294-F298 HydrophobicContact CB-CE2 4.25Å; L294-F298 HydrophobicContact CD2-CD2 4.42Å; L294-F298 HydrophobicContact CD2-CE2 3.82Å; L294-F298 HydrophobicContact CG-CE2 4.45Å; L294-F298 WeakPolarHBondContact O-CB 3.37Å; L294-F298 VanDerWaalsContact O-CD2 3.27Å; L294-F298 WeakPolarHBondContact O-CD2 3.36Å; L294-F298 PolarHBondContact O-N 3.46Å
295M90.9Very high89Confident32 Ų3250.6 Ų50.616%0.15827%0.274CS..Hα-helixtrans-59.1-47.9173.6-77.2-178.466.700110.7T291 D292 S297 F298 I299 I309 F310 V313T291-M295 HydrophobicContact CG2-CG 4.42Å; T291-M295 HydrophobicContact CG2-SD 4.33Å; T291-M295 WeakPolarHBondContact O-CB 3.23Å; T291-M295 WeakPolarHBondContact O-CG 3.42Å; T291-M295 PolarHBondContact O-N 3.05Å; D292-M295 PolarHBondContact O-N 3.02Å; M295-S297 PolarHBondContact O-N 3.13Å; M295-F298 PolarHBondContact O-N 3.35Å; M295-I299 HydrophobicContact CB-CD1 4.11Å; M295-I299 HydrophobicContact CE-CD1 3.98Å; M295-I299 HydrophobicContact CG-CD1 4.41Å; M295-I299 WeakPolarHBondContact O-CB 3.49Å; M295-I299 VanDerWaalsContact O-CG1 3.32Å; M295-I299 WeakPolarHBondContact O-CG1 3.43Å; M295-I299 PolarHBondContact O-N 3.45Å; M295-I309 HydrophobicContact CE-CG2 3.91Å; M295-F310 HydrophobicContact CB-CD2 4.16Å; M295-F310 HydrophobicContact CE-CB 4.05Å; M295-F310 HydrophobicContact CE-CD2 4.29Å; M295-V313 HydrophobicContact SD-CB 4.03Å; M295-V313 HydrophobicContact SD-CG1 3.85Å; M295-V313 HydrophobicContact SD-CG2 3.84Å
296W87.1Confident89Confident70 Ų7053.6 Ų53.627%0.26529%0.287SS..Hα-helixtrans-59-38.5175-165.7103.3000112V199 R203 Y206 D292 R293 L294 F310V199-W296 HydrophobicContact CB-CH2 4.23Å; V199-W296 HydrophobicContact CB-CZ2 4.49Å; V199-W296 HydrophobicContact CG1-CH2 4.45Å; V199-W296 HydrophobicContact CG2-CH2 4.11Å; V199-W296 HydrophobicContact CG2-CZ2 4.26Å; R203-W296 HydrophobicContact CG-CH2 4.29Å; R203-W296 HydrophobicContact CG-CZ3 3.99Å; R203-W296 PolarHBondContact NH2-O 3.38Å; Y206-W296 AromaticContact CD1-CE3 3.42Å; Y206-W296 HydrophobicContact CD1-CE3 3.42Å; Y206-W296 VanDerWaalsContact CD1-CE3 3.42Å; Y206-W296 AromaticContact CD1-CH2 3.91Å; Y206-W296 HydrophobicContact CD1-CH2 3.91Å; Y206-W296 AromaticContact CD1-CZ3 3.04Å; Y206-W296 HydrophobicContact CD1-CZ3 3.04Å; Y206-W296 AromaticContact CE1-CD2 3.87Å; Y206-W296 HydrophobicContact CE1-CD2 3.87Å; Y206-W296 AromaticContact CE1-CE3 3.06Å; Y206-W296 HydrophobicContact CE1-CE3 3.06Å; Y206-W296 HydrophobicContact CE1-CH2 4.07Å; Y206-W296 AromaticContact CE1-CZ3 3.21Å; Y206-W296 HydrophobicContact CE1-CZ3 3.21Å; Y206-W296 HydrophobicContact CG-CH2 4.33Å; Y206-W296 AromaticContact CG-CZ3 3.85Å; Y206-W296 HydrophobicContact CG-CZ3 3.85Å; D292-W296 PolarHBondContact O-N 3.48Å; D292-W296 VanDerWaalsContact O-N 3.07Å; R293-W296 PolarHBondContact O-N 3.31Å; L294-W296 VanDerWaalsContact C-N 3.35Å; W296-F310 HydrophobicContact CB-CE2 4.32Å
297S86.8Confident88.9Confident3 Ų358 Ų582%0.02131%0.308CS..Hα-helixtrans-71.8-41.6-179.3-179.70000113.9N207 R293 L294 M295N207-S297 WeakPolarHBondContact CA-OG 3.38Å; N207-S297 WeakPolarHBondContact CB-OG 3.24Å; N207-S297 VanDerWaalsContact CG-O 3.3Å; N207-S297 VanDerWaalsContact CG-OG 3.31Å; N207-S297 PolarHBondContact ND2-O 3.1Å; N207-S297 WeakPolarHBondContact OD1-CA 3.41Å; N207-S297 PolarHBondContact OD1-O 3.09Å; N207-S297 PolarHBondContact OD1-OG 3.03Å; R293-S297 WeakPolarHBondContact O-CB 3.21Å; R293-S297 PolarHBondContact O-N 3.28Å; L294-S297 PolarHBondContact O-N 3.47Å; L294-S297 VanDerWaalsContact O-N 3.14Å; M295-S297 PolarHBondContact O-N 3.13Å
298F86.6Confident88.8Confident130 Ų13062.9 Ų62.957%0.5732%0.322SS*.Hα-helixtrans-92.8-28.3-170.6-74.6-60.2000114.1Q211 L294 M295 S300Q211-F298 HydrophobicContact CG-CZ 4.18Å; L294-F298 HydrophobicContact CB-CD2 4.12Å; L294-F298 HydrophobicContact CB-CE2 4.25Å; L294-F298 HydrophobicContact CD2-CD2 4.42Å; L294-F298 HydrophobicContact CD2-CE2 3.82Å; L294-F298 HydrophobicContact CG-CE2 4.45Å; L294-F298 WeakPolarHBondContact O-CB 3.37Å; L294-F298 VanDerWaalsContact O-CD2 3.27Å; L294-F298 WeakPolarHBondContact O-CD2 3.36Å; L294-F298 PolarHBondContact O-N 3.46Å; M295-F298 PolarHBondContact O-N 3.35Å; F298-S300 PolarHBondContact O-N 3.08Å; F298-S300 VanDerWaalsContact O-N 3.15Å
299I86.3Confident88.7Confident33 Ų3366.1 Ų66.117%0.16934%0.337CS..  trans-80.899.1-178.5-59.9173.3000108.8R203 M295 W302R203-I299 PolarHBondContact NH2-O 3.26Å; M295-I299 HydrophobicContact CB-CD1 4.11Å; M295-I299 HydrophobicContact CE-CD1 3.98Å; M295-I299 HydrophobicContact CG-CD1 4.41Å; M295-I299 WeakPolarHBondContact O-CB 3.49Å; M295-I299 VanDerWaalsContact O-CG1 3.32Å; M295-I299 WeakPolarHBondContact O-CG1 3.43Å; M295-I299 PolarHBondContact O-N 3.45Å; I299-W302 HydrophobicContact CB-CZ2 4.17Å; I299-W302 HydrophobicContact CD1-CH2 4.39Å; I299-W302 HydrophobicContact CG2-CD2 3.87Å; I299-W302 HydrophobicContact CG2-CE3 4.3Å; I299-W302 HydrophobicContact CG2-CG 4.12Å; I299-W302 HydrophobicContact CG2-CZ2 4.31Å; I299-W302 PolarHBondContact O-NE1 3.27Å
300S80.4Confident88.7Confident75 Ų7566.5 Ų66.552%0.52434%0.339SS..  trans-70.6-48.5173.549.40000111.4F298F298-S300 PolarHBondContact O-N 3.08Å; F298-S300 VanDerWaalsContact O-N 3.15Å
301D84.5Confident88.6Confident124 Ų12470.4 Ų70.466%0.66336%0.357SS*.SBendtrans-110.5107.4-170.9-54.8-61.2000110.2H306D301-H306 PolarHBondContact O-ND1 3.04Å
302W86.8Confident88.6Confident68 Ų6874.9 Ų74.926%0.25837%0.368SS..  trans-86129.8-177.1-67.680.7000110.4I299 H306 H307 F310I299-W302 HydrophobicContact CB-CZ2 4.17Å; I299-W302 HydrophobicContact CD1-CH2 4.39Å; I299-W302 HydrophobicContact CG2-CD2 3.87Å; I299-W302 HydrophobicContact CG2-CE3 4.3Å; I299-W302 HydrophobicContact CG2-CG 4.12Å; I299-W302 HydrophobicContact CG2-CZ2 4.31Å; I299-W302 PolarHBondContact O-NE1 3.27Å; W302-H306 HydrophobicContact CE3-CB 3.9Å; W302-H306 HydrophobicContact CZ3-CB 4.38Å; W302-H307 VanDerWaalsContact CB-NE2 3.28Å; W302-H307 WeakPolarHBondContact CB-NE2 3.3Å; W302-H307 AromaticContact CD2-CE1 3.88Å; W302-H307 AromaticContact CE3-CE1 3.75Å; W302-H307 AromaticContact CE3-ND1 3.57Å; W302-H307 AromaticContact CG-CE1 3.83Å; W302-F310 HydrophobicContact CH2-CB 3.93Å; W302-F310 HydrophobicContact CH2-CD1 4.1Å; W302-F310 AromaticContact CH2-CD2 3.64Å; W302-F310 HydrophobicContact CH2-CD2 3.64Å; W302-F310 HydrophobicContact CH2-CE2 4.16Å; W302-F310 AromaticContact CH2-CG 3.6Å; W302-F310 HydrophobicContact CH2-CG 3.6Å; W302-F310 HydrophobicContact CZ3-CB 3.52Å; W302-F310 HydrophobicContact CZ3-CD1 4.18Å; W302-F310 HydrophobicContact CZ3-CD2 4.16Å; W302-F310 AromaticContact CZ3-CG 3.69Å; W302-F310 HydrophobicContact CZ3-CG 3.69Å
303T90.2Very high88.6Confident68 Ų6875.5 Ų75.542%0.41737%0.372SS..  trans-109164.5170.268.10000108.5S305 H306 H307T303-S305 PolarHBondContact O-N 2.8Å; T303-S305 VanDerWaalsContact O-N 3.16Å; T303-H306 PolarHBondContact N-ND1 2.91Å; T303-H306 WeakPolarHBondContact O-CA 3.47Å; T303-H306 WeakPolarHBondContact O-CB 3.37Å; T303-H306 PolarHBondContact O-N 3.35Å; T303-H306 PolarHBondContact OG1-CE1 3.24Å; T303-H306 PolarHBondContact OG1-N 3.35Å; T303-H306 PolarHBondContact OG1-ND1 2.91Å; T303-H307 PolarHBondContact O-CD2 2.97Å; T303-H307 PolarHBondContact O-N 2.69Å
304D87.4Confident88.7Confident130 Ų13079 Ų7970%0.69539%0.389SS*.Hα-helixtrans-55.5-35.7177.5-60.7-29.8000112.5H307 K308D304-H307 PolarHBondContact O-N 3.15Å; D304-K308 WeakPolarHBondContact O-CG 3.28Å; D304-K308 PolarHBondContact O-N 2.72Å; D304-K308 VanDerWaalsContact O-N 3.14Å
305S90.2Very high88.7Confident78 Ų7878.9 Ų78.955%0.54539%0.388SS..Hα-helixtrans-66.4-42174.4-620000112T303 K308 I309T303-S305 PolarHBondContact O-N 2.8Å; T303-S305 VanDerWaalsContact O-N 3.16Å; S305-K308 PolarHBondContact O-N 3.01Å; S305-I309 VanDerWaalsContact O-CG1 3.29Å; S305-I309 WeakPolarHBondContact O-CG1 3.33Å; S305-I309 PolarHBondContact O-N 3.06Å
306H90.1Very high88.9Confident69 Ų6981.2 Ų81.232%0.31940%0.401SS..Hα-helixtrans-63.1-41.9176.4-63.5133.8000111.6D301 W302 T303 I309 F310D301-H306 PolarHBondContact O-ND1 3.04Å; W302-H306 HydrophobicContact CE3-CB 3.9Å; W302-H306 HydrophobicContact CZ3-CB 4.38Å; T303-H306 PolarHBondContact N-ND1 2.91Å; T303-H306 WeakPolarHBondContact O-CA 3.47Å; T303-H306 WeakPolarHBondContact O-CB 3.37Å; T303-H306 PolarHBondContact O-N 3.35Å; T303-H306 PolarHBondContact OG1-CE1 3.24Å; T303-H306 PolarHBondContact OG1-N 3.35Å; T303-H306 PolarHBondContact OG1-ND1 2.91Å; H306-I309 PolarHBondContact O-N 3.42Å; H306-F310 VanDerWaalsContact O-CB 3.26Å; H306-F310 WeakPolarHBondContact O-CB 3.43Å; H306-F310 PolarHBondContact O-N 3.42Å
307H87.3Confident89.2Confident97 Ų9778.1 Ų78.145%0.44939%0.389SS..Hα-helixtrans-60.7-46.5176.9-75.4-60.8000112.2W302 T303 D304 F310 E311W302-H307 VanDerWaalsContact CB-NE2 3.28Å; W302-H307 WeakPolarHBondContact CB-NE2 3.3Å; W302-H307 AromaticContact CD2-CE1 3.88Å; W302-H307 AromaticContact CE3-CE1 3.75Å; W302-H307 AromaticContact CE3-ND1 3.57Å; W302-H307 AromaticContact CG-CE1 3.83Å; T303-H307 PolarHBondContact O-CD2 2.97Å; T303-H307 PolarHBondContact O-N 2.69Å; D304-H307 PolarHBondContact O-N 3.15Å; H307-F310 PolarHBondContact O-N 3.36Å; H307-E311 PolarHBondContact O-N 3.03Å
308K88.6Confident89.5Confident137 Ų13778.2 Ų78.260%0.59639%0.391SS*.Hα-helixtrans-60.8-46.6176.8-72.4174.6-178.3175.40112.2D304 S305 F310 E311 Y312D304-K308 WeakPolarHBondContact O-CG 3.28Å; D304-K308 PolarHBondContact O-N 2.72Å; D304-K308 VanDerWaalsContact O-N 3.14Å; S305-K308 PolarHBondContact O-N 3.01Å; K308-F310 VanDerWaalsContact C-N 3.33Å; K308-F310 PolarHBondContact O-N 2.82Å; K308-E311 PolarHBondContact O-N 3.41Å; K308-Y312 WeakPolarHBondContact O-CD2 3.39Å; K308-Y312 PolarHBondContact O-N 2.77Å
309I91.3Very high89.9Confident92 Ų9273.6 Ų73.647%0.47237%0.374SS..Hα-helixtrans-63.1-43.7178.8-65.5167.2000110.3M295 S305 H306 E311 Y312 V313M295-I309 HydrophobicContact CE-CG2 3.91Å; S305-I309 VanDerWaalsContact O-CG1 3.29Å; S305-I309 WeakPolarHBondContact O-CG1 3.33Å; S305-I309 PolarHBondContact O-N 3.06Å; H306-I309 PolarHBondContact O-N 3.42Å; I309-E311 PolarHBondContact O-N 3.41Å; I309-Y312 PolarHBondContact O-N 3.45Å; I309-V313 HydrophobicContact CG2-CG2 4.22Å; I309-V313 WeakPolarHBondContact O-CG2 3.39Å; I309-V313 PolarHBondContact O-N 2.97Å
310F91.1Very high90.3Very high40 Ų4075.3 Ų75.318%0.17538%0.38CS..Hα-helixtrans-62.7-41179179.1-100.7000112.2D292 M295 W296 W302 H306 H307 K308 Y312 V313 H314D292-F310 VanDerWaalsContact OD1-CE2 3.32Å; D292-F310 WeakPolarHBondContact OD1-CE2 3.43Å; M295-F310 HydrophobicContact CB-CD2 4.16Å; M295-F310 HydrophobicContact CE-CB 4.05Å; M295-F310 HydrophobicContact CE-CD2 4.29Å; W296-F310 HydrophobicContact CB-CE2 4.32Å; W302-F310 HydrophobicContact CH2-CB 3.93Å; W302-F310 HydrophobicContact CH2-CD1 4.1Å; W302-F310 AromaticContact CH2-CD2 3.64Å; W302-F310 HydrophobicContact CH2-CD2 3.64Å; W302-F310 HydrophobicContact CH2-CE2 4.16Å; W302-F310 AromaticContact CH2-CG 3.6Å; W302-F310 HydrophobicContact CH2-CG 3.6Å; W302-F310 HydrophobicContact CZ3-CB 3.52Å; W302-F310 HydrophobicContact CZ3-CD1 4.18Å; W302-F310 HydrophobicContact CZ3-CD2 4.16Å; W302-F310 AromaticContact CZ3-CG 3.69Å; W302-F310 HydrophobicContact CZ3-CG 3.69Å; H306-F310 VanDerWaalsContact O-CB 3.26Å; H306-F310 WeakPolarHBondContact O-CB 3.43Å; H306-F310 PolarHBondContact O-N 3.42Å; H307-F310 PolarHBondContact O-N 3.36Å; K308-F310 VanDerWaalsContact C-N 3.33Å; K308-F310 PolarHBondContact O-N 2.82Å; F310-Y312 PolarHBondContact O-N 3.39Å; F310-V313 PolarHBondContact O-N 2.95Å; F310-H314 WeakPolarHBondContact O-CB 3.34Å; F310-H314 PolarHBondContact O-N 3.4Å
311E89.3Confident90.9Very high87 Ų8772 Ų7241%0.40736%0.356SS..Hα-helixtrans-56.8-47.2174.8-173-178.9179.100111.7H307 K308 I309 H314 I315H307-E311 PolarHBondContact O-N 3.03Å; K308-E311 PolarHBondContact O-N 3.41Å; I309-E311 PolarHBondContact O-N 3.41Å; E311-H314 PolarHBondContact O-N 3.05Å; E311-I315 HydrophobicContact CG-CD1 4.14Å; E311-I315 WeakPolarHBondContact O-CD1 3.31Å; E311-I315 VanDerWaalsContact O-CG1 3.27Å; E311-I315 WeakPolarHBondContact O-CG1 3.24Å; E311-I315 PolarHBondContact O-N 3.07Å
312Y91.3Very high91.4Very high160 Ų16066.1 Ų66.163%0.62733%0.325SS*.Hα-helixtrans-63.7-44.8175.7-72.3-65.7000112.7K308 I309 F310 H314 I315 I316K308-Y312 WeakPolarHBondContact O-CD2 3.39Å; K308-Y312 PolarHBondContact O-N 2.77Å; I309-Y312 PolarHBondContact O-N 3.45Å; F310-Y312 PolarHBondContact O-N 3.39Å; Y312-H314 VanDerWaalsContact C-N 3.3Å; Y312-H314 PolarHBondContact O-N 3.45Å; Y312-I315 PolarHBondContact O-N 3.29Å; Y312-I316 WeakPolarHBondContact O-CB 3.43Å; Y312-I316 VanDerWaalsContact O-CG1 3.24Å; Y312-I316 WeakPolarHBondContact O-CG1 3.5Å; Y312-I316 PolarHBondContact O-N 2.7Å
313V93.6Very high91.8Very high29 Ų2965.7 Ų65.718%0.17633%0.327CS..Hα-helixtrans-62.3-40.4178.4170.40000110.7T291 D292 M295 I309 F310 I316 S317T291-V313 HydrophobicContact CG2-CG1 4.3Å; D292-V313 HydrophobicContact CB-CG1 4.01Å; M295-V313 HydrophobicContact SD-CB 4.03Å; M295-V313 HydrophobicContact SD-CG1 3.85Å; M295-V313 HydrophobicContact SD-CG2 3.84Å; I309-V313 HydrophobicContact CG2-CG2 4.22Å; I309-V313 WeakPolarHBondContact O-CG2 3.39Å; I309-V313 PolarHBondContact O-N 2.97Å; F310-V313 PolarHBondContact O-N 2.95Å; V313-I316 PolarHBondContact O-N 3.31Å; V313-S317 WeakPolarHBondContact O-CA 3.32Å; V313-S317 WeakPolarHBondContact O-CB 3.43Å; V313-S317 PolarHBondContact O-N 3.14Å
314H91.9Very high91.8Very high90 Ų9062.6 Ų62.642%0.41731%0.308SS..Hα-helixtrans-63.6-44.9178.7-168.371.1000111.9D292 F310 E311 Y312 S317 G318D292-H314 VanDerWaalsContact OD1-CA 3.24Å; D292-H314 WeakPolarHBondContact OD1-CA 3.2Å; D292-H314 WeakPolarHBondContact OD1-CB 3.34Å; D292-H314 IonicContact OD1-CG 2.96Å; D292-H314 IonicContact OD1-ND1 3.32Å; D292-H314 PolarHBondContact OD1-ND1 3.39Å; D292-H314 IonicContact OD2-ND1 2.84Å; D292-H314 PolarHBondContact OD2-ND1 2.77Å; F310-H314 WeakPolarHBondContact O-CB 3.34Å; F310-H314 PolarHBondContact O-N 3.4Å; E311-H314 PolarHBondContact O-N 3.05Å; Y312-H314 VanDerWaalsContact C-N 3.3Å; Y312-H314 PolarHBondContact O-N 3.45Å; H314-S317 WeakPolarHBondContact O-CB 3.32Å; H314-S317 PolarHBondContact O-N 3.04Å; H314-G318 PolarHBondContact O-N 2.83Å
315I92Very high92.1Very high44 Ų4456.5 Ų56.523%0.22628%0.276CS..Hα-helixtrans-64.5-48.6176.6-65.2162.6000111V30 V34 E311 Y312 S317 G318 V319V30-I315 HydrophobicContact CB-CD1 4.15Å; V30-I315 HydrophobicContact CG1-CD1 3.86Å; V30-I315 HydrophobicContact CG2-CD1 3.84Å; V30-I315 HydrophobicContact CG2-CG1 4.18Å; V34-I315 HydrophobicContact CG2-CG2 4.09Å; E311-I315 HydrophobicContact CG-CD1 4.14Å; E311-I315 WeakPolarHBondContact O-CD1 3.31Å; E311-I315 VanDerWaalsContact O-CG1 3.27Å; E311-I315 WeakPolarHBondContact O-CG1 3.24Å; E311-I315 PolarHBondContact O-N 3.07Å; Y312-I315 PolarHBondContact O-N 3.29Å; I315-S317 VanDerWaalsContact C-N 3.28Å; I315-S317 PolarHBondContact O-N 3.42Å; I315-G318 PolarHBondContact O-N 2.76Å; I315-V319 WeakPolarHBondContact O-CG2 3.01Å; I315-V319 PolarHBondContact O-N 3.23Å; I315-V319 VanDerWaalsContact O-N 3.08Å
316I93.8Very high92.2Very high82 Ų8253 Ų5342%0.42125%0.251SS..Hα-helixtrans-61.8-41.5178.9-67.8167.5000110.1P288 Y312 V313 V319 F320P288-I316 HydrophobicContact CB-CG2 4.15Å; P288-I316 HydrophobicContact CG-CG2 4.27Å; Y312-I316 WeakPolarHBondContact O-CB 3.43Å; Y312-I316 VanDerWaalsContact O-CG1 3.24Å; Y312-I316 WeakPolarHBondContact O-CG1 3.5Å; Y312-I316 PolarHBondContact O-N 2.7Å; V313-I316 PolarHBondContact O-N 3.31Å; I316-V319 PolarHBondContact O-N 3.13Å; I316-F320 HydrophobicContact CG2-CD2 3.83Å; I316-F320 HydrophobicContact CG2-CE2 3.99Å; I316-F320 HydrophobicContact CG2-CG 4.5Å; I316-F320 WeakPolarHBondContact O-CB 3.48Å; I316-F320 VanDerWaalsContact O-CD2 3.31Å; I316-F320 WeakPolarHBondContact O-CD2 3.36Å; I316-F320 PolarHBondContact O-N 3.46Å
317S94.5Very high92.1Very high4 Ų451 Ų513%0.02824%0.244CC..Hα-helixtrans-53.1-57174.1163.20000111.7F289 V313 H314 I315 V319 F320 F321F289-S317 VanDerWaalsContact CA-OG 3.22Å; F289-S317 WeakPolarHBondContact CA-OG 3.35Å; V313-S317 WeakPolarHBondContact O-CA 3.32Å; V313-S317 WeakPolarHBondContact O-CB 3.43Å; V313-S317 PolarHBondContact O-N 3.14Å; H314-S317 WeakPolarHBondContact O-CB 3.32Å; H314-S317 PolarHBondContact O-N 3.04Å; I315-S317 VanDerWaalsContact C-N 3.28Å; I315-S317 PolarHBondContact O-N 3.42Å; S317-V319 PolarHBondContact O-N 3.29Å; S317-F320 PolarHBondContact O-N 2.77Å; S317-F321 WeakPolarHBondContact O-CB 3.41Å; S317-F321 PolarHBondContact O-N 3.41Å
318G93.1Very high92Very high6 Ų646.5 Ų46.56%0.06222%0.223CC..Hα-helixtrans-59.4-47.5-179.900000112.3Y38 H314 I315 F320 F321 Y322Y38-G318 VanDerWaalsContact OH-C 3.31Å; Y38-G318 WeakPolarHBondContact OH-CA 3.5Å; H314-G318 PolarHBondContact O-N 2.83Å; I315-G318 PolarHBondContact O-N 2.76Å; G318-F320 PolarHBondContact O-N 2.84Å; G318-F321 PolarHBondContact O-N 3.33Å; G318-Y322 WeakPolarHBondContact O-CD2 3.25Å; G318-Y322 PolarHBondContact O-N 2.96Å; G318-Y322 VanDerWaalsContact O-N 3.12Å
319V94.6Very high91.7Very high33 Ų3340.5 Ų40.520%0.220%0.198CC..Hα-helixtrans-59.1-48.7178.8174.40000111.7Y38 I41 I315 I316 S317 L323Y38-V319 HydrophobicContact CE1-CG2 3.95Å; I41-V319 HydrophobicContact CD1-CG1 4.29Å; I315-V319 WeakPolarHBondContact O-CG2 3.01Å; I315-V319 PolarHBondContact O-N 3.23Å; I315-V319 VanDerWaalsContact O-N 3.08Å; I316-V319 PolarHBondContact O-N 3.13Å; S317-V319 PolarHBondContact O-N 3.29Å; V319-L323 WeakPolarHBondContact O-CB 3.29Å; V319-L323 PolarHBondContact O-N 2.84Å
320F94.8Very high91.3Very high69 Ų6939.6 Ų39.630%0.30319%0.193SC..Hα-helixtrans-69.4-35.6-178.4-86.1-118.3000112I284 C285 P288 I316 S317 G318 L323 S324I284-F320 HydrophobicContact CG2-CD1 4.28Å; I284-F320 HydrophobicContact CG2-CE1 3.93Å; C285-F320 WeakPolarHBondContact CB-O 3.12Å; C285-F320 CarbonylContact O-C 3.56Å; C285-F320 WeakPolarHBondContact O-CB 3.27Å; P288-F320 HydrophobicContact CG-CB 4.17Å; P288-F320 HydrophobicContact CG-CD1 4.17Å; P288-F320 HydrophobicContact CG-CG 4.19Å; I316-F320 HydrophobicContact CG2-CD2 3.83Å; I316-F320 HydrophobicContact CG2-CE2 3.99Å; I316-F320 HydrophobicContact CG2-CG 4.5Å; I316-F320 WeakPolarHBondContact O-CB 3.48Å; I316-F320 VanDerWaalsContact O-CD2 3.31Å; I316-F320 WeakPolarHBondContact O-CD2 3.36Å; I316-F320 PolarHBondContact O-N 3.46Å; S317-F320 PolarHBondContact O-N 2.77Å; G318-F320 PolarHBondContact O-N 2.84Å; F320-L323 PolarHBondContact O-N 2.93Å; F320-S324 PolarHBondContact O-N 3.4Å
321F93.4Very high90.6Very high6 Ų638.4 Ų38.43%0.02619%0.189CC..Hα-helixtrans-57.5-53.4175.1176.3-100000111.3V80 F112 C116 W286 F289 S317 G318 S324V80-F321 HydrophobicContact CG1-CD1 4.5Å; V80-F321 HydrophobicContact CG1-CE1 3.76Å; V80-F321 HydrophobicContact CG1-CZ 4.34Å; V80-F321 HydrophobicContact CG2-CZ 4.41Å; F112-F321 HydrophobicContact CD1-CE1 4.11Å; F112-F321 HydrophobicContact CD1-CZ 4.26Å; F112-F321 HydrophobicContact CE1-CE1 4.08Å; C116-F321 HydrophobicContact CB-CE2 4.49Å; W286-F321 HydrophobicContact CH2-CD2 4.05Å; W286-F321 AromaticContact CH2-CE2 3.5Å; W286-F321 HydrophobicContact CH2-CE2 3.5Å; W286-F321 VanDerWaalsContact CH2-CE2 3.5Å; W286-F321 HydrophobicContact CH2-CZ 4.48Å; W286-F321 HydrophobicContact CZ2-CD2 4.34Å; W286-F321 HydrophobicContact CZ2-CE2 4.05Å; W286-F321 HydrophobicContact CZ3-CD2 4.24Å; W286-F321 AromaticContact CZ3-CE2 3.92Å; W286-F321 HydrophobicContact CZ3-CE2 3.92Å; F289-F321 HydrophobicContact CB-CD2 4.43Å; F289-F321 HydrophobicContact CD1-CD2 4.37Å; F289-F321 AromaticContact CD2-CD2 3.98Å; F289-F321 HydrophobicContact CD2-CD2 3.98Å; F289-F321 HydrophobicContact CD2-CG 4.38Å; F289-F321 HydrophobicContact CE2-CD2 4.3Å; F289-F321 HydrophobicContact CE2-CE2 4.43Å; F289-F321 HydrophobicContact CG-CD2 4Å; F289-F321 HydrophobicContact CZ-CE2 4.42Å; S317-F321 WeakPolarHBondContact O-CB 3.41Å; S317-F321 PolarHBondContact O-N 3.41Å; G318-F321 PolarHBondContact O-N 3.33Å; F321-S324 VanDerWaalsContact O-CB 3.28Å; F321-S324 WeakPolarHBondContact O-CB 3.23Å; F321-S324 PolarHBondContact O-N 3.49Å; F321-S324 PolarHBondContact O-OG 2.82Å
322Y94.7Very high90Very high0 Ų034.4 Ų34.40%017%0.17CC..Hα-helixtrans-71.3-33.9178.2-66.7-64.9000113.4Y38 I41 V80 L81 M85 E88 F112 G318 S324 S325 A326Y38-Y322 HydrophobicContact CD1-CD2 4.36Å; Y38-Y322 HydrophobicContact CD2-CD2 4.26Å; Y38-Y322 HydrophobicContact CD2-CE2 4.24Å; Y38-Y322 AromaticContact CE1-CD2 3.8Å; Y38-Y322 HydrophobicContact CE1-CD2 3.8Å; Y38-Y322 HydrophobicContact CE1-CE2 4.34Å; Y38-Y322 AromaticContact CE2-CD2 3.67Å; Y38-Y322 HydrophobicContact CE2-CD2 3.67Å; Y38-Y322 AromaticContact CE2-CE2 3.43Å; Y38-Y322 HydrophobicContact CE2-CE2 3.43Å; Y38-Y322 VanDerWaalsContact CE2-CE2 3.43Å; Y38-Y322 AromaticContact CZ-CD2 3.42Å; Y38-Y322 VanDerWaalsContact CZ-CD2 3.42Å; Y38-Y322 AromaticContact CZ-CE2 3.51Å; I41-Y322 WeakPolarHBondContact CG2-O 3.42Å; V80-Y322 HydrophobicContact CG1-CD1 3.52Å; V80-Y322 HydrophobicContact CG1-CE1 3.55Å; L81-Y322 HydrophobicContact CD2-CD1 4.26Å; M85-Y322 WeakPolarHBondContact CA-OH 3.37Å; M85-Y322 HydrophobicContact CB-CD1 4.12Å; M85-Y322 HydrophobicContact CB-CE1 3.64Å; M85-Y322 HydrophobicContact CE-CD1 3.74Å; M85-Y322 HydrophobicContact CE-CD2 4.18Å; M85-Y322 HydrophobicContact CE-CE1 4.41Å; M85-Y322 HydrophobicContact CE-CG 3.62Å; M85-Y322 HydrophobicContact CG-CE1 4.35Å; M85-Y322 PolarHBondContact N-OH 3.04Å; E88-Y322 WeakPolarHBondContact OE2-CE2 3.25Å; E88-Y322 PolarHBondContact OE2-OH 2.91Å; F112-Y322 HydrophobicContact CE1-CE1 4.44Å; F112-Y322 WeakPolarHBondContact CE1-OH 3.23Å; F112-Y322 VanDerWaalsContact CZ-OH 3.25Å; F112-Y322 WeakPolarHBondContact CZ-OH 3.23Å; G318-Y322 WeakPolarHBondContact O-CD2 3.25Å; G318-Y322 PolarHBondContact O-N 2.96Å; G318-Y322 VanDerWaalsContact O-N 3.12Å; Y322-S324 PolarHBondContact O-N 3.23Å; Y322-S325 PolarHBondContact O-N 2.94Å; Y322-S325 VanDerWaalsContact O-N 3.12Å; Y322-A326 PolarHBondContact O-N 2.92Å
323L93.9Very high89.1Confident58 Ų5829.4 Ų29.430%0.30415%0.154SC..Hα-helixtrans-58.6-33.6175.6-176.462.9000111.1I41 V319 F320 S325 A326 V327I41-L323 HydrophobicContact CD1-CB 4.34Å; I41-L323 HydrophobicContact CG1-CD1 4.43Å; V319-L323 WeakPolarHBondContact O-CB 3.29Å; V319-L323 PolarHBondContact O-N 2.84Å; F320-L323 PolarHBondContact O-N 2.93Å; L323-S325 PolarHBondContact O-N 3.29Å; L323-A326 PolarHBondContact O-N 3.21Å; L323-V327 HydrophobicContact CD1-CG2 3.89Å; L323-V327 HydrophobicContact CG-CG2 3.89Å; L323-V327 VanDerWaalsContact O-CG2 3.31Å; L323-V327 WeakPolarHBondContact O-CG2 3.2Å; L323-V327 PolarHBondContact O-N 2.88Å
324S91.7Very high88.1Confident4 Ų433.9 Ų33.93%0.02818%0.177CC..Hα-helixtrans-54.4-39.2176.8840000112.8W286 F320 F321 Y322 N328W286-S324 PolarHBondContact NE1-OG 3.41Å; W286-S324 VanDerWaalsContact NE1-OG 3.12Å; F320-S324 PolarHBondContact O-N 3.4Å; F321-S324 VanDerWaalsContact O-CB 3.28Å; F321-S324 WeakPolarHBondContact O-CB 3.23Å; F321-S324 PolarHBondContact O-N 3.49Å; F321-S324 PolarHBondContact O-OG 2.82Å; Y322-S324 PolarHBondContact O-N 3.23Å; S324-N328 PolarHBondContact O-ND2 2.9Å
325S92.6Very high86.8Confident2 Ų232 Ų321%0.01417%0.169CC..Hα-helixtrans-75.3-29.3178.6-65.10000113.2N49 D77 Y322 L323N49-S325 PolarHBondContact ND2-O 3.3Å; D77-S325 WeakPolarHBondContact OD1-CA 3.33Å; D77-S325 VanDerWaalsContact OD1-CB 3.31Å; D77-S325 WeakPolarHBondContact OD1-CB 3.28Å; D77-S325 PolarHBondContact OD1-OG 3.04Å; Y322-S325 PolarHBondContact O-N 2.94Å; Y322-S325 VanDerWaalsContact O-N 3.12Å; L323-S325 PolarHBondContact O-N 3.29Å
326A92.3Very high85.9Confident3 Ų330.6 Ų30.63%0.02516%0.163CC..Hα-helixtrans-81.8-28.5178.700000113.7I41 V44 Y322 L323I41-A326 HydrophobicContact CG2-CB 3.88Å; V44-A326 HydrophobicContact CG1-CB 4.44Å; Y322-A326 PolarHBondContact O-N 2.92Å; L323-A326 PolarHBondContact O-N 3.21Å
327V89.4Confident84.7Confident27 Ų2729.3 Ų29.316%0.16416%0.159CC..Hα-helixtrans-74.4-28.5-178.4177.70000112.2V281 L323 I330 L331V281-V327 HydrophobicContact CG1-CB 4.06Å; V281-V327 HydrophobicContact CG1-CG1 3.6Å; V281-V327 HydrophobicContact CG1-CG2 4.5Å; L323-V327 HydrophobicContact CD1-CG2 3.89Å; L323-V327 HydrophobicContact CG-CG2 3.89Å; L323-V327 VanDerWaalsContact O-CG2 3.31Å; L323-V327 WeakPolarHBondContact O-CG2 3.2Å; L323-V327 PolarHBondContact O-N 2.88Å; V327-I330 WeakPolarHBondContact O-CB 3.37Å; V327-I330 PolarHBondContact O-N 2.88Å; V327-I330 VanDerWaalsContact O-N 3.15Å; V327-L331 HydrophobicContact CG1-CD1 3.81Å; V327-L331 HydrophobicContact CG1-CD2 4.43Å; V327-L331 HydrophobicContact CG1-CG 3.76Å; V327-L331 WeakPolarHBondContact O-CG 3.27Å; V327-L331 PolarHBondContact O-N 3.22Å
328N84.6Confident83.5Confident4 Ų433.1 Ų33.12%0.02117%0.172CC..Hα-helixtrans-53.9-55.6-177.5-72.9-26.6000113.2D77 S324 I330 L331 Y332D77-N328 PolarHBondContact OD2-ND2 2.79Å; S324-N328 PolarHBondContact O-ND2 2.9Å; N328-I330 VanDerWaalsContact C-N 3.34Å; N328-I330 PolarHBondContact O-N 3.08Å; N328-L331 PolarHBondContact O-N 3.04Å; N328-Y332 HydrophobicContact CB-CE2 4.26Å; N328-Y332 WeakPolarHBondContact O-CD1 3.37Å; N328-Y332 WeakPolarHBondContact O-CD2 3.24Å; N328-Y332 VanDerWaalsContact O-CG 3.25Å; N328-Y332 PolarHBondContact O-N 3.26Å; N328-Y332 VanDerWaalsContact O-N 3.09Å
329P82.2Confident82.5Confident10 Ų1033.5 Ų33.57%0.06517%0.172CC..Hα-helixtrans-60-36.8174.9-26.234.3000115G48 N49 L331 Y332 N333G48-P329 VanDerWaalsContact CA-CB 3.48Å; N49-P329 HydrophobicContact CB-CG 4.37Å; N49-P329 VanDerWaalsContact OD1-CG 3.31Å; N49-P329 WeakPolarHBondContact OD1-CG 3.3Å; P329-L331 VanDerWaalsContact C-N 3.34Å; P329-Y332 PolarHBondContact O-N 3.32Å; P329-N333 PolarHBondContact O-N 2.86Å
330I81.9Confident81.7Confident73 Ų7337 Ų3737%0.37418%0.182SC..Hα-helixtrans-60.9-47.9178.1-60.2174.1000109.2V44 V327 N328 Y332 N333 L334V44-I330 HydrophobicContact CG1-CD1 3.92Å; V44-I330 HydrophobicContact CG1-CG1 4.27Å; V327-I330 WeakPolarHBondContact O-CB 3.37Å; V327-I330 PolarHBondContact O-N 2.88Å; V327-I330 VanDerWaalsContact O-N 3.15Å; N328-I330 VanDerWaalsContact C-N 3.34Å; N328-I330 PolarHBondContact O-N 3.08Å; I330-Y332 VanDerWaalsContact C-N 3.32Å; I330-Y332 PolarHBondContact O-N 3.21Å; I330-N333 PolarHBondContact O-N 3.43Å; I330-L334 HydrophobicContact CG2-CD1 3.68Å; I330-L334 HydrophobicContact CG2-CG 4.2Å; I330-L334 WeakPolarHBondContact O-CB 3.2Å; I330-L334 VanDerWaalsContact O-CG 3.29Å; I330-L334 WeakPolarHBondContact O-CG 3.44Å; I330-L334 PolarHBondContact O-N 3.15Å
331L78.3Confident80.9Confident16 Ų1639.7 Ų39.78%0.08420%0.196CC..Hα-helixtrans-61.4-40.3177.2-68.7178.6000111.8V277 L278 V281 V327 N328 P329 M335V277-L331 HydrophobicContact CG1-CD1 4.39Å; V277-L331 HydrophobicContact CG1-CD2 3.72Å; L278-L331 HydrophobicContact CB-CD1 4.01Å; L278-L331 HydrophobicContact CG-CD1 4.26Å; V281-L331 HydrophobicContact CB-CD1 4.45Å; V281-L331 HydrophobicContact CG2-CD1 4.29Å; V327-L331 HydrophobicContact CG1-CD1 3.81Å; V327-L331 HydrophobicContact CG1-CD2 4.43Å; V327-L331 HydrophobicContact CG1-CG 3.76Å; V327-L331 WeakPolarHBondContact O-CG 3.27Å; V327-L331 PolarHBondContact O-N 3.22Å; N328-L331 PolarHBondContact O-N 3.04Å; P329-L331 VanDerWaalsContact C-N 3.34Å; L331-M335 WeakPolarHBondContact O-CB 3.34Å; L331-M335 WeakPolarHBondContact O-CG 3.46Å; L331-M335 PolarHBondContact O-N 2.93Å
332Y76Confident80.1Confident2 Ų240.4 Ų40.41%0.00820%0.199CC..Hα-helixtrans-62.3-44.9176.5-55.6-27.2000112T52 L70 L73 M274 L278 N328 P329 I330 S336T52-Y332 HydrophobicContact CG2-CD2 4.16Å; T52-Y332 HydrophobicContact CG2-CE2 4.21Å; L70-Y332 HydrophobicContact CD2-CE1 3.75Å; L70-Y332 HydrophobicContact CD2-CE2 4.46Å; L70-Y332 WeakPolarHBondContact CD2-OH 3.35Å; L73-Y332 WeakPolarHBondContact CD2-OH 3.26Å; M274-Y332 HydrophobicContact CE-CD1 3.97Å; M274-Y332 HydrophobicContact CE-CE1 4.43Å; M274-Y332 HydrophobicContact SD-CD1 4.28Å; L278-Y332 HydrophobicContact CD1-CE1 3.54Å; N328-Y332 HydrophobicContact CB-CE2 4.26Å; N328-Y332 WeakPolarHBondContact O-CD1 3.37Å; N328-Y332 WeakPolarHBondContact O-CD2 3.24Å; N328-Y332 VanDerWaalsContact O-CG 3.25Å; N328-Y332 PolarHBondContact O-N 3.26Å; N328-Y332 VanDerWaalsContact O-N 3.09Å; P329-Y332 PolarHBondContact O-N 3.32Å; I330-Y332 VanDerWaalsContact C-N 3.32Å; I330-Y332 PolarHBondContact O-N 3.21Å; Y332-S336 WeakPolarHBondContact O-CA 3.43Å; Y332-S336 WeakPolarHBondContact O-CB 3.47Å; Y332-S336 PolarHBondContact O-N 3.27Å
333N72.9Confident79.1Confident56 Ų5643 Ų4330%0.29921%0.211SC..Hα-helixtrans-69.9-40.7-178.6-164.4-1.9000112.4P329 I330P329-N333 PolarHBondContact O-N 2.86Å; I330-N333 PolarHBondContact O-N 3.43Å
334L71.3Confident78.4Confident123 Ų12346.3 Ų46.364%0.64422%0.223SC*.Hα-helixtrans-68.2-40.2178.6-70.8177.7000112.3I330I330-L334 HydrophobicContact CG2-CD1 3.68Å; I330-L334 HydrophobicContact CG2-CG 4.2Å; I330-L334 WeakPolarHBondContact O-CB 3.2Å; I330-L334 VanDerWaalsContact O-CG 3.29Å; I330-L334 WeakPolarHBondContact O-CG 3.44Å; I330-L334 PolarHBondContact O-N 3.15Å
335M65.9Low77.8Confident50 Ų5051.2 Ų51.225%0.24625%0.245CC..Hα-helixtrans-107-16.1-165.5-58.1-76.8-82.800113.8Q270 K273 M274 V277 L331Q270-M335 PolarHBondContact NE2-O 3.46Å; K273-M335 HydrophobicContact CG-CE 4.23Å; M274-M335 HydrophobicContact CB-CB 3.62Å; M274-M335 HydrophobicContact CB-CE 4.3Å; M274-M335 HydrophobicContact CB-CG 4.33Å; M274-M335 HydrophobicContact CG-CB 3.41Å; M274-M335 VanDerWaalsContact CG-CB 3.41Å; M274-M335 HydrophobicContact CG-CG 4.09Å; M274-M335 HydrophobicContact SD-CB 3.73Å; V277-M335 HydrophobicContact CG2-CE 4.06Å; L331-M335 WeakPolarHBondContact O-CB 3.34Å; L331-M335 WeakPolarHBondContact O-CG 3.46Å; L331-M335 PolarHBondContact O-N 2.93Å
336S71.5Confident77Confident15 Ų1552.5 Ų52.511%0.10525%0.253CS..  trans-112.7105.6177.6-176.20000112.4Y332 R338 F339 R340Y332-S336 WeakPolarHBondContact O-CA 3.43Å; Y332-S336 WeakPolarHBondContact O-CB 3.47Å; Y332-S336 PolarHBondContact O-N 3.27Å; S336-R338 PolarHBondContact O-N 3.24Å; S336-F339 PolarHBondContact O-N 3.39Å; S336-F339 VanDerWaalsContact O-N 3.14Å; S336-F339 PolarHBondContact OG-N 2.88Å; S336-R340 PolarHBondContact O-N 3.43Å
337T69.3Low76.2Confident55 Ų5557.9 Ų57.934%0.33728%0.279SS..Hα-helixtrans-57.6-36.9176.649.10000112.5R340 E341T337-R340 PolarHBondContact O-N 2.81Å; T337-E341 WeakPolarHBondContact O-CG 3.32Å; T337-E341 PolarHBondContact O-N 3.32Å
338R69.3Low75.3Confident83 Ų8360.6 Ų60.631%0.31330%0.298SS..Hα-helixtrans-66.8-41177.5-169.6-174.6-172139.3-8.3112.1V61 M62 S336 R340 E341 M342V61-R338 PolarHBondContact O-NH2 3.05Å; M62-R338 HydrophobicContact SD-CG 3.86Å; M62-R338 PolarHBondContact SD-NE 2.88Å; S336-R338 PolarHBondContact O-N 3.24Å; R338-R340 VanDerWaalsContact C-N 3.33Å; R338-E341 PolarHBondContact O-N 3.17Å; R338-M342 VanDerWaalsContact O-CG 3.3Å; R338-M342 WeakPolarHBondContact O-CG 3.34Å; R338-M342 PolarHBondContact O-N 3.09Å
339F71.1Confident73.7Confident14 Ų1468.7 Ų68.76%0.06134%0.336CS..Hα-helixtrans-64.6-42174.5-95.5-87.5000110.8T52 V55 I56 M62 L70 S336 E341 M342 F343T52-F339 HydrophobicContact CG2-CE1 4.13Å; V55-F339 HydrophobicContact CG1-CD1 4.27Å; V55-F339 HydrophobicContact CG1-CE1 4.36Å; I56-F339 HydrophobicContact CD1-CE1 4.26Å; I56-F339 HydrophobicContact CD1-CZ 4Å; I56-F339 HydrophobicContact CG1-CE1 4.16Å; I56-F339 HydrophobicContact CG1-CZ 4.07Å; M62-F339 HydrophobicContact CE-CD1 4.03Å; M62-F339 HydrophobicContact CE-CD2 3.73Å; M62-F339 HydrophobicContact CE-CE1 3.82Å; M62-F339 HydrophobicContact CE-CE2 3.51Å; M62-F339 HydrophobicContact CE-CG 3.99Å; M62-F339 HydrophobicContact CE-CZ 3.56Å; L70-F339 HydrophobicContact CD1-CE2 3.74Å; L70-F339 HydrophobicContact CD1-CZ 3.88Å; S336-F339 PolarHBondContact O-N 3.39Å; S336-F339 VanDerWaalsContact O-N 3.14Å; S336-F339 PolarHBondContact OG-N 2.88Å; F339-E341 PolarHBondContact O-N 3.49Å; F339-M342 PolarHBondContact O-N 3.42Å; F339-F343 WeakPolarHBondContact O-CB 3.42Å; F339-F343 PolarHBondContact O-N 3Å
340R79.2Confident72.1Confident107 Ų10779.1 Ų79.140%0.40437%0.373SS..Hα-helixtrans-63.8-39.5177.3-171.4172.966.2-162.33.5113.4S336 T337 R338 K344S336-R340 PolarHBondContact O-N 3.43Å; T337-R340 PolarHBondContact O-N 2.81Å; R338-R340 VanDerWaalsContact C-N 3.33Å; R340-K344 WeakPolarHBondContact O-CG 3.3Å; R340-K344 PolarHBondContact O-N 3.42Å; R340-K344 VanDerWaalsContact O-N 3.09Å
341E77.6Confident70.3Confident126 Ų12680.8 Ų80.859%0.58939%0.392SS*.Hα-helixtrans-64.4-49.3175.3-76.8166.7-169.300111.2T337 R338 F339 F343 K344 E345T337-E341 WeakPolarHBondContact O-CG 3.32Å; T337-E341 PolarHBondContact O-N 3.32Å; R338-E341 PolarHBondContact O-N 3.17Å; F339-E341 PolarHBondContact O-N 3.49Å; E341-F343 VanDerWaalsContact C-N 3.3Å; E341-F343 PolarHBondContact O-N 3.49Å; E341-K344 PolarHBondContact O-N 3.14Å; E341-E345 PolarHBondContact O-N 3.5Å; E341-E345 VanDerWaalsContact O-N 3.12Å
342M77Confident68.6Low20 Ų2087.2 Ų87.210%0.09942%0.421CS..Hα-helixtrans-67.6-32.3178.3-62.4-52.1-33.400112.8V55 N59 M62 R338 F339 E345 V346V55-M342 HydrophobicContact CG1-CB 3.59Å; V55-M342 HydrophobicContact CG1-CG 4.37Å; N59-M342 HydrophobicContact CB-CE 3.99Å; N59-M342 WeakPolarHBondContact ND2-CE 3.38Å; N59-M342 WeakPolarHBondContact OD1-CE 3.47Å; M62-M342 HydrophobicContact CG-CG 4.13Å; M62-M342 HydrophobicContact SD-CG 4.09Å; R338-M342 VanDerWaalsContact O-CG 3.3Å; R338-M342 WeakPolarHBondContact O-CG 3.34Å; R338-M342 PolarHBondContact O-N 3.09Å; F339-M342 PolarHBondContact O-N 3.42Å; M342-E345 HydrophobicContact CE-CB 4.26Å; M342-E345 HydrophobicContact CE-CG 4.46Å; M342-E345 WeakPolarHBondContact CE-OE2 3.28Å; M342-E345 PolarHBondContact O-N 2.98Å; M342-V346 WeakPolarHBondContact O-CG2 3.29Å; M342-V346 PolarHBondContact O-N 3.39Å
343F74.3Confident66.8Low56 Ų5695.2 Ų95.225%0.24646%0.458CS..Hα-helixtrans-59.8-48.4172.6172.2-116.8000111.2L51 F339 E341 E345 V346 M347L51-F343 HydrophobicContact CD1-CD2 3.48Å; L51-F343 VanDerWaalsContact CD1-CD2 3.48Å; L51-F343 HydrophobicContact CD1-CE2 3.68Å; L51-F343 HydrophobicContact CD2-CD2 3.15Å; L51-F343 HydrophobicContact CD2-CE2 3.13Å; L51-F343 HydrophobicContact CD2-CG 4.21Å; L51-F343 HydrophobicContact CD2-CZ 4.21Å; L51-F343 HydrophobicContact CG-CD2 3.73Å; L51-F343 HydrophobicContact CG-CE2 3.93Å; F339-F343 WeakPolarHBondContact O-CB 3.42Å; F339-F343 PolarHBondContact O-N 3Å; E341-F343 VanDerWaalsContact C-N 3.3Å; E341-F343 PolarHBondContact O-N 3.49Å; F343-E345 PolarHBondContact O-N 3.34Å; F343-V346 PolarHBondContact O-N 3.04Å; F343-M347 HydrophobicContact CD2-CG 3.67Å; F343-M347 HydrophobicContact CE1-CG 4.19Å; F343-M347 HydrophobicContact CE2-CG 3.23Å; F343-M347 HydrophobicContact CE2-SD 3.83Å; F343-M347 HydrophobicContact CG-CG 4.36Å; F343-M347 HydrophobicContact CZ-CG 3.56Å; F343-M347 HydrophobicContact CZ-SD 4.32Å; F343-M347 WeakPolarHBondContact O-CB 3.1Å; F343-M347 WeakPolarHBondContact O-CG 3.09Å; F343-M347 PolarHBondContact O-N 3.27Å
344K78.3Confident65.4Low126 Ų12698.8 Ų98.855%0.54848%0.476SS..Hα-helixtrans-60.1-36.7176-73.6179-179.8-1700111.9R340 E341 C348R340-K344 WeakPolarHBondContact O-CG 3.3Å; R340-K344 PolarHBondContact O-N 3.42Å; R340-K344 VanDerWaalsContact O-N 3.09Å; E341-K344 PolarHBondContact O-N 3.14Å; K344-C348 WeakPolarHBondContact O-CA 3.43Å; K344-C348 WeakPolarHBondContact O-CB 3.47Å; K344-C348 PolarHBondContact O-N 2.92Å
345E78.2Confident63.7Low107 Ų10799.5 Ų99.550%0.548%0.48SS..Hα-helixtrans-68.9-34.5177.8-169.5172.8173.600113.1E341 M342 F343 C348E341-E345 PolarHBondContact O-N 3.5Å; E341-E345 VanDerWaalsContact O-N 3.12Å; M342-E345 HydrophobicContact CE-CB 4.26Å; M342-E345 HydrophobicContact CE-CG 4.46Å; M342-E345 WeakPolarHBondContact CE-OE2 3.28Å; M342-E345 PolarHBondContact O-N 2.98Å; F343-E345 PolarHBondContact O-N 3.34Å; E345-C348 VanDerWaalsContact O-O 3.12Å
346V76.4Confident62.4Low29 Ų29101.9 Ų101.918%0.17650%0.5CS..Hα-helixtrans-76.4-39.1176.1173.80000111.8L51 T54 V55 M342 F343L51-V346 HydrophobicContact CD1-CG1 4.46Å; T54-V346 HydrophobicContact CG2-CG1 4.26Å; V55-V346 HydrophobicContact CG2-CG2 4.03Å; M342-V346 WeakPolarHBondContact O-CG2 3.29Å; M342-V346 PolarHBondContact O-N 3.39Å; F343-V346 PolarHBondContact O-N 3.04Å
347M75.4Confident60.7Low117 Ų117112.1 Ų112.158%0.57654%0.536SS*.Hα-helixtrans-79.9-43-177.8-66.9-59.6-65.800112.8F343 H349F343-M347 HydrophobicContact CD2-CG 3.67Å; F343-M347 HydrophobicContact CE1-CG 4.19Å; F343-M347 HydrophobicContact CE2-CG 3.23Å; F343-M347 HydrophobicContact CE2-SD 3.83Å; F343-M347 HydrophobicContact CG-CG 4.36Å; F343-M347 HydrophobicContact CZ-CG 3.56Å; F343-M347 HydrophobicContact CZ-SD 4.32Å; F343-M347 WeakPolarHBondContact O-CB 3.1Å; F343-M347 WeakPolarHBondContact O-CG 3.09Å; F343-M347 PolarHBondContact O-N 3.27Å; M347-H349 PolarHBondContact O-N 3.47Å
348C71Confident59.1Low84 Ų84119.1 Ų119.157%0.56856%0.562SS**THydrogen-bonded Turntrans-88.395173.3-54.80000106.9K344 E345 R350K344-C348 WeakPolarHBondContact O-CA 3.43Å; K344-C348 WeakPolarHBondContact O-CB 3.47Å; K344-C348 PolarHBondContact O-N 2.92Å; E345-C348 VanDerWaalsContact O-O 3.12Å; C348-R350 PolarHBondContact O-N 2.93Å
349H51.2Low57.5Low174 Ų174123.2 Ų123.281%0.80658%0.584SS**THydrogen-bonded Turntrans-54.283.7171.4-88.866.5000110.4M347 S351M347-H349 PolarHBondContact O-N 3.47Å; H349-S351 PolarHBondContact O-N 3.32Å
350R48.9Very low55.7Low228 Ų228127.4 Ų127.486%0.8662%0.615SS**  trans-80.9100.3158.2-92.6-173.9173-173.6-2.2105.3C348 H352C348-R350 PolarHBondContact O-N 2.93Å; R350-H352 PolarHBondContact O-N 3.38Å; R350-H352 VanDerWaalsContact O-N 3.15Å
351S42.4Very low53.9Low108 Ų108130.9 Ų130.976%0.75564%0.641SS**  trans-41.2124.8164.4-167.30000107.8H349 H353H349-S351 PolarHBondContact O-N 3.32Å; S351-H353 PolarHBondContact O-N 3.3Å
352H44.2Very low52Low152 Ų152129.2 Ų129.270%0.70464%0.643SS**  trans-70.373.8-171.7-152.2-79.2000108.3R350 I354R350-H352 PolarHBondContact O-N 3.38Å; R350-H352 VanDerWaalsContact O-N 3.15Å; H352-I354 WeakPolarHBondContact ND1-CG1 3.47Å; H352-I354 PolarHBondContact O-N 3.39Å
353H37.5Very low50.4Low169 Ų169134.5 Ų134.578%0.78268%0.676SS**  trans-65.598.6159-108.3-72.8000105.3S351 N355S351-H353 PolarHBondContact O-N 3.3Å; H353-N355 PolarHBondContact O-N 2.63Å
354I43.8Very low48.7Very low132 Ų132138.7 Ų138.768%0.67771%0.706SS**  trans-6084164.6-60171.8000105.6H352 P356H352-I354 WeakPolarHBondContact ND1-CG1 3.47Å; H352-I354 PolarHBondContact O-N 3.39Å; I354-P356 WeakPolarHBondContact O-CD 3.41Å
355N35.7Very low46.9Very low138 Ų138144.3 Ų144.374%0.73872%0.724SS**  trans-86.8109.5154.3-109.9-19.9000104.6H353 R357H353-N355 PolarHBondContact O-N 2.63Å; N355-R357 VanDerWaalsContact C-N 3.32Å; N355-R357 PolarHBondContact O-N 2.94Å
356P37.3Very low44.9Very low100 Ų100145.5 Ų145.565%0.64974%0.738SS**  trans-60.5104.3170.925.4-29.4000106.1I354 K358I354-P356 WeakPolarHBondContact O-CD 3.41Å; P356-K358 VanDerWaalsContact C-N 3.26Å; P356-K358 PolarHBondContact O-N 3.01Å
357R37.1Very low42.9Very low230 Ų230150.2 Ų150.287%0.86877%0.768SS**  trans-58.7102.1163.4-85.7-177.4174.7166.5-0.9105.2N355 H359N355-R357 VanDerWaalsContact C-N 3.32Å; N355-R357 PolarHBondContact O-N 2.94Å; R357-H359 PolarHBondContact O-N 2.95Å
358K34.9Very low40.9Very low201 Ų201153.1 Ų153.187%0.87478%0.784SS**  trans-54.891.3160.4-71.3-178.6179.3179.40106P356 S360P356-K358 VanDerWaalsContact C-N 3.26Å; P356-K358 PolarHBondContact O-N 3.01Å; K358-S360 VanDerWaalsContact C-N 3.28Å; K358-S360 PolarHBondContact O-N 3.16Å
359H36.5Very low39Very low170 Ų170160.7 Ų160.779%0.78780%0.801SS**  trans-60.5106.4154.2-103.6-85000104.3R357 L361R357-H359 PolarHBondContact O-N 2.95Å; H359-L361 VanDerWaalsContact C-N 3.31Å; H359-L361 PolarHBondContact O-N 3.45Å
360S32Very low38.1Very low102 Ų102157.8 Ų157.871%0.71380%0.8SS**  trans-51.9101.2168.7-179.80000107.7K358 S362K358-S360 VanDerWaalsContact C-N 3.28Å; K358-S360 PolarHBondContact O-N 3.16Å; S360-S362 PolarHBondContact O-N 2.73Å
361L42.6Very low37.4Very low180 Ų180153.5 Ų153.594%0.94280%0.8SS**  trans-70.782158.5-87.6152.6000105.6H359H359-L361 VanDerWaalsContact C-N 3.31Å; H359-L361 PolarHBondContact O-N 3.45Å
362S38Very low36.8Very low90 Ų90156.6 Ų156.663%0.62981%0.807SS**  trans-123.3137.9161.6-175.80000107.7S360S360-S362 PolarHBondContact O-N 2.73Å
363V42.8Very low36.1Very low132 Ų132154.7 Ų154.780%0.881%0.811SS**  trans85.367.5-176.9-157.80000115.6
364T37.9Very low35.7Very low144 Ų144154.4 Ų154.488%0.88382%0.815SS**  trans-149.776.6136.2-43.70000109.9
365R42.1Very low35Very low243 Ų243152.8 Ų152.892%0.91782%0.821SS**  trans-158.264.4163.3-120.8-164.8-154.2163.25.6111
366V34.7Very low35Very low132 Ų132151.7 Ų151.780%0.882%0.822SS**SBendtrans-147.9112.5160.6-167.70000109.2
367T35.4Very low34.5Very low129 Ų129154.9 Ų154.979%0.79183%0.832SS**  trans56.298153.661.80000119.8
368L32.8Very low34.1Very low177 Ų177148.6 Ų148.693%0.92782%0.824SS**  trans-10989146.6-161.6137.9000107.9
369R32.1Very low33.8Very low243 Ų243146.6 Ų146.692%0.91782%0.823SS**  trans-169.895.9156.1-118.9-177.2179.1179.2-0.1110.2
370S30.7Very low33.4Very low113 Ų113142.3 Ų142.379%0.7983%0.825SS**  trans-163.885.2154.260.80000109.3
371T34.2Very low33.2Very low139 Ų139142.5 Ų142.585%0.85383%0.832SS**  trans-168114.4150.420.70000108.3
372L29.8Very low32.6Very low172 Ų172138.5 Ų138.590%0.90183%0.825SS**  trans154.384.2159.2-85.3159.9000105.5
373S30.5Very low32.2Very low112 Ų112140.8 Ų140.878%0.78384%0.835SS**  50.2104.894.5-87.30000114.2
374D28.7Very low31.5Very low164 Ų164138.2 Ų138.288%0.87783%0.828SS**  trans16.3118.1144.5-60.4-31.4000119.9
375A28.6Very low30.9Very low97 Ų97140.7 Ų140.780%0.80283%0.829SS**  trans-165.2137.413100000110.1
376P36.7Very low30.3Very low116 Ų116133.6 Ų133.675%0.75382%0.822SS**  trans-96.7143.4-17735.1-28.2000112.3
377L27.5Very low29.9Very low166 Ų166134.7 Ų134.787%0.86982%0.824SS**  162.1149.3124.9-107.6105.1000113.2
378S27.3Very low29.6Very low99 Ų99137.6 Ų137.669%0.69283%0.831SS**  trans91.194.4146.2-172.30000119.9
379N28.4Very low29.5Very low159 Ų159135.8 Ų135.885%0.8583%0.827SS**  37.7121.3126-70.5-4.6000120.9
380G28.1Very low29.3Very low80 Ų80129.1 Ų129.183%0.82582%0.823SS**  100.5105122.400000117.2
381A28.1Very low29.2Very low106 Ų106131.6 Ų131.688%0.87683%0.828SS**  161.811812000000110
382A30.4Very low28.9Very low95 Ų95128.4 Ų128.479%0.78582%0.822SS**  trans-78.4161.2162.600000110.3
383V29Very low28.9Very low139 Ų139129.9 Ų129.984%0.84283%0.825SS**  trans15499.1152.5163.40000104.9
384A28.1Very low28.8Very low78 Ų78128.5 Ų128.565%0.64583%0.829SS**  76119.57300000114.4
385E27Very low28.8Very low196 Ų196129.8 Ų129.892%0.91683%0.826SS**  trans64.5151150.6-67.1177.5141.200117.8
386A27.8Very low28.8Very low93 Ų93132.5 Ų132.577%0.76982%0.822SS**  cis-156.5155.216.400000109.7
387D27.9Very low28.5Very low156 Ų156135.7 Ų135.783%0.83482%0.824SS**  trans-58.8144.7156.7-74-52.6000111.6
388M27.6Very low28.6Very low190 Ų190134.9 Ų134.994%0.93682%0.821SS**  -173.1124.9126.1-103.9-171.6-142.600113.5
389V31.1Very low29Very low139 Ų139138.7 Ų138.784%0.84283%0.828SS**  trans-28137.7152.31790000115.2
390A29.1Very low29.2Very low103 Ų103138.3 Ų138.385%0.85183%0.831SS**  trans-155.5125.6139.800000111.5
391D28.1Very low29.4Very low164 Ų164139.1 Ų139.188%0.87783%0.825SS**  trans-71.3163.2175.4-151.1-6000111.7
392G28.2Very low29.8Very low72 Ų72142.8 Ų142.874%0.74282%0.821SS**  trans170.395.1173.300000116.6
393E28.3Very low30.4Very low203 Ų203147.2 Ų147.295%0.94985%0.846SS**  trans-52.3159.4175.6-60.8174.6104.800116.9
394G28.8Very low30.5Very low84 Ų84147.7 Ų147.787%0.86685%0.846SS**  trans-178.2107.8164.300000114.6
395K29.3Very low30.6Very low191 Ų191151.3 Ų151.383%0.8386%0.857SS**  trans-87.5169.1-166.5-122.9168.9176.91720115.3
396Q28.1Very low30.8Very low154 Ų154148.8 Ų148.872%0.7285%0.854SS**  trans85.6111.5147.2-113.7134.4-3600118.5
397K31.2Very low31Very low183 Ų183152.1 Ų152.180%0.79686%0.859SS**  70119.779.7-87.3-168.9172.7-171.90114.6
398D29.8Very low31.2Very low148 Ų148151.9 Ų151.979%0.79186%0.86SS**  -176.5115.6122.4-86.5-14.3000107.5
399E35.5Very low31.4Very low179 Ų179149.3 Ų149.384%0.83686%0.855SS**  59.1114.992.4-102.6-174.5-173.400115.4
400T31.6Very low31.5Very low152 Ų152150.1 Ų150.193%0.93386%0.856SS**  -168136.6129.417.30000110.6
401S33.2Very low31.6Very low97 Ų97153.7 Ų153.768%0.67886%0.857SS**  trans-119.2166.7-178.9-177.90000109.3
402F36.6Very low31.9Very low183 Ų183152.8 Ų152.880%0.80386%0.855SS**  trans81.6110.3168.6-78.4-88.7000119.1
403S42.7Very low32.3Very low188 Ų188160.2 Ų160.2100%1.31587%0.865SS**  -158.6078.4-67.70000111.5

Retrieved 403 of 403 residues in 472.3 ms (Link to these results)

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