A0A077Z6D0_TRITR Loading...

Organic cation transporter protein

AlphaFold DB , UniProt , Accession A0A077Z6D0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 540 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M57.1Low75.7Confident71 Ų7143.4 Ų43.435%0.3523%0.226SC..  0129.90-163.8172.5-154.500109D5 I6 E9 Q306M1-D5 HydrophobicContact CE-CB 3.73Å; M1-D5 HydrophobicContact CG-CB 3.55Å; M1-I6 HydrophobicContact CE-CG1 4.34Å; M1-I6 HydrophobicContact CG-CG1 3.96Å; M1-I6 HydrophobicContact SD-CG1 3.7Å; M1-E9 HydrophobicContact CE-CB 4.04Å; M1-E9 HydrophobicContact CE-CG 4.1Å; M1-E9 WeakPolarHBondContact CE-OE2 3.25Å; M1-Q306 PolarHBondContact O-NE2 3.02Å
2T69.9Low76.4Confident66 Ų6640.3 Ų40.341%0.40521%0.214SC..  trans-85.3163.3175.370.10000111.3D4 D5 I6T2-D4 PolarHBondContact O-N 3.28Å; T2-D5 WeakPolarHBondContact CB-OD2 3.37Å; T2-D5 PolarHBondContact N-OD2 2.92Å; T2-D5 WeakPolarHBondContact O-CB 3.23Å; T2-D5 PolarHBondContact O-N 3.31Å; T2-D5 VanDerWaalsContact O-N 3.09Å; T2-D5 PolarHBondContact OG1-N 3.32Å; T2-D5 PolarHBondContact OG1-OD1 3.42Å; T2-D5 PolarHBondContact OG1-OD2 3.15Å; T2-I6 PolarHBondContact O-N 3.29Å; T2-I6 VanDerWaalsContact O-N 3.17Å
3F72.2Confident76.9Confident27 Ų2740.8 Ų40.812%0.11821%0.214CC..Hα-helixtrans-57-34.6174.4-175.9-90.2000112.6I6 L7 A268 R269 M272 L284F3-I6 PolarHBondContact O-N 3.4Å; F3-L7 HydrophobicContact CD1-CD1 3.9Å; F3-L7 HydrophobicContact CD1-CG 4.19Å; F3-L7 HydrophobicContact CE1-CD1 3.45Å; F3-L7 VanDerWaalsContact CE1-CD1 3.45Å; F3-L7 HydrophobicContact CE1-CD2 4.32Å; F3-L7 HydrophobicContact CE1-CG 3.8Å; F3-L7 HydrophobicContact CZ-CD1 4.36Å; F3-L7 HydrophobicContact CZ-CD2 4.48Å; F3-L7 HydrophobicContact CZ-CG 4.36Å; F3-L7 PolarHBondContact O-N 3.4Å; F3-L7 VanDerWaalsContact O-N 3.13Å; F3-A268 HydrophobicContact CE2-CB 3.88Å; F3-A268 HydrophobicContact CZ-CB 3.86Å; F3-R269 HydrophobicContact CD1-CG 3.59Å; F3-R269 HydrophobicContact CD2-CG 4.23Å; F3-R269 HydrophobicContact CE1-CG 3.33Å; F3-R269 VanDerWaalsContact CE1-NE 3.29Å; F3-R269 HydrophobicContact CE2-CG 4.03Å; F3-R269 HydrophobicContact CG-CG 4.03Å; F3-R269 HydrophobicContact CZ-CG 3.59Å; F3-M272 HydrophobicContact CD2-CG 4.41Å; F3-L284 HydrophobicContact CE2-CD1 4.18Å; F3-L284 HydrophobicContact CE2-CD2 4.14Å; F3-L284 HydrophobicContact CZ-CD2 4.17Å
4D73.8Confident77.6Confident37 Ų3741.4 Ų41.420%0.19821%0.214CC..Hα-helixtrans-68.1-37.5177.5-74.6-13000111.4T2 I6 L7 C8 P212 R215 R269T2-D4 PolarHBondContact O-N 3.28Å; D4-I6 VanDerWaalsContact C-N 3.34Å; D4-I6 PolarHBondContact O-N 2.88Å; D4-L7 PolarHBondContact O-N 3.12Å; D4-C8 WeakPolarHBondContact O-CB 3.41Å; D4-C8 PolarHBondContact O-N 3.29Å; D4-C8 PolarHBondContact O-SG 2.97Å; D4-P212 HydrophobicContact CB-CG 4.24Å; D4-R215 IonicContact OD1-NH2 3.23Å; D4-R215 PolarHBondContact OD1-NH2 3.26Å; D4-R215 IonicContact OD2-CZ 3.76Å; D4-R215 IonicContact OD2-NH1 3.65Å; D4-R215 IonicContact OD2-NH2 2.63Å; D4-R215 PolarHBondContact OD2-NH2 3.27Å; D4-R269 IonicContact OD1-CZ 2.75Å; D4-R269 IonicContact OD1-NH1 3.5Å; D4-R269 IonicContact OD1-NH2 3.64Å; D4-R269 PolarHBondContact OD1-NH2 3.09Å
5D76.6Confident78.3Confident61 Ų6139.9 Ų39.933%0.32621%0.213SC..Hα-helixtrans-63.7-41.5175.4-53.5-31.3000110.8M1 T2 L7 C8 E9M1-D5 HydrophobicContact CE-CB 3.73Å; M1-D5 HydrophobicContact CG-CB 3.55Å; T2-D5 WeakPolarHBondContact CB-OD2 3.37Å; T2-D5 PolarHBondContact N-OD2 2.92Å; T2-D5 WeakPolarHBondContact O-CB 3.23Å; T2-D5 PolarHBondContact O-N 3.31Å; T2-D5 VanDerWaalsContact O-N 3.09Å; T2-D5 PolarHBondContact OG1-N 3.32Å; T2-D5 PolarHBondContact OG1-OD1 3.42Å; T2-D5 PolarHBondContact OG1-OD2 3.15Å; D5-L7 VanDerWaalsContact C-N 3.34Å; D5-L7 PolarHBondContact O-N 2.97Å; D5-C8 PolarHBondContact O-N 3.47Å; D5-E9 WeakPolarHBondContact O-CB 3.23Å; D5-E9 WeakPolarHBondContact O-CG 2.87Å; D5-E9 PolarHBondContact O-N 3.46Å
6I77.7Confident79.2Confident4 Ų449.8 Ų49.82%0.02125%0.246CC..Hα-helixtrans-62-43177.6-62.1170.1000110.9M1 T2 F3 D4 H10 V11 L284 L295 V299 I303M1-I6 HydrophobicContact CE-CG1 4.34Å; M1-I6 HydrophobicContact CG-CG1 3.96Å; M1-I6 HydrophobicContact SD-CG1 3.7Å; T2-I6 PolarHBondContact O-N 3.29Å; T2-I6 VanDerWaalsContact O-N 3.17Å; F3-I6 PolarHBondContact O-N 3.4Å; D4-I6 VanDerWaalsContact C-N 3.34Å; D4-I6 PolarHBondContact O-N 2.88Å; I6-H10 WeakPolarHBondContact O-CB 3.35Å; I6-H10 PolarHBondContact O-N 2.94Å; I6-V11 HydrophobicContact CG2-CG2 4.46Å; I6-V11 PolarHBondContact O-N 3.3Å; I6-L284 HydrophobicContact CG2-CD1 4.32Å; I6-L295 HydrophobicContact CG2-CD1 3.94Å; I6-V299 HydrophobicContact CD1-CG1 3.69Å; I6-V299 HydrophobicContact CG1-CG1 3.99Å; I6-V299 HydrophobicContact CG2-CG1 4.14Å; I6-I303 HydrophobicContact CD1-CD1 3.71Å; I6-I303 HydrophobicContact CD1-CG1 3.56Å
7L79.6Confident80Confident7 Ų747.2 Ų47.24%0.03723%0.233CC..Iπ-helixtrans-62.3-44.5175.1-75.1179.4000111.8F3 D4 D5 V11 G12 L284F3-L7 HydrophobicContact CD1-CD1 3.9Å; F3-L7 HydrophobicContact CD1-CG 4.19Å; F3-L7 HydrophobicContact CE1-CD1 3.45Å; F3-L7 VanDerWaalsContact CE1-CD1 3.45Å; F3-L7 HydrophobicContact CE1-CD2 4.32Å; F3-L7 HydrophobicContact CE1-CG 3.8Å; F3-L7 HydrophobicContact CZ-CD1 4.36Å; F3-L7 HydrophobicContact CZ-CD2 4.48Å; F3-L7 HydrophobicContact CZ-CG 4.36Å; F3-L7 PolarHBondContact O-N 3.4Å; F3-L7 VanDerWaalsContact O-N 3.13Å; D4-L7 PolarHBondContact O-N 3.12Å; D5-L7 VanDerWaalsContact C-N 3.34Å; D5-L7 PolarHBondContact O-N 2.97Å; L7-V11 HydrophobicContact CD2-CB 4.29Å; L7-V11 HydrophobicContact CD2-CG2 4.47Å; L7-G12 CarbonylContact O-C 3.56Å; L7-G12 VanDerWaalsContact O-CA 3.29Å; L7-G12 WeakPolarHBondContact O-CA 3.36Å; L7-G12 PolarHBondContact O-N 3.26Å; L7-L284 HydrophobicContact CD2-CD2 4.23Å
8C77.6Confident80.7Confident41 Ų4144.7 Ų44.728%0.27722%0.221SC..Iπ-helixtrans-67.5-50.3-178.4-69.70000112.3D4 D5 E13 R293D4-C8 WeakPolarHBondContact O-CB 3.41Å; D4-C8 PolarHBondContact O-N 3.29Å; D4-C8 PolarHBondContact O-SG 2.97Å; D5-C8 PolarHBondContact O-N 3.47Å; C8-E13 HydrophobicContact CB-CG 4.38Å; C8-R293 PolarHBondContact O-NH1 3.35Å
9E81.1Confident81.3Confident122 Ų12248.5 Ų48.557%0.5724%0.236SC*.Iπ-helixtrans-80.4-47.5-171.5-66.6-178.4-164.600111.9M1 D5 R293M1-E9 HydrophobicContact CE-CB 4.04Å; M1-E9 HydrophobicContact CE-CG 4.1Å; M1-E9 WeakPolarHBondContact CE-OE2 3.25Å; D5-E9 WeakPolarHBondContact O-CB 3.23Å; D5-E9 WeakPolarHBondContact O-CG 2.87Å; D5-E9 PolarHBondContact O-N 3.46Å; E9-R293 PolarHBondContact O-NH1 3.4Å
10H83Confident82Confident41 Ų4149.7 Ų49.719%0.1924%0.243CC..Iπ-helixtrans-105.8-32.1-165-63.698.4000114.4I6 R293 L295 P296I6-H10 WeakPolarHBondContact O-CB 3.35Å; I6-H10 PolarHBondContact O-N 2.94Å; H10-R293 WeakPolarHBondContact O-CB 3.49Å; H10-R293 WeakPolarHBondContact O-CD 3.3Å; H10-L295 HydrophobicContact CB-CD1 3.74Å; H10-P296 WeakPolarHBondContact CD2-CD 3.4Å
11V84.4Confident82.5Confident0 Ų047.8 Ų47.80%023%0.233CC..Iπ-helixtrans-100.8-33.9-175.8-170.90000112.4I6 L7 L284 A287 N291I6-V11 HydrophobicContact CG2-CG2 4.46Å; I6-V11 PolarHBondContact O-N 3.3Å; L7-V11 HydrophobicContact CD2-CB 4.29Å; L7-V11 HydrophobicContact CD2-CG2 4.47Å; V11-L284 HydrophobicContact CG2-CD2 4.22Å; V11-A287 HydrophobicContact CG1-CB 3.62Å; V11-N291 PolarHBondContact O-ND2 3.24Å
12G84.1Confident84.2Confident7 Ų745.3 Ų45.37%0.07222%0.22CC..  trans94137.3-169.600000112.2L7 F14 Q18L7-G12 CarbonylContact O-C 3.56Å; L7-G12 VanDerWaalsContact O-CA 3.29Å; L7-G12 WeakPolarHBondContact O-CA 3.36Å; L7-G12 PolarHBondContact O-N 3.26Å; G12-F14 PolarHBondContact O-N 3.5Å; G12-Q18 PolarHBondContact O-NE2 3.02Å
13E82.3Confident85.3Confident47 Ų4746 Ų4622%0.2222%0.221CC..THydrogen-bonded Turntrans-66.1-32.4-172.3-66.8-173.2-159.600114.6C8 V210 G211 K213C8-E13 HydrophobicContact CB-CG 4.38Å; E13-V210 CarbonylContact O-C 3.45Å; E13-V210 VanDerWaalsContact O-CA 3.31Å; E13-V210 WeakPolarHBondContact O-CA 3.3Å; E13-G211 PolarHBondContact O-N 3.39Å; E13-K213 IonicContact OE1-NZ 3.77Å; E13-K213 WeakPolarHBondContact OE2-CB 3.28Å
14F86.6Confident86.4Confident49 Ų4945.9 Ų45.922%0.21522%0.222CC..THydrogen-bonded Turntrans-155.557.4-179.8-162.6-127.8000112.1G12 Q18 K19 V210 Q214 L217G12-F14 PolarHBondContact O-N 3.5Å; F14-Q18 HydrophobicContact CD2-CB 3.85Å; F14-Q18 HydrophobicContact CE2-CB 4.34Å; F14-K19 HydrophobicContact CD1-CD 4.45Å; F14-K19 HydrophobicContact CD1-CG 3.93Å; F14-K19 HydrophobicContact CD2-CG 4.45Å; F14-K19 HydrophobicContact CE1-CD 4.31Å; F14-K19 HydrophobicContact CE1-CG 3.61Å; F14-K19 HydrophobicContact CE2-CG 4.18Å; F14-K19 HydrophobicContact CG-CG 4.35Å; F14-K19 HydrophobicContact CZ-CG 3.76Å; F14-K19 WeakPolarHBondContact O-CE 3.13Å; F14-V210 HydrophobicContact CD2-CB 4.19Å; F14-V210 HydrophobicContact CD2-CG1 3.34Å; F14-V210 HydrophobicContact CE2-CG1 3.56Å; F14-V210 HydrophobicContact CG-CG1 4.49Å; F14-Q214 HydrophobicContact CB-CB 4.38Å; F14-Q214 HydrophobicContact CB-CG 3.93Å; F14-Q214 HydrophobicContact CG-CG 4.44Å; F14-L217 HydrophobicContact CD1-CD2 4.48Å; F14-L217 HydrophobicContact CE1-CD2 3.88Å; F14-L217 HydrophobicContact CZ-CD2 4.28Å
15G89.4Confident87.3Confident19 Ų1944.1 Ų44.120%0.19621%0.212CC..  trans-71.9-174.1178.200000114.2Y17 Q18 K19 N291G15-Y17 VanDerWaalsContact C-N 3.29Å; G15-Y17 PolarHBondContact O-N 3.09Å; G15-Q18 VanDerWaalsContact CA-OE1 3.28Å; G15-Q18 PolarHBondContact O-N 3.04Å; G15-K19 WeakPolarHBondContact O-CG 3.46Å; G15-K19 PolarHBondContact O-N 2.96Å; G15-N291 WeakPolarHBondContact CA-OD1 3.47Å
16R92.9Very high88.1Confident198 Ų19841.2 Ų41.275%0.74720%0.197SC*.Hα-helixtrans-61.1-38.5-179-67-178.1179.4179.6-0.2111.9K19 L20 F290 N291R16-K19 PolarHBondContact O-N 3.31Å; R16-L20 WeakPolarHBondContact O-CB 3.43Å; R16-L20 PolarHBondContact O-N 2.84Å; R16-F290 HydrophobicContact CB-CD1 4.1Å; R16-F290 HydrophobicContact CB-CE1 3.97Å; R16-N291 PolarHBondContact N-OD1 3.09Å
17Y92.5Very high88.9Confident6 Ų643.6 Ų43.62%0.02421%0.209CC..Hα-helixtrans-61.8-49.1176.5-177.5-99.7000111.5G15 K19 L20 Q21 L209 P265 K286 A287 F290 N291G15-Y17 VanDerWaalsContact C-N 3.29Å; G15-Y17 PolarHBondContact O-N 3.09Å; Y17-K19 VanDerWaalsContact C-N 3.35Å; Y17-K19 PolarHBondContact O-N 3.37Å; Y17-L20 PolarHBondContact O-N 2.89Å; Y17-Q21 HydrophobicContact CD1-CG 4.22Å; Y17-Q21 HydrophobicContact CD2-CG 4.45Å; Y17-Q21 HydrophobicContact CE1-CG 3.86Å; Y17-Q21 HydrophobicContact CE2-CG 4.11Å; Y17-Q21 WeakPolarHBondContact O-CB 3.46Å; Y17-Q21 WeakPolarHBondContact O-CG 3.25Å; Y17-Q21 PolarHBondContact O-N 3.02Å; Y17-L209 HydrophobicContact CD1-CD1 4.29Å; Y17-L209 HydrophobicContact CE1-CD1 4.13Å; Y17-P265 WeakPolarHBondContact OH-CG 3.28Å; Y17-K286 HydrophobicContact CE2-CD 4.44Å; Y17-K286 HydrophobicContact CE2-CG 4.38Å; Y17-A287 HydrophobicContact CD1-CB 3.35Å; Y17-A287 HydrophobicContact CE1-CB 3.55Å; Y17-A287 HydrophobicContact CG-CB 3.89Å; Y17-F290 HydrophobicContact CD2-CB 4.05Å; Y17-F290 HydrophobicContact CD2-CD1 4.35Å; Y17-F290 HydrophobicContact CD2-CG 4.08Å; Y17-F290 HydrophobicContact CG-CB 4.44Å; Y17-N291 PolarHBondContact N-OD1 3.12Å
18Q92Very high89.7Confident1 Ų143.3 Ų43.31%0.00521%0.208CC..Hα-helixtrans-62.7-43-179.9-69.383.6-9.900111.4G12 F14 G15 L20 Q21 Y22 L209 N291G12-Q18 PolarHBondContact O-NE2 3.02Å; F14-Q18 HydrophobicContact CD2-CB 3.85Å; F14-Q18 HydrophobicContact CE2-CB 4.34Å; G15-Q18 VanDerWaalsContact CA-OE1 3.28Å; G15-Q18 PolarHBondContact O-N 3.04Å; Q18-L20 PolarHBondContact O-N 2.84Å; Q18-Q21 PolarHBondContact O-N 3.33Å; Q18-Y22 WeakPolarHBondContact O-CB 3.47Å; Q18-Y22 PolarHBondContact O-N 3.37Å; Q18-L209 HydrophobicContact CB-CD1 4.43Å; Q18-L209 HydrophobicContact CB-CD2 4.23Å; Q18-L209 HydrophobicContact CB-CG 3.95Å; Q18-L209 HydrophobicContact CG-CD1 3.87Å; Q18-L209 HydrophobicContact CG-CG 3.72Å; Q18-L209 WeakPolarHBondContact CG-O 3.28Å; Q18-L209 WeakPolarHBondContact O-CD2 3.14Å; Q18-N291 PolarHBondContact OE1-ND2 3.46Å
19K93.1Very high90.6Very high117 Ų11741.3 Ų41.351%0.50919%0.194SC..Hα-helixtrans-59.9-45.4176.8-72.5175.7-178.2-175.30112.2F14 G15 R16 Y17 L23F14-K19 HydrophobicContact CD1-CD 4.45Å; F14-K19 HydrophobicContact CD1-CG 3.93Å; F14-K19 HydrophobicContact CD2-CG 4.45Å; F14-K19 HydrophobicContact CE1-CD 4.31Å; F14-K19 HydrophobicContact CE1-CG 3.61Å; F14-K19 HydrophobicContact CE2-CG 4.18Å; F14-K19 HydrophobicContact CG-CG 4.35Å; F14-K19 HydrophobicContact CZ-CG 3.76Å; F14-K19 WeakPolarHBondContact O-CE 3.13Å; G15-K19 WeakPolarHBondContact O-CG 3.46Å; G15-K19 PolarHBondContact O-N 2.96Å; R16-K19 PolarHBondContact O-N 3.31Å; Y17-K19 VanDerWaalsContact C-N 3.35Å; Y17-K19 PolarHBondContact O-N 3.37Å; K19-L23 WeakPolarHBondContact O-CB 3.41Å; K19-L23 PolarHBondContact O-N 3.47Å
20L94.2Very high91.3Very high72 Ų7236.4 Ų36.438%0.37717%0.172SC..Hα-helixtrans-64-48.6178.1177.561.7000111.6R16 Y17 Q18 L23 L24 F290R16-L20 WeakPolarHBondContact O-CB 3.43Å; R16-L20 PolarHBondContact O-N 2.84Å; Y17-L20 PolarHBondContact O-N 2.89Å; Q18-L20 PolarHBondContact O-N 2.84Å; L20-L23 PolarHBondContact O-N 3.48Å; L20-L24 HydrophobicContact CD1-CD1 4.28Å; L20-L24 HydrophobicContact CD1-CG 4.3Å; L20-L24 HydrophobicContact CG-CD1 4.15Å; L20-L24 VanDerWaalsContact O-CG 3.32Å; L20-L24 WeakPolarHBondContact O-CG 2.9Å; L20-L24 PolarHBondContact O-N 3.28Å; L20-F290 HydrophobicContact CD2-CZ 4.19Å
21Q92.9Very high92Very high10 Ų1034.7 Ų34.75%0.04716%0.164CC..Hα-helixtrans-66.3-38.9-179.9-70.1-61.7-24.700112Y17 Q18 L24 V25 L209 L263 P265Y17-Q21 HydrophobicContact CD1-CG 4.22Å; Y17-Q21 HydrophobicContact CD2-CG 4.45Å; Y17-Q21 HydrophobicContact CE1-CG 3.86Å; Y17-Q21 HydrophobicContact CE2-CG 4.11Å; Y17-Q21 WeakPolarHBondContact O-CB 3.46Å; Y17-Q21 WeakPolarHBondContact O-CG 3.25Å; Y17-Q21 PolarHBondContact O-N 3.02Å; Q18-Q21 PolarHBondContact O-N 3.33Å; Q21-L24 PolarHBondContact O-N 3.49Å; Q21-V25 WeakPolarHBondContact O-CB 3.45Å; Q21-V25 VanDerWaalsContact O-CG2 3.25Å; Q21-V25 WeakPolarHBondContact O-CG2 3.46Å; Q21-V25 PolarHBondContact O-N 3.24Å; Q21-L209 HydrophobicContact CB-CD1 4.5Å; Q21-L209 HydrophobicContact CB-CD2 3.5Å; Q21-L263 PolarHBondContact NE2-O 2.98Å; Q21-L263 PolarHBondContact OE1-O 2.9Å; Q21-P265 VanDerWaalsContact CD-CD 3.49Å
22Y92.4Very high92.6Very high19 Ų1934.7 Ų34.78%0.07516%0.164CC..Hα-helixtrans-60.9-45.8173.2-177.5-98.3000111.4Q18 N26 A218 G221 A222 F225Q18-Y22 WeakPolarHBondContact O-CB 3.47Å; Q18-Y22 PolarHBondContact O-N 3.37Å; Y22-N26 WeakPolarHBondContact CD2-ND2 3.42Å; Y22-N26 VanDerWaalsContact CE2-ND2 3.29Å; Y22-N26 WeakPolarHBondContact CE2-ND2 3.5Å; Y22-N26 WeakPolarHBondContact O-CB 3.17Å; Y22-N26 PolarHBondContact O-N 3.08Å; Y22-N26 PolarHBondContact O-ND2 2.84Å; Y22-A218 HydrophobicContact CD2-CB 4.28Å; Y22-A218 VanDerWaalsContact CE2-CA 3.49Å; Y22-A218 HydrophobicContact CE2-CB 3.7Å; Y22-A218 WeakPolarHBondContact CE2-O 3.16Å; Y22-A218 WeakPolarHBondContact OH-CA 3.4Å; Y22-A218 PolarHBondContact OH-O 2.96Å; Y22-G221 VanDerWaalsContact OH-C 3.26Å; Y22-G221 WeakPolarHBondContact OH-CA 3.44Å; Y22-A222 PolarHBondContact OH-N 3.33Å; Y22-F225 HydrophobicContact CE1-CE2 4.07Å
23L93.8Very high93.1Very high81 Ų8134.3 Ų34.342%0.42416%0.16SC..Hα-helixtrans-58.9-53.6175.2176.463.9000110.9K19 L20 V25 N26 L27 F225K19-L23 WeakPolarHBondContact O-CB 3.41Å; K19-L23 PolarHBondContact O-N 3.47Å; L20-L23 PolarHBondContact O-N 3.48Å; L23-V25 PolarHBondContact O-N 3.29Å; L23-N26 PolarHBondContact O-N 2.97Å; L23-L27 HydrophobicContact CD1-CD2 4.34Å; L23-L27 HydrophobicContact CD1-CG 4.4Å; L23-L27 WeakPolarHBondContact O-CG 3.35Å; L23-L27 PolarHBondContact O-N 3.36Å; L23-L27 VanDerWaalsContact O-N 3.12Å; L23-F225 HydrophobicContact CD1-CE1 3.78Å; L23-F225 HydrophobicContact CD1-CZ 3.79Å
24L94Very high93.9Very high24 Ų2432.6 Ų32.613%0.12615%0.152CC..Hα-helixtrans-53.8-56-178.7-72.2171.6000110.5L20 Q21 N26 L27 P28 Y260 L263 V264L20-L24 HydrophobicContact CD1-CD1 4.28Å; L20-L24 HydrophobicContact CD1-CG 4.3Å; L20-L24 HydrophobicContact CG-CD1 4.15Å; L20-L24 VanDerWaalsContact O-CG 3.32Å; L20-L24 WeakPolarHBondContact O-CG 2.9Å; L20-L24 PolarHBondContact O-N 3.28Å; Q21-L24 PolarHBondContact O-N 3.49Å; L24-N26 PolarHBondContact O-N 2.8Å; L24-N26 VanDerWaalsContact O-N 3.17Å; L24-L27 PolarHBondContact O-N 2.88Å; L24-L27 VanDerWaalsContact O-N 3.11Å; L24-P28 VanDerWaalsContact O-CD 3.24Å; L24-P28 WeakPolarHBondContact O-CD 3.41Å; L24-Y260 WeakPolarHBondContact CA-OH 3.37Å; L24-Y260 HydrophobicContact CB-CE1 4.22Å; L24-Y260 HydrophobicContact CD2-CE2 3.75Å; L24-Y260 WeakPolarHBondContact O-CE1 3.47Å; L24-Y260 PolarHBondContact O-OH 2.87Å; L24-L263 HydrophobicContact CD1-CB 4.15Å; L24-V264 HydrophobicContact CB-CG2 4.28Å
25V92.6Very high94.4Very high1 Ų130.2 Ų30.21%0.00614%0.142CC..Hα-helixtrans-61.3-27.9-175.9170.80000113.3Q21 L23 A202 I205 V264Q21-V25 WeakPolarHBondContact O-CB 3.45Å; Q21-V25 VanDerWaalsContact O-CG2 3.25Å; Q21-V25 WeakPolarHBondContact O-CG2 3.46Å; Q21-V25 PolarHBondContact O-N 3.24Å; L23-V25 PolarHBondContact O-N 3.29Å; V25-A202 HydrophobicContact CG1-CB 3.6Å; V25-A202 WeakPolarHBondContact O-CB 3.31Å; V25-I205 HydrophobicContact CG1-CB 4.19Å; V25-I205 HydrophobicContact CG1-CG2 4.26Å; V25-I205 HydrophobicContact CG2-CG2 4.04Å; V25-V264 HydrophobicContact CG2-CG1 3.65Å; V25-V264 HydrophobicContact CG2-CG2 4.03Å
26N94.2Very high94.8Very high0 Ų029.3 Ų29.30%013%0.133CC..Hα-helixtrans-88.8-15.8177.6-76-81.6000114.5Y22 L23 L24 V29 A222 F225Y22-N26 WeakPolarHBondContact CD2-ND2 3.42Å; Y22-N26 VanDerWaalsContact CE2-ND2 3.29Å; Y22-N26 WeakPolarHBondContact CE2-ND2 3.5Å; Y22-N26 WeakPolarHBondContact O-CB 3.17Å; Y22-N26 PolarHBondContact O-N 3.08Å; Y22-N26 PolarHBondContact O-ND2 2.84Å; L23-N26 PolarHBondContact O-N 2.97Å; L24-N26 PolarHBondContact O-N 2.8Å; L24-N26 VanDerWaalsContact O-N 3.17Å; N26-V29 WeakPolarHBondContact O-CB 3.35Å; N26-V29 PolarHBondContact O-N 3.29Å; N26-A222 WeakPolarHBondContact OD1-CB 3.49Å; N26-F225 HydrophobicContact CB-CB 4.36Å; N26-F225 HydrophobicContact CB-CD1 3.86Å; N26-F225 HydrophobicContact CB-CD2 3.5Å; N26-F225 VanDerWaalsContact CB-CD2 3.5Å; N26-F225 HydrophobicContact CB-CE1 3.96Å; N26-F225 HydrophobicContact CB-CE2 3.6Å; N26-F225 HydrophobicContact CB-CG 3.64Å; N26-F225 HydrophobicContact CB-CZ 3.83Å
27L95.4Very high94.9Very high54 Ų5419.9 Ų19.928%0.28310%0.097SC..Hα-helixtrans-59.3-39177.2-72.3172.4000113.4L23 L24 V29 I30 F225 F257 Y260L23-L27 HydrophobicContact CD1-CD2 4.34Å; L23-L27 HydrophobicContact CD1-CG 4.4Å; L23-L27 WeakPolarHBondContact O-CG 3.35Å; L23-L27 PolarHBondContact O-N 3.36Å; L23-L27 VanDerWaalsContact O-N 3.12Å; L24-L27 PolarHBondContact O-N 2.88Å; L24-L27 VanDerWaalsContact O-N 3.11Å; L27-V29 PolarHBondContact O-N 3.45Å; L27-I30 HydrophobicContact CD2-CD1 3.82Å; L27-I30 VanDerWaalsContact O-CB 3.27Å; L27-I30 WeakPolarHBondContact O-CB 3.35Å; L27-I30 WeakPolarHBondContact O-CG1 3.41Å; L27-I30 PolarHBondContact O-N 2.96Å; L27-I30 VanDerWaalsContact O-N 3.1Å; L27-F225 HydrophobicContact CD2-CE1 4.25Å; L27-F257 HydrophobicContact CB-CE1 3.85Å; L27-F257 HydrophobicContact CB-CZ 4.1Å; L27-Y260 WeakPolarHBondContact CB-OH 3.44Å; L27-Y260 VanDerWaalsContact CD1-OH 3.23Å; L27-Y260 WeakPolarHBondContact CD1-OH 3.35Å
28P95.7Very high95.1Very high0 Ų019.6 Ų19.60%010%0.096CC..Hα-helixtrans-62.7-19.8172.6-27.938.1000115.2L24 I30 I31 T32 F161 I165 I198 F257 Y260L24-P28 VanDerWaalsContact O-CD 3.24Å; L24-P28 WeakPolarHBondContact O-CD 3.41Å; P28-I30 PolarHBondContact O-N 2.64Å; P28-I31 PolarHBondContact O-N 2.87Å; P28-T32 PolarHBondContact O-N 2.63Å; P28-T32 PolarHBondContact O-OG1 3.22Å; P28-T32 VanDerWaalsContact O-OG1 3.04Å; P28-F161 HydrophobicContact CB-CZ 4.01Å; P28-F161 HydrophobicContact CG-CE1 4.21Å; P28-F161 HydrophobicContact CG-CZ 3.76Å; P28-I165 HydrophobicContact CB-CD1 4.42Å; P28-I165 HydrophobicContact CG-CD1 4.28Å; P28-I198 HydrophobicContact CB-CG2 3.65Å; P28-F257 VanDerWaalsContact CA-CE2 3.49Å; P28-F257 HydrophobicContact CB-CD2 3.99Å; P28-F257 HydrophobicContact CB-CE2 3.86Å; P28-F257 HydrophobicContact CB-CZ 4.31Å; P28-F257 HydrophobicContact CG-CB 4.47Å; P28-F257 HydrophobicContact CG-CD1 3.88Å; P28-F257 HydrophobicContact CG-CD2 3.75Å; P28-F257 HydrophobicContact CG-CE1 3.96Å; P28-F257 HydrophobicContact CG-CE2 3.8Å; P28-F257 HydrophobicContact CG-CG 3.79Å; P28-F257 HydrophobicContact CG-CZ 3.93Å; P28-Y260 HydrophobicContact CG-CD1 4.29Å; P28-Y260 HydrophobicContact CG-CE1 3.78Å
29V95.3Very high95.3Very high0 Ų019.6 Ų19.60%010%0.096CC..Hα-helixtrans-64-33.8173.5172.70000111.1N26 L27 I31 T32 S33 F199 A202 F225 F226N26-V29 WeakPolarHBondContact O-CB 3.35Å; N26-V29 PolarHBondContact O-N 3.29Å; L27-V29 PolarHBondContact O-N 3.45Å; V29-I31 PolarHBondContact O-N 3.22Å; V29-T32 PolarHBondContact O-N 3.17Å; V29-S33 WeakPolarHBondContact O-CB 3.47Å; V29-S33 PolarHBondContact O-N 3.4Å; V29-F199 HydrophobicContact CB-CD2 4.28Å; V29-F199 HydrophobicContact CG1-CD2 3.46Å; V29-F199 VanDerWaalsContact CG1-CD2 3.46Å; V29-F199 HydrophobicContact CG1-CE2 3.75Å; V29-F199 HydrophobicContact CG2-CD2 3.9Å; V29-A202 HydrophobicContact CG2-CB 3.88Å; V29-F225 HydrophobicContact CB-CB 4.21Å; V29-F225 HydrophobicContact CG1-CB 4.14Å; V29-F226 HydrophobicContact CG1-CB 4.28Å; V29-F226 HydrophobicContact CG1-CD2 4.42Å
30I96.8Very high95.4Very high18 Ų1814.2 Ų14.29%0.0927%0.073CC..Hα-helixtrans-58-50.1176.6-59.7177.5000109.7L27 P28 T32 S33 M34 F225 F228 G229 F232L27-I30 HydrophobicContact CD2-CD1 3.82Å; L27-I30 VanDerWaalsContact O-CB 3.27Å; L27-I30 WeakPolarHBondContact O-CB 3.35Å; L27-I30 WeakPolarHBondContact O-CG1 3.41Å; L27-I30 PolarHBondContact O-N 2.96Å; L27-I30 VanDerWaalsContact O-N 3.1Å; P28-I30 PolarHBondContact O-N 2.64Å; I30-T32 VanDerWaalsContact C-N 3.34Å; I30-T32 PolarHBondContact O-N 2.76Å; I30-S33 WeakPolarHBondContact O-CB 3.42Å; I30-S33 PolarHBondContact O-N 3.15Å; I30-M34 HydrophobicContact CG2-CE 4.28Å; I30-M34 WeakPolarHBondContact O-CG 3.47Å; I30-M34 PolarHBondContact O-N 2.95Å; I30-F225 HydrophobicContact CD1-CD1 4.08Å; I30-F225 HydrophobicContact CG1-CB 4.19Å; I30-F225 HydrophobicContact CG1-CD1 4.12Å; I30-F225 WeakPolarHBondContact CG1-O 3.07Å; I30-F228 HydrophobicContact CD1-CB 4.35Å; I30-F228 HydrophobicContact CG1-CB 4.35Å; I30-G229 WeakPolarHBondContact O-CA 3.49Å; I30-F232 HydrophobicContact CD1-CE2 4.45Å; I30-F232 HydrophobicContact CG2-CD2 3.61Å; I30-F232 HydrophobicContact CG2-CE2 4.07Å
31I96.9Very high95.5Very high5 Ų510.8 Ų10.83%0.0266%0.055CC..Hα-helixtrans-66.5-37.7178.9-57.2-164.5000111.4P28 V29 S33 M34 H35 I250 P253 A254 F257P28-I31 PolarHBondContact O-N 2.87Å; V29-I31 PolarHBondContact O-N 3.22Å; I31-S33 VanDerWaalsContact C-N 3.33Å; I31-S33 PolarHBondContact O-N 3.43Å; I31-M34 HydrophobicContact CB-CE 4.18Å; I31-M34 HydrophobicContact CG1-CE 3.8Å; I31-M34 PolarHBondContact O-N 3.46Å; I31-H35 PolarHBondContact O-CD2 3.04Å; I31-H35 PolarHBondContact O-N 3.38Å; I31-I250 HydrophobicContact CG2-CG2 4.45Å; I31-P253 HydrophobicContact CD1-CB 3.87Å; I31-A254 HydrophobicContact CD1-CB 3.8Å; I31-A254 VanDerWaalsContact CD1-N 3.33Å; I31-A254 HydrophobicContact CG2-CB 4.46Å; I31-F257 HydrophobicContact CB-CE2 4.48Å; I31-F257 HydrophobicContact CD1-CD2 4.22Å; I31-F257 HydrophobicContact CD1-CE2 3.36Å; I31-F257 HydrophobicContact CD1-CZ 4.02Å; I31-F257 HydrophobicContact CG1-CE2 3.83Å; I31-F257 HydrophobicContact CG1-CZ 4.32Å
32T97Very high95.6Very high0 Ų010.4 Ų10.40%05%0.053CC..Hα-helixtrans-62.5-40.6175.6-60.40000112.2P28 V29 I30 H35 V36 Q168 H195 I198P28-T32 PolarHBondContact O-N 2.63Å; P28-T32 PolarHBondContact O-OG1 3.22Å; P28-T32 VanDerWaalsContact O-OG1 3.04Å; V29-T32 PolarHBondContact O-N 3.17Å; I30-T32 VanDerWaalsContact C-N 3.34Å; I30-T32 PolarHBondContact O-N 2.76Å; T32-H35 PolarHBondContact O-N 2.98Å; T32-V36 WeakPolarHBondContact O-CG1 3.46Å; T32-V36 PolarHBondContact O-N 3.24Å; T32-V36 VanDerWaalsContact O-N 3.07Å; T32-Q168 PolarHBondContact OG1-NE2 2.87Å; T32-H195 HydrophobicContact CG2-CB 4Å; T32-H195 VanDerWaalsContact CG2-CG 3.41Å; T32-I198 WeakPolarHBondContact OG1-CG2 3.44Å
33S96.4Very high95.7Very high0 Ų09.5 Ų9.50%05%0.05CC..Hα-helixtrans-61.9-44.9173.5175.90000111.7V29 I30 I31 H35 V36 L37 F226V29-S33 WeakPolarHBondContact O-CB 3.47Å; V29-S33 PolarHBondContact O-N 3.4Å; I30-S33 WeakPolarHBondContact O-CB 3.42Å; I30-S33 PolarHBondContact O-N 3.15Å; I31-S33 VanDerWaalsContact C-N 3.33Å; I31-S33 PolarHBondContact O-N 3.43Å; S33-H35 PolarHBondContact O-N 2.93Å; S33-V36 WeakPolarHBondContact O-CG1 3.38Å; S33-V36 PolarHBondContact O-N 3.25Å; S33-L37 PolarHBondContact O-N 3.32Å; S33-F226 WeakPolarHBondContact CB-O 3.28Å; S33-F226 WeakPolarHBondContact OG-CD1 3.27Å; S33-F226 WeakPolarHBondContact OG-CE1 3.45Å; S33-F226 PolarHBondContact OG-O 3.25Å
34M97.6Very high95.7Very high10 Ų107.8 Ų7.85%0.0494%0.039CC..Hα-helixtrans-59.3-45.7174.4-65.8-168.2-74.700111.5I30 I31 V36 L37 S38 G229 F232 L233 L236 I250I30-M34 HydrophobicContact CG2-CE 4.28Å; I30-M34 WeakPolarHBondContact O-CG 3.47Å; I30-M34 PolarHBondContact O-N 2.95Å; I31-M34 HydrophobicContact CB-CE 4.18Å; I31-M34 HydrophobicContact CG1-CE 3.8Å; I31-M34 PolarHBondContact O-N 3.46Å; M34-V36 PolarHBondContact O-N 2.79Å; M34-L37 PolarHBondContact O-N 3.27Å; M34-S38 WeakPolarHBondContact O-CA 3.49Å; M34-S38 WeakPolarHBondContact O-CB 3.46Å; M34-S38 PolarHBondContact O-N 2.89Å; M34-G229 WeakPolarHBondContact CG-O 3.24Å; M34-F232 HydrophobicContact SD-CB 3.94Å; M34-L233 HydrophobicContact CB-CB 4.39Å; M34-L233 HydrophobicContact CG-CB 4Å; M34-L236 HydrophobicContact SD-CD1 3.99Å; M34-I250 HydrophobicContact CB-CG1 4.27Å; M34-I250 HydrophobicContact CB-CG2 3.55Å; M34-I250 HydrophobicContact CE-CG2 4.37Å; M34-I250 HydrophobicContact SD-CG1 4.38Å
35H97.8Very high95.6Very high0 Ų08.3 Ų8.30%04%0.044CC..Hα-helixtrans-65.2-38.5179.9-83.1-57.1000114.7I31 T32 S33 L37 S38 Q168 L191 Q247 S251I31-H35 PolarHBondContact O-CD2 3.04Å; I31-H35 PolarHBondContact O-N 3.38Å; T32-H35 PolarHBondContact O-N 2.98Å; S33-H35 PolarHBondContact O-N 2.93Å; H35-L37 VanDerWaalsContact C-N 3.32Å; H35-S38 PolarHBondContact O-OG 2.76Å; H35-Q168 VanDerWaalsContact CD2-CD 3.47Å; H35-Q168 VanDerWaalsContact CD2-CG 3.42Å; H35-Q168 WeakPolarHBondContact CD2-CG 3.29Å; H35-L191 HydrophobicContact CB-CD1 4.32Å; H35-Q247 PolarHBondContact CE1-NE2 3.48Å; H35-S251 PolarHBondContact CE1-OG 3.41Å
36V96.9Very high95.5Very high0 Ų08.6 Ų8.60%05%0.045CC..Hα-helixtrans-68.8-34.3179.361.20000111.7T32 S33 M34 Q134 Y137 Y138 F226 Y349T32-V36 WeakPolarHBondContact O-CG1 3.46Å; T32-V36 PolarHBondContact O-N 3.24Å; T32-V36 VanDerWaalsContact O-N 3.07Å; S33-V36 WeakPolarHBondContact O-CG1 3.38Å; S33-V36 PolarHBondContact O-N 3.25Å; M34-V36 PolarHBondContact O-N 2.79Å; V36-Q134 PolarHBondContact O-NE2 2.85Å; V36-Y137 HydrophobicContact CB-CE1 3.72Å; V36-Y137 HydrophobicContact CB-CE2 4.41Å; V36-Y137 WeakPolarHBondContact CB-OH 3.42Å; V36-Y137 HydrophobicContact CG2-CD1 3.99Å; V36-Y137 HydrophobicContact CG2-CE1 3.41Å; V36-Y137 VanDerWaalsContact CG2-CE1 3.41Å; V36-Y138 HydrophobicContact CG2-CE1 3.95Å; V36-F226 HydrophobicContact CG1-CE2 3.93Å; V36-F226 HydrophobicContact CG1-CZ 3.62Å; V36-Y349 HydrophobicContact CG2-CE1 4.43Å
37L96.5Very high95.4Very high0 Ų014.2 Ų14.20%07%0.072CC..Hα-helixtrans-96.9-10.6-178.4-58.4-179.4000114.2S33 M34 H35 W39 T40 F226 Q230 L233 F366S33-L37 PolarHBondContact O-N 3.32Å; M34-L37 PolarHBondContact O-N 3.27Å; H35-L37 VanDerWaalsContact C-N 3.32Å; L37-W39 PolarHBondContact O-N 2.97Å; L37-T40 VanDerWaalsContact O-CB 3.3Å; L37-T40 WeakPolarHBondContact O-CB 3.45Å; L37-T40 PolarHBondContact O-N 2.94Å; L37-T40 PolarHBondContact O-OG1 3.32Å; L37-F226 HydrophobicContact CD1-CE1 4.34Å; L37-Q230 HydrophobicContact CD1-CB 4.18Å; L37-Q230 HydrophobicContact CD1-CG 3.88Å; L37-L233 HydrophobicContact CB-CD2 3.58Å; L37-F366 HydrophobicContact CB-CE1 3.97Å; L37-F366 HydrophobicContact CD1-CE1 4.08Å
38S96.5Very high95.3Very high0 Ų012.7 Ų12.70%06%0.063CC..THydrogen-bonded Turntrans-59.7-26.8-173.872.10000113.5M34 H35 T40 F41 T42 R188 Q247M34-S38 WeakPolarHBondContact O-CA 3.49Å; M34-S38 WeakPolarHBondContact O-CB 3.46Å; M34-S38 PolarHBondContact O-N 2.89Å; H35-S38 PolarHBondContact O-OG 2.76Å; S38-T40 PolarHBondContact O-N 3.38Å; S38-F41 PolarHBondContact O-N 3.48Å; S38-F41 VanDerWaalsContact O-N 3.15Å; S38-T42 PolarHBondContact O-N 3.25Å; S38-T42 PolarHBondContact O-OG1 2.73Å; S38-T42 VanDerWaalsContact O-OG1 3.08Å; S38-R188 PolarHBondContact OG-NH2 2.84Å; S38-Q247 PolarHBondContact OG-OE1 3.28Å
39W96.4Very high95.1Very high0 Ų013.9 Ų13.90%07%0.067CC..Hα-helixtrans-59.8-27.9177.9-156.8-124.5000113.8L37 F41 T42 S43 A116 R130 V133 Q134 V184 R188L37-W39 PolarHBondContact O-N 2.97Å; W39-F41 VanDerWaalsContact C-N 3.25Å; W39-F41 PolarHBondContact O-N 3.4Å; W39-T42 HydrophobicContact CE3-CG2 3.57Å; W39-T42 HydrophobicContact CZ3-CG2 3.47Å; W39-T42 VanDerWaalsContact CZ3-CG2 3.47Å; W39-T42 PolarHBondContact O-N 2.81Å; W39-S43 VanDerWaalsContact CD1-OG 3.3Å; W39-S43 VanDerWaalsContact CE2-CB 3.42Å; W39-S43 PolarHBondContact NE1-OG 3.43Å; W39-S43 WeakPolarHBondContact O-CA 3.46Å; W39-S43 VanDerWaalsContact O-CB 3.25Å; W39-S43 WeakPolarHBondContact O-CB 3.43Å; W39-S43 PolarHBondContact O-N 3.27Å; W39-S43 PolarHBondContact O-OG 3.22Å; W39-A116 HydrophobicContact CH2-CB 3.92Å; W39-A116 HydrophobicContact CZ3-CB 4.03Å; W39-R130 PolarHBondContact NE1-O 3.49Å; W39-V133 HydrophobicContact CD2-CG1 4.04Å; W39-V133 HydrophobicContact CE3-CG1 4.18Å; W39-V133 HydrophobicContact CH2-CB 4.01Å; W39-V133 HydrophobicContact CH2-CG1 3.53Å; W39-V133 HydrophobicContact CH2-CG2 4.28Å; W39-V133 HydrophobicContact CZ2-CB 3.41Å; W39-V133 VanDerWaalsContact CZ2-CB 3.41Å; W39-V133 HydrophobicContact CZ2-CG1 3.36Å; W39-V133 HydrophobicContact CZ2-CG2 3.93Å; W39-V133 HydrophobicContact CZ3-CG1 3.92Å; W39-Q134 HydrophobicContact CG-CB 4.47Å; W39-Q134 VanDerWaalsContact CG-OE1 3.28Å; W39-V184 HydrophobicContact CH2-CG1 4.25Å; W39-V184 HydrophobicContact CZ3-CG1 3.88Å; W39-R188 VanDerWaalsContact CE3-CZ 3.4Å; W39-R188 VanDerWaalsContact N-NH2 3.12Å
40T95.1Very high95Very high4 Ų414.1 Ų14.13%0.0257%0.069CC..Hα-helixtrans-56.4-44.9177.6-62.70000111L37 S38 I353 I362 F366L37-T40 VanDerWaalsContact O-CB 3.3Å; L37-T40 WeakPolarHBondContact O-CB 3.45Å; L37-T40 PolarHBondContact O-N 2.94Å; L37-T40 PolarHBondContact O-OG1 3.32Å; S38-T40 PolarHBondContact O-N 3.38Å; T40-I353 WeakPolarHBondContact CB-O 3.44Å; T40-I353 WeakPolarHBondContact CG2-O 3.38Å; T40-I353 WeakPolarHBondContact OG1-CA 3.18Å; T40-I353 PolarHBondContact OG1-O 3.13Å; T40-I362 HydrophobicContact CG2-CD1 3.61Å; T40-I362 HydrophobicContact CG2-CG1 4.04Å; T40-F366 HydrophobicContact CG2-CD2 4.33Å; T40-F366 HydrophobicContact CG2-CE2 3.21Å; T40-F366 HydrophobicContact CG2-CZ 3.39Å
41F95.4Very high94.7Very high1 Ų114.4 Ų14.40%0.0047%0.07CC..Hα-helixtrans-82.4-41.8176.1-61-71.9000112.2S38 W39 S43 E44 F112 L233 A237 L246 I362 N363 F366S38-F41 PolarHBondContact O-N 3.48Å; S38-F41 VanDerWaalsContact O-N 3.15Å; W39-F41 VanDerWaalsContact C-N 3.25Å; W39-F41 PolarHBondContact O-N 3.4Å; F41-S43 PolarHBondContact O-N 3.31Å; F41-E44 WeakPolarHBondContact O-CB 3.42Å; F41-E44 PolarHBondContact O-N 3.17Å; F41-F112 HydrophobicContact CB-CZ 4.19Å; F41-F112 HydrophobicContact CD1-CE2 4.38Å; F41-F112 AromaticContact CD1-CZ 3.75Å; F41-F112 HydrophobicContact CD1-CZ 3.75Å; F41-F112 HydrophobicContact CG-CZ 4.43Å; F41-L233 HydrophobicContact CD2-CD1 4.17Å; F41-L233 HydrophobicContact CD2-CD2 4.02Å; F41-L233 HydrophobicContact CD2-CG 3.83Å; F41-L233 HydrophobicContact CE2-CD2 3.93Å; F41-L233 HydrophobicContact CE2-CG 3.71Å; F41-A237 HydrophobicContact CB-CB 4.29Å; F41-A237 HydrophobicContact CD1-CB 3.52Å; F41-A237 HydrophobicContact CD2-CB 3.9Å; F41-A237 HydrophobicContact CE1-CB 3.65Å; F41-A237 HydrophobicContact CE2-CB 4.05Å; F41-A237 HydrophobicContact CG-CB 3.61Å; F41-A237 HydrophobicContact CZ-CB 3.91Å; F41-L246 HydrophobicContact CB-CD2 3.76Å; F41-L246 HydrophobicContact CG-CD2 4.47Å; F41-I362 HydrophobicContact CD1-CD1 3.99Å; F41-I362 HydrophobicContact CD1-CG1 4.1Å; F41-I362 HydrophobicContact CD1-CG2 4.35Å; F41-I362 HydrophobicContact CE1-CB 4.34Å; F41-I362 HydrophobicContact CE1-CD1 4.09Å; F41-I362 HydrophobicContact CE1-CG1 3.67Å; F41-I362 HydrophobicContact CE1-CG2 4.03Å; F41-I362 HydrophobicContact CZ-CG1 4.33Å; F41-N363 WeakPolarHBondContact CE1-OD1 3.49Å; F41-F366 HydrophobicContact CE1-CD2 4.4Å; F41-F366 HydrophobicContact CE2-CB 4.42Å; F41-F366 AromaticContact CE2-CD1 3.65Å; F41-F366 HydrophobicContact CE2-CD1 3.65Å; F41-F366 AromaticContact CE2-CD2 3.98Å; F41-F366 HydrophobicContact CE2-CD2 3.98Å; F41-F366 AromaticContact CE2-CE1 3.83Å; F41-F366 HydrophobicContact CE2-CE1 3.83Å; F41-F366 HydrophobicContact CE2-CE2 4.16Å; F41-F366 AromaticContact CE2-CG 3.73Å; F41-F366 HydrophobicContact CE2-CG 3.73Å; F41-F366 HydrophobicContact CE2-CZ 4.08Å; F41-F366 HydrophobicContact CZ-CB 3.85Å; F41-F366 AromaticContact CZ-CD1 3.9Å; F41-F366 HydrophobicContact CZ-CD1 3.9Å; F41-F366 AromaticContact CZ-CD2 3.56Å; F41-F366 HydrophobicContact CZ-CD2 3.56Å; F41-F366 HydrophobicContact CZ-CE1 4.38Å; F41-F366 HydrophobicContact CZ-CE2 4.09Å; F41-F366 AromaticContact CZ-CG 3.46Å; F41-F366 HydrophobicContact CZ-CG 3.46Å; F41-F366 VanDerWaalsContact CZ-CG 3.46Å; F41-F366 HydrophobicContact CZ-CZ 4.46Å
42T95.2Very high94.4Very high2 Ų214.7 Ų14.71%0.0127%0.071CC..Hα-helixtrans-60.6-33.4179.7-57.30000112.4S38 W39 T115 A116 Y243S38-T42 PolarHBondContact O-N 3.25Å; S38-T42 PolarHBondContact O-OG1 2.73Å; S38-T42 VanDerWaalsContact O-OG1 3.08Å; W39-T42 HydrophobicContact CE3-CG2 3.57Å; W39-T42 HydrophobicContact CZ3-CG2 3.47Å; W39-T42 VanDerWaalsContact CZ3-CG2 3.47Å; W39-T42 PolarHBondContact O-N 2.81Å; T42-T115 WeakPolarHBondContact O-CB 3.43Å; T42-A116 HydrophobicContact CG2-CB 3.68Å; T42-A116 VanDerWaalsContact O-CB 3.24Å; T42-A116 WeakPolarHBondContact O-CB 3.24Å; T42-A116 PolarHBondContact O-N 3.15Å; T42-Y243 HydrophobicContact CG2-CD2 3.63Å; T42-Y243 HydrophobicContact CG2-CE2 4.48Å; T42-Y243 HydrophobicContact CG2-CG 3.99Å
43S94.1Very high94Very high0 Ų016.9 Ų16.90%09%0.085CC..THydrogen-bonded Turntrans-107.324.4-177.975.30000113.9W39 F41 V45 V117 R130W39-S43 VanDerWaalsContact CD1-OG 3.3Å; W39-S43 VanDerWaalsContact CE2-CB 3.42Å; W39-S43 PolarHBondContact NE1-OG 3.43Å; W39-S43 WeakPolarHBondContact O-CA 3.46Å; W39-S43 VanDerWaalsContact O-CB 3.25Å; W39-S43 WeakPolarHBondContact O-CB 3.43Å; W39-S43 PolarHBondContact O-N 3.27Å; W39-S43 PolarHBondContact O-OG 3.22Å; F41-S43 PolarHBondContact O-N 3.31Å; S43-V45 PolarHBondContact O-N 3.09Å; S43-V117 WeakPolarHBondContact O-CG2 3.48Å; S43-R130 PolarHBondContact O-NE 3.21Å; S43-R130 PolarHBondContact O-NH2 3.19Å; S43-R130 VanDerWaalsContact O-NH2 3.14Å
44E93.1Very high93.6Very high44 Ų4419.1 Ų19.121%0.20611%0.108CC..  trans-64.3134175.8-177.26417500110.8F41 F112 T115 I362F41-E44 WeakPolarHBondContact O-CB 3.42Å; F41-E44 PolarHBondContact O-N 3.17Å; E44-F112 HydrophobicContact CB-CD2 4.11Å; E44-F112 HydrophobicContact CB-CE2 4.13Å; E44-F112 HydrophobicContact CG-CD2 4.04Å; E44-F112 HydrophobicContact CG-CE2 4.07Å; E44-T115 HydrophobicContact CB-CG2 4.29Å; E44-T115 PolarHBondContact O-OG1 3.48Å; E44-I362 WeakPolarHBondContact OE2-CD1 3.35Å
45V92Very high93.2Very high35 Ų3519.5 Ų19.521%0.21211%0.11CC..  trans-90.4115.3178.8177.20000108.4S43 V117 V123S43-V45 PolarHBondContact O-N 3.09Å; V45-V117 HydrophobicContact CG2-CG1 4.28Å; V45-V117 HydrophobicContact CG2-CG2 4.37Å; V45-V123 HydrophobicContact CG1-CG1 4.12Å
46L91.9Very high92.7Very high8 Ų824.1 Ų24.14%0.04214%0.135CC..  trans-82.2154.5171-56.7-175.7000110.1H48 W107 F112 T115 T118L46-H48 PolarHBondContact O-N 2.91Å; L46-H48 PolarHBondContact O-ND1 3.08Å; L46-W107 HydrophobicContact CB-CE3 4.07Å; L46-F112 VanDerWaalsContact CD1-O 3.3Å; L46-F112 WeakPolarHBondContact CD1-O 3.23Å; L46-F112 HydrophobicContact CD2-CB 4.36Å; L46-T115 HydrophobicContact CG-CG2 4.45Å; L46-T118 HydrophobicContact CB-CG2 4.44Å; L46-T118 HydrophobicContact CD1-CG2 3.79Å; L46-T118 HydrophobicContact CG-CG2 4.16Å
47Q91.3Very high92Very high118 Ų11829.2 Ų29.255%0.55117%0.171SC*.  trans-57.6134170.3-67.3179.8-21.400109.1F61 W107 N108Q47-F61 HydrophobicContact CB-CE2 4.34Å; Q47-F61 HydrophobicContact CB-CZ 4.02Å; Q47-W107 CarbonylContact O-C 3.58Å; Q47-W107 WeakPolarHBondContact O-CA 3.36Å; Q47-N108 HydrophobicContact CB-CB 3.93Å; Q47-N108 PolarHBondContact O-N 3.48Å; Q47-N108 PolarHBondContact OE1-ND2 3.27Å; Q47-N108 VanDerWaalsContact OE1-ND2 3.13Å
48H93Very high91.3Very high22 Ų2235 Ų3510%0.10221%0.206CC..EExtended strand (participates in β ladder)trans-140.9159.8-173.856.3-82.4000111.9L46 S78 Y105 R106 W107L46-H48 PolarHBondContact O-N 2.91Å; L46-H48 PolarHBondContact O-ND1 3.08Å; H48-S78 PolarHBondContact NE2-OG 3.08Å; H48-S78 VanDerWaalsContact NE2-OG 3.11Å; H48-S78 WeakPolarHBondContact O-CB 3.15Å; H48-Y105 HydrophobicContact CB-CD1 4.47Å; H48-Y105 AromaticContact CD2-CD1 3.79Å; H48-R106 CarbonylContact C-O 3.59Å; H48-R106 WeakPolarHBondContact CA-O 3.4Å; H48-W107 HydrophobicContact CB-CD2 4.22Å; H48-W107 HydrophobicContact CB-CE3 3.5Å; H48-W107 HydrophobicContact CB-CH2 4.21Å; H48-W107 HydrophobicContact CB-CZ3 3.5Å; H48-W107 AromaticContact CG-CZ3 3.75Å; H48-W107 AromaticContact ND1-CZ3 3.8Å
49R92.1Very high90.6Very high25 Ų2536.3 Ų36.39%0.09422%0.215CC..EExtended strand (participates in β ladder)trans-143.2163.2168.464164.2178.284.5-1.9109.7E55 T60 F61 Y105 R106R49-E55 IonicContact CZ-OE1 2.7Å; R49-E55 IonicContact CZ-OE2 3.68Å; R49-E55 IonicContact NH1-OE1 2.59Å; R49-E55 PolarHBondContact NH1-OE1 3.34Å; R49-E55 IonicContact NH1-OE2 3.47Å; R49-E55 PolarHBondContact NH1-OE2 3Å; R49-E55 IonicContact NH2-OE1 3.34Å; R49-E55 PolarHBondContact NH2-OE1 3.4Å; R49-E55 IonicContact NH2-OE2 2.85Å; R49-T60 PolarHBondContact NH2-O 3.36Å; R49-F61 HydrophobicContact CB-CE2 4.41Å; R49-F61 HydrophobicContact CG-CD2 4.32Å; R49-F61 HydrophobicContact CG-CE2 4.17Å; R49-F61 PolarHBondContact NE-O 3.1Å; R49-Y105 CarbonylContact O-C 3.57Å; R49-Y105 VanDerWaalsContact O-CA 3.3Å; R49-Y105 WeakPolarHBondContact O-CA 3.14Å; R49-R106 HydrophobicContact CG-CB 4.01Å; R49-R106 PolarHBondContact N-O 3.4Å; R49-R106 PolarHBondContact O-N 2.82Å
50C92.1Very high90.1Very high4 Ų440.8 Ų40.83%0.02724%0.242CC..EExtended strand (participates in β ladder)trans-62.9146.3171.5-55.80000111.9Q80 R81 C101C50-Q80 VanDerWaalsContact SG-C 3.55Å; C50-R81 HydrophobicContact CB-CB 4.01Å; C50-R81 HydrophobicContact CB-CG 4.03Å; C50-C101 WeakPolarHBondContact CA-SG 3.08Å; C50-C101 HydrophobicContact CB-CB 3.67Å; C50-C101 WeakPolarHBondContact CB-SG 3.47Å; C50-C101 VanDerWaalsContact SG-CA 3.58Å; C50-C101 WeakPolarHBondContact SG-CB 3.49Å; C50-C101 CovalentContact SG-SG 2.02Å; C50-C101 PolarHBondContact SG-SG 3.23Å
51I91.2Very high89.7Confident24 Ų2442.4 Ų42.412%0.12325%0.249CC..PPolyproline II helixtrans-73.2137.3162.3-68.2165.4000108.8E55 R81 D103 G104 Y105 R106I51-E55 HydrophobicContact CG2-CB 4.37Å; I51-R81 PolarHBondContact O-NE 3.19Å; I51-D103 HydrophobicContact CB-CB 4.22Å; I51-D103 WeakPolarHBondContact CD1-O 3.39Å; I51-D103 HydrophobicContact CG2-CB 4.18Å; I51-G104 PolarHBondContact N-O 3.01Å; I51-Y105 WeakPolarHBondContact CD1-O 3.43Å; I51-R106 VanDerWaalsContact CD1-NH1 3.31Å; I51-R106 HydrophobicContact CG1-CG 3.7Å
52Y90.5Very high89.3Confident12 Ų1249.6 Ų49.65%0.04728%0.277CS..PPolyproline II helixtrans-96.4142.5172.5-70.6-86.5000111.3G54 E55 I63 W67 L71 R81 V85Y52-G54 PolarHBondContact O-N 3.15Å; Y52-E55 PolarHBondContact N-OE2 3.18Å; Y52-E55 WeakPolarHBondContact O-CB 3.44Å; Y52-E55 PolarHBondContact O-N 3.5Å; Y52-I63 HydrophobicContact CE2-CD1 4.22Å; Y52-W67 AromaticContact CD1-CH2 3.51Å; Y52-W67 HydrophobicContact CD1-CH2 3.51Å; Y52-W67 HydrophobicContact CD1-CZ2 4.46Å; Y52-W67 HydrophobicContact CD1-CZ3 4.26Å; Y52-W67 AromaticContact CD2-CH2 3.65Å; Y52-W67 HydrophobicContact CD2-CH2 3.65Å; Y52-W67 AromaticContact CD2-CZ3 3.96Å; Y52-W67 HydrophobicContact CD2-CZ3 3.96Å; Y52-W67 AromaticContact CE1-CH2 3.5Å; Y52-W67 HydrophobicContact CE1-CH2 3.5Å; Y52-W67 AromaticContact CE1-CZ3 3.83Å; Y52-W67 HydrophobicContact CE1-CZ3 3.83Å; Y52-W67 AromaticContact CE2-CH2 3.67Å; Y52-W67 HydrophobicContact CE2-CH2 3.67Å; Y52-W67 AromaticContact CE2-CZ3 3.52Å; Y52-W67 HydrophobicContact CE2-CZ3 3.52Å; Y52-W67 AromaticContact CG-CH2 3.56Å; Y52-W67 HydrophobicContact CG-CH2 3.56Å; Y52-W67 HydrophobicContact CG-CZ2 4.34Å; Y52-W67 HydrophobicContact CG-CZ3 4.29Å; Y52-W67 AromaticContact CZ-CH2 3.57Å; Y52-W67 AromaticContact CZ-CZ3 3.43Å; Y52-W67 VanDerWaalsContact CZ-CZ3 3.43Å; Y52-L71 PolarHBondContact OH-O 2.69Å; Y52-R81 HydrophobicContact CE1-CB 4.12Å; Y52-V85 HydrophobicContact CD1-CG1 4.32Å; Y52-V85 HydrophobicContact CE1-CG1 4.24Å
53P89.3Confident88.7Confident46 Ų4651.6 Ų51.630%0.29929%0.288SS..THydrogen-bonded Turntrans-54.1130.1174.9-26.133.1000112.1V85 S86 Y87P53-V85 WeakPolarHBondContact CD-O 3.34Å; P53-S86 CarbonylContact O-C 3.21Å; P53-S86 WeakPolarHBondContact O-CA 3.44Å; P53-S86 WeakPolarHBondContact O-CB 3.35Å; P53-Y87 PolarHBondContact O-N 3.04Å
54G88.2Confident88.2Confident47 Ų4753.6 Ų53.649%0.48530%0.301SS..THydrogen-bonded Turntrans870-17700000114.9Y52 W88Y52-G54 PolarHBondContact O-N 3.15Å; G54-W88 PolarHBondContact O-NE1 3.02Å
55E88.4Confident87.4Confident17 Ų1757.7 Ų57.78%0.07933%0.334CS..  trans-73.8129.2173.4-171.5178.6166.300111.4R49 I51 Y52 S59 Y87 R106R49-E55 IonicContact CZ-OE1 2.7Å; R49-E55 IonicContact CZ-OE2 3.68Å; R49-E55 IonicContact NH1-OE1 2.59Å; R49-E55 PolarHBondContact NH1-OE1 3.34Å; R49-E55 IonicContact NH1-OE2 3.47Å; R49-E55 PolarHBondContact NH1-OE2 3Å; R49-E55 IonicContact NH2-OE1 3.34Å; R49-E55 PolarHBondContact NH2-OE1 3.4Å; R49-E55 IonicContact NH2-OE2 2.85Å; I51-E55 HydrophobicContact CG2-CB 4.37Å; Y52-E55 PolarHBondContact N-OE2 3.18Å; Y52-E55 WeakPolarHBondContact O-CB 3.44Å; Y52-E55 PolarHBondContact O-N 3.5Å; E55-S59 WeakPolarHBondContact CG-OG 3.42Å; E55-S59 VanDerWaalsContact OE1-CB 3.22Å; E55-S59 WeakPolarHBondContact OE1-CB 3.23Å; E55-Y87 HydrophobicContact CB-CD2 3.82Å; E55-Y87 HydrophobicContact CB-CE2 4.42Å; E55-Y87 HydrophobicContact CB-CG 3.92Å; E55-Y87 HydrophobicContact CG-CD2 3.77Å; E55-Y87 HydrophobicContact CG-CE2 3.86Å; E55-Y87 HydrophobicContact CG-CG 4.22Å; E55-R106 WeakPolarHBondContact OE1-CG 3.19Å; E55-R106 IonicContact OE1-NE 2.82Å; E55-R106 PolarHBondContact OE1-NE 3.01Å
56N86.7Confident86.7Confident98 Ų9862.5 Ų62.552%0.52436%0.359SS..  trans-65.6154.6177.3-73.1-11.3000112.3T58 S59 R106N56-T58 PolarHBondContact O-N 3.34Å; N56-S59 WeakPolarHBondContact O-CB 3.46Å; N56-S59 PolarHBondContact O-N 3.24Å; N56-S59 PolarHBondContact O-OG 3.02Å; N56-R106 PolarHBondContact O-NH2 3.03Å
57S82Confident86.1Confident107 Ų10763.7 Ų63.775%0.74836%0.362SS*.THydrogen-bonded Turntrans-65.1-23.5176.1550000113.7
58T82.3Confident85.5Confident120 Ų12060.2 Ų60.274%0.73635%0.351SS*.THydrogen-bonded Turntrans-89.1-2.1178.454.20000113.8N56N56-T58 PolarHBondContact O-N 3.34Å
59S82Confident84.8Confident28 Ų2864 Ų6420%0.19638%0.38CS..  trans-63.2138.6179.6-65.80000111.6E55 N56E55-S59 WeakPolarHBondContact CG-OG 3.42Å; E55-S59 VanDerWaalsContact OE1-CB 3.22Å; E55-S59 WeakPolarHBondContact OE1-CB 3.23Å; N56-S59 WeakPolarHBondContact O-CB 3.46Å; N56-S59 PolarHBondContact O-N 3.24Å; N56-S59 PolarHBondContact O-OG 3.02Å
60T86.1Confident84.2Confident94 Ų9465.5 Ų65.558%0.57739%0.394SS*.  trans-72.9163.5179.1530000112.3R49 Y62R49-T60 PolarHBondContact NH2-O 3.36Å; T60-Y62 PolarHBondContact O-N 2.75Å; T60-Y62 PolarHBondContact OG1-O 3.49Å
61F86.5Confident83.7Confident38 Ų3865.3 Ų65.317%0.16739%0.393CS..SBendtrans-53.5-40.8169.2173.5-103.5000112.5Q47 R49 N108Q47-F61 HydrophobicContact CB-CE2 4.34Å; Q47-F61 HydrophobicContact CB-CZ 4.02Å; R49-F61 HydrophobicContact CB-CE2 4.41Å; R49-F61 HydrophobicContact CG-CD2 4.32Å; R49-F61 HydrophobicContact CG-CE2 4.17Å; R49-F61 PolarHBondContact NE-O 3.1Å; F61-N108 HydrophobicContact CB-CB 4.12Å; F61-N108 HydrophobicContact CD1-CB 3.74Å; F61-N108 HydrophobicContact CD2-CB 3.88Å; F61-N108 HydrophobicContact CE1-CB 4.1Å; F61-N108 HydrophobicContact CE2-CB 4.23Å; F61-N108 HydrophobicContact CG-CB 3.62Å; F61-N108 HydrophobicContact CZ-CB 4.33Å
62Y86.4Confident83.3Confident153 Ų15367.5 Ų67.560%0.640%0.404SS*.SBendtrans-71.6132178.9-58.9-76.1000111.7T60T60-Y62 PolarHBondContact O-N 2.75Å; T60-Y62 PolarHBondContact OG1-O 3.49Å
63I83.8Confident82.8Confident44 Ų4467.3 Ų67.323%0.22640%0.404CS..PPolyproline II helixtrans-73.3140171.1-62.8175.3000108.2Y52 W67 I72Y52-I63 HydrophobicContact CE2-CD1 4.22Å; I63-W67 HydrophobicContact CD1-CE3 4.2Å; I63-W67 HydrophobicContact CD1-CZ3 4.32Å; I63-W67 HydrophobicContact CG2-CB 3.47Å; I63-W67 VanDerWaalsContact CG2-CB 3.47Å; I63-W67 HydrophobicContact CG2-CD2 3.62Å; I63-W67 HydrophobicContact CG2-CE3 3.43Å; I63-W67 VanDerWaalsContact CG2-CE3 3.43Å; I63-W67 HydrophobicContact CG2-CG 3.68Å; I63-W67 HydrophobicContact CG2-CZ3 4.38Å; I63-I72 HydrophobicContact CD1-CD1 3.92Å; I63-I72 HydrophobicContact CD1-CG1 4.18Å
64P82.2Confident82Confident42 Ų4270.7 Ų70.727%0.27343%0.429SS..PPolyproline II helixtrans-56.6144.9178.2-23.933.8000112.8N66 W67 Y87P64-N66 WeakPolarHBondContact CB-OD1 3.38Å; P64-N66 PolarHBondContact O-N 2.85Å; P64-N66 VanDerWaalsContact O-N 3.11Å; P64-W67 WeakPolarHBondContact O-CB 3.37Å; P64-W67 PolarHBondContact O-N 3.14Å; P64-Y87 VanDerWaalsContact CD-OH 3.29Å; P64-Y87 WeakPolarHBondContact CD-OH 3.41Å; P64-Y87 WeakPolarHBondContact CG-OH 3.2Å
65S77.4Confident81.4Confident129 Ų12972.3 Ų72.390%0.90243%0.433SS*.THydrogen-bonded Turntrans-64.1-18.5-177.854.60000114.5W67S65-W67 VanDerWaalsContact C-N 3.29Å
66N77.1Confident80.7Confident137 Ų13774.5 Ų74.573%0.73346%0.46SS*.THydrogen-bonded Turntrans-81.1-4.3177.340.4-36.5000113.5P64P64-N66 WeakPolarHBondContact CB-OD1 3.38Å; P64-N66 PolarHBondContact O-N 2.85Å; P64-N66 VanDerWaalsContact O-N 3.11Å
67W79.8Confident80.5Confident32 Ų3271.9 Ų71.912%0.12145%0.449CS..SBendtrans-81.9131.9175-11849.4000111.6Y52 I63 P64 S65 S69 L71 V85 S86 Y87Y52-W67 AromaticContact CD1-CH2 3.51Å; Y52-W67 HydrophobicContact CD1-CH2 3.51Å; Y52-W67 HydrophobicContact CD1-CZ2 4.46Å; Y52-W67 HydrophobicContact CD1-CZ3 4.26Å; Y52-W67 AromaticContact CD2-CH2 3.65Å; Y52-W67 HydrophobicContact CD2-CH2 3.65Å; Y52-W67 AromaticContact CD2-CZ3 3.96Å; Y52-W67 HydrophobicContact CD2-CZ3 3.96Å; Y52-W67 AromaticContact CE1-CH2 3.5Å; Y52-W67 HydrophobicContact CE1-CH2 3.5Å; Y52-W67 AromaticContact CE1-CZ3 3.83Å; Y52-W67 HydrophobicContact CE1-CZ3 3.83Å; Y52-W67 AromaticContact CE2-CH2 3.67Å; Y52-W67 HydrophobicContact CE2-CH2 3.67Å; Y52-W67 AromaticContact CE2-CZ3 3.52Å; Y52-W67 HydrophobicContact CE2-CZ3 3.52Å; Y52-W67 AromaticContact CG-CH2 3.56Å; Y52-W67 HydrophobicContact CG-CH2 3.56Å; Y52-W67 HydrophobicContact CG-CZ2 4.34Å; Y52-W67 HydrophobicContact CG-CZ3 4.29Å; Y52-W67 AromaticContact CZ-CH2 3.57Å; Y52-W67 AromaticContact CZ-CZ3 3.43Å; Y52-W67 VanDerWaalsContact CZ-CZ3 3.43Å; I63-W67 HydrophobicContact CD1-CE3 4.2Å; I63-W67 HydrophobicContact CD1-CZ3 4.32Å; I63-W67 HydrophobicContact CG2-CB 3.47Å; I63-W67 VanDerWaalsContact CG2-CB 3.47Å; I63-W67 HydrophobicContact CG2-CD2 3.62Å; I63-W67 HydrophobicContact CG2-CE3 3.43Å; I63-W67 VanDerWaalsContact CG2-CE3 3.43Å; I63-W67 HydrophobicContact CG2-CG 3.68Å; I63-W67 HydrophobicContact CG2-CZ3 4.38Å; P64-W67 WeakPolarHBondContact O-CB 3.37Å; P64-W67 PolarHBondContact O-N 3.14Å; S65-W67 VanDerWaalsContact C-N 3.29Å; W67-S69 PolarHBondContact O-N 3.03Å; W67-L71 HydrophobicContact CD2-CD1 4.35Å; W67-L71 HydrophobicContact CE3-CB 4.31Å; W67-L71 HydrophobicContact CZ3-CB 4.16Å; W67-V85 HydrophobicContact CH2-CG1 4.33Å; W67-S86 VanDerWaalsContact CZ2-O 3.32Å; W67-S86 WeakPolarHBondContact CZ2-O 3.12Å; W67-Y87 HydrophobicContact CZ2-CD2 4.41Å; W67-Y87 PolarHBondContact NE1-O 3.12Å
68S79.1Confident80.8Confident45 Ų4568.9 Ų68.932%0.31543%0.429SS..  trans-65.9129.5179.1-177.10000110.8S70 L71S68-S70 PolarHBondContact O-N 2.83Å; S68-S70 VanDerWaalsContact O-N 3.11Å; S68-S70 PolarHBondContact OG-N 3.11Å; S68-S70 PolarHBondContact OG-OG 3.01Å; S68-L71 WeakPolarHBondContact O-CB 3.31Å; S68-L71 PolarHBondContact O-N 3.48Å
69S78.5Confident81.3Confident101 Ų10164.6 Ų64.671%0.70640%0.403SS*.G310 helixtrans-58.9-22.2173.356.50000112.8W67 L71 I72W67-S69 PolarHBondContact O-N 3.03Å; S69-L71 PolarHBondContact O-N 2.95Å; S69-I72 PolarHBondContact O-N 3Å; S69-I72 VanDerWaalsContact O-N 3.16Å
70S79.7Confident81.8Confident57 Ų5767 Ų6740%0.39941%0.411SS..G310 helixtrans-67.2-15.1174.471.50000114.2S68 I72S68-S70 PolarHBondContact O-N 2.83Å; S68-S70 VanDerWaalsContact O-N 3.11Å; S68-S70 PolarHBondContact OG-N 3.11Å; S68-S70 PolarHBondContact OG-OG 3.01Å; S70-I72 VanDerWaalsContact C-N 3.35Å
71L81.7Confident82Confident0 Ų062.9 Ų62.90%039%0.385CS..G310 helixtrans-88.3-9.5176.4-64.3161.3000112.3Y52 W67 S68 S69 Y82 V85 D89 L92Y52-L71 PolarHBondContact OH-O 2.69Å; W67-L71 HydrophobicContact CD2-CD1 4.35Å; W67-L71 HydrophobicContact CE3-CB 4.31Å; W67-L71 HydrophobicContact CZ3-CB 4.16Å; S68-L71 WeakPolarHBondContact O-CB 3.31Å; S68-L71 PolarHBondContact O-N 3.48Å; S69-L71 PolarHBondContact O-N 2.95Å; L71-Y82 WeakPolarHBondContact O-CD2 3.48Å; L71-V85 HydrophobicContact CB-CG1 4.5Å; L71-V85 HydrophobicContact CD2-CG1 3.81Å; L71-V85 HydrophobicContact CD2-CG2 4.38Å; L71-D89 WeakPolarHBondContact CD1-O 3.32Å; L71-L92 HydrophobicContact CD2-CB 4.35Å; L71-L92 HydrophobicContact CD2-CD1 4.36Å
72I82.2Confident82.2Confident70 Ų7062.6 Ų62.636%0.35938%0.383SS..SBendtrans-95.6138.6176-56.7174.3000106.9I63 S69 S70 S74I63-I72 HydrophobicContact CD1-CD1 3.92Å; I63-I72 HydrophobicContact CD1-CG1 4.18Å; S69-I72 PolarHBondContact O-N 3Å; S69-I72 VanDerWaalsContact O-N 3.16Å; S70-I72 VanDerWaalsContact C-N 3.35Å; I72-S74 PolarHBondContact O-N 2.9Å; I72-S74 VanDerWaalsContact O-N 3.15Å
73D79.9Confident82.4Confident9 Ų961.2 Ų61.25%0.04838%0.38CS..  trans-55.3122.3174.9179.67.5000109.9S75 G76 S77 L98D73-S75 PolarHBondContact O-N 2.81Å; D73-S75 WeakPolarHBondContact OD1-CB 3.47Å; D73-S75 PolarHBondContact OD1-N 3.21Å; D73-S75 PolarHBondContact OD1-OG 3.41Å; D73-S75 PolarHBondContact OD2-OG 2.91Å; D73-G76 PolarHBondContact O-N 3.43Å; D73-S77 WeakPolarHBondContact OD2-CB 3.35Å; D73-L98 HydrophobicContact CB-CD2 4.01Å
74S72.8Confident82.5Confident116 Ų11662 Ų6281%0.81140%0.4SS*.THydrogen-bonded Turntrans-64.4-19.5-179.758.70000112.8I72 G76I72-S74 PolarHBondContact O-N 2.9Å; I72-S74 VanDerWaalsContact O-N 3.15Å; S74-G76 PolarHBondContact O-N 2.98Å
75S74.7Confident82.9Confident82 Ų8260 Ų6057%0.57339%0.387SS*.THydrogen-bonded Turntrans-66.7-18.2172.385.90000112.9D73 S77D73-S75 PolarHBondContact O-N 2.81Å; D73-S75 WeakPolarHBondContact OD1-CB 3.47Å; D73-S75 PolarHBondContact OD1-N 3.21Å; D73-S75 PolarHBondContact OD1-OG 3.41Å; D73-S75 PolarHBondContact OD2-OG 2.91Å; S75-S77 PolarHBondContact O-N 3.3Å; S75-S77 WeakPolarHBondContact OG-CB 3.25Å; S75-S77 PolarHBondContact OG-N 3.49Å; S75-S77 VanDerWaalsContact OG-N 3.12Å
76G74.7Confident83.4Confident63 Ų6355.2 Ų55.265%0.64935%0.353SS*.  trans73.313.2-172.800000113.8D73 S74 S78D73-G76 PolarHBondContact O-N 3.43Å; S74-G76 PolarHBondContact O-N 2.98Å; G76-S78 PolarHBondContact O-N 3.05Å
77S82.2Confident83.8Confident42 Ų4250 Ų5029%0.29432%0.323SS..  trans-64.3124.5179-179.30000112.1D73 S75 C79D73-S77 WeakPolarHBondContact OD2-CB 3.35Å; S75-S77 PolarHBondContact O-N 3.3Å; S75-S77 WeakPolarHBondContact OG-CB 3.25Å; S75-S77 PolarHBondContact OG-N 3.49Å; S75-S77 VanDerWaalsContact OG-N 3.12Å; S77-C79 PolarHBondContact O-N 3.43Å; S77-C79 PolarHBondContact OG-N 3.38Å
78S88.4Confident84.1Confident45 Ų4556.7 Ų56.732%0.31535%0.348SS..THydrogen-bonded Turntrans-74.1-8.717157.50000113.7H48 G76H48-S78 PolarHBondContact NE2-OG 3.08Å; H48-S78 VanDerWaalsContact NE2-OG 3.11Å; H48-S78 WeakPolarHBondContact O-CB 3.15Å; G76-S78 PolarHBondContact O-N 3.05Å
79C92.1Very high84.5Confident30 Ų3057.4 Ų57.420%0.20335%0.349CS..THydrogen-bonded Turntrans-104.2-8.5-170.4-72.40000114.1S77 C101 C124S77-C79 PolarHBondContact O-N 3.43Å; S77-C79 PolarHBondContact OG-N 3.38Å; C79-C101 VanDerWaalsContact C-SG 3.55Å; C79-C101 PolarHBondContact O-N 2.81Å; C79-C101 PolarHBondContact O-SG 2.96Å; C79-C124 WeakPolarHBondContact CA-SG 3.43Å; C79-C124 HydrophobicContact CB-CB 3.7Å; C79-C124 WeakPolarHBondContact CB-SG 3.33Å; C79-C124 VanDerWaalsContact SG-CA 3.59Å; C79-C124 WeakPolarHBondContact SG-CB 3.39Å; C79-C124 CovalentContact SG-SG 2.02Å; C79-C124 PolarHBondContact SG-SG 3.43Å
80Q91.9Very high84.8Confident79 Ų7960.1 Ų60.137%0.36935%0.35SS..EExtended strand (participates in β ladder)trans-130.7148.9-175.6-67.3-177.2-20.700110.9C50 Q99C50-Q80 VanDerWaalsContact SG-C 3.55Å; Q80-Q99 WeakPolarHBondContact CA-O 3.2Å
81R90.8Very high85Confident7 Ų767.5 Ų67.53%0.02637%0.37CS..EExtended strand (participates in β ladder)trans-139.8159.4170.965.5173.6-172.186.7-7.5110.2C50 I51 Y52 V85 Q99 D103C50-R81 HydrophobicContact CB-CB 4.01Å; C50-R81 HydrophobicContact CB-CG 4.03Å; I51-R81 PolarHBondContact O-NE 3.19Å; Y52-R81 HydrophobicContact CE1-CB 4.12Å; R81-V85 PolarHBondContact NH1-O 2.68Å; R81-Q99 HydrophobicContact CG-CG 4.37Å; R81-Q99 PolarHBondContact N-O 2.77Å; R81-Q99 WeakPolarHBondContact O-CG 3.47Å; R81-Q99 PolarHBondContact O-N 2.99Å; R81-Q99 VanDerWaalsContact O-O 3.11Å; R81-D103 IonicContact CZ-OD2 3.54Å; R81-D103 IonicContact NE-OD2 3.78Å; R81-D103 IonicContact NH2-OD2 2.64Å; R81-D103 PolarHBondContact NH2-OD2 2.68Å
82Y90.8Very high85.2Confident31 Ų3170.1 Ų70.112%0.12238%0.383CS..EExtended strand (participates in β ladder)trans-66.5136.3171.6-67.3-72.2000111.6L71 L92 A96 T97 L98L71-Y82 WeakPolarHBondContact O-CD2 3.48Å; Y82-L92 HydrophobicContact CD1-CD1 3.97Å; Y82-L92 HydrophobicContact CD2-CD1 3.43Å; Y82-L92 VanDerWaalsContact CD2-CD1 3.43Å; Y82-L92 HydrophobicContact CE1-CD1 4.34Å; Y82-L92 HydrophobicContact CE1-CD2 4.22Å; Y82-L92 HydrophobicContact CE2-CD1 3.84Å; Y82-L92 HydrophobicContact CE2-CD2 4.28Å; Y82-L92 HydrophobicContact CG-CD1 3.49Å; Y82-L92 VanDerWaalsContact CG-CD1 3.49Å; Y82-A96 HydrophobicContact CD1-CB 3.74Å; Y82-A96 HydrophobicContact CE1-CB 4.31Å; Y82-A96 HydrophobicContact CG-CB 4.31Å; Y82-T97 CarbonylContact C-O 3.58Å; Y82-T97 WeakPolarHBondContact CA-O 3.4Å; Y82-L98 HydrophobicContact CD1-CD2 3.82Å; Y82-L98 HydrophobicContact CD1-CG 4.36Å; Y82-L98 HydrophobicContact CE1-CD2 3.77Å; Y82-L98 HydrophobicContact CE1-CG 4.2Å; Y82-L98 HydrophobicContact CG-CD2 4.26Å
83K90.3Very high85.3Confident124 Ų12469.6 Ų69.654%0.53939%0.385SS..THydrogen-bonded Turntrans-69.7136.7177.2-177.4172.3-176.4-177.30110.5V85 T97 Q99K83-V85 PolarHBondContact O-N 3.02Å; K83-T97 WeakPolarHBondContact CB-O 3.31Å; K83-T97 PolarHBondContact N-O 3.32Å; K83-Q99 HydrophobicContact CB-CB 4.43Å; K83-Q99 HydrophobicContact CB-CG 3.95Å
84G87.2Confident85.6Confident62 Ų6277.4 Ų77.464%0.63943%0.426SS*.THydrogen-bonded Turntrans77.6-10.6178.500000115.4S86G84-S86 PolarHBondContact O-N 3.09Å
85V89.3Confident86.1Confident0 Ų079.3 Ų79.30%043%0.427CS..  trans-74.6122173.8176.50000109.8Y52 P53 W67 L71 R81 K83 D89 L92 P93Y52-V85 HydrophobicContact CD1-CG1 4.32Å; Y52-V85 HydrophobicContact CE1-CG1 4.24Å; P53-V85 WeakPolarHBondContact CD-O 3.34Å; W67-V85 HydrophobicContact CH2-CG1 4.33Å; L71-V85 HydrophobicContact CB-CG1 4.5Å; L71-V85 HydrophobicContact CD2-CG1 3.81Å; L71-V85 HydrophobicContact CD2-CG2 4.38Å; R81-V85 PolarHBondContact NH1-O 2.68Å; K83-V85 PolarHBondContact O-N 3.02Å; V85-D89 HydrophobicContact CG1-CB 4.41Å; V85-L92 HydrophobicContact CG2-CD1 3.95Å; V85-P93 HydrophobicContact CG2-CG 4.45Å
86S88.2Confident86.6Confident27 Ų2776.7 Ų76.719%0.18941%0.411CS..  trans-97.4165.9175.574.40000111.7P53 W67 G84 W88 D89P53-S86 CarbonylContact O-C 3.21Å; P53-S86 WeakPolarHBondContact O-CA 3.44Å; P53-S86 WeakPolarHBondContact O-CB 3.35Å; W67-S86 VanDerWaalsContact CZ2-O 3.32Å; W67-S86 WeakPolarHBondContact CZ2-O 3.12Å; G84-S86 PolarHBondContact O-N 3.09Å; S86-W88 PolarHBondContact O-N 3.18Å; S86-W88 VanDerWaalsContact O-N 3.13Å; S86-W88 PolarHBondContact OG-N 3.33Å; S86-D89 WeakPolarHBondContact CA-OD2 3.41Å; S86-D89 WeakPolarHBondContact CB-OD2 3.21Å; S86-D89 PolarHBondContact N-OD2 3.36Å; S86-D89 PolarHBondContact O-N 3.36Å; S86-D89 PolarHBondContact OG-OD2 2.66Å
87Y86.7Confident87.4Confident29 Ų2977.6 Ų77.611%0.11440%0.404CS..THydrogen-bonded Turntrans-60.7-18.5178-168.1-104.2000113.6P53 E55 P64 W67P53-Y87 PolarHBondContact O-N 3.04Å; E55-Y87 HydrophobicContact CB-CD2 3.82Å; E55-Y87 HydrophobicContact CB-CE2 4.42Å; E55-Y87 HydrophobicContact CB-CG 3.92Å; E55-Y87 HydrophobicContact CG-CD2 3.77Å; E55-Y87 HydrophobicContact CG-CE2 3.86Å; E55-Y87 HydrophobicContact CG-CG 4.22Å; P64-Y87 VanDerWaalsContact CD-OH 3.29Å; P64-Y87 WeakPolarHBondContact CD-OH 3.41Å; P64-Y87 WeakPolarHBondContact CG-OH 3.2Å; W67-Y87 HydrophobicContact CZ2-CD2 4.41Å; W67-Y87 PolarHBondContact NE1-O 3.12Å
88W84.8Confident87.8Confident171 Ų17179.2 Ų79.265%0.64841%0.409SS*.THydrogen-bonded Turntrans-103.6-7-175.9-50.9107.2000113.6G54 S86G54-W88 PolarHBondContact O-NE1 3.02Å; S86-W88 PolarHBondContact O-N 3.18Å; S86-W88 VanDerWaalsContact O-N 3.13Å; S86-W88 PolarHBondContact OG-N 3.33Å
89D86.9Confident87.9Confident60 Ų6079 Ų7932%0.32140%0.403SS..  trans-69.6143.5-179.9-71.2-46.8000111.3L71 V85 S86L71-D89 WeakPolarHBondContact CD1-O 3.32Å; V85-D89 HydrophobicContact CG1-CB 4.41Å; S86-D89 WeakPolarHBondContact CA-OD2 3.41Å; S86-D89 WeakPolarHBondContact CB-OD2 3.21Å; S86-D89 PolarHBondContact N-OD2 3.36Å; S86-D89 PolarHBondContact O-N 3.36Å; S86-D89 PolarHBondContact OG-OD2 2.66Å
90Q84.7Confident87.9Confident159 Ų15980 Ų8074%0.74341%0.41SS*.  trans-109.2-13.7178.7-65.3-177.6-2.100112.9
91R84.9Confident87.9Confident212 Ų21276.9 Ų76.980%0.840%0.396SS*.SBendtrans-136.8141.1-175.5-66.9-176.4-174.8175.41.6110.6
92L85.6Confident87.9Confident54 Ų5481.2 Ų81.228%0.28342%0.423SS..  trans-73.4132.3176.1-168.372.6000109.3L71 Y82 V85 A96L71-L92 HydrophobicContact CD2-CB 4.35Å; L71-L92 HydrophobicContact CD2-CD1 4.36Å; Y82-L92 HydrophobicContact CD1-CD1 3.97Å; Y82-L92 HydrophobicContact CD2-CD1 3.43Å; Y82-L92 VanDerWaalsContact CD2-CD1 3.43Å; Y82-L92 HydrophobicContact CE1-CD1 4.34Å; Y82-L92 HydrophobicContact CE1-CD2 4.22Å; Y82-L92 HydrophobicContact CE2-CD1 3.84Å; Y82-L92 HydrophobicContact CE2-CD2 4.28Å; Y82-L92 HydrophobicContact CG-CD1 3.49Å; Y82-L92 VanDerWaalsContact CG-CD1 3.49Å; V85-L92 HydrophobicContact CG2-CD1 3.95Å; L92-A96 HydrophobicContact CD1-CB 3.71Å; L92-A96 HydrophobicContact CD2-CB 3.95Å; L92-A96 HydrophobicContact CG-CB 3.62Å
93P85.4Confident87.8Confident60 Ų6083.5 Ų83.539%0.3944%0.438SS..  trans-61.1144.6172.2-22.532.5000112.2V85 N95 A96V85-P93 HydrophobicContact CG2-CG 4.45Å; P93-N95 PolarHBondContact O-N 2.56Å; P93-A96 HydrophobicContact CB-CB 4.5Å; P93-A96 WeakPolarHBondContact O-CB 3.47Å; P93-A96 PolarHBondContact O-N 2.61Å
94D84.4Confident87.9Confident172 Ų17278.2 Ų78.292%0.9242%0.418SS*.THydrogen-bonded Turntrans-60.4-32.2-178.5-62.6-37.9000113.1
95N84.8Confident88.2Confident157 Ų15776.5 Ų76.584%0.8439%0.393SS*.THydrogen-bonded Turntrans-100.434.2175.4-74.1-19.6000112.5P93 T97P93-N95 PolarHBondContact O-N 2.56Å; N95-T97 PolarHBondContact O-N 3.12Å
96A85.5Confident88.3Confident27 Ų2778.7 Ų78.722%0.22340%0.401CS..  trans-64.9125.5178.600000111.3Y82 L92 P93Y82-A96 HydrophobicContact CD1-CB 3.74Å; Y82-A96 HydrophobicContact CE1-CB 4.31Å; Y82-A96 HydrophobicContact CG-CB 4.31Å; L92-A96 HydrophobicContact CD1-CB 3.71Å; L92-A96 HydrophobicContact CD2-CB 3.95Å; L92-A96 HydrophobicContact CG-CB 3.62Å; P93-A96 HydrophobicContact CB-CB 4.5Å; P93-A96 WeakPolarHBondContact O-CB 3.47Å; P93-A96 PolarHBondContact O-N 2.61Å
97T90.6Very high88.5Confident82 Ų8279.7 Ų79.750%0.50340%0.401SS..  trans-115.2147.8174.748.40000109.7Y82 K83 N95Y82-T97 CarbonylContact C-O 3.58Å; Y82-T97 WeakPolarHBondContact CA-O 3.4Å; K83-T97 WeakPolarHBondContact CB-O 3.31Å; K83-T97 PolarHBondContact N-O 3.32Å; N95-T97 PolarHBondContact O-N 3.12Å
98L90.6Very high88.8Confident76 Ų7679 Ų7940%0.39840%0.399SS..EExtended strand (participates in β ladder)trans-77.1143175-69.1170.3000110.4D73 Y82D73-L98 HydrophobicContact CB-CD2 4.01Å; Y82-L98 HydrophobicContact CD1-CD2 3.82Å; Y82-L98 HydrophobicContact CD1-CG 4.36Å; Y82-L98 HydrophobicContact CE1-CD2 3.77Å; Y82-L98 HydrophobicContact CE1-CG 4.2Å; Y82-L98 HydrophobicContact CG-CD2 4.26Å
99Q91.2Very high88.8Confident41 Ų4175 Ų7519%0.19240%0.395CS..EExtended strand (participates in β ladder)trans-139.6158.1171.763.1174.611.800110.3Q80 R81 K83Q80-Q99 WeakPolarHBondContact CA-O 3.2Å; R81-Q99 HydrophobicContact CG-CG 4.37Å; R81-Q99 PolarHBondContact N-O 2.77Å; R81-Q99 WeakPolarHBondContact O-CG 3.47Å; R81-Q99 PolarHBondContact O-N 2.99Å; R81-Q99 VanDerWaalsContact O-O 3.11Å; K83-Q99 HydrophobicContact CB-CB 4.43Å; K83-Q99 HydrophobicContact CB-CG 3.95Å
100S91.9Very high88.7Confident51 Ų5176.7 Ų76.736%0.35741%0.408SS..EExtended strand (participates in β ladder)trans-63.3159.5171.8-53.70000111.5V102S100-V102 VanDerWaalsContact C-N 3.34Å; S100-V102 PolarHBondContact O-N 3.45Å
101C91.4Very high88.5Confident12 Ų1272.3 Ų72.38%0.08140%0.395CS..  trans-65.986177.2-49.60000112.1C50 C79 Y105C50-C101 WeakPolarHBondContact CA-SG 3.08Å; C50-C101 HydrophobicContact CB-CB 3.67Å; C50-C101 WeakPolarHBondContact CB-SG 3.47Å; C50-C101 VanDerWaalsContact SG-CA 3.58Å; C50-C101 WeakPolarHBondContact SG-CB 3.49Å; C50-C101 CovalentContact SG-SG 2.02Å; C50-C101 PolarHBondContact SG-SG 3.23Å; C79-C101 VanDerWaalsContact C-SG 3.55Å; C79-C101 PolarHBondContact O-N 2.81Å; C79-C101 PolarHBondContact O-SG 2.96Å; C101-Y105 HydrophobicContact CB-CD1 4.17Å; C101-Y105 HydrophobicContact CB-CE1 3.66Å; C101-Y105 HydrophobicContact CB-CE2 4.46Å; C101-Y105 WeakPolarHBondContact SG-CE1 3.37Å
102V90.1Very high88.7Confident98 Ų9862.4 Ų62.459%0.59436%0.358SS*.THydrogen-bonded Turntrans-70.6-30.2-177.8-66.20000114S100 G104S100-V102 VanDerWaalsContact C-N 3.34Å; S100-V102 PolarHBondContact O-N 3.45Å; V102-G104 VanDerWaalsContact C-N 3.33Å
103D89.9Confident89Confident80 Ų8062.5 Ų62.543%0.42837%0.366SS..THydrogen-bonded Turntrans-92.28.1-177.5-53.4-68.3000113I51 R81I51-D103 HydrophobicContact CB-CB 4.22Å; I51-D103 WeakPolarHBondContact CD1-O 3.39Å; I51-D103 HydrophobicContact CG2-CB 4.18Å; R81-D103 IonicContact CZ-OD2 3.54Å; R81-D103 IonicContact NE-OD2 3.78Å; R81-D103 IonicContact NH2-OD2 2.64Å; R81-D103 PolarHBondContact NH2-OD2 2.68Å
104G91.9Very high89.4Confident12 Ų1264 Ų6412%0.12436%0.364CS..  trans88.9-161.9-177.100000114.2I51 V102I51-G104 PolarHBondContact N-O 3.01Å; V102-G104 VanDerWaalsContact C-N 3.33Å
105Y93.5Very high89.9Confident27 Ų2755.8 Ų55.811%0.10632%0.32CS..EExtended strand (participates in β ladder)trans-125.6146.9-167.5-58.6-88.2000113.4H48 R49 I51 C101 W107 D121 V123 C124H48-Y105 HydrophobicContact CB-CD1 4.47Å; H48-Y105 AromaticContact CD2-CD1 3.79Å; R49-Y105 CarbonylContact O-C 3.57Å; R49-Y105 VanDerWaalsContact O-CA 3.3Å; R49-Y105 WeakPolarHBondContact O-CA 3.14Å; I51-Y105 WeakPolarHBondContact CD1-O 3.43Å; C101-Y105 HydrophobicContact CB-CD1 4.17Å; C101-Y105 HydrophobicContact CB-CE1 3.66Å; C101-Y105 HydrophobicContact CB-CE2 4.46Å; C101-Y105 WeakPolarHBondContact SG-CE1 3.37Å; Y105-W107 HydrophobicContact CD2-CZ2 4.23Å; Y105-W107 HydrophobicContact CG-CH2 4.46Å; Y105-W107 HydrophobicContact CG-CZ2 4.13Å; Y105-D121 HydrophobicContact CD2-CB 3.86Å; Y105-D121 HydrophobicContact CE2-CB 3.94Å; Y105-V123 HydrophobicContact CD1-CG2 4.04Å; Y105-V123 HydrophobicContact CD2-CG2 4.01Å; Y105-V123 HydrophobicContact CE1-CG2 3.66Å; Y105-V123 HydrophobicContact CE2-CG2 3.67Å; Y105-V123 HydrophobicContact CG-CG2 4.2Å; Y105-V123 VanDerWaalsContact CZ-CG2 3.48Å; Y105-C124 PolarHBondContact OH-SG 3.35Å; Y105-C124 VanDerWaalsContact OH-SG 3.38Å
106R91.7Very high90.4Very high46 Ų4648.3 Ų48.317%0.17428%0.28CS..EExtended strand (participates in β ladder)trans-99.9129.8163.3-68.6-59.2-175.8-133.2-0.5109.4H48 R49 I51 E55 N56H48-R106 CarbonylContact C-O 3.59Å; H48-R106 WeakPolarHBondContact CA-O 3.4Å; R49-R106 HydrophobicContact CG-CB 4.01Å; R49-R106 PolarHBondContact N-O 3.4Å; R49-R106 PolarHBondContact O-N 2.82Å; I51-R106 VanDerWaalsContact CD1-NH1 3.31Å; I51-R106 HydrophobicContact CG1-CG 3.7Å; E55-R106 WeakPolarHBondContact OE1-CG 3.19Å; E55-R106 IonicContact OE1-NE 2.82Å; E55-R106 PolarHBondContact OE1-NE 3.01Å; N56-R106 PolarHBondContact O-NH2 3.03Å
107W92.3Very high90.9Very high48 Ų4847 Ų4718%0.18227%0.269CS..EExtended strand (participates in β ladder)trans-105.8145.3-175.3-53.899.4000111.1L46 Q47 H48 Y105 P109 V117 T118 D121 V123L46-W107 HydrophobicContact CB-CE3 4.07Å; Q47-W107 CarbonylContact O-C 3.58Å; Q47-W107 WeakPolarHBondContact O-CA 3.36Å; H48-W107 HydrophobicContact CB-CD2 4.22Å; H48-W107 HydrophobicContact CB-CE3 3.5Å; H48-W107 HydrophobicContact CB-CH2 4.21Å; H48-W107 HydrophobicContact CB-CZ3 3.5Å; H48-W107 AromaticContact CG-CZ3 3.75Å; H48-W107 AromaticContact ND1-CZ3 3.8Å; Y105-W107 HydrophobicContact CD2-CZ2 4.23Å; Y105-W107 HydrophobicContact CG-CH2 4.46Å; Y105-W107 HydrophobicContact CG-CZ2 4.13Å; W107-P109 WeakPolarHBondContact O-CD 3.47Å; W107-V117 HydrophobicContact CH2-CG1 4.09Å; W107-V117 HydrophobicContact CZ3-CG1 4.32Å; W107-T118 HydrophobicContact CB-CG2 4.35Å; W107-T118 HydrophobicContact CD2-CG2 3.47Å; W107-T118 VanDerWaalsContact CD2-CG2 3.47Å; W107-T118 HydrophobicContact CE3-CG2 3.66Å; W107-T118 HydrophobicContact CG-CG2 3.77Å; W107-T118 HydrophobicContact CZ2-CG2 4.37Å; W107-T118 HydrophobicContact CZ3-CG2 4.19Å; W107-D121 WeakPolarHBondContact CZ2-OD1 3.29Å; W107-V123 HydrophobicContact CH2-CB 4.39Å; W107-V123 HydrophobicContact CH2-CG1 3.61Å; W107-V123 HydrophobicContact CH2-CG2 3.84Å; W107-V123 HydrophobicContact CZ3-CG1 3.88Å
108N91.7Very high91.1Very high13 Ų1344.1 Ų44.17%0.0725%0.252CS..  trans-92108.5169.1-164.82.3000109.9Q47 F61 T110Q47-N108 HydrophobicContact CB-CB 3.93Å; Q47-N108 PolarHBondContact O-N 3.48Å; Q47-N108 PolarHBondContact OE1-ND2 3.27Å; Q47-N108 VanDerWaalsContact OE1-ND2 3.13Å; F61-N108 HydrophobicContact CB-CB 4.12Å; F61-N108 HydrophobicContact CD1-CB 3.74Å; F61-N108 HydrophobicContact CD2-CB 3.88Å; F61-N108 HydrophobicContact CE1-CB 4.1Å; F61-N108 HydrophobicContact CE2-CB 4.23Å; F61-N108 HydrophobicContact CG-CB 3.62Å; F61-N108 HydrophobicContact CZ-CB 4.33Å; N108-T110 VanDerWaalsContact C-N 3.25Å; N108-T110 PolarHBondContact O-N 3.07Å
109P86.3Confident91.2Very high89 Ų8944.2 Ų44.258%0.57825%0.25SS*.  trans-82.564.7-175.735.4-36.2000111.5W107W107-P109 WeakPolarHBondContact O-CD 3.47Å
110T83.8Confident91.4Very high94 Ų9443.8 Ų43.858%0.57725%0.247SC*.SBendtrans-84.3-53.2-179.349.70000112.7N108N108-T110 VanDerWaalsContact C-N 3.25Å; N108-T110 PolarHBondContact O-N 3.07Å
111S81.8Confident91.6Very high68 Ų6844 Ų4448%0.47624%0.244SC..SBendtrans-97.7-34.4-175.2-54.40000113
112F89Confident91.8Very high4 Ų443.4 Ų43.42%0.01824%0.24CC..  trans-137.7143.1-178.6-68.3-78.5000109.4F41 E44 L46 T115 D241F41-F112 HydrophobicContact CB-CZ 4.19Å; F41-F112 HydrophobicContact CD1-CE2 4.38Å; F41-F112 AromaticContact CD1-CZ 3.75Å; F41-F112 HydrophobicContact CD1-CZ 3.75Å; F41-F112 HydrophobicContact CG-CZ 4.43Å; E44-F112 HydrophobicContact CB-CD2 4.11Å; E44-F112 HydrophobicContact CB-CE2 4.13Å; E44-F112 HydrophobicContact CG-CD2 4.04Å; E44-F112 HydrophobicContact CG-CE2 4.07Å; L46-F112 VanDerWaalsContact CD1-O 3.3Å; L46-F112 WeakPolarHBondContact CD1-O 3.23Å; L46-F112 HydrophobicContact CD2-CB 4.36Å; F112-T115 HydrophobicContact CB-CG2 3.62Å; F112-T115 HydrophobicContact CD2-CG2 4.2Å; F112-T115 HydrophobicContact CG-CG2 3.96Å; F112-D241 CarbonylContact C-O 3.56Å; F112-D241 WeakPolarHBondContact CA-O 3.4Å; F112-D241 WeakPolarHBondContact CB-O 3.39Å
113A91.3Very high92Very high56 Ų5638.8 Ų38.846%0.46321%0.212SC..SBendtrans-76.7-33.317200000111.3D241 R242A113-D241 HydrophobicContact CB-CB 4.1Å; A113-D241 WeakPolarHBondContact CB-OD2 3.23Å; A113-D241 PolarHBondContact N-O 3.48Å; A113-R242 HydrophobicContact CB-CG 4.32Å
114R93.3Very high92.1Very high90 Ų9035.9 Ų35.934%0.3420%0.198SC..BIsolated β-bridgetrans-154.8127.3-179.9-172.6-175.8-70.6-144.77.6111.8E119 D241 R242 Y243R114-E119 WeakPolarHBondContact CD-OE2 3.5Å; R114-E119 IonicContact CZ-OE2 3.6Å; R114-E119 IonicContact NE-OE2 3.17Å; R114-E119 IonicContact NH1-OE1 3.79Å; R114-E119 IonicContact NH1-OE2 2.61Å; R114-E119 PolarHBondContact NH1-OE2 3.45Å; R114-D241 PolarHBondContact N-O 2.87Å; R114-R242 HydrophobicContact CB-CB 4.45Å; R114-R242 HydrophobicContact CB-CG 4.12Å; R114-R242 WeakPolarHBondContact O-CA 3.47Å; R114-Y243 HydrophobicContact CG-CD1 4.16Å; R114-Y243 HydrophobicContact CG-CE1 4.13Å; R114-Y243 PolarHBondContact O-N 3.45Å
115T95.5Very high92.1Very high0 Ų041.3 Ų41.30%022%0.224CC..  trans-118.2166.7172.1750000110.4T42 E44 L46 F112 V117 T118 E119T42-T115 WeakPolarHBondContact O-CB 3.43Å; E44-T115 HydrophobicContact CB-CG2 4.29Å; E44-T115 PolarHBondContact O-OG1 3.48Å; L46-T115 HydrophobicContact CG-CG2 4.45Å; F112-T115 HydrophobicContact CB-CG2 3.62Å; F112-T115 HydrophobicContact CD2-CG2 4.2Å; F112-T115 HydrophobicContact CG-CG2 3.96Å; T115-V117 PolarHBondContact O-N 3.29Å; T115-V117 WeakPolarHBondContact OG1-CB 2.95Å; T115-V117 PolarHBondContact OG1-N 3.48Å; T115-T118 PolarHBondContact N-OG1 3.46Å; T115-T118 PolarHBondContact O-N 2.95Å; T115-T118 PolarHBondContact O-OG1 3.27Å; T115-T118 PolarHBondContact OG1-N 3.39Å; T115-E119 WeakPolarHBondContact O-CB 3.43Å; T115-E119 PolarHBondContact O-N 2.79Å
116A95.4Very high92.1Very high0 Ų044.9 Ų44.90%024%0.24CC..Hα-helixtrans-58.8-29.9170.300000111.9W39 T42 W120W39-A116 HydrophobicContact CH2-CB 3.92Å; W39-A116 HydrophobicContact CZ3-CB 4.03Å; T42-A116 HydrophobicContact CG2-CB 3.68Å; T42-A116 VanDerWaalsContact O-CB 3.24Å; T42-A116 WeakPolarHBondContact O-CB 3.24Å; T42-A116 PolarHBondContact O-N 3.15Å; A116-W120 HydrophobicContact CB-CE3 3.83Å; A116-W120 HydrophobicContact CB-CH2 4.46Å; A116-W120 HydrophobicContact CB-CZ3 3.44Å; A116-W120 VanDerWaalsContact CB-CZ3 3.44Å; A116-W120 PolarHBondContact O-N 2.81Å
117V95.1Very high92.2Very high0 Ų044.6 Ų44.60%024%0.24CC..Hα-helixtrans-68-44.2176.7176.20000110.6S43 V45 W107 T115 D121 L122 V123 R130S43-V117 WeakPolarHBondContact O-CG2 3.48Å; V45-V117 HydrophobicContact CG2-CG1 4.28Å; V45-V117 HydrophobicContact CG2-CG2 4.37Å; W107-V117 HydrophobicContact CH2-CG1 4.09Å; W107-V117 HydrophobicContact CZ3-CG1 4.32Å; T115-V117 PolarHBondContact O-N 3.29Å; T115-V117 WeakPolarHBondContact OG1-CB 2.95Å; T115-V117 PolarHBondContact OG1-N 3.48Å; V117-D121 VanDerWaalsContact O-CA 3.27Å; V117-D121 WeakPolarHBondContact O-CA 3.29Å; V117-D121 PolarHBondContact O-N 3.4Å; V117-L122 HydrophobicContact CB-CB 4.5Å; V117-L122 HydrophobicContact CG1-CB 4.33Å; V117-L122 HydrophobicContact CG2-CB 4.38Å; V117-L122 PolarHBondContact O-N 3.38Å; V117-V123 HydrophobicContact CG1-CG1 3.52Å; V117-R130 HydrophobicContact CG2-CG 3.95Å
118T94.7Very high92.4Very high21 Ų2147.4 Ų47.413%0.12925%0.251CS..Hα-helixtrans-73.6-28.8178.863.20000113.3L46 W107 T115L46-T118 HydrophobicContact CB-CG2 4.44Å; L46-T118 HydrophobicContact CD1-CG2 3.79Å; L46-T118 HydrophobicContact CG-CG2 4.16Å; W107-T118 HydrophobicContact CB-CG2 4.35Å; W107-T118 HydrophobicContact CD2-CG2 3.47Å; W107-T118 VanDerWaalsContact CD2-CG2 3.47Å; W107-T118 HydrophobicContact CE3-CG2 3.66Å; W107-T118 HydrophobicContact CG-CG2 3.77Å; W107-T118 HydrophobicContact CZ2-CG2 4.37Å; W107-T118 HydrophobicContact CZ3-CG2 4.19Å; T115-T118 PolarHBondContact N-OG1 3.46Å; T115-T118 PolarHBondContact O-N 2.95Å; T115-T118 PolarHBondContact O-OG1 3.27Å; T115-T118 PolarHBondContact OG1-N 3.39Å
119E94.4Very high92.6Very high79 Ų7946.9 Ų46.937%0.36925%0.248SC..Hα-helixtrans-71.4-35.3179.5-171.569.6-16500112.2R114 T115 Y243R114-E119 WeakPolarHBondContact CD-OE2 3.5Å; R114-E119 IonicContact CZ-OE2 3.6Å; R114-E119 IonicContact NE-OE2 3.17Å; R114-E119 IonicContact NH1-OE1 3.79Å; R114-E119 IonicContact NH1-OE2 2.61Å; R114-E119 PolarHBondContact NH1-OE2 3.45Å; T115-E119 WeakPolarHBondContact O-CB 3.43Å; T115-E119 PolarHBondContact O-N 2.79Å; E119-Y243 HydrophobicContact CB-CE1 4.19Å; E119-Y243 HydrophobicContact CG-CE1 4.49Å
120W95.4Very high93.1Very high32 Ų3243.2 Ų43.212%0.12122%0.222CC..Hα-helixtrans-121.615.4-174-57.2-55000114.4A116 L122 A178 P179 W181 V184 Y243A116-W120 HydrophobicContact CB-CE3 3.83Å; A116-W120 HydrophobicContact CB-CH2 4.46Å; A116-W120 HydrophobicContact CB-CZ3 3.44Å; A116-W120 VanDerWaalsContact CB-CZ3 3.44Å; A116-W120 PolarHBondContact O-N 2.81Å; W120-L122 HydrophobicContact CB-CD1 4.37Å; W120-L122 HydrophobicContact CB-CD2 3.94Å; W120-L122 HydrophobicContact CB-CG 3.92Å; W120-L122 HydrophobicContact CE3-CD1 4.26Å; W120-L122 WeakPolarHBondContact O-CD2 3.48Å; W120-L122 PolarHBondContact O-N 3.18Å; W120-A178 WeakPolarHBondContact CZ2-O 3.15Å; W120-P179 PolarHBondContact NE1-O 3.23Å; W120-W181 HydrophobicContact CD2-CB 3.97Å; W120-W181 HydrophobicContact CE3-CB 3.71Å; W120-W181 HydrophobicContact CG-CB 4.35Å; W120-W181 HydrophobicContact CZ3-CB 4.27Å; W120-V184 HydrophobicContact CH2-CG2 3.57Å; W120-V184 HydrophobicContact CZ2-CG2 4.39Å; W120-V184 HydrophobicContact CZ3-CG2 3.98Å; W120-Y243 HydrophobicContact CH2-CE2 4.23Å; W120-Y243 AromaticContact CH2-CZ 3.96Å; W120-Y243 VanDerWaalsContact CH2-OH 3.26Å; W120-Y243 WeakPolarHBondContact CH2-OH 3.29Å; W120-Y243 WeakPolarHBondContact CZ2-OH 3.45Å
121D95Very high93.8Very high54 Ų5438.8 Ų38.829%0.28920%0.195SC..THydrogen-bonded Turntrans48.751.6-179.3-64.5-37.3000113.1Y105 W107 V117 V123Y105-D121 HydrophobicContact CD2-CB 3.86Å; Y105-D121 HydrophobicContact CE2-CB 3.94Å; W107-D121 WeakPolarHBondContact CZ2-OD1 3.29Å; V117-D121 VanDerWaalsContact O-CA 3.27Å; V117-D121 WeakPolarHBondContact O-CA 3.29Å; V117-D121 PolarHBondContact O-N 3.4Å; D121-V123 PolarHBondContact O-N 2.63Å
122L95.5Very high94.6Very high0 Ų038.8 Ų38.80%019%0.187CC..  trans-85.643.6-174.2-54.1179.8000113.5V117 W120 V129 R130 W181V117-L122 HydrophobicContact CB-CB 4.5Å; V117-L122 HydrophobicContact CG1-CB 4.33Å; V117-L122 HydrophobicContact CG2-CB 4.38Å; V117-L122 PolarHBondContact O-N 3.38Å; W120-L122 HydrophobicContact CB-CD1 4.37Å; W120-L122 HydrophobicContact CB-CD2 3.94Å; W120-L122 HydrophobicContact CB-CG 3.92Å; W120-L122 HydrophobicContact CE3-CD1 4.26Å; W120-L122 WeakPolarHBondContact O-CD2 3.48Å; W120-L122 PolarHBondContact O-N 3.18Å; L122-V129 HydrophobicContact CD1-CB 4.49Å; L122-V129 HydrophobicContact CD1-CG1 3.94Å; L122-V129 HydrophobicContact CD2-CB 4.11Å; L122-V129 HydrophobicContact CD2-CG1 3.92Å; L122-V129 HydrophobicContact CD2-CG2 4.33Å; L122-V129 HydrophobicContact CG-CG1 4.49Å; L122-R130 HydrophobicContact CB-CG 4.5Å; L122-W181 HydrophobicContact CD1-CB 4.28Å; L122-W181 HydrophobicContact CD2-CG 4.15Å
123V94Very high95Very high2 Ų238.6 Ų38.61%0.01219%0.186CC..SBendtrans-113.6175.4178.1-68.40000111.2V45 Y105 W107 V117 D121 D125 K126V45-V123 HydrophobicContact CG1-CG1 4.12Å; Y105-V123 HydrophobicContact CD1-CG2 4.04Å; Y105-V123 HydrophobicContact CD2-CG2 4.01Å; Y105-V123 HydrophobicContact CE1-CG2 3.66Å; Y105-V123 HydrophobicContact CE2-CG2 3.67Å; Y105-V123 HydrophobicContact CG-CG2 4.2Å; Y105-V123 VanDerWaalsContact CZ-CG2 3.48Å; W107-V123 HydrophobicContact CH2-CB 4.39Å; W107-V123 HydrophobicContact CH2-CG1 3.61Å; W107-V123 HydrophobicContact CH2-CG2 3.84Å; W107-V123 HydrophobicContact CZ3-CG1 3.88Å; V117-V123 HydrophobicContact CG1-CG1 3.52Å; D121-V123 PolarHBondContact O-N 2.63Å; V123-D125 PolarHBondContact O-N 3.09Å; V123-K126 PolarHBondContact O-N 3.35Å
124C92.7Very high95.3Very high19 Ų1935.9 Ų35.913%0.12816%0.164CC..G310 helixtrans54.2-119.9174-47.70000111.6C79 Y105 K126 K127C79-C124 WeakPolarHBondContact CA-SG 3.43Å; C79-C124 HydrophobicContact CB-CB 3.7Å; C79-C124 WeakPolarHBondContact CB-SG 3.33Å; C79-C124 VanDerWaalsContact SG-CA 3.59Å; C79-C124 WeakPolarHBondContact SG-CB 3.39Å; C79-C124 CovalentContact SG-SG 2.02Å; C79-C124 PolarHBondContact SG-SG 3.43Å; Y105-C124 PolarHBondContact OH-SG 3.35Å; Y105-C124 VanDerWaalsContact OH-SG 3.38Å; C124-K126 PolarHBondContact O-N 3.48Å; C124-K127 WeakPolarHBondContact O-CB 3.38Å; C124-K127 WeakPolarHBondContact O-CG 3.29Å; C124-K127 PolarHBondContact O-N 2.93Å
125D91.7Very high95.5Very high125 Ų12531.8 Ų31.867%0.66815%0.149SC*.G310 helixtrans-58.8-21.9179.2-61.5-31.4000113.7V123 W128V123-D125 PolarHBondContact O-N 3.09Å; D125-W128 PolarHBondContact O-NE1 3.14Å
126K93.9Very high95.7Very high103 Ų10332.1 Ų32.145%0.44815%0.151SC..G310 helixtrans-101.33.7179.7-67178.5-178.2170.10113.9V123 C124 W128 V129V123-K126 PolarHBondContact O-N 3.35Å; C124-K126 PolarHBondContact O-N 3.48Å; K126-W128 PolarHBondContact O-N 3.35Å; K126-W128 VanDerWaalsContact O-N 3.09Å; K126-V129 HydrophobicContact CB-CG2 4.38Å; K126-V129 VanDerWaalsContact O-CB 3.29Å; K126-V129 WeakPolarHBondContact O-CB 3.17Å; K126-V129 VanDerWaalsContact O-CG2 3.29Å; K126-V129 WeakPolarHBondContact O-CG2 3.43Å; K126-V129 PolarHBondContact O-N 2.98Å
127K93.8Very high95.8Very high39 Ų3932.1 Ų32.117%0.1715%0.151CC..THydrogen-bonded Turntrans-57.7-29.9-177.971.4178.7177.3178.80113.7C124 V129 R130 D477C124-K127 WeakPolarHBondContact O-CB 3.38Å; C124-K127 WeakPolarHBondContact O-CG 3.29Å; C124-K127 PolarHBondContact O-N 2.93Å; K127-V129 PolarHBondContact O-N 3.12Å; K127-R130 PolarHBondContact O-N 2.95Å; K127-D477 IonicContact NZ-OD1 3.96Å; K127-D477 PolarHBondContact NZ-OD1 3.34Å; K127-D477 IonicContact NZ-OD2 2.97Å; K127-D477 PolarHBondContact NZ-OD2 2.93Å
128W95.3Very high95.9Very high108 Ų10832.1 Ų32.141%0.40915%0.151SC..Hα-helixtrans-59.8-2617769.2-94.1000113.2D125 K126 R130 S131 F132 W181D125-W128 PolarHBondContact O-NE1 3.14Å; K126-W128 PolarHBondContact O-N 3.35Å; K126-W128 VanDerWaalsContact O-N 3.09Å; W128-R130 PolarHBondContact O-N 3.11Å; W128-S131 PolarHBondContact O-N 3.21Å; W128-S131 VanDerWaalsContact O-N 3.17Å; W128-F132 HydrophobicContact CE3-CB 3.81Å; W128-F132 HydrophobicContact CE3-CG 4.34Å; W128-F132 HydrophobicContact CZ3-CB 3.78Å; W128-F132 HydrophobicContact CZ3-CD1 4.19Å; W128-F132 HydrophobicContact CZ3-CD2 4.28Å; W128-F132 AromaticContact CZ3-CG 3.83Å; W128-F132 HydrophobicContact CZ3-CG 3.83Å; W128-F132 PolarHBondContact O-N 2.8Å; W128-W181 HydrophobicContact CH2-CH2 4.31Å
129V97.6Very high96Very high1 Ų134.2 Ų34.21%0.00616%0.16CC..Hα-helixtrans-60.6-36.4-178.7177.10000110.8L122 K126 K127 S131 F132 V133 W181L122-V129 HydrophobicContact CD1-CB 4.49Å; L122-V129 HydrophobicContact CD1-CG1 3.94Å; L122-V129 HydrophobicContact CD2-CB 4.11Å; L122-V129 HydrophobicContact CD2-CG1 3.92Å; L122-V129 HydrophobicContact CD2-CG2 4.33Å; L122-V129 HydrophobicContact CG-CG1 4.49Å; K126-V129 HydrophobicContact CB-CG2 4.38Å; K126-V129 VanDerWaalsContact O-CB 3.29Å; K126-V129 WeakPolarHBondContact O-CB 3.17Å; K126-V129 VanDerWaalsContact O-CG2 3.29Å; K126-V129 WeakPolarHBondContact O-CG2 3.43Å; K126-V129 PolarHBondContact O-N 2.98Å; K127-V129 PolarHBondContact O-N 3.12Å; V129-S131 PolarHBondContact O-N 3.41Å; V129-F132 PolarHBondContact O-N 3.17Å; V129-V133 HydrophobicContact CG1-CG2 4.02Å; V129-V133 VanDerWaalsContact O-CG2 3.3Å; V129-V133 WeakPolarHBondContact O-CG2 3.3Å; V129-V133 PolarHBondContact O-N 3.35Å; V129-W181 HydrophobicContact CG1-CD2 3.52Å; V129-W181 HydrophobicContact CG1-CE3 3.47Å; V129-W181 VanDerWaalsContact CG1-CE3 3.47Å; V129-W181 HydrophobicContact CG1-CG 4.02Å; V129-W181 HydrophobicContact CG1-CH2 4.4Å; V129-W181 HydrophobicContact CG1-CZ2 4.45Å; V129-W181 HydrophobicContact CG1-CZ3 3.93Å; V129-W181 HydrophobicContact CG2-CZ2 4.33Å
130R96.8Very high96.2Very high13 Ų1330.5 Ų30.55%0.04914%0.143CC..Hα-helixtrans-58.9-47.7177-63.316860.9-141.82.5111.4W39 S43 V117 L122 K127 W128 Q134 L472 E476W39-R130 PolarHBondContact NE1-O 3.49Å; S43-R130 PolarHBondContact O-NE 3.21Å; S43-R130 PolarHBondContact O-NH2 3.19Å; S43-R130 VanDerWaalsContact O-NH2 3.14Å; V117-R130 HydrophobicContact CG2-CG 3.95Å; L122-R130 HydrophobicContact CB-CG 4.5Å; K127-R130 PolarHBondContact O-N 2.95Å; W128-R130 PolarHBondContact O-N 3.11Å; R130-Q134 PolarHBondContact O-N 2.84Å; R130-L472 PolarHBondContact NH1-O 3.12Å; R130-E476 IonicContact NH1-OE2 2.68Å; R130-E476 PolarHBondContact NH1-OE2 3.17Å
131S97.3Very high96.2Very high0 Ų029.4 Ų29.40%014%0.139CC..Hα-helixtrans-66.2-39177-66.40000112W128 V129 Q134 S135 S468 L472 W473W128-S131 PolarHBondContact O-N 3.21Å; W128-S131 VanDerWaalsContact O-N 3.17Å; V129-S131 PolarHBondContact O-N 3.41Å; S131-Q134 PolarHBondContact O-N 3.46Å; S131-S135 WeakPolarHBondContact O-CB 3.19Å; S131-S135 PolarHBondContact O-N 3.4Å; S131-S135 PolarHBondContact O-OG 3.42Å; S131-S468 PolarHBondContact OG-O 3.45Å; S131-L472 WeakPolarHBondContact OG-CB 3.41Å; S131-W473 VanDerWaalsContact OG-CB 3.26Å; S131-W473 WeakPolarHBondContact OG-CB 3.46Å; S131-W473 PolarHBondContact OG-N 3.49Å
132F98.2Very high96.1Very high68 Ų6829.8 Ų29.830%0.29814%0.139SC..Hα-helixtrans-64.6-47.7177.9-179.2-101.5000112.3W128 V129 Q134 S135 V136 W181W128-F132 HydrophobicContact CE3-CB 3.81Å; W128-F132 HydrophobicContact CE3-CG 4.34Å; W128-F132 HydrophobicContact CZ3-CB 3.78Å; W128-F132 HydrophobicContact CZ3-CD1 4.19Å; W128-F132 HydrophobicContact CZ3-CD2 4.28Å; W128-F132 AromaticContact CZ3-CG 3.83Å; W128-F132 HydrophobicContact CZ3-CG 3.83Å; W128-F132 PolarHBondContact O-N 2.8Å; V129-F132 PolarHBondContact O-N 3.17Å; F132-Q134 VanDerWaalsContact C-N 3.25Å; F132-Q134 PolarHBondContact O-N 3.09Å; F132-S135 PolarHBondContact O-N 2.86Å; F132-S135 VanDerWaalsContact O-N 3.12Å; F132-S135 PolarHBondContact O-OG 2.83Å; F132-V136 HydrophobicContact CD1-CG1 4.31Å; F132-V136 HydrophobicContact CD2-CG1 4.34Å; F132-V136 HydrophobicContact CE1-CG1 3.88Å; F132-V136 HydrophobicContact CE2-CG1 3.92Å; F132-V136 HydrophobicContact CZ-CG1 3.67Å; F132-V136 WeakPolarHBondContact O-CG1 3.42Å; F132-V136 PolarHBondContact O-N 3.46Å; F132-W181 HydrophobicContact CD1-CZ3 4.27Å; F132-W181 HydrophobicContact CE1-CZ3 4.41Å
133V98.2Very high96Very high0 Ų034.9 Ų34.90%016%0.161CC..Hα-helixtrans-62.1-34.9179174.70000111.6W39 V129 V136 W181 V184 A185 R188W39-V133 HydrophobicContact CD2-CG1 4.04Å; W39-V133 HydrophobicContact CE3-CG1 4.18Å; W39-V133 HydrophobicContact CH2-CB 4.01Å; W39-V133 HydrophobicContact CH2-CG1 3.53Å; W39-V133 HydrophobicContact CH2-CG2 4.28Å; W39-V133 HydrophobicContact CZ2-CB 3.41Å; W39-V133 VanDerWaalsContact CZ2-CB 3.41Å; W39-V133 HydrophobicContact CZ2-CG1 3.36Å; W39-V133 HydrophobicContact CZ2-CG2 3.93Å; W39-V133 HydrophobicContact CZ3-CG1 3.92Å; V129-V133 HydrophobicContact CG1-CG2 4.02Å; V129-V133 VanDerWaalsContact O-CG2 3.3Å; V129-V133 WeakPolarHBondContact O-CG2 3.3Å; V129-V133 PolarHBondContact O-N 3.35Å; V133-V136 WeakPolarHBondContact O-CG2 3.38Å; V133-W181 HydrophobicContact CG2-CE3 4.24Å; V133-V184 HydrophobicContact CG1-CG1 4.15Å; V133-A185 HydrophobicContact CG2-CB 4.09Å; V133-R188 HydrophobicContact CG1-CG 3.86Å
134Q97.8Very high96Very high0 Ų034.8 Ų34.80%016%0.161CC..Hα-helixtrans-73.1-39.4173.5-169.658.916.800112.5V36 W39 R130 S131 F132 V136 Y137 Y138 R188 I353 S468 L472V36-Q134 PolarHBondContact O-NE2 2.85Å; W39-Q134 HydrophobicContact CG-CB 4.47Å; W39-Q134 VanDerWaalsContact CG-OE1 3.28Å; R130-Q134 PolarHBondContact O-N 2.84Å; S131-Q134 PolarHBondContact O-N 3.46Å; F132-Q134 VanDerWaalsContact C-N 3.25Å; F132-Q134 PolarHBondContact O-N 3.09Å; Q134-V136 PolarHBondContact O-N 3.24Å; Q134-Y137 VanDerWaalsContact O-CB 3.3Å; Q134-Y137 WeakPolarHBondContact O-CB 3.4Å; Q134-Y137 PolarHBondContact O-N 3.23Å; Q134-Y138 HydrophobicContact CG-CE2 4.11Å; Q134-Y138 WeakPolarHBondContact O-CD2 3.4Å; Q134-R188 VanDerWaalsContact OE1-NH1 3.12Å; Q134-I353 HydrophobicContact CG-CD1 3.9Å; Q134-I353 HydrophobicContact CG-CG1 4.47Å; Q134-S468 WeakPolarHBondContact CG-OG 3.42Å; Q134-L472 HydrophobicContact CB-CD1 3.89Å; Q134-L472 HydrophobicContact CG-CD1 4.29Å
135S97.9Very high95.9Very high4 Ų435.2 Ų35.23%0.02816%0.164CC..Hα-helixtrans-67.3-36.7-178.674.30000112.3S131 F132 Y137 Y138 I139S131-S135 WeakPolarHBondContact O-CB 3.19Å; S131-S135 PolarHBondContact O-N 3.4Å; S131-S135 PolarHBondContact O-OG 3.42Å; F132-S135 PolarHBondContact O-N 2.86Å; F132-S135 VanDerWaalsContact O-N 3.12Å; F132-S135 PolarHBondContact O-OG 2.83Å; S135-Y137 VanDerWaalsContact C-N 3.25Å; S135-Y137 PolarHBondContact O-N 2.87Å; S135-Y138 WeakPolarHBondContact O-CB 3.48Å; S135-Y138 PolarHBondContact O-N 3.03Å; S135-I139 PolarHBondContact O-N 2.86Å
136V98.2Very high95.8Very high7 Ų734.5 Ų34.54%0.04215%0.152CC..Hα-helixtrans-66.4-25.6177.4-61.40000113F132 V133 Q134 Y138 I139 G140 A185 R188 I189F132-V136 HydrophobicContact CD1-CG1 4.31Å; F132-V136 HydrophobicContact CD2-CG1 4.34Å; F132-V136 HydrophobicContact CE1-CG1 3.88Å; F132-V136 HydrophobicContact CE2-CG1 3.92Å; F132-V136 HydrophobicContact CZ-CG1 3.67Å; F132-V136 WeakPolarHBondContact O-CG1 3.42Å; F132-V136 PolarHBondContact O-N 3.46Å; V133-V136 WeakPolarHBondContact O-CG2 3.38Å; Q134-V136 PolarHBondContact O-N 3.24Å; V136-Y138 VanDerWaalsContact C-N 3.32Å; V136-Y138 PolarHBondContact O-N 3.1Å; V136-I139 HydrophobicContact CG1-CD1 4.34Å; V136-I139 PolarHBondContact O-N 2.93Å; V136-G140 PolarHBondContact O-N 3.25Å; V136-A185 HydrophobicContact CG2-CB 4.22Å; V136-A185 WeakPolarHBondContact CG2-O 3.33Å; V136-R188 HydrophobicContact CG2-CB 4.37Å; V136-I189 HydrophobicContact CB-CD1 4.16Å; V136-I189 HydrophobicContact CB-CG1 3.71Å; V136-I189 HydrophobicContact CG2-CG1 4.07Å; V136-I189 WeakPolarHBondContact O-CG1 3.28Å
137Y98.4Very high95.7Very high0 Ų032.5 Ų32.50%015%0.146CC..Hα-helixtrans-57.9-47.3167.8-178.8-79.8000110.7V36 Q134 S135 I139 G140 Q141 R188 L191 G192 H195V36-Y137 HydrophobicContact CB-CE1 3.72Å; V36-Y137 HydrophobicContact CB-CE2 4.41Å; V36-Y137 WeakPolarHBondContact CB-OH 3.42Å; V36-Y137 HydrophobicContact CG2-CD1 3.99Å; V36-Y137 HydrophobicContact CG2-CE1 3.41Å; V36-Y137 VanDerWaalsContact CG2-CE1 3.41Å; Q134-Y137 VanDerWaalsContact O-CB 3.3Å; Q134-Y137 WeakPolarHBondContact O-CB 3.4Å; Q134-Y137 PolarHBondContact O-N 3.23Å; S135-Y137 VanDerWaalsContact C-N 3.25Å; S135-Y137 PolarHBondContact O-N 2.87Å; Y137-I139 VanDerWaalsContact C-N 3.33Å; Y137-I139 PolarHBondContact O-N 3.08Å; Y137-G140 WeakPolarHBondContact O-CA 3.47Å; Y137-G140 PolarHBondContact O-N 3.06Å; Y137-G140 VanDerWaalsContact O-N 3.17Å; Y137-Q141 PolarHBondContact O-N 3.03Å; Y137-R188 WeakPolarHBondContact CD2-O 3.27Å; Y137-L191 HydrophobicContact CD2-CB 4.01Å; Y137-L191 HydrophobicContact CE2-CB 3.63Å; Y137-G192 VanDerWaalsContact O-CA 3.31Å; Y137-G192 WeakPolarHBondContact O-CA 3.41Å; Y137-H195 AromaticContact CE1-ND1 3.77Å; Y137-H195 AromaticContact CZ-ND1 3.72Å; Y137-H195 PolarHBondContact OH-ND1 2.98Å
138Y97.7Very high95.5Very high0 Ų031 Ų310%014%0.14CC..Hα-helixtrans-70.2-28.5179.6-64.7-59.7000113.1V36 Q134 S135 V136 Q141 F142 Y349 I353 A464 S468V36-Y138 HydrophobicContact CG2-CE1 3.95Å; Q134-Y138 HydrophobicContact CG-CE2 4.11Å; Q134-Y138 WeakPolarHBondContact O-CD2 3.4Å; S135-Y138 WeakPolarHBondContact O-CB 3.48Å; S135-Y138 PolarHBondContact O-N 3.03Å; V136-Y138 VanDerWaalsContact C-N 3.32Å; V136-Y138 PolarHBondContact O-N 3.1Å; Y138-Q141 VanDerWaalsContact CD1-OE1 3.28Å; Y138-Q141 PolarHBondContact O-N 3.02Å; Y138-F142 PolarHBondContact O-N 3.46Å; Y138-Y349 HydrophobicContact CE1-CD1 4.15Å; Y138-Y349 HydrophobicContact CE1-CD2 4.36Å; Y138-Y349 HydrophobicContact CE1-CE1 4.13Å; Y138-Y349 HydrophobicContact CE1-CE2 4.4Å; Y138-Y349 HydrophobicContact CE1-CG 4.27Å; Y138-Y349 AromaticContact CZ-CD1 3.97Å; Y138-Y349 WeakPolarHBondContact OH-CD1 3.26Å; Y138-I353 HydrophobicContact CE2-CD1 4.02Å; Y138-A464 HydrophobicContact CD1-CB 3.49Å; Y138-A464 VanDerWaalsContact CD1-CB 3.49Å; Y138-A464 HydrophobicContact CD2-CB 3.8Å; Y138-A464 VanDerWaalsContact CD2-O 3.28Å; Y138-A464 WeakPolarHBondContact CD2-O 3.46Å; Y138-A464 HydrophobicContact CE1-CB 3.73Å; Y138-A464 HydrophobicContact CE2-CB 3.99Å; Y138-A464 WeakPolarHBondContact CE2-O 3.41Å; Y138-A464 HydrophobicContact CG-CB 3.54Å; Y138-S468 WeakPolarHBondContact CD2-OG 3.43Å; Y138-S468 WeakPolarHBondContact CE2-OG 3.19Å
139I97Very high95Very high64 Ų6427.1 Ų27.133%0.32813%0.134SC..Hα-helixtrans-64.3-45.9168.5-62.8174.8000110.2S135 V136 Y137 Q141 F142 F143 I465S135-I139 PolarHBondContact O-N 2.86Å; V136-I139 HydrophobicContact CG1-CD1 4.34Å; V136-I139 PolarHBondContact O-N 2.93Å; Y137-I139 VanDerWaalsContact C-N 3.33Å; Y137-I139 PolarHBondContact O-N 3.08Å; I139-Q141 VanDerWaalsContact C-N 3.28Å; I139-Q141 PolarHBondContact O-N 3.47Å; I139-F142 WeakPolarHBondContact O-CB 3.4Å; I139-F142 PolarHBondContact O-N 2.92Å; I139-F143 HydrophobicContact CG2-CD2 4.08Å; I139-F143 HydrophobicContact CG2-CE2 3.91Å; I139-F143 WeakPolarHBondContact O-CD2 3.25Å; I139-F143 PolarHBondContact O-N 2.73Å; I139-I465 HydrophobicContact CG1-CD1 3.76Å; I139-I465 HydrophobicContact CG1-CG1 4.35Å
140G97.3Very high94.6Very high1 Ų134.3 Ų34.31%0.0116%0.161CC..Hα-helixtrans-55.3-45.9172.100000111.7V136 Y137 F142 F143 G144 I189 G192 F193V136-G140 PolarHBondContact O-N 3.25Å; Y137-G140 WeakPolarHBondContact O-CA 3.47Å; Y137-G140 PolarHBondContact O-N 3.06Å; Y137-G140 VanDerWaalsContact O-N 3.17Å; G140-F142 VanDerWaalsContact C-N 3.34Å; G140-F142 PolarHBondContact O-N 3.41Å; G140-F143 PolarHBondContact O-N 3.41Å; G140-G144 PolarHBondContact O-N 2.96Å; G140-I189 WeakPolarHBondContact CA-O 3.37Å; G140-G192 VanDerWaalsContact C-C 3.47Å; G140-F193 VanDerWaalsContact O-CA 3.29Å; G140-F193 WeakPolarHBondContact O-CA 3.47Å
141Q95.4Very high94.3Very high9 Ų936.8 Ų36.84%0.04218%0.175CC..Hα-helixtrans-63.6-35.4178-168.317629.300113.6Y137 Y138 I139 S145 G192 H195 P196Y137-Q141 PolarHBondContact O-N 3.03Å; Y138-Q141 VanDerWaalsContact CD1-OE1 3.28Å; Y138-Q141 PolarHBondContact O-N 3.02Å; I139-Q141 VanDerWaalsContact C-N 3.28Å; I139-Q141 PolarHBondContact O-N 3.47Å; Q141-S145 WeakPolarHBondContact O-CB 3.41Å; Q141-S145 PolarHBondContact O-N 3.37Å; Q141-S145 PolarHBondContact O-OG 2.97Å; Q141-G192 WeakPolarHBondContact CA-O 3.39Å; Q141-G192 WeakPolarHBondContact CB-O 3.34Å; Q141-G192 VanDerWaalsContact N-C 3.32Å; Q141-G192 PolarHBondContact N-O 3.27Å; Q141-H195 HydrophobicContact CG-CB 4.42Å; Q141-H195 PolarHBondContact NE2-CD2 2.73Å; Q141-H195 VanDerWaalsContact NE2-CD2 3.25Å; Q141-H195 PolarHBondContact NE2-CE1 3.19Å; Q141-H195 PolarHBondContact NE2-ND1 3.22Å; Q141-H195 PolarHBondContact NE2-NE2 3.44Å; Q141-P196 HydrophobicContact CG-CG 4.49Å
142F93.8Very high94Very high63 Ų6337.2 Ų37.228%0.27618%0.178SC..Hα-helixtrans-58.5-53.8174176.2-87000111.3Y138 I139 G140 S145 Y146 M458 R461Y138-F142 PolarHBondContact O-N 3.46Å; I139-F142 WeakPolarHBondContact O-CB 3.4Å; I139-F142 PolarHBondContact O-N 2.92Å; G140-F142 VanDerWaalsContact C-N 3.34Å; G140-F142 PolarHBondContact O-N 3.41Å; F142-S145 PolarHBondContact O-N 3.32Å; F142-Y146 PolarHBondContact O-N 3.37Å; F142-M458 HydrophobicContact CD1-CE 4.36Å; F142-M458 HydrophobicContact CD2-CB 3.91Å; F142-M458 HydrophobicContact CD2-CE 4.49Å; F142-M458 HydrophobicContact CD2-CG 4.28Å; F142-M458 WeakPolarHBondContact CD2-O 3.35Å; F142-M458 HydrophobicContact CE1-CE 3.62Å; F142-M458 HydrophobicContact CE2-CB 3.58Å; F142-M458 HydrophobicContact CE2-CE 3.81Å; F142-M458 HydrophobicContact CE2-CG 4.12Å; F142-M458 HydrophobicContact CZ-CB 4.34Å; F142-M458 HydrophobicContact CZ-CE 3.3Å; F142-R461 HydrophobicContact CB-CB 4.15Å; F142-R461 HydrophobicContact CB-CG 3.93Å; F142-R461 HydrophobicContact CD2-CB 4.19Å; F142-R461 HydrophobicContact CD2-CG 4.34Å
143F93.8Very high93.4Very high107 Ų10738.6 Ų38.647%0.46919%0.189SC..Hα-helixtrans-69-37.7179.3-73-71.6000112.2I139 G140 S145 Y146 I147 F193I139-F143 HydrophobicContact CG2-CD2 4.08Å; I139-F143 HydrophobicContact CG2-CE2 3.91Å; I139-F143 WeakPolarHBondContact O-CD2 3.25Å; I139-F143 PolarHBondContact O-N 2.73Å; G140-F143 PolarHBondContact O-N 3.41Å; F143-S145 VanDerWaalsContact C-N 3.29Å; F143-S145 PolarHBondContact O-N 3.19Å; F143-Y146 PolarHBondContact O-N 3.39Å; F143-I147 HydrophobicContact CB-CD1 4.47Å; F143-I147 WeakPolarHBondContact O-CB 3.31Å; F143-I147 WeakPolarHBondContact O-CG1 3.35Å; F143-I147 PolarHBondContact O-N 2.91Å; F143-F193 HydrophobicContact CB-CD2 4.42Å
144G93.8Very high93Very high0 Ų047.5 Ų47.50%022%0.222CC..Hα-helixtrans-58-41.6173.700000111.9G140 Y146 I147 C148G140-G144 PolarHBondContact O-N 2.96Å; G144-Y146 VanDerWaalsContact C-N 3.31Å; G144-Y146 PolarHBondContact O-N 2.9Å; G144-I147 PolarHBondContact O-N 2.79Å; G144-C148 WeakPolarHBondContact O-CA 3.41Å; G144-C148 WeakPolarHBondContact O-CB 3.18Å; G144-C148 PolarHBondContact O-N 3.14Å; G144-C148 PolarHBondContact O-SG 3.44Å; G144-C148 VanDerWaalsContact O-SG 3.38Å
145S90Very high92.7Very high27 Ų2753 Ų5319%0.18925%0.246CC..Hα-helixtrans-64.7-38.8-177.8-600000111.5Q141 F142 F143 G149 P196Q141-S145 WeakPolarHBondContact O-CB 3.41Å; Q141-S145 PolarHBondContact O-N 3.37Å; Q141-S145 PolarHBondContact O-OG 2.97Å; F142-S145 PolarHBondContact O-N 3.32Å; F143-S145 VanDerWaalsContact C-N 3.29Å; F143-S145 PolarHBondContact O-N 3.19Å; S145-G149 PolarHBondContact O-N 3.02Å; S145-P196 VanDerWaalsContact N-CG 3.3Å
146Y88.7Confident92.3Very high110 Ų11052.8 Ų52.843%0.43125%0.245SC..Hα-helixtrans-71.9-48.8175.9-177.7-100.3000112.4F142 F143 G144 R150 M458F142-Y146 PolarHBondContact O-N 3.37Å; F143-Y146 PolarHBondContact O-N 3.39Å; G144-Y146 VanDerWaalsContact C-N 3.31Å; G144-Y146 PolarHBondContact O-N 2.9Å; Y146-R150 WeakPolarHBondContact O-CG 3.34Å; Y146-R150 PolarHBondContact O-N 3.28Å; Y146-R150 PolarHBondContact OH-NH1 3.44Å; Y146-R150 PolarHBondContact OH-NH2 3.27Å; Y146-M458 HydrophobicContact CD2-CE 4.21Å; Y146-M458 HydrophobicContact CD2-SD 4.17Å; Y146-M458 HydrophobicContact CG-CE 4.47Å
147I92.1Very high92Very high62 Ų6253.6 Ų53.632%0.31825%0.247SC..Hα-helixtrans-77.1-50.4-172.3-65169.1000111.2F143 G144 G149 R150 L151 F193F143-I147 HydrophobicContact CB-CD1 4.47Å; F143-I147 WeakPolarHBondContact O-CB 3.31Å; F143-I147 WeakPolarHBondContact O-CG1 3.35Å; F143-I147 PolarHBondContact O-N 2.91Å; G144-I147 PolarHBondContact O-N 2.79Å; I147-G149 VanDerWaalsContact C-N 3.25Å; I147-G149 PolarHBondContact O-N 3.3Å; I147-R150 PolarHBondContact O-N 3.32Å; I147-L151 HydrophobicContact CG2-CD1 3.69Å; I147-L151 HydrophobicContact CG2-CG 4.11Å; I147-L151 WeakPolarHBondContact O-CB 3.3Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 3.46Å; I147-L151 PolarHBondContact O-N 3.49Å; I147-F193 HydrophobicContact CB-CE2 4.01Å; I147-F193 HydrophobicContact CB-CZ 3.96Å; I147-F193 HydrophobicContact CD1-CE2 3.8Å; I147-F193 HydrophobicContact CD1-CZ 4.36Å; I147-F193 HydrophobicContact CG1-CE2 4.44Å; I147-F193 HydrophobicContact CG2-CE2 4.27Å; I147-F193 HydrophobicContact CG2-CZ 3.78Å
148C91.1Very high91.7Very high7 Ų755.6 Ų55.65%0.04726%0.256CS..Hα-helixtrans-60.3-36.9177.7-63.30000111.4G144 L151 S152 V160G144-C148 WeakPolarHBondContact O-CA 3.41Å; G144-C148 WeakPolarHBondContact O-CB 3.18Å; G144-C148 PolarHBondContact O-N 3.14Å; G144-C148 PolarHBondContact O-SG 3.44Å; G144-C148 VanDerWaalsContact O-SG 3.38Å; C148-L151 PolarHBondContact O-N 3.38Å; C148-S152 WeakPolarHBondContact O-CB 3.03Å; C148-S152 PolarHBondContact O-N 2.84Å; C148-S152 PolarHBondContact O-OG 3.43Å; C148-V160 HydrophobicContact CB-CG1 3.97Å
149G85Confident91.5Very high27 Ų2760.7 Ų60.728%0.27828%0.281SS..Hα-helixtrans-57-56.2173.500000111.9S145 I147 L151 S152 D153S145-G149 PolarHBondContact O-N 3.02Å; I147-G149 VanDerWaalsContact C-N 3.25Å; I147-G149 PolarHBondContact O-N 3.3Å; G149-L151 VanDerWaalsContact C-N 3.35Å; G149-L151 PolarHBondContact O-N 2.88Å; G149-S152 PolarHBondContact O-N 3.23Å; G149-S152 VanDerWaalsContact O-N 3.14Å; G149-S152 PolarHBondContact O-OG 3.4Å; G149-D153 PolarHBondContact O-N 2.96Å; G149-D153 VanDerWaalsContact O-N 3.15Å
150R87.9Confident91.4Very high151 Ų15158.2 Ų58.257%0.5727%0.269SS*.Hα-helixtrans-57.9-43.1177.5-75.6-89.2179.775.61.8113.1Y146 I147 S152 R154Y146-R150 WeakPolarHBondContact O-CG 3.34Å; Y146-R150 PolarHBondContact O-N 3.28Å; Y146-R150 PolarHBondContact OH-NH1 3.44Å; Y146-R150 PolarHBondContact OH-NH2 3.27Å; I147-R150 PolarHBondContact O-N 3.32Å; R150-S152 VanDerWaalsContact C-N 3.34Å; R150-R154 WeakPolarHBondContact O-CB 3.27Å; R150-R154 PolarHBondContact O-N 2.99Å
151L91.3Very high91.3Very high65 Ų6558.2 Ų58.234%0.3427%0.268SS..Hα-helixtrans-67.4-37.5178.8-68.4176.9000111.1I147 C148 G149 D153 R154 F155 V160I147-L151 HydrophobicContact CG2-CD1 3.69Å; I147-L151 HydrophobicContact CG2-CG 4.11Å; I147-L151 WeakPolarHBondContact O-CB 3.3Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 3.46Å; I147-L151 PolarHBondContact O-N 3.49Å; C148-L151 PolarHBondContact O-N 3.38Å; G149-L151 VanDerWaalsContact C-N 3.35Å; G149-L151 PolarHBondContact O-N 2.88Å; L151-D153 VanDerWaalsContact C-N 3.33Å; L151-D153 PolarHBondContact O-N 3Å; L151-R154 PolarHBondContact O-N 2.79Å; L151-F155 HydrophobicContact CB-CD2 4.38Å; L151-F155 HydrophobicContact CD2-CD2 3.75Å; L151-F155 HydrophobicContact CD2-CE2 3.59Å; L151-F155 PolarHBondContact O-N 3.25Å; L151-V160 HydrophobicContact CB-CG2 3.66Å
152S90.7Very high91.2Very high10 Ų1058.4 Ų58.47%0.0727%0.269CS..Hα-helixtrans-69.7-33.1-177.376.40000112.2C148 G149 R150 G156C148-S152 WeakPolarHBondContact O-CB 3.03Å; C148-S152 PolarHBondContact O-N 2.84Å; C148-S152 PolarHBondContact O-OG 3.43Å; G149-S152 PolarHBondContact O-N 3.23Å; G149-S152 VanDerWaalsContact O-N 3.14Å; G149-S152 PolarHBondContact O-OG 3.4Å; R150-S152 VanDerWaalsContact C-N 3.34Å; S152-G156 CarbonylContact O-C 3.59Å; S152-G156 WeakPolarHBondContact O-CA 3.35Å; S152-G156 PolarHBondContact O-N 3.19Å
153D85.9Confident91.3Very high97 Ų9759.4 Ų59.452%0.51928%0.28SS..Hα-helixtrans-73.5-29.7173.2-69.4-25.6000112G149 L151 W270G149-D153 PolarHBondContact O-N 2.96Å; G149-D153 VanDerWaalsContact O-N 3.15Å; L151-D153 VanDerWaalsContact C-N 3.33Å; L151-D153 PolarHBondContact O-N 3Å; D153-W270 PolarHBondContact O-NE1 2.89Å
154R89Confident91.4Very high187 Ų18754.5 Ų54.571%0.70626%0.259SS*.Hα-helixtrans-88.3-45.8-176.8-174.2176.7-177.2-176.70.5114R150 L151R150-R154 WeakPolarHBondContact O-CB 3.27Å; R150-R154 PolarHBondContact O-N 2.99Å; L151-R154 PolarHBondContact O-N 2.79Å
155F91.5Very high91.5Very high115 Ų11554.5 Ų54.550%0.50426%0.26SS..Hα-helixtrans-104.6-2.5-171.5-66.5-68.6000113.5L151L151-F155 HydrophobicContact CB-CD2 4.38Å; L151-F155 HydrophobicContact CD2-CD2 3.75Å; L151-F155 HydrophobicContact CD2-CE2 3.59Å; L151-F155 PolarHBondContact O-N 3.25Å
156G90.1Very high91.9Very high0 Ų056.9 Ų56.90%027%0.269CS..  trans93.5152.7-17200000111.4S152 E266 W270S152-G156 CarbonylContact O-C 3.59Å; S152-G156 WeakPolarHBondContact O-CA 3.35Å; S152-G156 PolarHBondContact O-N 3.19Å; G156-E266 WeakPolarHBondContact CA-OE2 3.33Å; G156-W270 VanDerWaalsContact CA-CE2 3.49Å
157R91.5Very high92.3Very high24 Ų2454.2 Ų54.29%0.09126%0.262CS..Hα-helixtrans-80.3-35-172.2-61.5-168.2-175139.60.8111.7M159 V160 F161 I201 I205 E208 E266 S267R157-M159 VanDerWaalsContact C-N 3.33Å; R157-M159 PolarHBondContact O-N 3.47Å; R157-V160 PolarHBondContact O-N 3.43Å; R157-F161 VanDerWaalsContact O-CB 3.26Å; R157-F161 WeakPolarHBondContact O-CB 3.27Å; R157-F161 PolarHBondContact O-N 3.25Å; R157-I201 HydrophobicContact CB-CG2 3.93Å; R157-I205 HydrophobicContact CB-CD1 4.18Å; R157-I205 HydrophobicContact CB-CG1 4.31Å; R157-E208 IonicContact CZ-OE1 2.64Å; R157-E208 IonicContact CZ-OE2 3.12Å; R157-E208 IonicContact NH1-OE1 3.58Å; R157-E208 PolarHBondContact NH1-OE1 2.84Å; R157-E208 IonicContact NH1-OE2 2.67Å; R157-E208 PolarHBondContact NH1-OE2 3.24Å; R157-E208 IonicContact NH2-OE1 3.44Å; R157-E208 PolarHBondContact NH2-OE1 3.44Å; R157-E208 IonicContact NH2-OE2 3.63Å; R157-E266 WeakPolarHBondContact CB-OE1 3.49Å; R157-E266 PolarHBondContact N-OE1 2.92Å; R157-E266 PolarHBondContact N-OE2 3.46Å; R157-E266 VanDerWaalsContact N-OE2 3.1Å; R157-S267 PolarHBondContact NH1-OG 3.27Å
158K92.9Very high92.6Very high42 Ų4251.4 Ų51.418%0.18325%0.248CC..Hα-helixtrans-57.2-49.1176.4-175.1-177.5172.3168.40110.6V160 F161 F162 Y261 V264 E266K158-V160 PolarHBondContact O-N 3.1Å; K158-F161 WeakPolarHBondContact O-CB 3.47Å; K158-F161 PolarHBondContact O-N 3.38Å; K158-F162 HydrophobicContact CD-CE2 4.34Å; K158-F162 HydrophobicContact CG-CD2 3.85Å; K158-F162 HydrophobicContact CG-CE2 3.55Å; K158-F162 WeakPolarHBondContact O-CD2 3.16Å; K158-F162 PolarHBondContact O-N 3.21Å; K158-Y261 WeakPolarHBondContact CE-O 3.26Å; K158-Y261 PolarHBondContact NZ-O 2.96Å; K158-V264 WeakPolarHBondContact CD-O 3.45Å; K158-V264 WeakPolarHBondContact CE-O 3.3Å; K158-V264 PolarHBondContact NZ-O 3.01Å; K158-E266 HydrophobicContact CB-CB 4.38Å; K158-E266 WeakPolarHBondContact CB-OE2 3.34Å; K158-E266 PolarHBondContact N-OE1 2.74Å; K158-E266 PolarHBondContact N-OE2 2.88Å
159M93.5Very high92.9Very high107 Ų10751.4 Ų51.453%0.52725%0.247SC..Hα-helixtrans-61.1-47.8-177.3-171.760.9147.400112R157 F161 F162 V163R157-M159 VanDerWaalsContact C-N 3.33Å; R157-M159 PolarHBondContact O-N 3.47Å; M159-F161 VanDerWaalsContact C-N 3.33Å; M159-F161 PolarHBondContact O-N 3.35Å; M159-F162 PolarHBondContact O-N 3.06Å; M159-V163 WeakPolarHBondContact O-CG2 3.43Å; M159-V163 PolarHBondContact O-N 3.31Å
160V94.6Very high93.5Very high12 Ų1253.4 Ų53.47%0.07325%0.254CS..Hα-helixtrans-65.7-37.4179.2179.10000111.8C148 L151 R157 K158 F162 V163 A164 I201C148-V160 HydrophobicContact CB-CG1 3.97Å; L151-V160 HydrophobicContact CB-CG2 3.66Å; R157-V160 PolarHBondContact O-N 3.43Å; K158-V160 PolarHBondContact O-N 3.1Å; V160-F162 PolarHBondContact O-N 3.04Å; V160-V163 PolarHBondContact O-N 3.09Å; V160-A164 VanDerWaalsContact O-CB 3.31Å; V160-A164 WeakPolarHBondContact O-CB 3.45Å; V160-A164 PolarHBondContact O-N 3.33Å; V160-I201 HydrophobicContact CB-CD1 3.78Å; V160-I201 HydrophobicContact CG1-CD1 3.6Å
161F94.5Very high94Very high1 Ų146.8 Ų46.80%0.00423%0.231CC..Hα-helixtrans-58.3-45.5174-172.4-105.8000111.9P28 R157 K158 M159 A164 I165 G197 I198 I201 A202 Y260P28-F161 HydrophobicContact CB-CZ 4.01Å; P28-F161 HydrophobicContact CG-CE1 4.21Å; P28-F161 HydrophobicContact CG-CZ 3.76Å; R157-F161 VanDerWaalsContact O-CB 3.26Å; R157-F161 WeakPolarHBondContact O-CB 3.27Å; R157-F161 PolarHBondContact O-N 3.25Å; K158-F161 WeakPolarHBondContact O-CB 3.47Å; K158-F161 PolarHBondContact O-N 3.38Å; M159-F161 VanDerWaalsContact C-N 3.33Å; M159-F161 PolarHBondContact O-N 3.35Å; F161-A164 PolarHBondContact O-N 3.35Å; F161-I165 HydrophobicContact CD1-CD1 3.74Å; F161-I165 HydrophobicContact CE1-CD1 3.51Å; F161-I165 HydrophobicContact CG-CD1 4.49Å; F161-I165 HydrophobicContact CZ-CD1 4.09Å; F161-I165 WeakPolarHBondContact O-CG1 3.49Å; F161-I165 PolarHBondContact O-N 2.89Å; F161-G197 WeakPolarHBondContact CD2-O 3.24Å; F161-I198 HydrophobicContact CE2-CB 4.32Å; F161-I198 HydrophobicContact CE2-CG2 3.82Å; F161-I198 WeakPolarHBondContact CE2-O 3.47Å; F161-I198 HydrophobicContact CZ-CG2 4.37Å; F161-I201 HydrophobicContact CB-CG2 4.06Å; F161-I201 HydrophobicContact CD2-CB 4.16Å; F161-I201 HydrophobicContact CD2-CG2 3.98Å; F161-I201 HydrophobicContact CG-CG2 4.4Å; F161-A202 HydrophobicContact CE2-CB 4.3Å; F161-Y260 HydrophobicContact CE1-CD1 4.42Å
162F94.1Very high94.3Very high12 Ų1243.7 Ų43.75%0.05322%0.215CC..Hα-helixtrans-66.9-43.9176.6-79.5-67.7000113.5K158 M159 V160 A164 I165 I166 F257 Y260 Y261K158-F162 HydrophobicContact CD-CE2 4.34Å; K158-F162 HydrophobicContact CG-CD2 3.85Å; K158-F162 HydrophobicContact CG-CE2 3.55Å; K158-F162 WeakPolarHBondContact O-CD2 3.16Å; K158-F162 PolarHBondContact O-N 3.21Å; M159-F162 PolarHBondContact O-N 3.06Å; V160-F162 PolarHBondContact O-N 3.04Å; F162-A164 PolarHBondContact O-N 3.33Å; F162-I165 PolarHBondContact O-N 3.09Å; F162-I166 WeakPolarHBondContact O-CG1 3.34Å; F162-I166 PolarHBondContact O-N 3.06Å; F162-F257 WeakPolarHBondContact CE1-O 3.38Å; F162-Y260 WeakPolarHBondContact CZ-O 3.43Å; F162-Y261 AromaticContact CD2-CD2 3.93Å; F162-Y261 HydrophobicContact CD2-CD2 3.93Å; F162-Y261 VanDerWaalsContact CE1-N 3.28Å; F162-Y261 HydrophobicContact CE2-CD2 4.16Å; F162-Y261 HydrophobicContact CG-CD2 4.3Å
163V95.6Very high94.6Very high84 Ų8445.6 Ų45.651%0.50922%0.223SC..Hα-helixtrans-59.6-40176.2171.30000110.5M159 V160 I166 L167M159-V163 WeakPolarHBondContact O-CG2 3.43Å; M159-V163 PolarHBondContact O-N 3.31Å; V160-V163 PolarHBondContact O-N 3.09Å; V163-I166 PolarHBondContact O-N 2.83Å; V163-L167 WeakPolarHBondContact O-CB 3.37Å; V163-L167 PolarHBondContact O-N 3.42Å
164A96.5Very high95.2Very high4 Ų444.7 Ų44.73%0.03322%0.218CC..Hα-helixtrans-65.8-40.7176.300000112.4V160 F161 F162 L167 Q168 A194 I198V160-A164 VanDerWaalsContact O-CB 3.31Å; V160-A164 WeakPolarHBondContact O-CB 3.45Å; V160-A164 PolarHBondContact O-N 3.33Å; F161-A164 PolarHBondContact O-N 3.35Å; F162-A164 PolarHBondContact O-N 3.33Å; A164-L167 PolarHBondContact O-N 3.4Å; A164-Q168 WeakPolarHBondContact O-CB 3.26Å; A164-Q168 PolarHBondContact O-N 3.47Å; A164-A194 HydrophobicContact CB-CB 4.36Å; A164-A194 WeakPolarHBondContact O-CB 3.33Å; A164-I198 HydrophobicContact CB-CD1 4.41Å; A164-I198 HydrophobicContact CB-CG1 3.78Å
165I96Very high95.7Very high1 Ų135.8 Ų35.81%0.00519%0.185CC..Hα-helixtrans-61.1-45.6174-70.5167.5000111.2P28 F161 F162 L167 Q168 L169 I198 F257P28-I165 HydrophobicContact CB-CD1 4.42Å; P28-I165 HydrophobicContact CG-CD1 4.28Å; F161-I165 HydrophobicContact CD1-CD1 3.74Å; F161-I165 HydrophobicContact CE1-CD1 3.51Å; F161-I165 HydrophobicContact CG-CD1 4.49Å; F161-I165 HydrophobicContact CZ-CD1 4.09Å; F161-I165 WeakPolarHBondContact O-CG1 3.49Å; F161-I165 PolarHBondContact O-N 2.89Å; F162-I165 PolarHBondContact O-N 3.09Å; I165-L167 VanDerWaalsContact C-N 3.34Å; I165-L167 PolarHBondContact O-N 3.38Å; I165-Q168 PolarHBondContact O-N 3.07Å; I165-L169 WeakPolarHBondContact O-CB 3.43Å; I165-L169 PolarHBondContact O-N 3Å; I165-I198 HydrophobicContact CG1-CD1 4.06Å; I165-I198 HydrophobicContact CG1-CG1 4.09Å; I165-F257 HydrophobicContact CD1-CB 4.11Å; I165-F257 HydrophobicContact CG2-CB 4.23Å
166I96.5Very high95.9Very high77 Ų7730.8 Ų30.840%0.39516%0.164SC..Hα-helixtrans-60.5-45.8177.7-70.8163.8000110.9F162 V163 L169 T170 F258F162-I166 WeakPolarHBondContact O-CG1 3.34Å; F162-I166 PolarHBondContact O-N 3.06Å; V163-I166 PolarHBondContact O-N 2.83Å; I166-L169 PolarHBondContact O-N 3.2Å; I166-T170 WeakPolarHBondContact O-CB 3.11Å; I166-T170 PolarHBondContact O-N 3.07Å; I166-T170 PolarHBondContact O-OG1 3.2Å; I166-F258 HydrophobicContact CD1-CE1 4.12Å; I166-F258 HydrophobicContact CG1-CE1 3.52Å; I166-F258 HydrophobicContact CG1-CZ 4.01Å
167L97.6Very high96.2Very high54 Ų5435.6 Ų35.628%0.28319%0.193SC..Hα-helixtrans-63.3-44.5178.5-178.863.8000111.3V163 A164 I165 T170 C171 F193 A194V163-L167 WeakPolarHBondContact O-CB 3.37Å; V163-L167 PolarHBondContact O-N 3.42Å; A164-L167 PolarHBondContact O-N 3.4Å; I165-L167 VanDerWaalsContact C-N 3.34Å; I165-L167 PolarHBondContact O-N 3.38Å; L167-T170 PolarHBondContact O-N 3.05Å; L167-C171 WeakPolarHBondContact O-CB 3.43Å; L167-C171 PolarHBondContact O-N 2.68Å; L167-C171 PolarHBondContact O-SG 2.98Å; L167-F193 HydrophobicContact CD2-CB 4.43Å; L167-F193 HydrophobicContact CD2-CD1 3.56Å; L167-F193 HydrophobicContact CD2-CE1 4.29Å; L167-F193 HydrophobicContact CD2-CG 4.39Å; L167-A194 HydrophobicContact CB-CB 4.26Å; L167-A194 HydrophobicContact CD2-CB 4.11Å; L167-A194 HydrophobicContact CG-CB 4.24Å
168Q98Very high96.5Very high2 Ų234.7 Ų34.71%0.00919%0.191CC..Hα-helixtrans-60.3-48.4177-177.5173.891.400111.5T32 H35 A164 I165 G172 L191 A194 I198T32-Q168 PolarHBondContact OG1-NE2 2.87Å; H35-Q168 VanDerWaalsContact CD2-CD 3.47Å; H35-Q168 VanDerWaalsContact CD2-CG 3.42Å; H35-Q168 WeakPolarHBondContact CD2-CG 3.29Å; A164-Q168 WeakPolarHBondContact O-CB 3.26Å; A164-Q168 PolarHBondContact O-N 3.47Å; I165-Q168 PolarHBondContact O-N 3.07Å; Q168-G172 WeakPolarHBondContact O-CA 3.41Å; Q168-G172 PolarHBondContact O-N 3.31Å; Q168-L191 HydrophobicContact CB-CD2 4.42Å; Q168-L191 HydrophobicContact CG-CD2 3.93Å; Q168-L191 WeakPolarHBondContact O-CD2 3.4Å; Q168-A194 HydrophobicContact CB-CB 3.91Å; Q168-I198 HydrophobicContact CB-CD1 4.06Å; Q168-I198 HydrophobicContact CG-CD1 4.43Å
169L97.5Very high96.6Very high7 Ų737 Ų374%0.03721%0.21CC..Hα-helixtrans-60.6-48.5178.3174.963.7000111.7I165 I166 G172 I173 S251 A254 F255 F258I165-L169 WeakPolarHBondContact O-CB 3.43Å; I165-L169 PolarHBondContact O-N 3Å; I166-L169 PolarHBondContact O-N 3.2Å; L169-G172 PolarHBondContact O-N 3.03Å; L169-I173 HydrophobicContact CD1-CD1 3.67Å; L169-I173 HydrophobicContact CD1-CG1 4.23Å; L169-I173 HydrophobicContact CG-CD1 4.09Å; L169-I173 WeakPolarHBondContact O-CG1 3.5Å; L169-I173 PolarHBondContact O-N 3.44Å; L169-S251 WeakPolarHBondContact CD1-O 3.27Å; L169-A254 HydrophobicContact CB-CB 4.41Å; L169-A254 HydrophobicContact CD1-CB 4.17Å; L169-F255 HydrophobicContact CD1-CD2 3.84Å; L169-F255 HydrophobicContact CD1-CE2 3.76Å; L169-F255 HydrophobicContact CD1-CG 4.48Å; L169-F255 HydrophobicContact CD1-CZ 4.32Å; L169-F255 HydrophobicContact CD2-CD1 3.91Å; L169-F255 HydrophobicContact CD2-CD2 4.13Å; L169-F255 HydrophobicContact CD2-CE1 3.8Å; L169-F255 HydrophobicContact CD2-CE2 4.05Å; L169-F255 HydrophobicContact CD2-CG 4.05Å; L169-F255 HydrophobicContact CD2-CZ 3.86Å; L169-F255 HydrophobicContact CG-CE2 4.34Å; L169-F255 HydrophobicContact CG-CZ 4.43Å; L169-F258 HydrophobicContact CD2-CE2 3.56Å; L169-F258 HydrophobicContact CD2-CZ 3.78Å
170T98Very high96.8Very high70 Ų7038 Ų3843%0.42921%0.209SC..Hα-helixtrans-63.5-51.2-177.6-53.60000110.9I166 L167 G172 I173 L174I166-T170 WeakPolarHBondContact O-CB 3.11Å; I166-T170 PolarHBondContact O-N 3.07Å; I166-T170 PolarHBondContact O-OG1 3.2Å; L167-T170 PolarHBondContact O-N 3.05Å; T170-G172 VanDerWaalsContact C-N 3.28Å; T170-G172 PolarHBondContact O-N 3.17Å; T170-I173 PolarHBondContact O-N 3.24Å; T170-L174 HydrophobicContact CG2-CD1 4.03Å; T170-L174 WeakPolarHBondContact O-CB 3.36Å; T170-L174 VanDerWaalsContact O-CG 3.29Å; T170-L174 WeakPolarHBondContact O-CG 3.38Å; T170-L174 PolarHBondContact O-N 2.95Å; T170-L174 VanDerWaalsContact O-N 3.07Å
171C98.4Very high96.9Very high12 Ų1240.4 Ų40.48%0.08122%0.217CC..Hα-helixtrans-63.1-37.3177.1-69.70000111.6L167 L174 I175 L187 L191L167-C171 WeakPolarHBondContact O-CB 3.43Å; L167-C171 PolarHBondContact O-N 2.68Å; L167-C171 PolarHBondContact O-SG 2.98Å; C171-L174 PolarHBondContact O-N 3.34Å; C171-I175 VanDerWaalsContact O-CG1 3.29Å; C171-I175 WeakPolarHBondContact O-CG1 3.15Å; C171-I175 PolarHBondContact O-N 3Å; C171-I175 VanDerWaalsContact O-N 3.09Å; C171-L187 HydrophobicContact CB-CB 4.46Å; C171-L187 HydrophobicContact CB-CD2 4.42Å; C171-L191 HydrophobicContact CB-CD2 3.71Å; C171-L191 HydrophobicContact CB-CG 3.91Å
172G98Very high97Very high0 Ų043.2 Ų43.20%024%0.235CC..Hα-helixtrans-62.1-46.3179.700000112.9Q168 L169 T170 Q247 S251Q168-G172 WeakPolarHBondContact O-CA 3.41Å; Q168-G172 PolarHBondContact O-N 3.31Å; L169-G172 PolarHBondContact O-N 3.03Å; T170-G172 VanDerWaalsContact C-N 3.28Å; T170-G172 PolarHBondContact O-N 3.17Å; G172-Q247 VanDerWaalsContact O-CG 3.31Å; G172-Q247 WeakPolarHBondContact O-CG 3.4Å; G172-Q247 PolarHBondContact O-NE2 3.11Å; G172-S251 WeakPolarHBondContact CA-OG 3.34Å; G172-S251 PolarHBondContact O-OG 3.3Å
173I98.1Very high97.2Very high49 Ų4944.9 Ų44.925%0.25125%0.245SC..Hα-helixtrans-67.3-43.9176.7-67.3169.4000110.9L169 T170 I175 A176 L248 L252 F255L169-I173 HydrophobicContact CD1-CD1 3.67Å; L169-I173 HydrophobicContact CD1-CG1 4.23Å; L169-I173 HydrophobicContact CG-CD1 4.09Å; L169-I173 WeakPolarHBondContact O-CG1 3.5Å; L169-I173 PolarHBondContact O-N 3.44Å; T170-I173 PolarHBondContact O-N 3.24Å; I173-I175 PolarHBondContact O-N 3.32Å; I173-A176 WeakPolarHBondContact O-CB 3.29Å; I173-A176 PolarHBondContact O-N 3.47Å; I173-A176 VanDerWaalsContact O-N 3.09Å; I173-L248 HydrophobicContact CG2-CD2 4.33Å; I173-L252 HydrophobicContact CD1-CD2 4.24Å; I173-F255 HydrophobicContact CD1-CE2 3.83Å; I173-F255 HydrophobicContact CD1-CZ 4.15Å
174L98.2Very high97.3Very high78 Ų7841 Ų4141%0.40822%0.221SC..Hα-helixtrans-63-29.6-178.9-72.2174.7000112.9T170 C171 A176 V177 A178 L187T170-L174 HydrophobicContact CG2-CD1 4.03Å; T170-L174 WeakPolarHBondContact O-CB 3.36Å; T170-L174 VanDerWaalsContact O-CG 3.29Å; T170-L174 WeakPolarHBondContact O-CG 3.38Å; T170-L174 PolarHBondContact O-N 2.95Å; T170-L174 VanDerWaalsContact O-N 3.07Å; C171-L174 PolarHBondContact O-N 3.34Å; L174-A176 VanDerWaalsContact C-N 3.3Å; L174-A176 PolarHBondContact O-N 3.46Å; L174-V177 PolarHBondContact O-N 3.3Å; L174-A178 PolarHBondContact O-N 2.87Å; L174-A178 VanDerWaalsContact O-N 3.09Å; L174-L187 HydrophobicContact CB-CD1 3.56Å; L174-L187 HydrophobicContact CB-CD2 3.84Å; L174-L187 HydrophobicContact CB-CG 4.35Å; L174-L187 HydrophobicContact CD1-CD2 3.86Å
175I98.2Very high97.4Very high1 Ų141.1 Ų41.11%0.00522%0.222CC..Hα-helixtrans-63.9-37.4175.3-73.1166000111.2C171 I173 V177 A178 V184 L187 R188 L191 Q247C171-I175 VanDerWaalsContact O-CG1 3.29Å; C171-I175 WeakPolarHBondContact O-CG1 3.15Å; C171-I175 PolarHBondContact O-N 3Å; C171-I175 VanDerWaalsContact O-N 3.09Å; I173-I175 PolarHBondContact O-N 3.32Å; I175-V177 PolarHBondContact O-N 2.86Å; I175-A178 PolarHBondContact O-N 3.06Å; I175-V184 HydrophobicContact CG1-CG1 4.49Å; I175-V184 HydrophobicContact CG2-CG1 4.08Å; I175-V184 HydrophobicContact CG2-CG2 4.38Å; I175-L187 HydrophobicContact CD1-CB 3.95Å; I175-L187 HydrophobicContact CG1-CB 3.5Å; I175-L187 HydrophobicContact CG1-CD1 3.83Å; I175-L187 HydrophobicContact CG1-CG 4.33Å; I175-R188 HydrophobicContact CD1-CG 4.26Å; I175-L191 HydrophobicContact CD1-CD1 3.5Å; I175-L191 VanDerWaalsContact CD1-CD1 3.5Å; I175-L191 HydrophobicContact CD1-CG 4.14Å; I175-Q247 HydrophobicContact CB-CG 4.09Å; I175-Q247 HydrophobicContact CG2-CG 3.89Å
176A96.6Very high97.5Very high9 Ų946.4 Ų46.47%0.07425%0.25CC..Hα-helixtrans-67.6-22.2-178.400000113.3I173 L174 D244 Q247 L248I173-A176 WeakPolarHBondContact O-CB 3.29Å; I173-A176 PolarHBondContact O-N 3.47Å; I173-A176 VanDerWaalsContact O-N 3.09Å; L174-A176 VanDerWaalsContact C-N 3.3Å; L174-A176 PolarHBondContact O-N 3.46Å; A176-D244 HydrophobicContact CB-CB 4.36Å; A176-D244 WeakPolarHBondContact CB-O 3.41Å; A176-D244 WeakPolarHBondContact O-CB 3.44Å; A176-Q247 HydrophobicContact CB-CB 4.2Å; A176-Q247 HydrophobicContact CB-CG 4.12Å; A176-L248 HydrophobicContact CB-CD1 4.31Å; A176-L248 HydrophobicContact CB-CD2 3.73Å; A176-L248 HydrophobicContact CB-CG 3.6Å
177V96.3Very high97.6Very high101 Ų10143.5 Ų43.561%0.61224%0.235SC*.THydrogen-bonded Turntrans-112.47.6179.8-60.30000112.9L174 I175 P179L174-V177 PolarHBondContact O-N 3.3Å; I175-V177 PolarHBondContact O-N 2.86Å; V177-P179 WeakPolarHBondContact O-CD 3.41Å
178A97.1Very high97.7Very high5 Ų540.9 Ų40.94%0.04122%0.221CC..  trans-69.5127-177.700000110.5W120 L174 I175 L183 V184W120-A178 WeakPolarHBondContact CZ2-O 3.15Å; L174-A178 PolarHBondContact O-N 2.87Å; L174-A178 VanDerWaalsContact O-N 3.09Å; I175-A178 PolarHBondContact O-N 3.06Å; A178-L183 HydrophobicContact CB-CB 4.34Å; A178-L183 HydrophobicContact CB-CD2 3.93Å; A178-L183 HydrophobicContact CB-CG 4.13Å; A178-V184 HydrophobicContact CB-CG2 3.62Å
179P96Very high97.7Very high90 Ų9043.8 Ų43.858%0.58424%0.236SC*.SBendtrans-82.3-16.1-176.327.7-30.8000114.2W120 V177W120-P179 PolarHBondContact NE1-O 3.23Å; V177-P179 WeakPolarHBondContact O-CD 3.41Å
180Y96.3Very high97.7Very high130 Ų13044.1 Ų44.151%0.5124%0.241SC..SBendtrans-144.4146.9-177.651.7-100000112.3P182 L183 V184Y180-P182 HydrophobicContact CD2-CB 4.01Å; Y180-P182 HydrophobicContact CD2-CG 4.16Å; Y180-P182 HydrophobicContact CE2-CB 4.33Å; Y180-L183 HydrophobicContact CD2-CB 3.73Å; Y180-L183 HydrophobicContact CE2-CB 3.46Å; Y180-L183 VanDerWaalsContact CE2-CB 3.46Å; Y180-L183 PolarHBondContact O-N 3.44Å; Y180-L183 VanDerWaalsContact O-N 3.1Å; Y180-V184 PolarHBondContact O-N 3.47Å
181W96.7Very high97.8Very high62 Ų6240.8 Ų40.824%0.23522%0.221CC..Hα-helixtrans-60-31.7-174.973.2-97.1000114.9W120 L122 W128 V129 F132 V133 L183 V184 A185W120-W181 HydrophobicContact CD2-CB 3.97Å; W120-W181 HydrophobicContact CE3-CB 3.71Å; W120-W181 HydrophobicContact CG-CB 4.35Å; W120-W181 HydrophobicContact CZ3-CB 4.27Å; L122-W181 HydrophobicContact CD1-CB 4.28Å; L122-W181 HydrophobicContact CD2-CG 4.15Å; W128-W181 HydrophobicContact CH2-CH2 4.31Å; V129-W181 HydrophobicContact CG1-CD2 3.52Å; V129-W181 HydrophobicContact CG1-CE3 3.47Å; V129-W181 VanDerWaalsContact CG1-CE3 3.47Å; V129-W181 HydrophobicContact CG1-CG 4.02Å; V129-W181 HydrophobicContact CG1-CH2 4.4Å; V129-W181 HydrophobicContact CG1-CZ2 4.45Å; V129-W181 HydrophobicContact CG1-CZ3 3.93Å; V129-W181 HydrophobicContact CG2-CZ2 4.33Å; F132-W181 HydrophobicContact CD1-CZ3 4.27Å; F132-W181 HydrophobicContact CE1-CZ3 4.41Å; V133-W181 HydrophobicContact CG2-CE3 4.24Å; W181-L183 VanDerWaalsContact C-N 3.26Å; W181-L183 PolarHBondContact O-N 3.05Å; W181-V184 WeakPolarHBondContact O-CB 3.36Å; W181-V184 PolarHBondContact O-N 3.16Å; W181-V184 VanDerWaalsContact O-N 3.13Å; W181-A185 PolarHBondContact O-N 3.33Å
182P98.2Very high97.7Very high60 Ų6040.2 Ų40.239%0.3922%0.217SC..Hα-helixtrans-61.5-32.3175-27.535.3000113.9Y180 A185 L186Y180-P182 HydrophobicContact CD2-CB 4.01Å; Y180-P182 HydrophobicContact CD2-CG 4.16Å; Y180-P182 HydrophobicContact CE2-CB 4.33Å; P182-A185 WeakPolarHBondContact O-CB 3.48Å; P182-A185 PolarHBondContact O-N 2.96Å; P182-L186 PolarHBondContact O-N 3.36Å
183L98.1Very high97.7Very high47 Ų4742.9 Ų42.925%0.24623%0.229CC..Hα-helixtrans-69.7-40.6174.6-179.559.9000110.5A178 Y180 W181 A185 L186 L187A178-L183 HydrophobicContact CB-CB 4.34Å; A178-L183 HydrophobicContact CB-CD2 3.93Å; A178-L183 HydrophobicContact CB-CG 4.13Å; Y180-L183 HydrophobicContact CD2-CB 3.73Å; Y180-L183 HydrophobicContact CE2-CB 3.46Å; Y180-L183 VanDerWaalsContact CE2-CB 3.46Å; Y180-L183 PolarHBondContact O-N 3.44Å; Y180-L183 VanDerWaalsContact O-N 3.1Å; W181-L183 VanDerWaalsContact C-N 3.26Å; W181-L183 PolarHBondContact O-N 3.05Å; L183-A185 VanDerWaalsContact C-N 3.29Å; L183-A185 PolarHBondContact O-N 3.07Å; L183-L186 HydrophobicContact CD1-CD2 4.45Å; L183-L186 PolarHBondContact O-N 3.47Å; L183-L187 HydrophobicContact CD1-CD1 4.14Å; L183-L187 HydrophobicContact CD1-CG 4.15Å; L183-L187 HydrophobicContact CG-CD1 3.84Å; L183-L187 HydrophobicContact CG-CG 4.33Å; L183-L187 WeakPolarHBondContact O-CB 3.09Å; L183-L187 VanDerWaalsContact O-CG 3.23Å; L183-L187 WeakPolarHBondContact O-CG 3.04Å; L183-L187 PolarHBondContact O-N 3.44Å
184V98Very high97.7Very high1 Ų140.5 Ų40.51%0.00622%0.217CC..Hα-helixtrans-57.7-44.8171.9177.10000110.5W39 W120 V133 I175 A178 Y180 W181 L186 L187 R188W39-V184 HydrophobicContact CH2-CG1 4.25Å; W39-V184 HydrophobicContact CZ3-CG1 3.88Å; W120-V184 HydrophobicContact CH2-CG2 3.57Å; W120-V184 HydrophobicContact CZ2-CG2 4.39Å; W120-V184 HydrophobicContact CZ3-CG2 3.98Å; V133-V184 HydrophobicContact CG1-CG1 4.15Å; I175-V184 HydrophobicContact CG1-CG1 4.49Å; I175-V184 HydrophobicContact CG2-CG1 4.08Å; I175-V184 HydrophobicContact CG2-CG2 4.38Å; A178-V184 HydrophobicContact CB-CG2 3.62Å; Y180-V184 PolarHBondContact O-N 3.47Å; W181-V184 WeakPolarHBondContact O-CB 3.36Å; W181-V184 PolarHBondContact O-N 3.16Å; W181-V184 VanDerWaalsContact O-N 3.13Å; V184-L186 PolarHBondContact O-N 3.5Å; V184-L187 PolarHBondContact O-N 3.38Å; V184-R188 HydrophobicContact CG1-CG 4.19Å; V184-R188 WeakPolarHBondContact O-CB 3.45Å; V184-R188 VanDerWaalsContact O-CG 3.23Å; V184-R188 WeakPolarHBondContact O-CG 3.33Å; V184-R188 PolarHBondContact O-N 2.88Å
185A98.3Very high97.6Very high7 Ų736.9 Ų36.96%0.05820%0.198CC..Hα-helixtrans-58-46.4176.500000112.1V133 V136 W181 P182 L183 R188 I189V133-A185 HydrophobicContact CG2-CB 4.09Å; V136-A185 HydrophobicContact CG2-CB 4.22Å; V136-A185 WeakPolarHBondContact CG2-O 3.33Å; W181-A185 PolarHBondContact O-N 3.33Å; P182-A185 WeakPolarHBondContact O-CB 3.48Å; P182-A185 PolarHBondContact O-N 2.96Å; L183-A185 VanDerWaalsContact C-N 3.29Å; L183-A185 PolarHBondContact O-N 3.07Å; A185-R188 WeakPolarHBondContact O-CB 3.29Å; A185-R188 PolarHBondContact O-N 3.39Å; A185-I189 PolarHBondContact O-N 3.36Å; A185-I189 VanDerWaalsContact O-N 3.17Å
186L98.4Very high97.4Very high112 Ų11237 Ų3759%0.58620%0.199SC*.Hα-helixtrans-62.1-45.1176.9-179.364.3000112.1P182 L183 V184 R188 I189 G190P182-L186 PolarHBondContact O-N 3.36Å; L183-L186 HydrophobicContact CD1-CD2 4.45Å; L183-L186 PolarHBondContact O-N 3.47Å; V184-L186 PolarHBondContact O-N 3.5Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 2.9Å; L186-I189 WeakPolarHBondContact O-CB 3.47Å; L186-I189 PolarHBondContact O-N 2.88Å; L186-G190 PolarHBondContact O-N 3.35Å
187L98.6Very high97.2Very high16 Ų1636.6 Ų36.68%0.08420%0.195CC..Hα-helixtrans-68.4-31.5178.8-65.2168.1000112C171 L174 I175 L183 V184 I189 G190 L191C171-L187 HydrophobicContact CB-CB 4.46Å; C171-L187 HydrophobicContact CB-CD2 4.42Å; L174-L187 HydrophobicContact CB-CD1 3.56Å; L174-L187 HydrophobicContact CB-CD2 3.84Å; L174-L187 HydrophobicContact CB-CG 4.35Å; L174-L187 HydrophobicContact CD1-CD2 3.86Å; I175-L187 HydrophobicContact CD1-CB 3.95Å; I175-L187 HydrophobicContact CG1-CB 3.5Å; I175-L187 HydrophobicContact CG1-CD1 3.83Å; I175-L187 HydrophobicContact CG1-CG 4.33Å; L183-L187 HydrophobicContact CD1-CD1 4.14Å; L183-L187 HydrophobicContact CD1-CG 4.15Å; L183-L187 HydrophobicContact CG-CD1 3.84Å; L183-L187 HydrophobicContact CG-CG 4.33Å; L183-L187 WeakPolarHBondContact O-CB 3.09Å; L183-L187 VanDerWaalsContact O-CG 3.23Å; L183-L187 WeakPolarHBondContact O-CG 3.04Å; L183-L187 PolarHBondContact O-N 3.44Å; V184-L187 PolarHBondContact O-N 3.38Å; L187-I189 VanDerWaalsContact C-N 3.34Å; L187-G190 WeakPolarHBondContact O-CA 3.45Å; L187-G190 PolarHBondContact O-N 2.78Å; L187-G190 VanDerWaalsContact O-N 3.11Å; L187-L191 PolarHBondContact O-N 2.83Å
188R98.1Very high97.1Very high0 Ų031.8 Ų31.80%017%0.166CC..Hα-helixtrans-63.8-36171.9-76.8-60.5-169.993.3-19.3112.5S38 W39 V133 Q134 V136 Y137 I175 V184 A185 L186 G190 L191 G192S38-R188 PolarHBondContact OG-NH2 2.84Å; W39-R188 VanDerWaalsContact CE3-CZ 3.4Å; W39-R188 VanDerWaalsContact N-NH2 3.12Å; V133-R188 HydrophobicContact CG1-CG 3.86Å; Q134-R188 VanDerWaalsContact OE1-NH1 3.12Å; V136-R188 HydrophobicContact CG2-CB 4.37Å; Y137-R188 WeakPolarHBondContact CD2-O 3.27Å; I175-R188 HydrophobicContact CD1-CG 4.26Å; V184-R188 HydrophobicContact CG1-CG 4.19Å; V184-R188 WeakPolarHBondContact O-CB 3.45Å; V184-R188 VanDerWaalsContact O-CG 3.23Å; V184-R188 WeakPolarHBondContact O-CG 3.33Å; V184-R188 PolarHBondContact O-N 2.88Å; A185-R188 WeakPolarHBondContact O-CB 3.29Å; A185-R188 PolarHBondContact O-N 3.39Å; L186-R188 VanDerWaalsContact C-N 3.31Å; L186-R188 PolarHBondContact O-N 2.9Å; R188-G190 VanDerWaalsContact C-N 3.28Å; R188-G190 PolarHBondContact O-N 3.22Å; R188-L191 PolarHBondContact O-N 3.46Å; R188-G192 PolarHBondContact O-N 3.21Å
189I98.4Very high96.9Very high63 Ų6333 Ų3332%0.32317%0.17SC..Hα-helixtrans-59.4-44.1170.2-63.3167.7000109.8V136 G140 A185 L186 L187 G192 F193V136-I189 HydrophobicContact CB-CD1 4.16Å; V136-I189 HydrophobicContact CB-CG1 3.71Å; V136-I189 HydrophobicContact CG2-CG1 4.07Å; V136-I189 WeakPolarHBondContact O-CG1 3.28Å; G140-I189 WeakPolarHBondContact CA-O 3.37Å; A185-I189 PolarHBondContact O-N 3.36Å; A185-I189 VanDerWaalsContact O-N 3.17Å; L186-I189 WeakPolarHBondContact O-CB 3.47Å; L186-I189 PolarHBondContact O-N 2.88Å; L187-I189 VanDerWaalsContact C-N 3.34Å; I189-G192 PolarHBondContact O-N 3.25Å; I189-F193 WeakPolarHBondContact O-CB 3.42Å; I189-F193 PolarHBondContact O-N 3.38Å
190G98.4Very high96.6Very high14 Ų1431.3 Ų31.314%0.14416%0.158CC..Hα-helixtrans-60.6-45.3176.100000113.4L186 L187 R188 G192 F193 A194L186-G190 PolarHBondContact O-N 3.35Å; L187-G190 WeakPolarHBondContact O-CA 3.45Å; L187-G190 PolarHBondContact O-N 2.78Å; L187-G190 VanDerWaalsContact O-N 3.11Å; R188-G190 VanDerWaalsContact C-N 3.28Å; R188-G190 PolarHBondContact O-N 3.22Å; G190-G192 PolarHBondContact O-N 3.09Å; G190-F193 PolarHBondContact O-N 2.98Å; G190-A194 PolarHBondContact O-N 2.96Å
191L98.4Very high96.3Very high0 Ų025.4 Ų25.40%014%0.135CC..Hα-helixtrans-60.6-43.9173.5-69.7-173.2000112.2H35 Y137 Q168 C171 I175 L187 R188 F193 A194 H195H35-L191 HydrophobicContact CB-CD1 4.32Å; Y137-L191 HydrophobicContact CD2-CB 4.01Å; Y137-L191 HydrophobicContact CE2-CB 3.63Å; Q168-L191 HydrophobicContact CB-CD2 4.42Å; Q168-L191 HydrophobicContact CG-CD2 3.93Å; Q168-L191 WeakPolarHBondContact O-CD2 3.4Å; C171-L191 HydrophobicContact CB-CD2 3.71Å; C171-L191 HydrophobicContact CB-CG 3.91Å; I175-L191 HydrophobicContact CD1-CD1 3.5Å; I175-L191 VanDerWaalsContact CD1-CD1 3.5Å; I175-L191 HydrophobicContact CD1-CG 4.14Å; L187-L191 PolarHBondContact O-N 2.83Å; R188-L191 PolarHBondContact O-N 3.46Å; L191-F193 VanDerWaalsContact C-N 3.35Å; L191-A194 PolarHBondContact O-N 3.22Å; L191-H195 PolarHBondContact O-N 3.48Å; L191-H195 VanDerWaalsContact O-N 3.14Å
192G97.9Very high96.1Very high0 Ų022.4 Ų22.40%012%0.124CC..Hα-helixtrans-60.2-44.3175.700000112.2Y137 G140 Q141 R188 I189 G190 A194 H195 P196Y137-G192 VanDerWaalsContact O-CA 3.31Å; Y137-G192 WeakPolarHBondContact O-CA 3.41Å; G140-G192 VanDerWaalsContact C-C 3.47Å; Q141-G192 WeakPolarHBondContact CA-O 3.39Å; Q141-G192 WeakPolarHBondContact CB-O 3.34Å; Q141-G192 VanDerWaalsContact N-C 3.32Å; Q141-G192 PolarHBondContact N-O 3.27Å; R188-G192 PolarHBondContact O-N 3.21Å; I189-G192 PolarHBondContact O-N 3.25Å; G190-G192 PolarHBondContact O-N 3.09Å; G192-A194 VanDerWaalsContact C-N 3.34Å; G192-A194 PolarHBondContact O-N 2.94Å; G192-H195 VanDerWaalsContact O-CB 3.28Å; G192-H195 WeakPolarHBondContact O-CB 3.32Å; G192-H195 PolarHBondContact O-N 3.43Å; G192-P196 VanDerWaalsContact O-CD 3.24Å; G192-P196 WeakPolarHBondContact O-CD 3.18Å
193F97.6Very high95.6Very high55 Ų5521 Ų2124%0.24111%0.114CC..Hα-helixtrans-61.8-39.6177.9-176.1-83.1000112.6G140 F143 I147 L167 I189 G190 L191 P196G140-F193 VanDerWaalsContact O-CA 3.29Å; G140-F193 WeakPolarHBondContact O-CA 3.47Å; F143-F193 HydrophobicContact CB-CD2 4.42Å; I147-F193 HydrophobicContact CB-CE2 4.01Å; I147-F193 HydrophobicContact CB-CZ 3.96Å; I147-F193 HydrophobicContact CD1-CE2 3.8Å; I147-F193 HydrophobicContact CD1-CZ 4.36Å; I147-F193 HydrophobicContact CG1-CE2 4.44Å; I147-F193 HydrophobicContact CG2-CE2 4.27Å; I147-F193 HydrophobicContact CG2-CZ 3.78Å; L167-F193 HydrophobicContact CD2-CB 4.43Å; L167-F193 HydrophobicContact CD2-CD1 3.56Å; L167-F193 HydrophobicContact CD2-CE1 4.29Å; L167-F193 HydrophobicContact CD2-CG 4.39Å; I189-F193 WeakPolarHBondContact O-CB 3.42Å; I189-F193 PolarHBondContact O-N 3.38Å; G190-F193 PolarHBondContact O-N 2.98Å; L191-F193 VanDerWaalsContact C-N 3.35Å; F193-P196 WeakPolarHBondContact O-CD 3.29Å
194A97.7Very high95.1Very high0 Ų020.9 Ų20.90%012%0.115CC..Hα-helixtrans-69-31.8176.800000113.3A164 L167 Q168 G190 L191 G192 G197 I198A164-A194 HydrophobicContact CB-CB 4.36Å; A164-A194 WeakPolarHBondContact O-CB 3.33Å; L167-A194 HydrophobicContact CB-CB 4.26Å; L167-A194 HydrophobicContact CD2-CB 4.11Å; L167-A194 HydrophobicContact CG-CB 4.24Å; Q168-A194 HydrophobicContact CB-CB 3.91Å; G190-A194 PolarHBondContact O-N 2.96Å; L191-A194 PolarHBondContact O-N 3.22Å; G192-A194 VanDerWaalsContact C-N 3.34Å; G192-A194 PolarHBondContact O-N 2.94Å; A194-G197 WeakPolarHBondContact O-CA 3.45Å; A194-G197 PolarHBondContact O-N 3.24Å; A194-I198 PolarHBondContact O-N 3.17Å
195H96.7Very high94.6Very high2 Ų221.5 Ų21.51%0.00912%0.119CC..Hα-helixtrans-47.4-57.1-175-174.9140.4000114.2T32 Y137 Q141 L191 G192 G197 I198 F199T32-H195 HydrophobicContact CG2-CB 4Å; T32-H195 VanDerWaalsContact CG2-CG 3.41Å; Y137-H195 AromaticContact CE1-ND1 3.77Å; Y137-H195 AromaticContact CZ-ND1 3.72Å; Y137-H195 PolarHBondContact OH-ND1 2.98Å; Q141-H195 HydrophobicContact CG-CB 4.42Å; Q141-H195 PolarHBondContact NE2-CD2 2.73Å; Q141-H195 VanDerWaalsContact NE2-CD2 3.25Å; Q141-H195 PolarHBondContact NE2-CE1 3.19Å; Q141-H195 PolarHBondContact NE2-ND1 3.22Å; Q141-H195 PolarHBondContact NE2-NE2 3.44Å; L191-H195 PolarHBondContact O-N 3.48Å; L191-H195 VanDerWaalsContact O-N 3.14Å; G192-H195 VanDerWaalsContact O-CB 3.28Å; G192-H195 WeakPolarHBondContact O-CB 3.32Å; G192-H195 PolarHBondContact O-N 3.43Å; H195-G197 VanDerWaalsContact C-N 3.29Å; H195-G197 PolarHBondContact O-N 3.05Å; H195-I198 PolarHBondContact O-N 3.08Å; H195-F199 PolarHBondContact O-N 3.25Å
196P92.8Very high94.1Very high4 Ų421.2 Ų21.23%0.02612%0.116CC..Hα-helixtrans-68.6-29.9-177.727.4-32.8000112.1Q141 S145 G192 F193 I198 V200 I201Q141-P196 HydrophobicContact CG-CG 4.49Å; S145-P196 VanDerWaalsContact N-CG 3.3Å; G192-P196 VanDerWaalsContact O-CD 3.24Å; G192-P196 WeakPolarHBondContact O-CD 3.18Å; F193-P196 WeakPolarHBondContact O-CD 3.29Å; P196-I198 PolarHBondContact O-N 2.94Å; P196-V200 HydrophobicContact CB-CG2 3.94Å; P196-V200 VanDerWaalsContact O-CB 3.27Å; P196-V200 WeakPolarHBondContact O-CB 3.23Å; P196-V200 PolarHBondContact O-N 2.93Å; P196-I201 PolarHBondContact O-N 3.42Å
197G93.1Very high93.5Very high0 Ų017.4 Ų17.40%010%0.097CC..Hα-helixtrans-61.8-19.6171.900000113.4F161 A194 H195 I201F161-G197 WeakPolarHBondContact CD2-O 3.24Å; A194-G197 WeakPolarHBondContact O-CA 3.45Å; A194-G197 PolarHBondContact O-N 3.24Å; H195-G197 VanDerWaalsContact C-N 3.29Å; H195-G197 PolarHBondContact O-N 3.05Å; G197-I201 WeakPolarHBondContact O-CB 3.49Å; G197-I201 VanDerWaalsContact O-CD1 3.27Å; G197-I201 WeakPolarHBondContact O-CD1 3.41Å; G197-I201 WeakPolarHBondContact O-CG1 3.43Å
198I95Very high92.9Very high0 Ų018.1 Ų18.10%010%0.1CC..Hα-helixtrans-101-63.3173.9-60.1167.3000110P28 T32 F161 A164 I165 Q168 A194 H195 P196 A202P28-I198 HydrophobicContact CB-CG2 3.65Å; T32-I198 WeakPolarHBondContact OG1-CG2 3.44Å; F161-I198 HydrophobicContact CE2-CB 4.32Å; F161-I198 HydrophobicContact CE2-CG2 3.82Å; F161-I198 WeakPolarHBondContact CE2-O 3.47Å; F161-I198 HydrophobicContact CZ-CG2 4.37Å; A164-I198 HydrophobicContact CB-CD1 4.41Å; A164-I198 HydrophobicContact CB-CG1 3.78Å; I165-I198 HydrophobicContact CG1-CD1 4.06Å; I165-I198 HydrophobicContact CG1-CG1 4.09Å; Q168-I198 HydrophobicContact CB-CD1 4.06Å; Q168-I198 HydrophobicContact CG-CD1 4.43Å; A194-I198 PolarHBondContact O-N 3.17Å; H195-I198 PolarHBondContact O-N 3.08Å; P196-I198 PolarHBondContact O-N 2.94Å; I198-A202 WeakPolarHBondContact O-CB 3.37Å; I198-A202 PolarHBondContact O-N 2.68Å
199F93Very high92.3Very high29 Ų2919.6 Ų19.613%0.12711%0.108CC..Hα-helixtrans-63.8-50.8-171.9-177.8-104.5000113.3V29 H195 A202 V203 A222 F226V29-F199 HydrophobicContact CB-CD2 4.28Å; V29-F199 HydrophobicContact CG1-CD2 3.46Å; V29-F199 VanDerWaalsContact CG1-CD2 3.46Å; V29-F199 HydrophobicContact CG1-CE2 3.75Å; V29-F199 HydrophobicContact CG2-CD2 3.9Å; H195-F199 PolarHBondContact O-N 3.25Å; F199-A202 PolarHBondContact O-N 3.39Å; F199-V203 HydrophobicContact CE1-CG2 4.45Å; F199-V203 HydrophobicContact CZ-CG2 4.39Å; F199-V203 WeakPolarHBondContact O-CG2 3.34Å; F199-V203 PolarHBondContact O-N 3.4Å; F199-V203 VanDerWaalsContact O-N 3.09Å; F199-A222 HydrophobicContact CE2-CB 4.23Å; F199-F226 HydrophobicContact CE2-CD2 4.36Å
200V89.6Confident91.7Very high55 Ų5516.6 Ų16.633%0.3339%0.092SC..Hα-helixtrans-70.1-41.7-176.4-179.20000110P196 A202 V203 V204P196-V200 HydrophobicContact CB-CG2 3.94Å; P196-V200 VanDerWaalsContact O-CB 3.27Å; P196-V200 WeakPolarHBondContact O-CB 3.23Å; P196-V200 PolarHBondContact O-N 2.93Å; V200-A202 VanDerWaalsContact C-N 3.28Å; V200-A202 PolarHBondContact O-N 3.15Å; V200-V203 PolarHBondContact O-N 3.13Å; V200-V204 HydrophobicContact CG1-CG2 4.32Å; V200-V204 WeakPolarHBondContact O-CB 3.46Å; V200-V204 VanDerWaalsContact O-CG2 3.25Å; V200-V204 WeakPolarHBondContact O-CG2 3.32Å; V200-V204 PolarHBondContact O-N 3.46Å
201I89.7Confident90.7Very high6 Ų615.9 Ų15.93%0.0319%0.086CC..Hα-helixtrans-62.8-37.9176-63.2-169.5000111R157 V160 F161 P196 G197 V204 I205R157-I201 HydrophobicContact CB-CG2 3.93Å; V160-I201 HydrophobicContact CB-CD1 3.78Å; V160-I201 HydrophobicContact CG1-CD1 3.6Å; F161-I201 HydrophobicContact CB-CG2 4.06Å; F161-I201 HydrophobicContact CD2-CB 4.16Å; F161-I201 HydrophobicContact CD2-CG2 3.98Å; F161-I201 HydrophobicContact CG-CG2 4.4Å; P196-I201 PolarHBondContact O-N 3.42Å; G197-I201 WeakPolarHBondContact O-CB 3.49Å; G197-I201 VanDerWaalsContact O-CD1 3.27Å; G197-I201 WeakPolarHBondContact O-CD1 3.41Å; G197-I201 WeakPolarHBondContact O-CG1 3.43Å; I201-V204 PolarHBondContact O-N 3.34Å; I201-I205 HydrophobicContact CG2-CD1 3.58Å; I201-I205 HydrophobicContact CG2-CG1 4.05Å; I201-I205 WeakPolarHBondContact O-CB 3.48Å; I201-I205 WeakPolarHBondContact O-CG1 3.39Å; I201-I205 PolarHBondContact O-N 3.08Å
202A91.5Very high89.6Confident0 Ų018.6 Ų18.60%010%0.103CC..Hα-helixtrans-62.1-46.1176.600000112.6V25 V29 F161 I198 F199 V200 V204 G206V25-A202 HydrophobicContact CG1-CB 3.6Å; V25-A202 WeakPolarHBondContact O-CB 3.31Å; V29-A202 HydrophobicContact CG2-CB 3.88Å; F161-A202 HydrophobicContact CE2-CB 4.3Å; I198-A202 WeakPolarHBondContact O-CB 3.37Å; I198-A202 PolarHBondContact O-N 2.68Å; F199-A202 PolarHBondContact O-N 3.39Å; V200-A202 VanDerWaalsContact C-N 3.28Å; V200-A202 PolarHBondContact O-N 3.15Å; A202-V204 VanDerWaalsContact C-N 3.32Å; A202-V204 PolarHBondContact O-N 3.45Å; A202-G206 PolarHBondContact O-N 2.9Å
203V89Confident88.6Confident31 Ų3126.2 Ų26.219%0.18814%0.136CC..Hα-helixtrans-60.3-43.3174171.80000111F199 V200 G206 T207 A222F199-V203 HydrophobicContact CE1-CG2 4.45Å; F199-V203 HydrophobicContact CZ-CG2 4.39Å; F199-V203 WeakPolarHBondContact O-CG2 3.34Å; F199-V203 PolarHBondContact O-N 3.4Å; F199-V203 VanDerWaalsContact O-N 3.09Å; V200-V203 PolarHBondContact O-N 3.13Å; V203-G206 PolarHBondContact O-N 2.83Å; V203-T207 HydrophobicContact CG1-CG2 4.36Å; V203-T207 WeakPolarHBondContact O-CB 3.3Å; V203-T207 VanDerWaalsContact O-CG2 3.29Å; V203-T207 WeakPolarHBondContact O-CG2 3.27Å; V203-T207 PolarHBondContact O-N 3.15Å; V203-T207 PolarHBondContact O-OG1 3.13Å; V203-A222 HydrophobicContact CG2-CB 3.54Å
204V87.4Confident88Confident43 Ų4326.7 Ų26.726%0.26114%0.139SC..Hα-helixtrans-68-48.6-177.8166.30000111.5V200 I201 A202 G206 T207 E208V200-V204 HydrophobicContact CG1-CG2 4.32Å; V200-V204 WeakPolarHBondContact O-CB 3.46Å; V200-V204 VanDerWaalsContact O-CG2 3.25Å; V200-V204 WeakPolarHBondContact O-CG2 3.32Å; V200-V204 PolarHBondContact O-N 3.46Å; I201-V204 PolarHBondContact O-N 3.34Å; A202-V204 VanDerWaalsContact C-N 3.32Å; A202-V204 PolarHBondContact O-N 3.45Å; V204-G206 VanDerWaalsContact C-N 3.29Å; V204-G206 PolarHBondContact O-N 2.62Å; V204-T207 PolarHBondContact O-N 3.04Å; V204-T207 PolarHBondContact O-OG1 3.03Å; V204-T207 VanDerWaalsContact O-OG1 3.06Å; V204-E208 WeakPolarHBondContact O-CG 3.4Å; V204-E208 PolarHBondContact O-N 3.24Å; V204-E208 VanDerWaalsContact O-N 3.08Å
205I87.8Confident87.3Confident15 Ų1530.3 Ų30.38%0.07715%0.153CC..Hα-helixtrans-60.1-43.9174-68172.7000109.9V25 R157 I201 T207 E208 L209V25-I205 HydrophobicContact CG1-CB 4.19Å; V25-I205 HydrophobicContact CG1-CG2 4.26Å; V25-I205 HydrophobicContact CG2-CG2 4.04Å; R157-I205 HydrophobicContact CB-CD1 4.18Å; R157-I205 HydrophobicContact CB-CG1 4.31Å; I201-I205 HydrophobicContact CG2-CD1 3.58Å; I201-I205 HydrophobicContact CG2-CG1 4.05Å; I201-I205 WeakPolarHBondContact O-CB 3.48Å; I201-I205 WeakPolarHBondContact O-CG1 3.39Å; I201-I205 PolarHBondContact O-N 3.08Å; I205-T207 PolarHBondContact O-N 3.26Å; I205-E208 PolarHBondContact O-N 2.96Å; I205-L209 WeakPolarHBondContact O-CB 3.42Å; I205-L209 PolarHBondContact O-N 3.09Å
206G87.5Confident86.8Confident0 Ų031.5 Ų31.50%016%0.16CC..Hα-helixtrans-60.2-43.8178.600000113.2A202 V203 V204 V210A202-G206 PolarHBondContact O-N 2.9Å; V203-G206 PolarHBondContact O-N 2.83Å; V204-G206 VanDerWaalsContact C-N 3.29Å; V204-G206 PolarHBondContact O-N 2.62Å; G206-V210 WeakPolarHBondContact O-CG1 3.45Å
207T85.3Confident86.5Confident33 Ų3334 Ų3420%0.20217%0.173CC..Hα-helixtrans-74.5-25.6-179.550.30000113.7V203 V204 I205 A218V203-T207 HydrophobicContact CG1-CG2 4.36Å; V203-T207 WeakPolarHBondContact O-CB 3.3Å; V203-T207 VanDerWaalsContact O-CG2 3.29Å; V203-T207 WeakPolarHBondContact O-CG2 3.27Å; V203-T207 PolarHBondContact O-N 3.15Å; V203-T207 PolarHBondContact O-OG1 3.13Å; V204-T207 PolarHBondContact O-N 3.04Å; V204-T207 PolarHBondContact O-OG1 3.03Å; V204-T207 VanDerWaalsContact O-OG1 3.06Å; I205-T207 PolarHBondContact O-N 3.26Å; T207-A218 HydrophobicContact CG2-CB 3.91Å
208E85.8Confident86.1Confident31 Ų3134.1 Ų34.115%0.14517%0.174CC..Hα-helixtrans-84.3-27.7177.5-75.6-168.9-179.500114.7R157 V204 I205 V210 S267 R269R157-E208 IonicContact CZ-OE1 2.64Å; R157-E208 IonicContact CZ-OE2 3.12Å; R157-E208 IonicContact NH1-OE1 3.58Å; R157-E208 PolarHBondContact NH1-OE1 2.84Å; R157-E208 IonicContact NH1-OE2 2.67Å; R157-E208 PolarHBondContact NH1-OE2 3.24Å; R157-E208 IonicContact NH2-OE1 3.44Å; R157-E208 PolarHBondContact NH2-OE1 3.44Å; R157-E208 IonicContact NH2-OE2 3.63Å; V204-E208 WeakPolarHBondContact O-CG 3.4Å; V204-E208 PolarHBondContact O-N 3.24Å; V204-E208 VanDerWaalsContact O-N 3.08Å; I205-E208 PolarHBondContact O-N 2.96Å; E208-V210 PolarHBondContact O-N 3.38Å; E208-S267 PolarHBondContact OE2-OG 2.67Å; E208-R269 HydrophobicContact CB-CG 4.43Å; E208-R269 HydrophobicContact CG-CG 4.47Å; E208-R269 PolarHBondContact O-NE 3.28Å; E208-R269 PolarHBondContact O-NH2 3.47Å
209L85.2Confident85.5Confident30 Ų3035.4 Ų35.416%0.15719%0.187CC..Hα-helixtrans-68.6-24.9176.8177.665.9000111.9Y17 Q18 Q21 I205Y17-L209 HydrophobicContact CD1-CD1 4.29Å; Y17-L209 HydrophobicContact CE1-CD1 4.13Å; Q18-L209 HydrophobicContact CB-CD1 4.43Å; Q18-L209 HydrophobicContact CB-CD2 4.23Å; Q18-L209 HydrophobicContact CB-CG 3.95Å; Q18-L209 HydrophobicContact CG-CD1 3.87Å; Q18-L209 HydrophobicContact CG-CG 3.72Å; Q18-L209 WeakPolarHBondContact CG-O 3.28Å; Q18-L209 WeakPolarHBondContact O-CD2 3.14Å; Q21-L209 HydrophobicContact CB-CD1 4.5Å; Q21-L209 HydrophobicContact CB-CD2 3.5Å; I205-L209 WeakPolarHBondContact O-CB 3.42Å; I205-L209 PolarHBondContact O-N 3.09Å
210V86.3Confident85.3Confident0 Ų034.1 Ų34.10%018%0.182CC..SBendtrans-106.4154.5-174.3-52.20000112.9E13 F14 G206 E208 Q214 R215 A218E13-V210 CarbonylContact O-C 3.45Å; E13-V210 VanDerWaalsContact O-CA 3.31Å; E13-V210 WeakPolarHBondContact O-CA 3.3Å; F14-V210 HydrophobicContact CD2-CB 4.19Å; F14-V210 HydrophobicContact CD2-CG1 3.34Å; F14-V210 HydrophobicContact CE2-CG1 3.56Å; F14-V210 HydrophobicContact CG-CG1 4.49Å; G206-V210 WeakPolarHBondContact O-CG1 3.45Å; E208-V210 PolarHBondContact O-N 3.38Å; V210-Q214 HydrophobicContact CB-CB 4.06Å; V210-Q214 HydrophobicContact CG2-CB 4.15Å; V210-R215 HydrophobicContact CG2-CG 4.02Å; V210-A218 HydrophobicContact CG2-CB 3.84Å
211G78.4Confident85.2Confident0 Ų031.8 Ų31.80%017%0.168CC..  trans-66.4161.317400000112.9E13 K213 Q214 R215E13-G211 PolarHBondContact O-N 3.39Å; G211-K213 VanDerWaalsContact C-N 3.26Å; G211-K213 PolarHBondContact O-N 3.5Å; G211-K213 VanDerWaalsContact O-N 3.12Å; G211-Q214 PolarHBondContact O-N 3.36Å; G211-R215 PolarHBondContact O-N 3.43Å
212P74.4Confident85.1Confident56 Ų5631.5 Ų31.536%0.36417%0.167SC..G310 helixtrans-52.3-38-174.6-28.335.3000114.8D4 Q214 R215D4-P212 HydrophobicContact CB-CG 4.24Å; P212-Q214 VanDerWaalsContact C-N 3.26Å; P212-Q214 PolarHBondContact O-N 3.08Å; P212-R215 PolarHBondContact O-N 2.72Å
213K77.2Confident85Confident160 Ų16032.3 Ų32.370%0.69618%0.175SC*.G310 helixtrans-66-28.3-179.3-63.6175.8-177.6162.10113E13 G211E13-K213 IonicContact OE1-NZ 3.77Å; E13-K213 WeakPolarHBondContact OE2-CB 3.28Å; G211-K213 VanDerWaalsContact C-N 3.26Å; G211-K213 PolarHBondContact O-N 3.5Å; G211-K213 VanDerWaalsContact O-N 3.12Å
214Q84.3Confident85.2Confident66 Ų6633 Ų3331%0.30818%0.177SC..G310 helixtrans-100.2-1.6-174.4-60.7-64.1-23.600112.8F14 V210 G211 P212 V216 L217 A218F14-Q214 HydrophobicContact CB-CB 4.38Å; F14-Q214 HydrophobicContact CB-CG 3.93Å; F14-Q214 HydrophobicContact CG-CG 4.44Å; V210-Q214 HydrophobicContact CB-CB 4.06Å; V210-Q214 HydrophobicContact CG2-CB 4.15Å; G211-Q214 PolarHBondContact O-N 3.36Å; P212-Q214 VanDerWaalsContact C-N 3.26Å; P212-Q214 PolarHBondContact O-N 3.08Å; Q214-V216 VanDerWaalsContact C-N 3.28Å; Q214-V216 PolarHBondContact O-N 2.84Å; Q214-L217 WeakPolarHBondContact O-CB 3.25Å; Q214-L217 PolarHBondContact O-N 3.46Å; Q214-L217 VanDerWaalsContact O-N 3.14Å; Q214-A218 PolarHBondContact O-N 3.15Å
215R84.1Confident85.6Confident76 Ų7632.2 Ų32.229%0.28717%0.17SC..Hα-helixtrans-61.9-35.2177.6-71.1-175.9-178.1149.46.6113.2D4 V210 G211 P212 L217 A218 G219 R269D4-R215 IonicContact OD1-NH2 3.23Å; D4-R215 PolarHBondContact OD1-NH2 3.26Å; D4-R215 IonicContact OD2-CZ 3.76Å; D4-R215 IonicContact OD2-NH1 3.65Å; D4-R215 IonicContact OD2-NH2 2.63Å; D4-R215 PolarHBondContact OD2-NH2 3.27Å; V210-R215 HydrophobicContact CG2-CG 4.02Å; G211-R215 PolarHBondContact O-N 3.43Å; P212-R215 PolarHBondContact O-N 2.72Å; R215-L217 VanDerWaalsContact C-N 3.33Å; R215-A218 PolarHBondContact O-N 3.45Å; R215-G219 PolarHBondContact O-N 3.43Å; R215-R269 VanDerWaalsContact NH2-NH1 3.16Å
216V84.8Confident85.9Confident26 Ų2632 Ų3216%0.15817%0.169CC..Hα-helixtrans-61.2-46.1174.8175.10000110Q214 A218 G219 V220 L381 I384 I438Q214-V216 VanDerWaalsContact C-N 3.28Å; Q214-V216 PolarHBondContact O-N 2.84Å; V216-A218 PolarHBondContact O-N 3.27Å; V216-G219 PolarHBondContact O-N 3.45Å; V216-V220 HydrophobicContact CG1-CG2 4.3Å; V216-V220 WeakPolarHBondContact O-CB 3.49Å; V216-V220 WeakPolarHBondContact O-CG2 3.28Å; V216-V220 PolarHBondContact O-N 3.48Å; V216-L381 HydrophobicContact CG1-CD2 4.32Å; V216-I384 HydrophobicContact CG1-CG2 3.67Å; V216-I438 HydrophobicContact CG1-CD1 4.1Å; V216-I438 HydrophobicContact CG2-CD1 4.44Å
217L87.2Confident86.3Confident58 Ų5832 Ų3230%0.30417%0.169SC..Hα-helixtrans-60.2-46.1174.6177.965.2000111.1F14 Q214 R215 G219 G221 L381F14-L217 HydrophobicContact CD1-CD2 4.48Å; F14-L217 HydrophobicContact CE1-CD2 3.88Å; F14-L217 HydrophobicContact CZ-CD2 4.28Å; Q214-L217 WeakPolarHBondContact O-CB 3.25Å; Q214-L217 PolarHBondContact O-N 3.46Å; Q214-L217 VanDerWaalsContact O-N 3.14Å; R215-L217 VanDerWaalsContact C-N 3.33Å; L217-G219 PolarHBondContact O-N 3.25Å; L217-G221 VanDerWaalsContact O-CA 3.27Å; L217-G221 WeakPolarHBondContact O-CA 3.44Å; L217-G221 PolarHBondContact O-N 2.87Å; L217-L381 HydrophobicContact CD1-CD1 3.86Å; L217-L381 HydrophobicContact CD1-CD2 4.09Å
218A84.9Confident86.8Confident2 Ų234.4 Ų34.42%0.01718%0.177CC..Hα-helixtrans-63.5-39.3-179.300000113Y22 T207 V210 Q214 R215 V216Y22-A218 HydrophobicContact CD2-CB 4.28Å; Y22-A218 VanDerWaalsContact CE2-CA 3.49Å; Y22-A218 HydrophobicContact CE2-CB 3.7Å; Y22-A218 WeakPolarHBondContact CE2-O 3.16Å; Y22-A218 WeakPolarHBondContact OH-CA 3.4Å; Y22-A218 PolarHBondContact OH-O 2.96Å; T207-A218 HydrophobicContact CG2-CB 3.91Å; V210-A218 HydrophobicContact CG2-CB 3.84Å; Q214-A218 PolarHBondContact O-N 3.15Å; R215-A218 PolarHBondContact O-N 3.45Å; V216-A218 PolarHBondContact O-N 3.27Å
219G83.3Confident87.3Confident26 Ų2632.9 Ų32.927%0.26817%0.17SC..Hα-helixtrans-72.8-50.9178.900000113.2R215 V216 L217R215-G219 PolarHBondContact O-N 3.43Å; V216-G219 PolarHBondContact O-N 3.45Å; L217-G219 PolarHBondContact O-N 3.25Å
220V87.1Confident87.8Confident3 Ų331.5 Ų31.52%0.01816%0.162CC..Hα-helixtrans-73.1-33.7-178.6178.10000111.3V216 A222 G223 L377 L381 A434 I438V216-V220 HydrophobicContact CG1-CG2 4.3Å; V216-V220 WeakPolarHBondContact O-CB 3.49Å; V216-V220 WeakPolarHBondContact O-CG2 3.28Å; V216-V220 PolarHBondContact O-N 3.48Å; V220-A222 PolarHBondContact O-N 3.31Å; V220-G223 PolarHBondContact O-N 3.37Å; V220-L377 HydrophobicContact CG1-CB 4.4Å; V220-L377 HydrophobicContact CG1-CD2 4.08Å; V220-L381 HydrophobicContact CB-CD2 3.6Å; V220-L381 HydrophobicContact CB-CG 4.22Å; V220-L381 HydrophobicContact CG1-CD2 3.8Å; V220-L381 HydrophobicContact CG1-CG 3.82Å; V220-L381 HydrophobicContact CG2-CD2 4.14Å; V220-A434 HydrophobicContact CB-CB 4.44Å; V220-A434 HydrophobicContact CG1-CB 4Å; V220-A434 HydrophobicContact CG2-CB 4.12Å; V220-I438 HydrophobicContact CG2-CD1 3.88Å
221G88.1Confident88.3Confident5 Ų532.1 Ų32.15%0.05217%0.165CC..Hα-helixtrans-62-27.9-179.300000113.8Y22 L217 G223 I224 F225Y22-G221 VanDerWaalsContact OH-C 3.26Å; Y22-G221 WeakPolarHBondContact OH-CA 3.44Å; L217-G221 VanDerWaalsContact O-CA 3.27Å; L217-G221 WeakPolarHBondContact O-CA 3.44Å; L217-G221 PolarHBondContact O-N 2.87Å; G221-G223 PolarHBondContact O-N 3.28Å; G221-I224 WeakPolarHBondContact O-CB 3.34Å; G221-I224 PolarHBondContact O-N 2.69Å; G221-F225 WeakPolarHBondContact O-CD2 3.42Å
222A87.3Confident89.2Confident0 Ų036.7 Ų36.70%019%0.186CC..Hα-helixtrans-61.3-28.5172.800000112.3Y22 N26 F199 V203 V220 I224 F225 F226Y22-A222 PolarHBondContact OH-N 3.33Å; N26-A222 WeakPolarHBondContact OD1-CB 3.49Å; F199-A222 HydrophobicContact CE2-CB 4.23Å; V203-A222 HydrophobicContact CG2-CB 3.54Å; V220-A222 PolarHBondContact O-N 3.31Å; A222-I224 VanDerWaalsContact C-N 3.29Å; A222-I224 PolarHBondContact O-N 3.34Å; A222-F225 PolarHBondContact O-N 3.45Å; A222-F226 PolarHBondContact O-N 3.26Å; A222-F226 VanDerWaalsContact O-N 3.13Å
223G90.6Very high90.3Very high17 Ų1734 Ų3418%0.17517%0.168CC..Hα-helixtrans-62.7-34.2172.400000112.8V220 G221 F225 F226 S227 L377V220-G223 PolarHBondContact O-N 3.37Å; G221-G223 PolarHBondContact O-N 3.28Å; G223-F225 VanDerWaalsContact C-N 3.35Å; G223-F225 PolarHBondContact O-N 3.07Å; G223-F226 WeakPolarHBondContact O-CA 3.41Å; G223-F226 VanDerWaalsContact O-CB 3.31Å; G223-F226 WeakPolarHBondContact O-CB 3.5Å; G223-F226 PolarHBondContact O-N 3.4Å; G223-F226 VanDerWaalsContact O-N 3.13Å; G223-S227 PolarHBondContact O-N 3.21Å; G223-S227 PolarHBondContact O-OG 3.4Å; G223-S227 VanDerWaalsContact O-OG 3.08Å; G223-L377 VanDerWaalsContact C-CD1 3.48Å
224I93.3Very high91.2Very high45 Ų4526.4 Ų26.423%0.23114%0.135CC..Hα-helixtrans-65.5-40.9178.2-58.1173.6000110.5G221 A222 F226 S227 F228 M374 L377G221-I224 WeakPolarHBondContact O-CB 3.34Å; G221-I224 PolarHBondContact O-N 2.69Å; A222-I224 VanDerWaalsContact C-N 3.29Å; A222-I224 PolarHBondContact O-N 3.34Å; I224-F226 VanDerWaalsContact C-N 3.3Å; I224-F226 PolarHBondContact O-N 2.92Å; I224-S227 PolarHBondContact O-N 3.36Å; I224-F228 HydrophobicContact CG2-CD2 4.01Å; I224-F228 HydrophobicContact CG2-CE2 3.75Å; I224-F228 VanDerWaalsContact O-CD2 3.29Å; I224-F228 WeakPolarHBondContact O-CD2 3.28Å; I224-F228 PolarHBondContact O-N 2.82Å; I224-M374 HydrophobicContact CG2-CG 4.42Å; I224-L377 HydrophobicContact CG1-CB 4.41Å; I224-L377 HydrophobicContact CG1-CD1 4.08Å
225F94.6Very high91.7Very high28 Ų2825.3 Ų25.312%0.12314%0.135CC..Hα-helixtrans-65.4-35.4174.1-70-90.3000111.9Y22 L23 N26 L27 V29 I30 G221 A222 G223 F228 G229Y22-F225 HydrophobicContact CE1-CE2 4.07Å; L23-F225 HydrophobicContact CD1-CE1 3.78Å; L23-F225 HydrophobicContact CD1-CZ 3.79Å; N26-F225 HydrophobicContact CB-CB 4.36Å; N26-F225 HydrophobicContact CB-CD1 3.86Å; N26-F225 HydrophobicContact CB-CD2 3.5Å; N26-F225 VanDerWaalsContact CB-CD2 3.5Å; N26-F225 HydrophobicContact CB-CE1 3.96Å; N26-F225 HydrophobicContact CB-CE2 3.6Å; N26-F225 HydrophobicContact CB-CG 3.64Å; N26-F225 HydrophobicContact CB-CZ 3.83Å; L27-F225 HydrophobicContact CD2-CE1 4.25Å; V29-F225 HydrophobicContact CB-CB 4.21Å; V29-F225 HydrophobicContact CG1-CB 4.14Å; I30-F225 HydrophobicContact CD1-CD1 4.08Å; I30-F225 HydrophobicContact CG1-CB 4.19Å; I30-F225 HydrophobicContact CG1-CD1 4.12Å; I30-F225 WeakPolarHBondContact CG1-O 3.07Å; G221-F225 WeakPolarHBondContact O-CD2 3.42Å; A222-F225 PolarHBondContact O-N 3.45Å; G223-F225 VanDerWaalsContact C-N 3.35Å; G223-F225 PolarHBondContact O-N 3.07Å; F225-F228 PolarHBondContact O-N 3.22Å; F225-G229 PolarHBondContact O-N 3.09Å; F225-G229 VanDerWaalsContact O-N 3.08Å
226F94Very high92.3Very high11 Ų1123.4 Ų23.45%0.04813%0.13CC..Hα-helixtrans-62.2-44.4172.5-164.5-83000111.3V29 S33 V36 L37 F199 A222 G223 I224 G229 Q230 Y348V29-F226 HydrophobicContact CG1-CB 4.28Å; V29-F226 HydrophobicContact CG1-CD2 4.42Å; S33-F226 WeakPolarHBondContact CB-O 3.28Å; S33-F226 WeakPolarHBondContact OG-CD1 3.27Å; S33-F226 WeakPolarHBondContact OG-CE1 3.45Å; S33-F226 PolarHBondContact OG-O 3.25Å; V36-F226 HydrophobicContact CG1-CE2 3.93Å; V36-F226 HydrophobicContact CG1-CZ 3.62Å; L37-F226 HydrophobicContact CD1-CE1 4.34Å; F199-F226 HydrophobicContact CE2-CD2 4.36Å; A222-F226 PolarHBondContact O-N 3.26Å; A222-F226 VanDerWaalsContact O-N 3.13Å; G223-F226 WeakPolarHBondContact O-CA 3.41Å; G223-F226 VanDerWaalsContact O-CB 3.31Å; G223-F226 WeakPolarHBondContact O-CB 3.5Å; G223-F226 PolarHBondContact O-N 3.4Å; G223-F226 VanDerWaalsContact O-N 3.13Å; I224-F226 VanDerWaalsContact C-N 3.3Å; I224-F226 PolarHBondContact O-N 2.92Å; F226-G229 PolarHBondContact O-N 3.47Å; F226-G229 VanDerWaalsContact O-N 3.17Å; F226-Q230 PolarHBondContact O-N 3.47Å; F226-Q230 VanDerWaalsContact O-N 3.15Å; F226-Y348 WeakPolarHBondContact CD1-OH 3.39Å; F226-Y348 VanDerWaalsContact CE1-OH 3.25Å; F226-Y348 WeakPolarHBondContact CE1-OH 3.31Å
227S95.4Very high92.8Very high0 Ų022.3 Ų22.30%012%0.124CC..Hα-helixtrans-64.5-38.1176.1-48.60000112.7G223 I224 G229 Q230 I231 E373G223-S227 PolarHBondContact O-N 3.21Å; G223-S227 PolarHBondContact O-OG 3.4Å; G223-S227 VanDerWaalsContact O-OG 3.08Å; I224-S227 PolarHBondContact O-N 3.36Å; S227-G229 VanDerWaalsContact C-N 3.3Å; S227-G229 PolarHBondContact O-N 3.27Å; S227-Q230 WeakPolarHBondContact O-CB 3.31Å; S227-Q230 PolarHBondContact O-N 3.01Å; S227-Q230 VanDerWaalsContact O-N 3.14Å; S227-I231 WeakPolarHBondContact O-CG1 3.38Å; S227-I231 PolarHBondContact O-N 3.4Å; S227-E373 WeakPolarHBondContact OG-CB 3.28Å; S227-E373 PolarHBondContact OG-OE2 3.3Å
228F96.5Very high93.1Very high82 Ų8228.4 Ų28.436%0.3614%0.144SC..Hα-helixtrans-58.8-42171.2-85.1-62.9000112.1I30 I224 F225 Q230 I231 F232 M374I30-F228 HydrophobicContact CD1-CB 4.35Å; I30-F228 HydrophobicContact CG1-CB 4.35Å; I224-F228 HydrophobicContact CG2-CD2 4.01Å; I224-F228 HydrophobicContact CG2-CE2 3.75Å; I224-F228 VanDerWaalsContact O-CD2 3.29Å; I224-F228 WeakPolarHBondContact O-CD2 3.28Å; I224-F228 PolarHBondContact O-N 2.82Å; F225-F228 PolarHBondContact O-N 3.22Å; F228-Q230 VanDerWaalsContact C-N 3.28Å; F228-Q230 PolarHBondContact O-N 3.42Å; F228-I231 PolarHBondContact O-N 3.37Å; F228-F232 HydrophobicContact CB-CE2 4.45Å; F228-F232 WeakPolarHBondContact O-CD2 3.49Å; F228-F232 WeakPolarHBondContact O-CG 3.45Å; F228-F232 PolarHBondContact O-N 3.04Å; F228-M374 HydrophobicContact CB-CE 4.32Å; F228-M374 HydrophobicContact CD1-CE 3.57Å; F228-M374 HydrophobicContact CD2-CE 3.83Å; F228-M374 HydrophobicContact CE1-CE 3.69Å; F228-M374 HydrophobicContact CE1-SD 4.45Å; F228-M374 HydrophobicContact CE2-CE 3.95Å; F228-M374 HydrophobicContact CG-CE 3.63Å; F228-M374 HydrophobicContact CZ-CE 3.88Å; F228-M374 HydrophobicContact CZ-SD 4.29Å
229G96.7Very high93.5Very high0 Ų034.3 Ų34.30%017%0.174CC..Hα-helixtrans-58.5-40.8174.400000112.3I30 M34 F225 F226 S227 F232 L233I30-G229 WeakPolarHBondContact O-CA 3.49Å; M34-G229 WeakPolarHBondContact CG-O 3.24Å; F225-G229 PolarHBondContact O-N 3.09Å; F225-G229 VanDerWaalsContact O-N 3.08Å; F226-G229 PolarHBondContact O-N 3.47Å; F226-G229 VanDerWaalsContact O-N 3.17Å; S227-G229 VanDerWaalsContact C-N 3.3Å; S227-G229 PolarHBondContact O-N 3.27Å; G229-F232 PolarHBondContact O-N 3.24Å; G229-L233 WeakPolarHBondContact O-CB 3.12Å; G229-L233 PolarHBondContact O-N 3.14Å
230Q95.6Very high94.1Very high1 Ų136.2 Ų36.21%0.00518%0.175CC..Hα-helixtrans-64.9-43.4176.3-170.6-168.1-16.500112.7L37 F226 S227 F228 L233 G234 F366L37-Q230 HydrophobicContact CD1-CB 4.18Å; L37-Q230 HydrophobicContact CD1-CG 3.88Å; F226-Q230 PolarHBondContact O-N 3.47Å; F226-Q230 VanDerWaalsContact O-N 3.15Å; S227-Q230 WeakPolarHBondContact O-CB 3.31Å; S227-Q230 PolarHBondContact O-N 3.01Å; S227-Q230 VanDerWaalsContact O-N 3.14Å; F228-Q230 VanDerWaalsContact C-N 3.28Å; F228-Q230 PolarHBondContact O-N 3.42Å; Q230-L233 PolarHBondContact O-N 3.37Å; Q230-G234 PolarHBondContact O-N 2.9Å; Q230-F366 HydrophobicContact CG-CD1 3.64Å; Q230-F366 HydrophobicContact CG-CE1 4.14Å; Q230-F366 PolarHBondContact NE2-O 3.18Å
231I97.1Very high94.3Very high12 Ų1240 Ų406%0.06220%0.196CC..Hα-helixtrans-61.8-46.4177.6-65.1170.8000110.3S227 F228 G234 S235 F371 M374S227-I231 WeakPolarHBondContact O-CG1 3.38Å; S227-I231 PolarHBondContact O-N 3.4Å; F228-I231 PolarHBondContact O-N 3.37Å; I231-G234 PolarHBondContact O-N 3.48Å; I231-S235 WeakPolarHBondContact O-CB 3.38Å; I231-S235 PolarHBondContact O-N 3.28Å; I231-S235 PolarHBondContact O-OG 3.29Å; I231-F371 HydrophobicContact CD1-CD1 3.82Å; I231-F371 HydrophobicContact CD1-CD2 4.14Å; I231-F371 HydrophobicContact CD1-CE1 3.87Å; I231-F371 HydrophobicContact CD1-CE2 4.19Å; I231-F371 HydrophobicContact CD1-CG 3.96Å; I231-F371 HydrophobicContact CD1-CZ 4.05Å; I231-F371 HydrophobicContact CG1-CD2 4.45Å; I231-F371 HydrophobicContact CG2-CE2 4.16Å; I231-F371 HydrophobicContact CG2-CZ 4.27Å; I231-M374 HydrophobicContact CD1-CE 3.41Å; I231-M374 VanDerWaalsContact CD1-CE 3.41Å; I231-M374 HydrophobicContact CD1-SD 4.33Å
232F96.8Very high94.7Very high97 Ų9742.8 Ų42.843%0.42521%0.205SC..Hα-helixtrans-64.9-39.6177.6-67.3-30.6000112.1I30 M34 F228 G229 S235 L236I30-F232 HydrophobicContact CD1-CE2 4.45Å; I30-F232 HydrophobicContact CG2-CD2 3.61Å; I30-F232 HydrophobicContact CG2-CE2 4.07Å; M34-F232 HydrophobicContact SD-CB 3.94Å; F228-F232 HydrophobicContact CB-CE2 4.45Å; F228-F232 WeakPolarHBondContact O-CD2 3.49Å; F228-F232 WeakPolarHBondContact O-CG 3.45Å; F228-F232 PolarHBondContact O-N 3.04Å; G229-F232 PolarHBondContact O-N 3.24Å; F232-S235 PolarHBondContact O-N 2.91Å; F232-L236 WeakPolarHBondContact O-CB 3.46Å; F232-L236 VanDerWaalsContact O-CG 3.24Å; F232-L236 WeakPolarHBondContact O-CG 3.48Å; F232-L236 PolarHBondContact O-N 3.46Å
233L97.1Very high95.1Very high0 Ų043.4 Ų43.40%021%0.207CC..Hα-helixtrans-58.9-50.9174.6178.663.5000111.6M34 L37 F41 G229 Q230 S235 L236 A237 I250 F366M34-L233 HydrophobicContact CB-CB 4.39Å; M34-L233 HydrophobicContact CG-CB 4Å; L37-L233 HydrophobicContact CB-CD2 3.58Å; F41-L233 HydrophobicContact CD2-CD1 4.17Å; F41-L233 HydrophobicContact CD2-CD2 4.02Å; F41-L233 HydrophobicContact CD2-CG 3.83Å; F41-L233 HydrophobicContact CE2-CD2 3.93Å; F41-L233 HydrophobicContact CE2-CG 3.71Å; G229-L233 WeakPolarHBondContact O-CB 3.12Å; G229-L233 PolarHBondContact O-N 3.14Å; Q230-L233 PolarHBondContact O-N 3.37Å; L233-S235 VanDerWaalsContact C-N 3.26Å; L233-S235 PolarHBondContact O-N 2.71Å; L233-L236 PolarHBondContact O-N 2.94Å; L233-A237 WeakPolarHBondContact O-CB 3.27Å; L233-A237 PolarHBondContact O-N 2.95Å; L233-I250 HydrophobicContact CD1-CD1 3.44Å; L233-I250 VanDerWaalsContact CD1-CD1 3.44Å; L233-I250 HydrophobicContact CD1-CG1 4.19Å; L233-F366 HydrophobicContact CD2-CD1 4.38Å; L233-F366 HydrophobicContact CD2-CE1 4.01Å
234G95.6Very high95.3Very high0 Ų043.6 Ų43.60%020%0.204CC..Hα-helixtrans-62.4-35178.700000112.5Q230 I231 Y238Q230-G234 PolarHBondContact O-N 2.9Å; I231-G234 PolarHBondContact O-N 3.48Å; G234-Y238 PolarHBondContact O-N 3.14Å
235S96Very high95.5Very high43 Ų4346.8 Ų46.830%0.30121%0.214SC..Hα-helixtrans-69.4-44175.7-54.10000111.9I231 F232 L233 A237 Y238 L239I231-S235 WeakPolarHBondContact O-CB 3.38Å; I231-S235 PolarHBondContact O-N 3.28Å; I231-S235 PolarHBondContact O-OG 3.29Å; F232-S235 PolarHBondContact O-N 2.91Å; L233-S235 VanDerWaalsContact C-N 3.26Å; L233-S235 PolarHBondContact O-N 2.71Å; S235-A237 VanDerWaalsContact C-N 3.31Å; S235-A237 PolarHBondContact O-N 2.86Å; S235-Y238 WeakPolarHBondContact O-CB 3.38Å; S235-Y238 PolarHBondContact O-N 2.95Å; S235-L239 PolarHBondContact O-N 2.89Å
236L96.5Very high95.7Very high36 Ų3645.5 Ų45.519%0.18821%0.209CC..Hα-helixtrans-64.6-36.6176.1-71.6171.4000111.4M34 F232 L233 Y238 L239 F240 L246 A249 I250M34-L236 HydrophobicContact SD-CD1 3.99Å; F232-L236 WeakPolarHBondContact O-CB 3.46Å; F232-L236 VanDerWaalsContact O-CG 3.24Å; F232-L236 WeakPolarHBondContact O-CG 3.48Å; F232-L236 PolarHBondContact O-N 3.46Å; L233-L236 PolarHBondContact O-N 2.94Å; L236-Y238 PolarHBondContact O-N 3.4Å; L236-L239 PolarHBondContact O-N 3.29Å; L236-F240 HydrophobicContact CB-CD2 4.44Å; L236-F240 HydrophobicContact CD2-CD2 4.31Å; L236-F240 HydrophobicContact CD2-CE2 3.91Å; L236-F240 WeakPolarHBondContact O-CD2 3.47Å; L236-F240 PolarHBondContact O-N 3.38Å; L236-L246 HydrophobicContact CB-CD1 3.65Å; L236-A249 HydrophobicContact CD2-CB 4.35Å; L236-I250 HydrophobicContact CD1-CG1 4.26Å
237A95.1Very high95.9Very high3 Ų345 Ų453%0.02521%0.206CC..Hα-helixtrans-64.8-22.4175.700000113.2F41 L233 S235 L246F41-A237 HydrophobicContact CB-CB 4.29Å; F41-A237 HydrophobicContact CD1-CB 3.52Å; F41-A237 HydrophobicContact CD2-CB 3.9Å; F41-A237 HydrophobicContact CE1-CB 3.65Å; F41-A237 HydrophobicContact CE2-CB 4.05Å; F41-A237 HydrophobicContact CG-CB 3.61Å; F41-A237 HydrophobicContact CZ-CB 3.91Å; L233-A237 WeakPolarHBondContact O-CB 3.27Å; L233-A237 PolarHBondContact O-N 2.95Å; S235-A237 VanDerWaalsContact C-N 3.31Å; S235-A237 PolarHBondContact O-N 2.86Å; A237-L246 HydrophobicContact CB-CD2 4.2Å
238Y92.4Very high96Very high186 Ų18647.2 Ų47.273%0.72922%0.218SC*.Hα-helixtrans-77.3-31170.4-165.6-93000112.6G234 S235 L236G234-Y238 PolarHBondContact O-N 3.14Å; S235-Y238 WeakPolarHBondContact O-CB 3.38Å; S235-Y238 PolarHBondContact O-N 2.95Å; L236-Y238 PolarHBondContact O-N 3.4Å
239L94.3Very high96Very high125 Ų12544.4 Ų44.465%0.65421%0.21SC*.Hα-helixtrans-84.7-29.4-178.1-62.6175.2000112.9S235 L236S235-L239 PolarHBondContact O-N 2.89Å; L236-L239 PolarHBondContact O-N 3.29Å
240F95.2Very high96.1Very high66 Ų6644.4 Ų44.429%0.28921%0.21SC..  trans-116.9109.3-176.7-65.3-77.7000110.9L236 R242 L246 A249L236-F240 HydrophobicContact CB-CD2 4.44Å; L236-F240 HydrophobicContact CD2-CD2 4.31Å; L236-F240 HydrophobicContact CD2-CE2 3.91Å; L236-F240 WeakPolarHBondContact O-CD2 3.47Å; L236-F240 PolarHBondContact O-N 3.38Å; F240-R242 VanDerWaalsContact C-N 3.33Å; F240-L246 HydrophobicContact CB-CB 3.98Å; F240-L246 HydrophobicContact CB-CD1 4.49Å; F240-A249 HydrophobicContact CD2-CB 3.93Å; F240-A249 HydrophobicContact CE2-CB 3.47Å; F240-A249 VanDerWaalsContact CE2-CB 3.47Å; F240-A249 HydrophobicContact CZ-CB 3.86Å
241D91.9Very high96.1Very high83 Ų8344.4 Ų44.444%0.44421%0.21SC..SBendtrans-80.3-11178.964.8-15000114F112 A113 R114F112-D241 CarbonylContact C-O 3.56Å; F112-D241 WeakPolarHBondContact CA-O 3.4Å; F112-D241 WeakPolarHBondContact CB-O 3.39Å; A113-D241 HydrophobicContact CB-CB 4.1Å; A113-D241 WeakPolarHBondContact CB-OD2 3.23Å; A113-D241 PolarHBondContact N-O 3.48Å; R114-D241 PolarHBondContact N-O 2.87Å
242R95.9Very high96.1Very high63 Ų6347.7 Ų47.724%0.23823%0.227CC..BIsolated β-bridgetrans-113.1134.2175.4-61.3174.449.3165.33.2111.9A113 R114 F240 D244 Y245 L246A113-R242 HydrophobicContact CB-CG 4.32Å; R114-R242 HydrophobicContact CB-CB 4.45Å; R114-R242 HydrophobicContact CB-CG 4.12Å; R114-R242 WeakPolarHBondContact O-CA 3.47Å; F240-R242 VanDerWaalsContact C-N 3.33Å; R242-D244 VanDerWaalsContact C-N 3.29Å; R242-D244 WeakPolarHBondContact CB-OD1 3.29Å; R242-D244 IonicContact CZ-OD1 3.4Å; R242-D244 IonicContact CZ-OD2 2.77Å; R242-D244 IonicContact NE-OD1 3.57Å; R242-D244 PolarHBondContact NE-OD1 3.35Å; R242-D244 VanDerWaalsContact NE-OD1 3.12Å; R242-D244 IonicContact NE-OD2 2.68Å; R242-D244 IonicContact NH2-OD1 3.74Å; R242-D244 IonicContact NH2-OD2 3.67Å; R242-D244 PolarHBondContact NH2-OD2 3.35Å; R242-D244 PolarHBondContact O-N 2.75Å; R242-Y245 HydrophobicContact CB-CD2 4Å; R242-Y245 HydrophobicContact CG-CD2 4.36Å; R242-Y245 PolarHBondContact NH1-OH 2.94Å; R242-Y245 PolarHBondContact O-N 3.43Å; R242-L246 PolarHBondContact O-N 3.09Å
243Y95.6Very high96Very high13 Ų1345.7 Ų45.75%0.05122%0.224CC..Hα-helixtrans-63.5-31.2-175.581.6-89.7000114.5T42 R114 E119 W120 Q247T42-Y243 HydrophobicContact CG2-CD2 3.63Å; T42-Y243 HydrophobicContact CG2-CE2 4.48Å; T42-Y243 HydrophobicContact CG2-CG 3.99Å; R114-Y243 HydrophobicContact CG-CD1 4.16Å; R114-Y243 HydrophobicContact CG-CE1 4.13Å; R114-Y243 PolarHBondContact O-N 3.45Å; E119-Y243 HydrophobicContact CB-CE1 4.19Å; E119-Y243 HydrophobicContact CG-CE1 4.49Å; W120-Y243 HydrophobicContact CH2-CE2 4.23Å; W120-Y243 AromaticContact CH2-CZ 3.96Å; W120-Y243 VanDerWaalsContact CH2-OH 3.26Å; W120-Y243 WeakPolarHBondContact CH2-OH 3.29Å; W120-Y243 WeakPolarHBondContact CZ2-OH 3.45Å; Y243-Q247 VanDerWaalsContact O-CB 3.23Å; Y243-Q247 WeakPolarHBondContact O-CB 3.38Å; Y243-Q247 PolarHBondContact O-N 3.35Å
244D96.4Very high95.8Very high22 Ų2245.7 Ų45.712%0.11822%0.224CC..Hα-helixtrans-71.7-45.2-179.153.8-18.9000111.2A176 R242 Q247 L248A176-D244 HydrophobicContact CB-CB 4.36Å; A176-D244 WeakPolarHBondContact CB-O 3.41Å; A176-D244 WeakPolarHBondContact O-CB 3.44Å; R242-D244 VanDerWaalsContact C-N 3.29Å; R242-D244 WeakPolarHBondContact CB-OD1 3.29Å; R242-D244 IonicContact CZ-OD1 3.4Å; R242-D244 IonicContact CZ-OD2 2.77Å; R242-D244 IonicContact NE-OD1 3.57Å; R242-D244 PolarHBondContact NE-OD1 3.35Å; R242-D244 VanDerWaalsContact NE-OD1 3.12Å; R242-D244 IonicContact NE-OD2 2.68Å; R242-D244 IonicContact NH2-OD1 3.74Å; R242-D244 IonicContact NH2-OD2 3.67Å; R242-D244 PolarHBondContact NH2-OD2 3.35Å; R242-D244 PolarHBondContact O-N 2.75Å; D244-Q247 PolarHBondContact O-N 3.29Å; D244-L248 WeakPolarHBondContact O-CG 3.26Å; D244-L248 PolarHBondContact O-N 2.9Å
245Y97.5Very high95.8Very high112 Ų11250.6 Ų50.644%0.43925%0.245SC..Hα-helixtrans-64.5-41171.9-64.2-36.8000112.4R242 Q247 L248 A249R242-Y245 HydrophobicContact CB-CD2 4Å; R242-Y245 HydrophobicContact CG-CD2 4.36Å; R242-Y245 PolarHBondContact NH1-OH 2.94Å; R242-Y245 PolarHBondContact O-N 3.43Å; Y245-Q247 VanDerWaalsContact C-N 3.31Å; Y245-Q247 PolarHBondContact O-N 3.09Å; Y245-L248 HydrophobicContact CD1-CD1 4.48Å; Y245-L248 PolarHBondContact O-N 3.29Å; Y245-A249 WeakPolarHBondContact O-CB 2.86Å; Y245-A249 PolarHBondContact O-N 2.83Å
246L97.5Very high95.6Very high1 Ų154.5 Ų54.51%0.00526%0.262CS..Hα-helixtrans-57.4-46.1172.7177.459.8000111.2F41 L236 A237 F240 R242 L248 A249 I250F41-L246 HydrophobicContact CB-CD2 3.76Å; F41-L246 HydrophobicContact CG-CD2 4.47Å; L236-L246 HydrophobicContact CB-CD1 3.65Å; A237-L246 HydrophobicContact CB-CD2 4.2Å; F240-L246 HydrophobicContact CB-CB 3.98Å; F240-L246 HydrophobicContact CB-CD1 4.49Å; R242-L246 PolarHBondContact O-N 3.09Å; L246-L248 PolarHBondContact O-N 2.84Å; L246-A249 PolarHBondContact O-N 3.33Å; L246-I250 HydrophobicContact CD1-CD1 4.16Å; L246-I250 HydrophobicContact CD1-CG1 4.47Å; L246-I250 HydrophobicContact CG-CD1 4.06Å; L246-I250 WeakPolarHBondContact O-CD1 3.45Å; L246-I250 VanDerWaalsContact O-CG1 3.27Å; L246-I250 WeakPolarHBondContact O-CG1 3.5Å; L246-I250 PolarHBondContact O-N 3.24Å
247Q97.9Very high95.4Very high0 Ų053.6 Ų53.60%026%0.257CS..Hα-helixtrans-64.1-38.2179.3-178.962.135.700112.3H35 S38 G172 I175 A176 Y243 D244 Y245 S251H35-Q247 PolarHBondContact CE1-NE2 3.48Å; S38-Q247 PolarHBondContact OG-OE1 3.28Å; G172-Q247 VanDerWaalsContact O-CG 3.31Å; G172-Q247 WeakPolarHBondContact O-CG 3.4Å; G172-Q247 PolarHBondContact O-NE2 3.11Å; I175-Q247 HydrophobicContact CB-CG 4.09Å; I175-Q247 HydrophobicContact CG2-CG 3.89Å; A176-Q247 HydrophobicContact CB-CB 4.2Å; A176-Q247 HydrophobicContact CB-CG 4.12Å; Y243-Q247 VanDerWaalsContact O-CB 3.23Å; Y243-Q247 WeakPolarHBondContact O-CB 3.38Å; Y243-Q247 PolarHBondContact O-N 3.35Å; D244-Q247 PolarHBondContact O-N 3.29Å; Y245-Q247 VanDerWaalsContact C-N 3.31Å; Y245-Q247 PolarHBondContact O-N 3.09Å; Q247-S251 PolarHBondContact NE2-OG 3.39Å; Q247-S251 WeakPolarHBondContact O-CB 3.33Å; Q247-S251 PolarHBondContact O-N 3.36Å; Q247-S251 VanDerWaalsContact O-N 3.07Å; Q247-S251 PolarHBondContact O-OG 3.45Å
248L97.9Very high95.1Very high47 Ų4757.1 Ų57.125%0.24627%0.272CS..Hα-helixtrans-66.3-44172.4-70.6173.1000111.8I173 A176 D244 Y245 L246 I250 S251 L252I173-L248 HydrophobicContact CG2-CD2 4.33Å; A176-L248 HydrophobicContact CB-CD1 4.31Å; A176-L248 HydrophobicContact CB-CD2 3.73Å; A176-L248 HydrophobicContact CB-CG 3.6Å; D244-L248 WeakPolarHBondContact O-CG 3.26Å; D244-L248 PolarHBondContact O-N 2.9Å; Y245-L248 HydrophobicContact CD1-CD1 4.48Å; Y245-L248 PolarHBondContact O-N 3.29Å; L246-L248 PolarHBondContact O-N 2.84Å; L248-I250 PolarHBondContact O-N 3.38Å; L248-S251 PolarHBondContact O-N 3.48Å; L248-S251 VanDerWaalsContact O-N 3.09Å; L248-L252 HydrophobicContact CB-CD1 4.3Å; L248-L252 WeakPolarHBondContact O-CB 3.44Å; L248-L252 VanDerWaalsContact O-CG 3.26Å; L248-L252 WeakPolarHBondContact O-CG 3.4Å; L248-L252 PolarHBondContact O-N 3.33Å
249A97.6Very high95Very high23 Ų2350.5 Ų50.519%0.1925%0.253CS..Hα-helixtrans-60.1-32.3178.400000112.5L236 F240 Y245 L246 P253L236-A249 HydrophobicContact CD2-CB 4.35Å; F240-A249 HydrophobicContact CD2-CB 3.93Å; F240-A249 HydrophobicContact CE2-CB 3.47Å; F240-A249 VanDerWaalsContact CE2-CB 3.47Å; F240-A249 HydrophobicContact CZ-CB 3.86Å; Y245-A249 WeakPolarHBondContact O-CB 2.86Å; Y245-A249 PolarHBondContact O-N 2.83Å; L246-A249 PolarHBondContact O-N 3.33Å; A249-P253 WeakPolarHBondContact O-CD 3.38Å; A249-P253 WeakPolarHBondContact O-CG 3.45Å
250I97.3Very high94.7Very high0 Ų045 Ų450%022%0.223CC..Hα-helixtrans-74.2-43.2173.4-64.8161.3000111.6I31 M34 L233 L236 L246 L248I31-I250 HydrophobicContact CG2-CG2 4.45Å; M34-I250 HydrophobicContact CB-CG1 4.27Å; M34-I250 HydrophobicContact CB-CG2 3.55Å; M34-I250 HydrophobicContact CE-CG2 4.37Å; M34-I250 HydrophobicContact SD-CG1 4.38Å; L233-I250 HydrophobicContact CD1-CD1 3.44Å; L233-I250 VanDerWaalsContact CD1-CD1 3.44Å; L233-I250 HydrophobicContact CD1-CG1 4.19Å; L236-I250 HydrophobicContact CD1-CG1 4.26Å; L246-I250 HydrophobicContact CD1-CD1 4.16Å; L246-I250 HydrophobicContact CD1-CG1 4.47Å; L246-I250 HydrophobicContact CG-CD1 4.06Å; L246-I250 WeakPolarHBondContact O-CD1 3.45Å; L246-I250 VanDerWaalsContact O-CG1 3.27Å; L246-I250 WeakPolarHBondContact O-CG1 3.5Å; L246-I250 PolarHBondContact O-N 3.24Å; L248-I250 PolarHBondContact O-N 3.38Å
251S97.4Very high94.4Very high0 Ų047.9 Ų47.90%023%0.233CC..Hα-helixtrans-79.8-42.6-169.4-51.60000113H35 L169 G172 Q247 L248 A254H35-S251 PolarHBondContact CE1-OG 3.41Å; L169-S251 WeakPolarHBondContact CD1-O 3.27Å; G172-S251 WeakPolarHBondContact CA-OG 3.34Å; G172-S251 PolarHBondContact O-OG 3.3Å; Q247-S251 PolarHBondContact NE2-OG 3.39Å; Q247-S251 WeakPolarHBondContact O-CB 3.33Å; Q247-S251 PolarHBondContact O-N 3.36Å; Q247-S251 VanDerWaalsContact O-N 3.07Å; Q247-S251 PolarHBondContact O-OG 3.45Å; L248-S251 PolarHBondContact O-N 3.48Å; L248-S251 VanDerWaalsContact O-N 3.09Å; S251-A254 VanDerWaalsContact O-CB 3.28Å; S251-A254 WeakPolarHBondContact O-CB 3.35Å; S251-A254 PolarHBondContact O-N 3.07Å; S251-A254 VanDerWaalsContact O-N 3.1Å
252L96.4Very high94.3Very high82 Ų8253.4 Ų53.443%0.42925%0.248SC..G310 helixtrans-61.4-38.1-172.1-68.7174.8000114.4I173 L248 A254 F255I173-L252 HydrophobicContact CD1-CD2 4.24Å; L248-L252 HydrophobicContact CB-CD1 4.3Å; L248-L252 WeakPolarHBondContact O-CB 3.44Å; L248-L252 VanDerWaalsContact O-CG 3.26Å; L248-L252 WeakPolarHBondContact O-CG 3.4Å; L248-L252 PolarHBondContact O-N 3.33Å; L252-A254 PolarHBondContact O-N 2.9Å; L252-F255 HydrophobicContact CD2-CD2 4.13Å; L252-F255 HydrophobicContact CD2-CE2 3.79Å; L252-F255 WeakPolarHBondContact O-CB 3.46Å; L252-F255 VanDerWaalsContact O-CD2 3.3Å; L252-F255 WeakPolarHBondContact O-CD2 3.3Å; L252-F255 PolarHBondContact O-N 3.34Å
253P95.2Very high94Very high54 Ų5454.4 Ų54.435%0.35126%0.257SS..G310 helixtrans-59-19.8176.2-26.336000114I31 A249 F255 L256I31-P253 HydrophobicContact CD1-CB 3.87Å; A249-P253 WeakPolarHBondContact O-CD 3.38Å; A249-P253 WeakPolarHBondContact O-CG 3.45Å; P253-F255 PolarHBondContact O-N 3.34Å; P253-L256 WeakPolarHBondContact O-CB 3.28Å; P253-L256 WeakPolarHBondContact O-CG 3.31Å; P253-L256 PolarHBondContact O-N 3.48Å; P253-L256 VanDerWaalsContact O-N 3.09Å
254A93.2Very high93.8Very high0 Ų053.8 Ų53.80%026%0.255CS..G310 helixtrans-65.5-19.217600000113.2I31 L169 S251 L252 L256 F257I31-A254 HydrophobicContact CD1-CB 3.8Å; I31-A254 VanDerWaalsContact CD1-N 3.33Å; I31-A254 HydrophobicContact CG2-CB 4.46Å; L169-A254 HydrophobicContact CB-CB 4.41Å; L169-A254 HydrophobicContact CD1-CB 4.17Å; S251-A254 VanDerWaalsContact O-CB 3.28Å; S251-A254 WeakPolarHBondContact O-CB 3.35Å; S251-A254 PolarHBondContact O-N 3.07Å; S251-A254 VanDerWaalsContact O-N 3.1Å; L252-A254 PolarHBondContact O-N 2.9Å; A254-L256 PolarHBondContact O-N 3.42Å; A254-F257 HydrophobicContact CB-CD2 4.18Å; A254-F257 WeakPolarHBondContact O-CB 3.25Å; A254-F257 PolarHBondContact O-N 3.31Å
255F93.9Very high93.6Very high103 Ų10354.1 Ų54.145%0.45226%0.259SS..G310 helixtrans-56.8-32.5170.6-84.3-77.5000112.3L169 I173 L252 P253 F257 F258L169-F255 HydrophobicContact CD1-CD2 3.84Å; L169-F255 HydrophobicContact CD1-CE2 3.76Å; L169-F255 HydrophobicContact CD1-CG 4.48Å; L169-F255 HydrophobicContact CD1-CZ 4.32Å; L169-F255 HydrophobicContact CD2-CD1 3.91Å; L169-F255 HydrophobicContact CD2-CD2 4.13Å; L169-F255 HydrophobicContact CD2-CE1 3.8Å; L169-F255 HydrophobicContact CD2-CE2 4.05Å; L169-F255 HydrophobicContact CD2-CG 4.05Å; L169-F255 HydrophobicContact CD2-CZ 3.86Å; L169-F255 HydrophobicContact CG-CE2 4.34Å; L169-F255 HydrophobicContact CG-CZ 4.43Å; I173-F255 HydrophobicContact CD1-CE2 3.83Å; I173-F255 HydrophobicContact CD1-CZ 4.15Å; L252-F255 HydrophobicContact CD2-CD2 4.13Å; L252-F255 HydrophobicContact CD2-CE2 3.79Å; L252-F255 WeakPolarHBondContact O-CB 3.46Å; L252-F255 VanDerWaalsContact O-CD2 3.3Å; L252-F255 WeakPolarHBondContact O-CD2 3.3Å; L252-F255 PolarHBondContact O-N 3.34Å; P253-F255 PolarHBondContact O-N 3.34Å; F255-F257 PolarHBondContact O-N 2.96Å; F255-F258 HydrophobicContact CB-CD2 4.47Å; F255-F258 AromaticContact CD1-CD2 3.81Å; F255-F258 HydrophobicContact CD1-CD2 3.81Å; F255-F258 AromaticContact CD1-CE2 3.49Å; F255-F258 HydrophobicContact CD1-CE2 3.49Å; F255-F258 VanDerWaalsContact CD1-CE2 3.49Å; F255-F258 AromaticContact CE1-CE2 3.91Å; F255-F258 HydrophobicContact CE1-CE2 3.91Å; F255-F258 HydrophobicContact CG-CE2 4.35Å; F255-F258 WeakPolarHBondContact O-CB 3.37Å; F255-F258 VanDerWaalsContact O-CD2 3.31Å; F255-F258 WeakPolarHBondContact O-CD2 3.41Å; F255-F258 PolarHBondContact O-N 3.36Å; F255-F258 VanDerWaalsContact O-N 3.12Å
256L93.2Very high93.4Very high126 Ų12650.1 Ų50.166%0.6624%0.244SC*.G310 helixtrans-61.1-28178.2-61.7175.6000111.8P253 A254 F258 S259P253-L256 WeakPolarHBondContact O-CB 3.28Å; P253-L256 WeakPolarHBondContact O-CG 3.31Å; P253-L256 PolarHBondContact O-N 3.48Å; P253-L256 VanDerWaalsContact O-N 3.09Å; A254-L256 PolarHBondContact O-N 3.42Å; L256-F258 VanDerWaalsContact C-N 3.26Å; L256-F258 PolarHBondContact O-N 3.43Å; L256-S259 WeakPolarHBondContact O-CB 3.37Å; L256-S259 PolarHBondContact O-N 3.23Å; L256-S259 PolarHBondContact O-OG 2.92Å
257F91.9Very high93.1Very high17 Ų1750.4 Ų50.48%0.07525%0.246CC..G310 helixtrans-77.2-7.3-179.1-54.7-43.1000113.7L27 P28 I31 F162 I165 A254 F255 S259 Y260L27-F257 HydrophobicContact CB-CE1 3.85Å; L27-F257 HydrophobicContact CB-CZ 4.1Å; P28-F257 VanDerWaalsContact CA-CE2 3.49Å; P28-F257 HydrophobicContact CB-CD2 3.99Å; P28-F257 HydrophobicContact CB-CE2 3.86Å; P28-F257 HydrophobicContact CB-CZ 4.31Å; P28-F257 HydrophobicContact CG-CB 4.47Å; P28-F257 HydrophobicContact CG-CD1 3.88Å; P28-F257 HydrophobicContact CG-CD2 3.75Å; P28-F257 HydrophobicContact CG-CE1 3.96Å; P28-F257 HydrophobicContact CG-CE2 3.8Å; P28-F257 HydrophobicContact CG-CG 3.79Å; P28-F257 HydrophobicContact CG-CZ 3.93Å; I31-F257 HydrophobicContact CB-CE2 4.48Å; I31-F257 HydrophobicContact CD1-CD2 4.22Å; I31-F257 HydrophobicContact CD1-CE2 3.36Å; I31-F257 HydrophobicContact CD1-CZ 4.02Å; I31-F257 HydrophobicContact CG1-CE2 3.83Å; I31-F257 HydrophobicContact CG1-CZ 4.32Å; F162-F257 WeakPolarHBondContact CE1-O 3.38Å; I165-F257 HydrophobicContact CD1-CB 4.11Å; I165-F257 HydrophobicContact CG2-CB 4.23Å; A254-F257 HydrophobicContact CB-CD2 4.18Å; A254-F257 WeakPolarHBondContact O-CB 3.25Å; A254-F257 PolarHBondContact O-N 3.31Å; F255-F257 PolarHBondContact O-N 2.96Å; F257-S259 PolarHBondContact O-N 3.39Å; F257-Y260 HydrophobicContact CB-CD1 4.45Å; F257-Y260 HydrophobicContact CB-CG 4.47Å; F257-Y260 HydrophobicContact CD1-CD1 4.29Å; F257-Y260 HydrophobicContact CD1-CD2 4.35Å; F257-Y260 AromaticContact CD1-CE1 3.75Å; F257-Y260 HydrophobicContact CD1-CE1 3.75Å; F257-Y260 AromaticContact CD1-CE2 3.86Å; F257-Y260 HydrophobicContact CD1-CE2 3.86Å; F257-Y260 AromaticContact CD1-CZ 3.57Å; F257-Y260 HydrophobicContact CE1-CE1 4.28Å; F257-Y260 HydrophobicContact CE1-CE2 4.49Å; F257-Y260 AromaticContact CE1-CZ 3.94Å; F257-Y260 HydrophobicContact CG-CE1 4.48Å; F257-Y260 WeakPolarHBondContact O-CB 3.14Å; F257-Y260 PolarHBondContact O-N 3.16Å
258F88.6Confident92.7Very high77 Ų7751 Ų5134%0.33825%0.25SS..G310 helixtrans-60.3-33.5167.5-75.7-56.4000112.4I166 L169 F255 L256 Y260 Y261I166-F258 HydrophobicContact CD1-CE1 4.12Å; I166-F258 HydrophobicContact CG1-CE1 3.52Å; I166-F258 HydrophobicContact CG1-CZ 4.01Å; L169-F258 HydrophobicContact CD2-CE2 3.56Å; L169-F258 HydrophobicContact CD2-CZ 3.78Å; F255-F258 HydrophobicContact CB-CD2 4.47Å; F255-F258 AromaticContact CD1-CD2 3.81Å; F255-F258 HydrophobicContact CD1-CD2 3.81Å; F255-F258 AromaticContact CD1-CE2 3.49Å; F255-F258 HydrophobicContact CD1-CE2 3.49Å; F255-F258 VanDerWaalsContact CD1-CE2 3.49Å; F255-F258 AromaticContact CE1-CE2 3.91Å; F255-F258 HydrophobicContact CE1-CE2 3.91Å; F255-F258 HydrophobicContact CG-CE2 4.35Å; F255-F258 WeakPolarHBondContact O-CB 3.37Å; F255-F258 VanDerWaalsContact O-CD2 3.31Å; F255-F258 WeakPolarHBondContact O-CD2 3.41Å; F255-F258 PolarHBondContact O-N 3.36Å; F255-F258 VanDerWaalsContact O-N 3.12Å; L256-F258 VanDerWaalsContact C-N 3.26Å; L256-F258 PolarHBondContact O-N 3.43Å; F258-Y260 PolarHBondContact O-N 3.29Å; F258-Y260 VanDerWaalsContact O-N 3.09Å; F258-Y261 WeakPolarHBondContact O-CB 3.39Å; F258-Y261 PolarHBondContact O-N 2.85Å; F258-Y261 VanDerWaalsContact O-N 3.15Å
259S89.4Confident92.2Very high47 Ų4751.2 Ų51.233%0.32925%0.248SC..G310 helixtrans-58.9-22.8174.269.30000113L256 F257 Y261 W262 L263L256-S259 WeakPolarHBondContact O-CB 3.37Å; L256-S259 PolarHBondContact O-N 3.23Å; L256-S259 PolarHBondContact O-OG 2.92Å; F257-S259 PolarHBondContact O-N 3.39Å; S259-Y261 PolarHBondContact O-N 3.21Å; S259-W262 PolarHBondContact O-N 3.47Å; S259-L263 PolarHBondContact O-N 2.93Å
260Y88.3Confident91.7Very high10 Ų1051.1 Ų51.14%0.03924%0.243CC..Hα-helixtrans-68-19.3-178.5-73.5-162.3000112.6L24 L27 P28 F161 F162 F257 F258 W262 L263 V264L24-Y260 WeakPolarHBondContact CA-OH 3.37Å; L24-Y260 HydrophobicContact CB-CE1 4.22Å; L24-Y260 HydrophobicContact CD2-CE2 3.75Å; L24-Y260 WeakPolarHBondContact O-CE1 3.47Å; L24-Y260 PolarHBondContact O-OH 2.87Å; L27-Y260 WeakPolarHBondContact CB-OH 3.44Å; L27-Y260 VanDerWaalsContact CD1-OH 3.23Å; L27-Y260 WeakPolarHBondContact CD1-OH 3.35Å; P28-Y260 HydrophobicContact CG-CD1 4.29Å; P28-Y260 HydrophobicContact CG-CE1 3.78Å; F161-Y260 HydrophobicContact CE1-CD1 4.42Å; F162-Y260 WeakPolarHBondContact CZ-O 3.43Å; F257-Y260 HydrophobicContact CB-CD1 4.45Å; F257-Y260 HydrophobicContact CB-CG 4.47Å; F257-Y260 HydrophobicContact CD1-CD1 4.29Å; F257-Y260 HydrophobicContact CD1-CD2 4.35Å; F257-Y260 AromaticContact CD1-CE1 3.75Å; F257-Y260 HydrophobicContact CD1-CE1 3.75Å; F257-Y260 AromaticContact CD1-CE2 3.86Å; F257-Y260 HydrophobicContact CD1-CE2 3.86Å; F257-Y260 AromaticContact CD1-CZ 3.57Å; F257-Y260 HydrophobicContact CE1-CE1 4.28Å; F257-Y260 HydrophobicContact CE1-CE2 4.49Å; F257-Y260 AromaticContact CE1-CZ 3.94Å; F257-Y260 HydrophobicContact CG-CE1 4.48Å; F257-Y260 WeakPolarHBondContact O-CB 3.14Å; F257-Y260 PolarHBondContact O-N 3.16Å; F258-Y260 PolarHBondContact O-N 3.29Å; F258-Y260 VanDerWaalsContact O-N 3.09Å; Y260-W262 PolarHBondContact O-N 3.06Å; Y260-W262 VanDerWaalsContact O-N 3.08Å; Y260-L263 HydrophobicContact CD2-CD1 4.14Å; Y260-L263 PolarHBondContact O-N 2.75Å; Y260-L263 VanDerWaalsContact O-N 3.08Å; Y260-V264 HydrophobicContact CD1-CG2 3.91Å; Y260-V264 HydrophobicContact CG-CG2 4.09Å; Y260-V264 PolarHBondContact O-N 3.21Å
261Y88.8Confident91.3Very high126 Ų12651.1 Ų51.149%0.49424%0.243SC..Hα-helixtrans-56.6-28.6177.5-177.3-95.6000110.8K158 F162 F258 S259K158-Y261 WeakPolarHBondContact CE-O 3.26Å; K158-Y261 PolarHBondContact NZ-O 2.96Å; F162-Y261 AromaticContact CD2-CD2 3.93Å; F162-Y261 HydrophobicContact CD2-CD2 3.93Å; F162-Y261 VanDerWaalsContact CE1-N 3.28Å; F162-Y261 HydrophobicContact CE2-CD2 4.16Å; F162-Y261 HydrophobicContact CG-CD2 4.3Å; F258-Y261 WeakPolarHBondContact O-CB 3.39Å; F258-Y261 PolarHBondContact O-N 2.85Å; F258-Y261 VanDerWaalsContact O-N 3.15Å; S259-Y261 PolarHBondContact O-N 3.21Å
262W90.5Very high90.7Very high199 Ų19952 Ų5275%0.75425%0.247SC*.Hα-helixtrans-96.8-27.2175-52.4-61.5000113.9S259 Y260S259-W262 PolarHBondContact O-N 3.47Å; Y260-W262 PolarHBondContact O-N 3.06Å; Y260-W262 VanDerWaalsContact O-N 3.08Å
263L90.4Very high90.1Very high83 Ų8352.6 Ų52.644%0.43525%0.254SS..Hα-helixtrans-85.4-36.3-174.2-59.9173.3000114Q21 L24 S259 Y260Q21-L263 PolarHBondContact NE2-O 2.98Å; Q21-L263 PolarHBondContact OE1-O 2.9Å; L24-L263 HydrophobicContact CD1-CB 4.15Å; S259-L263 PolarHBondContact O-N 2.93Å; Y260-L263 HydrophobicContact CD2-CD1 4.14Å; Y260-L263 PolarHBondContact O-N 2.75Å; Y260-L263 VanDerWaalsContact O-N 3.08Å
264V91.3Very high89.6Confident1 Ų153.3 Ų53.31%0.00626%0.255CS..SBendtrans-94.8121-175.2178.70000109.8L24 V25 K158 Y260L24-V264 HydrophobicContact CB-CG2 4.28Å; V25-V264 HydrophobicContact CG2-CG1 3.65Å; V25-V264 HydrophobicContact CG2-CG2 4.03Å; K158-V264 WeakPolarHBondContact CD-O 3.45Å; K158-V264 WeakPolarHBondContact CE-O 3.3Å; K158-V264 PolarHBondContact NZ-O 3.01Å; Y260-V264 HydrophobicContact CD1-CG2 3.91Å; Y260-V264 HydrophobicContact CG-CG2 4.09Å; Y260-V264 PolarHBondContact O-N 3.21Å
265P91.6Very high89.3Confident29 Ų2960.5 Ų60.519%0.18829%0.286CS..PPolyproline II helixtrans-75.2163.6175.236.4-38.8000111Y17 Q21 I283Y17-P265 WeakPolarHBondContact OH-CG 3.28Å; Q21-P265 VanDerWaalsContact CD-CD 3.49Å; P265-I283 HydrophobicContact CB-CD1 4.03Å; P265-I283 HydrophobicContact CB-CG1 4.09Å; P265-I283 HydrophobicContact CB-CG2 4.16Å; P265-I283 HydrophobicContact CG-CG2 4.45Å
266E93.8Very high89Confident27 Ų2760.4 Ų60.413%0.12628%0.283CS..PPolyproline II helixtrans-70.1160.4166.4-174.654.5-92.500110.8G156 R157 K158 A268 W270 L271G156-E266 WeakPolarHBondContact CA-OE2 3.33Å; R157-E266 WeakPolarHBondContact CB-OE1 3.49Å; R157-E266 PolarHBondContact N-OE1 2.92Å; R157-E266 PolarHBondContact N-OE2 3.46Å; R157-E266 VanDerWaalsContact N-OE2 3.1Å; K158-E266 HydrophobicContact CB-CB 4.38Å; K158-E266 WeakPolarHBondContact CB-OE2 3.34Å; K158-E266 PolarHBondContact N-OE1 2.74Å; K158-E266 PolarHBondContact N-OE2 2.88Å; E266-A268 PolarHBondContact O-N 3.49Å; E266-W270 HydrophobicContact CG-CE3 3.78Å; E266-W270 HydrophobicContact CG-CZ3 4.16Å; E266-L271 HydrophobicContact CB-CD1 4.19Å; E266-L271 HydrophobicContact CB-CG 4.48Å; E266-L271 HydrophobicContact CG-CD1 4.36Å; E266-L271 HydrophobicContact CG-CD2 4.29Å; E266-L271 HydrophobicContact CG-CG 4.11Å
267S90.3Very high88.8Confident7 Ų756.3 Ų56.35%0.04926%0.26CS..PPolyproline II helixtrans-61.3119.4173.4162.50000110.8R157 E208 R269 W270 L271R157-S267 PolarHBondContact NH1-OG 3.27Å; E208-S267 PolarHBondContact OE2-OG 2.67Å; S267-R269 PolarHBondContact O-N 2.99Å; S267-R269 PolarHBondContact OG-N 2.87Å; S267-W270 PolarHBondContact O-N 3.02Å; S267-W270 PolarHBondContact OG-N 3.37Å; S267-L271 WeakPolarHBondContact O-CG 3.21Å; S267-L271 PolarHBondContact O-N 3.29Å
268A89.7Confident88.7Confident12 Ų1261.8 Ų61.810%0.09929%0.29CS..Hα-helixtrans-59.6-36.3173.700000111.5F3 E266 L271 M272 I283 L284F3-A268 HydrophobicContact CE2-CB 3.88Å; F3-A268 HydrophobicContact CZ-CB 3.86Å; E266-A268 PolarHBondContact O-N 3.49Å; A268-L271 PolarHBondContact O-N 2.9Å; A268-M272 WeakPolarHBondContact O-CG 3.25Å; A268-M272 PolarHBondContact O-N 2.8Å; A268-I283 HydrophobicContact CB-CG2 4.4Å; A268-L284 HydrophobicContact CB-CD2 4.42Å; A268-L284 HydrophobicContact CB-CG 4.44Å
269R86.7Confident88.9Confident53 Ų5362 Ų6220%0.229%0.292CS..Hα-helixtrans-65.7-42.4175.8-60.8-169.3-164.1-149.1-14.4112.1F3 D4 E208 R215 S267 L271 M272 V273F3-R269 HydrophobicContact CD1-CG 3.59Å; F3-R269 HydrophobicContact CD2-CG 4.23Å; F3-R269 HydrophobicContact CE1-CG 3.33Å; F3-R269 VanDerWaalsContact CE1-NE 3.29Å; F3-R269 HydrophobicContact CE2-CG 4.03Å; F3-R269 HydrophobicContact CG-CG 4.03Å; F3-R269 HydrophobicContact CZ-CG 3.59Å; D4-R269 IonicContact OD1-CZ 2.75Å; D4-R269 IonicContact OD1-NH1 3.5Å; D4-R269 IonicContact OD1-NH2 3.64Å; D4-R269 PolarHBondContact OD1-NH2 3.09Å; E208-R269 HydrophobicContact CB-CG 4.43Å; E208-R269 HydrophobicContact CG-CG 4.47Å; E208-R269 PolarHBondContact O-NE 3.28Å; E208-R269 PolarHBondContact O-NH2 3.47Å; R215-R269 VanDerWaalsContact NH2-NH1 3.16Å; S267-R269 PolarHBondContact O-N 2.99Å; S267-R269 PolarHBondContact OG-N 2.87Å; R269-L271 VanDerWaalsContact C-N 3.33Å; R269-M272 WeakPolarHBondContact O-CB 3.47Å; R269-M272 PolarHBondContact O-N 3.37Å; R269-V273 WeakPolarHBondContact O-CG2 3.47Å; R269-V273 PolarHBondContact O-N 3.4Å
270W87.4Confident88.9Confident21 Ų2159.8 Ų59.88%0.0828%0.277CS..Hα-helixtrans-63.6-41177.518089.2000111.4D153 G156 E266 S267 M272 V273 N274D153-W270 PolarHBondContact O-NE1 2.89Å; G156-W270 VanDerWaalsContact CA-CE2 3.49Å; E266-W270 HydrophobicContact CG-CE3 3.78Å; E266-W270 HydrophobicContact CG-CZ3 4.16Å; S267-W270 PolarHBondContact O-N 3.02Å; S267-W270 PolarHBondContact OG-N 3.37Å; W270-M272 PolarHBondContact O-N 3.28Å; W270-V273 PolarHBondContact O-N 3Å; W270-N274 VanDerWaalsContact CD2-ND2 3.33Å; W270-N274 WeakPolarHBondContact CZ2-ND2 3.22Å; W270-N274 PolarHBondContact NE1-ND2 2.88Å; W270-N274 VanDerWaalsContact NE1-ND2 3.14Å; W270-N274 PolarHBondContact O-N 3.47Å; W270-N274 PolarHBondContact O-ND2 3.34Å
271L89.7Confident89Confident0 Ų059.9 Ų59.90%028%0.277CS..Hα-helixtrans-61.8-43.3175.6-71.4167.3000111.9E266 S267 A268 R269 N274 K275 R276 E279 A280 I283E266-L271 HydrophobicContact CB-CD1 4.19Å; E266-L271 HydrophobicContact CB-CG 4.48Å; E266-L271 HydrophobicContact CG-CD1 4.36Å; E266-L271 HydrophobicContact CG-CD2 4.29Å; E266-L271 HydrophobicContact CG-CG 4.11Å; S267-L271 WeakPolarHBondContact O-CG 3.21Å; S267-L271 PolarHBondContact O-N 3.29Å; A268-L271 PolarHBondContact O-N 2.9Å; R269-L271 VanDerWaalsContact C-N 3.33Å; L271-N274 CarbonylContact O-C 3.01Å; L271-N274 PolarHBondContact O-N 3.18Å; L271-K275 PolarHBondContact O-N 3.28Å; L271-R276 HydrophobicContact CB-CB 4.24Å; L271-R276 HydrophobicContact CD2-CB 3.76Å; L271-R276 HydrophobicContact CD2-CG 4.42Å; L271-R276 PolarHBondContact O-N 3.14Å; L271-E279 HydrophobicContact CD1-CB 3.91Å; L271-E279 HydrophobicContact CD2-CB 4.13Å; L271-A280 HydrophobicContact CB-CB 3.85Å; L271-I283 HydrophobicContact CD1-CD1 3.45Å; L271-I283 VanDerWaalsContact CD1-CD1 3.45Å
272M85.2Confident89.2Confident17 Ų1756.5 Ų56.58%0.08428%0.276CS..Hα-helixtrans-60-45.3175.7-69.9-75.7-59.200112.6F3 A268 R269 W270 N274 K275 F277 A280 I303F3-M272 HydrophobicContact CD2-CG 4.41Å; A268-M272 WeakPolarHBondContact O-CG 3.25Å; A268-M272 PolarHBondContact O-N 2.8Å; R269-M272 WeakPolarHBondContact O-CB 3.47Å; R269-M272 PolarHBondContact O-N 3.37Å; W270-M272 PolarHBondContact O-N 3.28Å; M272-N274 VanDerWaalsContact C-N 3.28Å; M272-N274 PolarHBondContact O-N 2.94Å; M272-K275 PolarHBondContact O-N 3.46Å; M272-F277 HydrophobicContact CE-CD1 4.27Å; M272-F277 HydrophobicContact CE-CE1 4.27Å; M272-F277 HydrophobicContact SD-CD1 3.84Å; M272-F277 HydrophobicContact SD-CE1 4.33Å; M272-A280 HydrophobicContact CG-CB 3.73Å; M272-A280 HydrophobicContact SD-CB 3.78Å; M272-I303 HydrophobicContact CE-CB 3.91Å; M272-I303 HydrophobicContact CE-CD1 4.15Å; M272-I303 HydrophobicContact CE-CG1 3.81Å; M272-I303 HydrophobicContact CE-CG2 3.2Å; M272-I303 HydrophobicContact SD-CB 4.45Å; M272-I303 HydrophobicContact SD-CD1 4.07Å; M272-I303 HydrophobicContact SD-CG1 4.36Å; M272-I303 HydrophobicContact SD-CG2 3.42Å; M272-I303 WeakPolarHBondContact SD-CG2 3.37Å
273V83Confident89.3Confident96 Ų9648.6 Ų48.658%0.58225%0.248SC*.Hα-helixtrans-64.3-36177.4170.90000111.3R269 W270 K275R269-V273 WeakPolarHBondContact O-CG2 3.47Å; R269-V273 PolarHBondContact O-N 3.4Å; W270-V273 PolarHBondContact O-N 3Å; V273-K275 VanDerWaalsContact C-N 3.27Å; V273-K275 PolarHBondContact O-N 3.03Å
274N84.4Confident89.3Confident69 Ų6944.9 Ų44.937%0.36923%0.228SC..THydrogen-bonded Turntrans-88.216.5178.4-70.5-73.2000114.1W270 L271 M272 R276W270-N274 VanDerWaalsContact CD2-ND2 3.33Å; W270-N274 WeakPolarHBondContact CZ2-ND2 3.22Å; W270-N274 PolarHBondContact NE1-ND2 2.88Å; W270-N274 VanDerWaalsContact NE1-ND2 3.14Å; W270-N274 PolarHBondContact O-N 3.47Å; W270-N274 PolarHBondContact O-ND2 3.34Å; L271-N274 CarbonylContact O-C 3.01Å; L271-N274 PolarHBondContact O-N 3.18Å; M272-N274 VanDerWaalsContact C-N 3.28Å; M272-N274 PolarHBondContact O-N 2.94Å; N274-R276 PolarHBondContact O-N 2.72Å; N274-R276 VanDerWaalsContact O-N 3.15Å
275K86.3Confident89.4Confident150 Ų15050.2 Ų50.265%0.65225%0.249SC*.THydrogen-bonded Turntrans58.724.2177.2-53-178.6177.7-175.30114.3L271 M272 V273 F277L271-K275 PolarHBondContact O-N 3.28Å; M272-K275 PolarHBondContact O-N 3.46Å; V273-K275 VanDerWaalsContact C-N 3.27Å; V273-K275 PolarHBondContact O-N 3.03Å; K275-F277 VanDerWaalsContact C-N 3.31Å; K275-F277 HydrophobicContact CB-CE2 3.88Å; K275-F277 HydrophobicContact CB-CZ 4.23Å; K275-F277 HydrophobicContact CG-CE2 4.34Å; K275-F277 HydrophobicContact CG-CZ 4.34Å; K275-F277 PolarHBondContact O-N 2.99Å
276R89.2Confident89.4Confident102 Ų10254.5 Ų54.539%0.38526%0.264SS..  trans-93.862.5173.7-66.4175.569.4-174.65.8109.3L271 N274 E279 A280L271-R276 HydrophobicContact CB-CB 4.24Å; L271-R276 HydrophobicContact CD2-CB 3.76Å; L271-R276 HydrophobicContact CD2-CG 4.42Å; L271-R276 PolarHBondContact O-N 3.14Å; N274-R276 PolarHBondContact O-N 2.72Å; N274-R276 VanDerWaalsContact O-N 3.15Å; R276-E279 IonicContact CZ-OE1 2.73Å; R276-E279 IonicContact CZ-OE2 3.68Å; R276-E279 VanDerWaalsContact CZ-OE2 3.23Å; R276-E279 IonicContact NE-OE1 3.15Å; R276-E279 PolarHBondContact NE-OE1 3.22Å; R276-E279 IonicContact NE-OE2 3.81Å; R276-E279 IonicContact NH2-OE1 2.83Å; R276-E279 PolarHBondContact NH2-OE1 3.09Å; R276-E279 IonicContact NH2-OE2 3.34Å; R276-E279 PolarHBondContact NH2-OE2 3.46Å; R276-E279 PolarHBondContact O-N 3.11Å; R276-A280 PolarHBondContact O-N 2.89Å
277F89Confident89.3Confident39 Ų3953.4 Ų53.417%0.17126%0.26CS..Hα-helixtrans-64.9-44.2-170.3-59.7-67.2000112.8M272 K275 E279 A280 I281 I303 E304M272-F277 HydrophobicContact CE-CD1 4.27Å; M272-F277 HydrophobicContact CE-CE1 4.27Å; M272-F277 HydrophobicContact SD-CD1 3.84Å; M272-F277 HydrophobicContact SD-CE1 4.33Å; K275-F277 VanDerWaalsContact C-N 3.31Å; K275-F277 HydrophobicContact CB-CE2 3.88Å; K275-F277 HydrophobicContact CB-CZ 4.23Å; K275-F277 HydrophobicContact CG-CE2 4.34Å; K275-F277 HydrophobicContact CG-CZ 4.34Å; K275-F277 PolarHBondContact O-N 2.99Å; F277-E279 VanDerWaalsContact C-N 3.29Å; F277-E279 PolarHBondContact O-N 3.19Å; F277-A280 WeakPolarHBondContact O-CB 3.49Å; F277-A280 PolarHBondContact O-N 3.47Å; F277-A280 VanDerWaalsContact O-N 3.09Å; F277-I281 HydrophobicContact CB-CD1 4.35Å; F277-I281 WeakPolarHBondContact O-CB 3.3Å; F277-I281 WeakPolarHBondContact O-CD1 3.25Å; F277-I281 VanDerWaalsContact O-CG1 3.28Å; F277-I281 WeakPolarHBondContact O-CG1 3.26Å; F277-I281 PolarHBondContact O-N 3.39Å; F277-I303 HydrophobicContact CD1-CG2 3.51Å; F277-I303 HydrophobicContact CE1-CG2 4.04Å; F277-I303 HydrophobicContact CG-CG2 4.34Å; F277-E304 HydrophobicContact CB-CG 4.25Å; F277-E304 HydrophobicContact CD1-CG 4.42Å; F277-E304 HydrophobicContact CD2-CG 3.98Å; F277-E304 HydrophobicContact CE2-CG 4.43Å; F277-E304 HydrophobicContact CG-CG 3.97Å
278D90.1Very high89.4Confident133 Ų13353.1 Ų53.171%0.71126%0.257SS*.Hα-helixtrans-54.3-44.7179.3-66.3-45.3000112.7A282D278-A282 VanDerWaalsContact O-CB 3.3Å; D278-A282 WeakPolarHBondContact O-CB 3.24Å; D278-A282 PolarHBondContact O-N 3.21Å
279E91.7Very high89.6Confident82 Ų8260.9 Ų60.938%0.38329%0.289SS..Hα-helixtrans-69.8-40.2179.1-67.6179.5-122.400112L271 R276 F277 A282 I283L271-E279 HydrophobicContact CD1-CB 3.91Å; L271-E279 HydrophobicContact CD2-CB 4.13Å; R276-E279 IonicContact CZ-OE1 2.73Å; R276-E279 IonicContact CZ-OE2 3.68Å; R276-E279 VanDerWaalsContact CZ-OE2 3.23Å; R276-E279 IonicContact NE-OE1 3.15Å; R276-E279 PolarHBondContact NE-OE1 3.22Å; R276-E279 IonicContact NE-OE2 3.81Å; R276-E279 IonicContact NH2-OE1 2.83Å; R276-E279 PolarHBondContact NH2-OE1 3.09Å; R276-E279 IonicContact NH2-OE2 3.34Å; R276-E279 PolarHBondContact NH2-OE2 3.46Å; R276-E279 PolarHBondContact O-N 3.11Å; F277-E279 VanDerWaalsContact C-N 3.29Å; F277-E279 PolarHBondContact O-N 3.19Å; E279-A282 PolarHBondContact O-N 3.34Å; E279-I283 WeakPolarHBondContact O-CG1 3.12Å; E279-I283 PolarHBondContact O-N 2.75Å; E279-I283 VanDerWaalsContact O-N 3.08Å
280A90Very high90Very high0 Ų063.5 Ų63.50%030%0.302CS..Hα-helixtrans-61.7-46.5175.500000111L271 M272 R276 F277 I283 L284L271-A280 HydrophobicContact CB-CB 3.85Å; M272-A280 HydrophobicContact CG-CB 3.73Å; M272-A280 HydrophobicContact SD-CB 3.78Å; R276-A280 PolarHBondContact O-N 2.89Å; F277-A280 WeakPolarHBondContact O-CB 3.49Å; F277-A280 PolarHBondContact O-N 3.47Å; F277-A280 VanDerWaalsContact O-N 3.09Å; A280-I283 PolarHBondContact O-N 2.55Å; A280-L284 WeakPolarHBondContact O-CG 3.23Å; A280-L284 PolarHBondContact O-N 3.23Å
281I90.7Very high90.3Very high11 Ų1164.2 Ų64.26%0.05631%0.307CS..Hα-helixtrans-64.3-41.4178.3-67160.3000110.5F277 I283 L284 R285 L295 A300 I303F277-I281 HydrophobicContact CB-CD1 4.35Å; F277-I281 WeakPolarHBondContact O-CB 3.3Å; F277-I281 WeakPolarHBondContact O-CD1 3.25Å; F277-I281 VanDerWaalsContact O-CG1 3.28Å; F277-I281 WeakPolarHBondContact O-CG1 3.26Å; F277-I281 PolarHBondContact O-N 3.39Å; I281-I283 VanDerWaalsContact C-N 3.32Å; I281-I283 PolarHBondContact O-N 2.85Å; I281-L284 PolarHBondContact O-N 3.42Å; I281-R285 VanDerWaalsContact O-CB 3.25Å; I281-R285 WeakPolarHBondContact O-CB 3.21Å; I281-R285 PolarHBondContact O-N 3.43Å; I281-L295 HydrophobicContact CG2-CD2 4.35Å; I281-A300 HydrophobicContact CD1-CB 3.54Å; I281-A300 HydrophobicContact CG1-CB 4.46Å; I281-I303 HydrophobicContact CG1-CD1 4.25Å
282A92.3Very high90.3Very high56 Ų5667.7 Ų67.746%0.46334%0.344SS..Hα-helixtrans-59.5-42.2176.200000112.1D278 E279 K286D278-A282 VanDerWaalsContact O-CB 3.3Å; D278-A282 WeakPolarHBondContact O-CB 3.24Å; D278-A282 PolarHBondContact O-N 3.21Å; E279-A282 PolarHBondContact O-N 3.34Å; A282-K286 WeakPolarHBondContact O-CB 3.39Å; A282-K286 PolarHBondContact O-N 3.48Å
283I92Very high90.6Very high32 Ų3272.1 Ų72.116%0.16436%0.359CS..Hα-helixtrans-66.3-46.3176.1-67.6163.2000110.9P265 A268 L271 E279 A280 I281 R285 K286 A287P265-I283 HydrophobicContact CB-CD1 4.03Å; P265-I283 HydrophobicContact CB-CG1 4.09Å; P265-I283 HydrophobicContact CB-CG2 4.16Å; P265-I283 HydrophobicContact CG-CG2 4.45Å; A268-I283 HydrophobicContact CB-CG2 4.4Å; L271-I283 HydrophobicContact CD1-CD1 3.45Å; L271-I283 VanDerWaalsContact CD1-CD1 3.45Å; E279-I283 WeakPolarHBondContact O-CG1 3.12Å; E279-I283 PolarHBondContact O-N 2.75Å; E279-I283 VanDerWaalsContact O-N 3.08Å; A280-I283 PolarHBondContact O-N 2.55Å; I281-I283 VanDerWaalsContact C-N 3.32Å; I281-I283 PolarHBondContact O-N 2.85Å; I283-R285 PolarHBondContact O-N 2.77Å; I283-K286 PolarHBondContact O-N 3.44Å; I283-A287 WeakPolarHBondContact O-CB 3.47Å; I283-A287 PolarHBondContact O-N 2.9Å
284L91.3Very high90.8Very high5 Ų573.4 Ų73.43%0.02637%0.368CS..Hα-helixtrans-63.3-41.2178.8-69.5173.1000111.9F3 I6 L7 V11 A268 A280 I281 A287 A288 L295 I303F3-L284 HydrophobicContact CE2-CD1 4.18Å; F3-L284 HydrophobicContact CE2-CD2 4.14Å; F3-L284 HydrophobicContact CZ-CD2 4.17Å; I6-L284 HydrophobicContact CG2-CD1 4.32Å; L7-L284 HydrophobicContact CD2-CD2 4.23Å; V11-L284 HydrophobicContact CG2-CD2 4.22Å; A268-L284 HydrophobicContact CB-CD2 4.42Å; A268-L284 HydrophobicContact CB-CG 4.44Å; A280-L284 WeakPolarHBondContact O-CG 3.23Å; A280-L284 PolarHBondContact O-N 3.23Å; I281-L284 PolarHBondContact O-N 3.42Å; L284-A287 WeakPolarHBondContact O-CB 3.35Å; L284-A287 PolarHBondContact O-N 2.7Å; L284-A288 WeakPolarHBondContact O-CB 3.35Å; L284-A288 PolarHBondContact O-N 2.7Å; L284-L295 HydrophobicContact CB-CD2 3.84Å; L284-I303 HydrophobicContact CD1-CD1 4.3Å
285R92.2Very high90.8Very high114 Ų11470.8 Ų70.843%0.4335%0.354SS..Hα-helixtrans-65.9-40.5176.5-171179.6-78.9152.2-7111.4I281 I283 A288 K289 L295 N297I281-R285 VanDerWaalsContact O-CB 3.25Å; I281-R285 WeakPolarHBondContact O-CB 3.21Å; I281-R285 PolarHBondContact O-N 3.43Å; I283-R285 PolarHBondContact O-N 2.77Å; R285-A288 PolarHBondContact O-N 3.3Å; R285-K289 WeakPolarHBondContact O-CB 3.49Å; R285-K289 PolarHBondContact O-N 3.4Å; R285-L295 HydrophobicContact CB-CD2 4.27Å; R285-N297 PolarHBondContact NH2-OD1 2.7Å
286K92.4Very high90.7Very high119 Ų11965.7 Ų65.752%0.51734%0.335SS..Hα-helixtrans-61-45172.5-174.6-178.5-178.5-179.50111.1Y17 A282 I283 F290Y17-K286 HydrophobicContact CE2-CD 4.44Å; Y17-K286 HydrophobicContact CE2-CG 4.38Å; A282-K286 WeakPolarHBondContact O-CB 3.39Å; A282-K286 PolarHBondContact O-N 3.48Å; I283-K286 PolarHBondContact O-N 3.44Å; K286-F290 WeakPolarHBondContact O-CB 3.47Å; K286-F290 PolarHBondContact O-N 3.39Å
287A92.6Very high90.2Very high4 Ų466.3 Ų66.33%0.03335%0.346CS..Hα-helixtrans-63.2-46.217800000112V11 Y17 I283 L284 F290 N291V11-A287 HydrophobicContact CG1-CB 3.62Å; Y17-A287 HydrophobicContact CD1-CB 3.35Å; Y17-A287 HydrophobicContact CE1-CB 3.55Å; Y17-A287 HydrophobicContact CG-CB 3.89Å; I283-A287 WeakPolarHBondContact O-CB 3.47Å; I283-A287 PolarHBondContact O-N 2.9Å; L284-A287 WeakPolarHBondContact O-CB 3.35Å; L284-A287 PolarHBondContact O-N 2.7Å; A287-F290 PolarHBondContact O-N 3.03Å; A287-N291 WeakPolarHBondContact O-CB 3.45Å; A287-N291 PolarHBondContact O-N 2.9Å; A287-N291 PolarHBondContact O-ND2 2.69Å
288A92.1Very high89.6Confident0 Ų068 Ų680%036%0.358CS..Hα-helixtrans-59.3-50.9176.800000110.7L284 R285 F290 N291 G292 R293 L295L284-A288 WeakPolarHBondContact O-CB 3.35Å; L284-A288 PolarHBondContact O-N 2.7Å; R285-A288 PolarHBondContact O-N 3.3Å; A288-F290 VanDerWaalsContact C-N 3.33Å; A288-F290 PolarHBondContact O-N 3.28Å; A288-N291 CarbonylContact O-C 3.27Å; A288-N291 WeakPolarHBondContact O-CA 3.26Å; A288-N291 PolarHBondContact O-N 3.41Å; A288-G292 PolarHBondContact O-N 2.78Å; A288-G292 VanDerWaalsContact O-N 3.12Å; A288-R293 CarbonylContact C-O 3.59Å; A288-R293 HydrophobicContact CB-CB 4.35Å; A288-R293 CarbonylContact O-C 3.53Å; A288-R293 PolarHBondContact O-N 3.5Å; A288-L295 HydrophobicContact CB-CB 4.25Å
289K94Very high88.8Confident176 Ų17661.8 Ų61.877%0.76532%0.324SS*.Hα-helixtrans-57-44.7178.6-174.3179.6-178.6178.70112.1R285 N291 G292 R293R285-K289 WeakPolarHBondContact O-CB 3.49Å; R285-K289 PolarHBondContact O-N 3.4Å; K289-N291 PolarHBondContact O-N 3.12Å; K289-G292 PolarHBondContact O-N 3.4Å; K289-G292 VanDerWaalsContact O-N 3.09Å; K289-R293 PolarHBondContact N-O 3.01Å
290F93.5Very high87.7Confident108 Ų10858.8 Ų58.847%0.47431%0.313SS..Hα-helixtrans-67.6-26.3179.4-161.7-80.8000112.7R16 Y17 L20 K286 A287 A288 G292R16-F290 HydrophobicContact CB-CD1 4.1Å; R16-F290 HydrophobicContact CB-CE1 3.97Å; Y17-F290 HydrophobicContact CD2-CB 4.05Å; Y17-F290 HydrophobicContact CD2-CD1 4.35Å; Y17-F290 HydrophobicContact CD2-CG 4.08Å; Y17-F290 HydrophobicContact CG-CB 4.44Å; L20-F290 HydrophobicContact CD2-CZ 4.19Å; K286-F290 WeakPolarHBondContact O-CB 3.47Å; K286-F290 PolarHBondContact O-N 3.39Å; A287-F290 PolarHBondContact O-N 3.03Å; A288-F290 VanDerWaalsContact C-N 3.33Å; A288-F290 PolarHBondContact O-N 3.28Å; F290-G292 VanDerWaalsContact C-N 3.34Å
291N93.8Very high86.9Confident35 Ų3563.3 Ų63.319%0.18734%0.337CS..THydrogen-bonded Turntrans-87.62.5173.3-70.6-18000113.8V11 G15 R16 Y17 Q18 A287 A288 K289 R293V11-N291 PolarHBondContact O-ND2 3.24Å; G15-N291 WeakPolarHBondContact CA-OD1 3.47Å; R16-N291 PolarHBondContact N-OD1 3.09Å; Y17-N291 PolarHBondContact N-OD1 3.12Å; Q18-N291 PolarHBondContact OE1-ND2 3.46Å; A287-N291 WeakPolarHBondContact O-CB 3.45Å; A287-N291 PolarHBondContact O-N 2.9Å; A287-N291 PolarHBondContact O-ND2 2.69Å; A288-N291 CarbonylContact O-C 3.27Å; A288-N291 WeakPolarHBondContact O-CA 3.26Å; A288-N291 PolarHBondContact O-N 3.41Å; K289-N291 PolarHBondContact O-N 3.12Å; N291-R293 VanDerWaalsContact C-N 3.3Å
292G90.5Very high85.9Confident74 Ų7466.8 Ų66.876%0.76336%0.355SS*.THydrogen-bonded Turntrans71.922.6-176.400000113.9A288 K289 F290A288-G292 PolarHBondContact O-N 2.78Å; A288-G292 VanDerWaalsContact O-N 3.12Å; K289-G292 PolarHBondContact O-N 3.4Å; K289-G292 VanDerWaalsContact O-N 3.09Å; F290-G292 VanDerWaalsContact C-N 3.34Å
293R90.9Very high84.8Confident110 Ų11064.4 Ų64.442%0.41533%0.334SS..  trans-112.4163.8174.1-62-167.5178.7-166.12.8110.9C8 E9 H10 A288 K289 N291C8-R293 PolarHBondContact O-NH1 3.35Å; E9-R293 PolarHBondContact O-NH1 3.4Å; H10-R293 WeakPolarHBondContact O-CB 3.49Å; H10-R293 WeakPolarHBondContact O-CD 3.3Å; A288-R293 CarbonylContact C-O 3.59Å; A288-R293 HydrophobicContact CB-CB 4.35Å; A288-R293 CarbonylContact O-C 3.53Å; A288-R293 PolarHBondContact O-N 3.5Å; K289-R293 PolarHBondContact N-O 3.01Å; N291-R293 VanDerWaalsContact C-N 3.3Å
294T87.2Confident83.6Confident123 Ų12367.6 Ų67.676%0.75535%0.348SS*.  trans-115.5132.7175.250.30000109.6P296T294-P296 WeakPolarHBondContact O-CD 3.34Å
295L85.8Confident82Confident14 Ų1473.9 Ų73.97%0.07338%0.381CS..  trans-87.9116.5171-170.471.3000108I6 H10 I281 L284 R285 A288 V299I6-L295 HydrophobicContact CG2-CD1 3.94Å; H10-L295 HydrophobicContact CB-CD1 3.74Å; I281-L295 HydrophobicContact CG2-CD2 4.35Å; L284-L295 HydrophobicContact CB-CD2 3.84Å; R285-L295 HydrophobicContact CB-CD2 4.27Å; A288-L295 HydrophobicContact CB-CB 4.25Å; L295-V299 HydrophobicContact CD1-CB 4.38Å; L295-V299 HydrophobicContact CD1-CG1 4.13Å; L295-V299 HydrophobicContact CD1-CG2 4.43Å; L295-V299 HydrophobicContact CG-CB 4.5Å
296P83Confident80.4Confident42 Ų4271.9 Ų71.927%0.27338%0.377SS..  trans-60150.6177.1-23.134.7000111.9H10 T294 D298 V299H10-P296 WeakPolarHBondContact CD2-CD 3.4Å; T294-P296 WeakPolarHBondContact O-CD 3.34Å; P296-D298 WeakPolarHBondContact CB-OD1 3.45Å; P296-V299 HydrophobicContact CB-CG2 4.09Å; P296-V299 HydrophobicContact CG-CG2 4.24Å; P296-V299 PolarHBondContact O-N 3.17Å
297N78.8Confident78.3Confident115 Ų11571.3 Ų71.362%0.61539%0.385SS*.THydrogen-bonded Turntrans-73-31.4-176.6-72.6-26.8000112.4R285 V299 A300R285-N297 PolarHBondContact NH2-OD1 2.7Å; N297-V299 PolarHBondContact O-N 3Å; N297-A300 VanDerWaalsContact O-CB 3.23Å; N297-A300 WeakPolarHBondContact O-CB 3.36Å; N297-A300 PolarHBondContact O-N 2.88Å; N297-A300 VanDerWaalsContact O-N 3.09Å
298D77.3Confident76.3Confident76 Ų7674.6 Ų74.641%0.40640%0.4SS..Hα-helixtrans-63-22.8174.856.9-52.8000113.1P296 A300 D301 M302P296-D298 WeakPolarHBondContact CB-OD1 3.45Å; D298-A300 PolarHBondContact O-N 2.67Å; D298-D301 PolarHBondContact O-N 3Å; D298-D301 VanDerWaalsContact O-N 3.15Å; D298-M302 HydrophobicContact CB-CE 4.47Å; D298-M302 WeakPolarHBondContact O-CG 3.45Å; D298-M302 PolarHBondContact O-N 3.49Å; D298-M302 WeakPolarHBondContact OD2-CE 3.19Å
299V73.3Confident74Confident1 Ų177.1 Ų77.11%0.00642%0.417CS..Hα-helixtrans-62.1-30.5173.3178.40000111.1I6 L295 P296 N297 M302 I303I6-V299 HydrophobicContact CD1-CG1 3.69Å; I6-V299 HydrophobicContact CG1-CG1 3.99Å; I6-V299 HydrophobicContact CG2-CG1 4.14Å; L295-V299 HydrophobicContact CD1-CB 4.38Å; L295-V299 HydrophobicContact CD1-CG1 4.13Å; L295-V299 HydrophobicContact CD1-CG2 4.43Å; L295-V299 HydrophobicContact CG-CB 4.5Å; P296-V299 HydrophobicContact CB-CG2 4.09Å; P296-V299 HydrophobicContact CG-CG2 4.24Å; P296-V299 PolarHBondContact O-N 3.17Å; N297-V299 PolarHBondContact O-N 3Å; V299-M302 PolarHBondContact O-N 3.45Å; V299-I303 HydrophobicContact CG1-CD1 3.96Å; V299-I303 HydrophobicContact CG1-CG1 4.26Å; V299-I303 VanDerWaalsContact O-CB 3.28Å; V299-I303 WeakPolarHBondContact O-CB 3.42Å; V299-I303 VanDerWaalsContact O-CG1 3.25Å; V299-I303 WeakPolarHBondContact O-CG1 3.33Å; V299-I303 PolarHBondContact O-N 2.91Å
300A68.7Low71.6Confident19 Ų1974.3 Ų74.316%0.15741%0.411CS..Hα-helixtrans-60.7-49.5173.500000110.8I281 N297 D298 M302 I303 E304I281-A300 HydrophobicContact CD1-CB 3.54Å; I281-A300 HydrophobicContact CG1-CB 4.46Å; N297-A300 VanDerWaalsContact O-CB 3.23Å; N297-A300 WeakPolarHBondContact O-CB 3.36Å; N297-A300 PolarHBondContact O-N 2.88Å; N297-A300 VanDerWaalsContact O-N 3.09Å; D298-A300 PolarHBondContact O-N 2.67Å; A300-M302 PolarHBondContact O-N 3.47Å; A300-I303 WeakPolarHBondContact O-CB 3.41Å; A300-I303 PolarHBondContact O-N 3.05Å; A300-E304 WeakPolarHBondContact O-CG 3.25Å; A300-E304 PolarHBondContact O-N 3.38Å; A300-E304 VanDerWaalsContact O-N 3.12Å
301D72.4Confident69.4Low95 Ų9572.7 Ų72.751%0.50841%0.41SS..Hα-helixtrans-64.1-42.1178.6-55.2-35.3000111D298 I303 E304 L305D298-D301 PolarHBondContact O-N 3Å; D298-D301 VanDerWaalsContact O-N 3.15Å; D301-I303 VanDerWaalsContact C-N 3.32Å; D301-I303 PolarHBondContact O-N 3.33Å; D301-E304 PolarHBondContact O-N 3.35Å; D301-L305 VanDerWaalsContact O-CB 3.28Å; D301-L305 WeakPolarHBondContact O-CB 3.27Å; D301-L305 WeakPolarHBondContact O-CD1 3.29Å; D301-L305 WeakPolarHBondContact O-CG 3.18Å; D301-L305 PolarHBondContact O-N 2.89Å
302M69.5Low66.8Low85 Ų8578 Ų7842%0.41943%0.434SS..Hα-helixtrans-64.7-34.2178.3-69.3-173.5-166.500113.4D298 V299 A300 Q306D298-M302 HydrophobicContact CB-CE 4.47Å; D298-M302 WeakPolarHBondContact O-CG 3.45Å; D298-M302 PolarHBondContact O-N 3.49Å; D298-M302 WeakPolarHBondContact OD2-CE 3.19Å; V299-M302 PolarHBondContact O-N 3.45Å; A300-M302 PolarHBondContact O-N 3.47Å; M302-Q306 PolarHBondContact O-N 3.46Å
303I70.1Confident64.6Low5 Ų584.1 Ų84.13%0.02643%0.433CS..Hα-helixtrans-65.8-47.3175.4-86.1174.8000110.1I6 M272 F277 I281 L284 V299 A300 D301 L305 Q306I6-I303 HydrophobicContact CD1-CD1 3.71Å; I6-I303 HydrophobicContact CD1-CG1 3.56Å; M272-I303 HydrophobicContact CE-CB 3.91Å; M272-I303 HydrophobicContact CE-CD1 4.15Å; M272-I303 HydrophobicContact CE-CG1 3.81Å; M272-I303 HydrophobicContact CE-CG2 3.2Å; M272-I303 HydrophobicContact SD-CB 4.45Å; M272-I303 HydrophobicContact SD-CD1 4.07Å; M272-I303 HydrophobicContact SD-CG1 4.36Å; M272-I303 HydrophobicContact SD-CG2 3.42Å; M272-I303 WeakPolarHBondContact SD-CG2 3.37Å; F277-I303 HydrophobicContact CD1-CG2 3.51Å; F277-I303 HydrophobicContact CE1-CG2 4.04Å; F277-I303 HydrophobicContact CG-CG2 4.34Å; I281-I303 HydrophobicContact CG1-CD1 4.25Å; L284-I303 HydrophobicContact CD1-CD1 4.3Å; V299-I303 HydrophobicContact CG1-CD1 3.96Å; V299-I303 HydrophobicContact CG1-CG1 4.26Å; V299-I303 VanDerWaalsContact O-CB 3.28Å; V299-I303 WeakPolarHBondContact O-CB 3.42Å; V299-I303 VanDerWaalsContact O-CG1 3.25Å; V299-I303 WeakPolarHBondContact O-CG1 3.33Å; V299-I303 PolarHBondContact O-N 2.91Å; A300-I303 WeakPolarHBondContact O-CB 3.41Å; A300-I303 PolarHBondContact O-N 3.05Å; D301-I303 VanDerWaalsContact C-N 3.32Å; D301-I303 PolarHBondContact O-N 3.33Å; I303-L305 VanDerWaalsContact C-N 3.33Å; I303-Q306 PolarHBondContact O-N 3.49Å
304E65.5Low62.5Low100 Ų10083.9 Ų83.947%0.46744%0.437SS..Hα-helixtrans-69-34.1-178.3-71-178.7-169.100112F277 A300 D301F277-E304 HydrophobicContact CB-CG 4.25Å; F277-E304 HydrophobicContact CD1-CG 4.42Å; F277-E304 HydrophobicContact CD2-CG 3.98Å; F277-E304 HydrophobicContact CE2-CG 4.43Å; F277-E304 HydrophobicContact CG-CG 3.97Å; A300-E304 WeakPolarHBondContact O-CG 3.25Å; A300-E304 PolarHBondContact O-N 3.38Å; A300-E304 VanDerWaalsContact O-N 3.12Å; D301-E304 PolarHBondContact O-N 3.35Å
305L59.1Low60.4Low136 Ų13681.5 Ų81.571%0.71243%0.425SS*.THydrogen-bonded Turntrans-81.1-6.1-179.9-69.2169.4000114.5D301 I303 P307D301-L305 VanDerWaalsContact O-CB 3.28Å; D301-L305 WeakPolarHBondContact O-CB 3.27Å; D301-L305 WeakPolarHBondContact O-CD1 3.29Å; D301-L305 WeakPolarHBondContact O-CG 3.18Å; D301-L305 PolarHBondContact O-N 2.89Å; I303-L305 VanDerWaalsContact C-N 3.33Å; L305-P307 WeakPolarHBondContact O-CD 3.23Å
306Q58Low58.7Low73 Ų7391.6 Ų91.634%0.34146%0.463SS..  trans-58.3115.9174.3-88.1-161.6-47.800109.6M1 M302 I303 Q308M1-Q306 PolarHBondContact O-NE2 3.02Å; M302-Q306 PolarHBondContact O-N 3.46Å; I303-Q306 PolarHBondContact O-N 3.49Å; Q306-Q308 PolarHBondContact O-N 2.87Å
307P48.7Very low57.3Low107 Ų10796.6 Ų96.670%0.69549%0.487SS*.  trans-65.8110.2171.225.8-29.8000107.3L305 S309L305-P307 WeakPolarHBondContact O-CD 3.23Å; P307-S309 PolarHBondContact O-N 2.7Å; P307-S309 PolarHBondContact O-OG 3.43Å
308Q50.8Low56.3Low73 Ų7399.6 Ų99.634%0.34150%0.495SS..THydrogen-bonded Turntrans-67.931.2172.7-66.7-172.1-12.800112.2Q306 N310 T311 E312Q306-Q308 PolarHBondContact O-N 2.87Å; Q308-N310 PolarHBondContact O-N 3.16Å; Q308-N310 VanDerWaalsContact O-N 3.11Å; Q308-T311 WeakPolarHBondContact O-CA 3.38Å; Q308-T311 WeakPolarHBondContact O-CB 3.37Å; Q308-T311 PolarHBondContact O-N 2.82Å; Q308-E312 PolarHBondContact O-N 3.36Å; Q308-E312 VanDerWaalsContact O-N 3.12Å
309S43.2Very low55.6Low52 Ų5297.5 Ų97.536%0.36449%0.485SS..Hα-helixtrans-58.4-22.4176.964.60000112.3P307 R313P307-S309 PolarHBondContact O-N 2.7Å; P307-S309 PolarHBondContact O-OG 3.43Å; S309-R313 VanDerWaalsContact O-CB 3.23Å; S309-R313 WeakPolarHBondContact O-CB 3.41Å; S309-R313 WeakPolarHBondContact O-CG 3.48Å; S309-R313 PolarHBondContact O-N 3.4Å
310N44.1Very low55.7Low117 Ų117100.7 Ų100.763%0.62651%0.507SS*.Hα-helixtrans-72.3-29.4170.2-77.8-8000113.2Q308 Q314Q308-N310 PolarHBondContact O-N 3.16Å; Q308-N310 VanDerWaalsContact O-N 3.11Å; N310-Q314 VanDerWaalsContact O-CG 3.29Å; N310-Q314 WeakPolarHBondContact O-CG 3.47Å; N310-Q314 PolarHBondContact O-N 2.82Å
311T45.9Very low56.1Low75 Ų75101.8 Ų101.846%0.4652%0.517SS..Hα-helixtrans-82.2-38.2177.4-410000111.3Q308 Q314 S315Q308-T311 WeakPolarHBondContact O-CA 3.38Å; Q308-T311 WeakPolarHBondContact O-CB 3.37Å; Q308-T311 PolarHBondContact O-N 2.82Å; T311-Q314 PolarHBondContact O-N 2.89Å; T311-S315 PolarHBondContact O-N 3.37Å
312E40.5Very low56.5Low146 Ų146100.1 Ų100.168%0.68252%0.516SS*.Hα-helixtrans-70.8-37.4174.4-72.7-174.3168.700112.4Q308 Q314 S315Q308-E312 PolarHBondContact O-N 3.36Å; Q308-E312 VanDerWaalsContact O-N 3.12Å; E312-Q314 VanDerWaalsContact C-N 3.29Å; E312-Q314 PolarHBondContact O-N 3.42Å; E312-S315 WeakPolarHBondContact O-CB 3.47Å; E312-S315 PolarHBondContact O-N 3.44Å; E312-S315 VanDerWaalsContact O-N 3.09Å; E312-S315 PolarHBondContact O-OG 3.13Å
313R44.5Very low57.1Low202 Ų20297.3 Ų97.376%0.76250%0.503SS*.Hα-helixtrans-64.6-30.4172.6-76.7176.4177.9-169.90.1113.1S309 S315S309-R313 VanDerWaalsContact O-CB 3.23Å; S309-R313 WeakPolarHBondContact O-CB 3.41Å; S309-R313 WeakPolarHBondContact O-CG 3.48Å; S309-R313 PolarHBondContact O-N 3.4Å; R313-S315 VanDerWaalsContact C-N 3.29Å; R313-S315 PolarHBondContact O-N 2.82Å
314Q45.5Very low57.6Low105 Ų10597.1 Ų97.149%0.49150%0.502SS..Hα-helixtrans-73.2-17.5173.2-77.7176.95.100113.7N310 T311 E312N310-Q314 VanDerWaalsContact O-CG 3.29Å; N310-Q314 WeakPolarHBondContact O-CG 3.47Å; N310-Q314 PolarHBondContact O-N 2.82Å; T311-Q314 PolarHBondContact O-N 2.89Å; E312-Q314 VanDerWaalsContact C-N 3.29Å; E312-Q314 PolarHBondContact O-N 3.42Å
315S44.7Very low58.6Low73 Ų7396.4 Ų96.451%0.5150%0.497SS..Hα-helixtrans-78.9-24.9-176.276.10000114.6T311 E312 R313 N317T311-S315 PolarHBondContact O-N 3.37Å; E312-S315 WeakPolarHBondContact O-CB 3.47Å; E312-S315 PolarHBondContact O-N 3.44Å; E312-S315 VanDerWaalsContact O-N 3.09Å; E312-S315 PolarHBondContact O-OG 3.13Å; R313-S315 VanDerWaalsContact C-N 3.29Å; R313-S315 PolarHBondContact O-N 2.82Å; S315-N317 PolarHBondContact O-N 3.46Å
316R49.4Very low59.8Low227 Ų22799.3 Ų99.386%0.85750%0.499SS*.THydrogen-bonded Turntrans-73.1-26-171-99.3-176.9175.6178.2-0.4114.7
317N54.2Low61.2Low146 Ų14699.8 Ų99.878%0.78150%0.497SS*.THydrogen-bonded Turntrans-143.387.4170.9-84.8-27.8000106.9S315 P319S315-N317 PolarHBondContact O-N 3.46Å; N317-P319 WeakPolarHBondContact O-CD 3.35Å
318K56.4Low62.9Low178 Ų17898.8 Ų98.877%0.77449%0.491SS*.  trans-60.3108170.7-76.1-177.3-179.61770107S320K318-S320 PolarHBondContact O-N 3.17Å
319P63Low64.6Low33 Ų3397.8 Ų97.821%0.21449%0.49CS..  trans-65.9135.2-178.632.1-36.9000108.4N317 D323 V447 I448N317-P319 WeakPolarHBondContact O-CD 3.35Å; P319-D323 WeakPolarHBondContact CA-OD2 3.35Å; P319-D323 WeakPolarHBondContact CB-OD2 3.36Å; P319-V447 HydrophobicContact CG-CB 4.05Å; P319-V447 HydrophobicContact CG-CG2 4.47Å; P319-V447 WeakPolarHBondContact CG-O 3.35Å; P319-I448 HydrophobicContact CB-CG2 3.35Å; P319-I448 HydrophobicContact CG-CG2 3.42Å; P319-I448 VanDerWaalsContact CG-CG2 3.42Å
320S76.4Confident66.7Low67 Ų6795.3 Ų95.347%0.46947%0.472SS..  trans-89.7161.3-173.1178.30000110K318 A322 D323K318-S320 PolarHBondContact O-N 3.17Å; S320-A322 PolarHBondContact O-N 3.32Å; S320-A322 PolarHBondContact OG-N 2.92Å; S320-D323 PolarHBondContact N-OD2 3.23Å; S320-D323 WeakPolarHBondContact O-CB 3.44Å; S320-D323 PolarHBondContact O-N 3.46Å
321A76.5Confident69Low43 Ų4395.8 Ų95.836%0.35547%0.465SS..THydrogen-bonded Turntrans-54.2-26.1167.300000111.9D323 L324 T451A321-D323 PolarHBondContact O-N 3.31Å; A321-L324 WeakPolarHBondContact O-CB 3.35Å; A321-L324 PolarHBondContact O-N 3.32Å; A321-T451 HydrophobicContact CB-CG2 3.88Å
322A81.6Confident71.3Confident59 Ų5998 Ų9849%0.48847%0.465SS..THydrogen-bonded Turntrans-61.3-29173.700000113.5S320 L324 F325 R326S320-A322 PolarHBondContact O-N 3.32Å; S320-A322 PolarHBondContact OG-N 2.92Å; A322-L324 PolarHBondContact O-N 3.19Å; A322-F325 PolarHBondContact O-N 3.07Å; A322-R326 PolarHBondContact O-N 3.46Å; A322-R326 VanDerWaalsContact O-N 3.09Å
323D81.2Confident73.8Confident26 Ų2691.6 Ų91.614%0.13944%0.435CS..Hα-helixtrans-67.1-22.1-179.7-68.3-43.7000112.5P319 S320 A321 F325 R326 I512P319-D323 WeakPolarHBondContact CA-OD2 3.35Å; P319-D323 WeakPolarHBondContact CB-OD2 3.36Å; S320-D323 PolarHBondContact N-OD2 3.23Å; S320-D323 WeakPolarHBondContact O-CB 3.44Å; S320-D323 PolarHBondContact O-N 3.46Å; A321-D323 PolarHBondContact O-N 3.31Å; D323-F325 PolarHBondContact O-N 3.28Å; D323-R326 PolarHBondContact O-N 3.09Å; D323-R326 IonicContact OD1-NH1 3.22Å; D323-I512 HydrophobicContact CB-CD1 4.27Å
324L81Confident76.1Confident1 Ų182 Ų821%0.00540%0.399CS..Hα-helixtrans-63.3-30.2172-66.7167.7000112.4A321 A322 L330 R331 S334 F444 I448 A452 L455A321-L324 WeakPolarHBondContact O-CB 3.35Å; A321-L324 PolarHBondContact O-N 3.32Å; A322-L324 PolarHBondContact O-N 3.19Å; L324-L330 CarbonylContact O-C 3.6Å; L324-L330 VanDerWaalsContact O-C 3.27Å; L324-R331 VanDerWaalsContact O-CA 3.27Å; L324-R331 WeakPolarHBondContact O-CA 3.41Å; L324-R331 PolarHBondContact O-N 2.9Å; L324-R331 VanDerWaalsContact O-N 3.16Å; L324-S334 PolarHBondContact O-OG 2.89Å; L324-F444 HydrophobicContact CD2-CD1 3.79Å; L324-F444 HydrophobicContact CD2-CE1 3.6Å; L324-F444 HydrophobicContact CD2-CZ 4.36Å; L324-I448 HydrophobicContact CD2-CD1 3.7Å; L324-I448 HydrophobicContact CD2-CG1 4.39Å; L324-I448 HydrophobicContact CG-CD1 4.49Å; L324-A452 HydrophobicContact CD1-CB 4.21Å; L324-A452 HydrophobicContact CD2-CB 3.82Å; L324-L455 HydrophobicContact CD1-CD2 3.92Å
325F86.7Confident78.5Confident85 Ų8581.6 Ų81.637%0.37340%0.399SS..Hα-helixtrans-103.2-11.9-177.4-58.7-82.8000113.2A322 D323 R331 L335 F338 L455A322-F325 PolarHBondContact O-N 3.07Å; D323-F325 PolarHBondContact O-N 3.28Å; F325-R331 HydrophobicContact CD1-CG 4.47Å; F325-L335 HydrophobicContact CE1-CD2 4.25Å; F325-F338 AromaticContact CE1-CE2 3.91Å; F325-F338 HydrophobicContact CE1-CE2 3.91Å; F325-F338 AromaticContact CZ-CE2 3.59Å; F325-F338 HydrophobicContact CZ-CE2 3.59Å; F325-F338 HydrophobicContact CZ-CZ 4.24Å; F325-L455 HydrophobicContact CE2-CD2 4.35Å
326R84.6Confident80.9Confident197 Ų19779 Ų7974%0.74338%0.38SS*.Hα-helixtrans-70.9-43.1-172.7-170.1175-178.3179.21.4113A322 D323A322-R326 PolarHBondContact O-N 3.46Å; A322-R326 VanDerWaalsContact O-N 3.09Å; D323-R326 PolarHBondContact O-N 3.09Å; D323-R326 IonicContact OD1-NH1 3.22Å
327R85.5Confident83.2Confident83 Ų8368.2 Ų68.231%0.31334%0.339SS..SBendtrans-100.2142.1-178.6-61.4-163.6-177-163.70.7111.6V329 L330 R331 E513 E516R327-V329 PolarHBondContact O-N 3.36Å; R327-L330 HydrophobicContact CB-CB 4.48Å; R327-L330 PolarHBondContact O-N 3.31Å; R327-R331 WeakPolarHBondContact O-CB 3.15Å; R327-R331 PolarHBondContact O-N 3.03Å; R327-E513 IonicContact NH2-OE1 2.8Å; R327-E516 VanDerWaalsContact CB-OE1 3.29Å; R327-E516 WeakPolarHBondContact CB-OE1 3.44Å; R327-E516 WeakPolarHBondContact CD-OE1 3.4Å; R327-E516 WeakPolarHBondContact CD-OE2 3.48Å; R327-E516 IonicContact CZ-OE2 3.88Å; R327-E516 IonicContact NH1-OE2 2.81Å; R327-E516 PolarHBondContact NH1-OE2 3.24Å
328P85.5Confident85.2Confident86 Ų8661.9 Ų61.956%0.55830%0.304SS*.Hα-helixtrans-64.1-38.2-170.824.1-33.8000113.8R332P328-R332 WeakPolarHBondContact O-CB 3.45Å; P328-R332 PolarHBondContact O-N 2.74Å
329V87.2Confident87.2Confident53 Ų5356.4 Ų56.432%0.32128%0.279SS..Hα-helixtrans-69.1-48.7179.2178.20000110.7R327 R331 R332 R333 E516R327-V329 PolarHBondContact O-N 3.36Å; V329-R331 VanDerWaalsContact C-N 3.32Å; V329-R331 PolarHBondContact O-N 3.1Å; V329-R332 PolarHBondContact O-N 3.23Å; V329-R333 WeakPolarHBondContact O-CG 3.42Å; V329-R333 PolarHBondContact O-N 2.84Å; V329-E516 HydrophobicContact CB-CG 4.19Å
330L87.2Confident88.8Confident0 Ų054.8 Ų54.80%027%0.269CS..Hα-helixtrans-62.5-39.7175.6-74.3-175000111.9L324 R327 R333 S334 I448 I512 A515L324-L330 CarbonylContact O-C 3.6Å; L324-L330 VanDerWaalsContact O-C 3.27Å; R327-L330 HydrophobicContact CB-CB 4.48Å; R327-L330 PolarHBondContact O-N 3.31Å; L330-R333 PolarHBondContact O-N 3.22Å; L330-S334 VanDerWaalsContact O-CB 3.25Å; L330-S334 WeakPolarHBondContact O-CB 3.33Å; L330-S334 PolarHBondContact O-N 3.02Å; L330-S334 PolarHBondContact O-OG 3.38Å; L330-I448 HydrophobicContact CD1-CD1 4.15Å; L330-I512 HydrophobicContact CD1-CG1 4.35Å; L330-I512 HydrophobicContact CD1-CG2 3.66Å; L330-A515 HydrophobicContact CD2-CB 4.23Å
331R91.7Very high89.8Confident127 Ų12751.6 Ų51.648%0.47925%0.247SC..Hα-helixtrans-60.6-48.3176.5-176.5177.167.1-171.32.4111.2L324 F325 R327 V329 R333 S334 L335L324-R331 VanDerWaalsContact O-CA 3.27Å; L324-R331 WeakPolarHBondContact O-CA 3.41Å; L324-R331 PolarHBondContact O-N 2.9Å; L324-R331 VanDerWaalsContact O-N 3.16Å; F325-R331 HydrophobicContact CD1-CG 4.47Å; R327-R331 WeakPolarHBondContact O-CB 3.15Å; R327-R331 PolarHBondContact O-N 3.03Å; V329-R331 VanDerWaalsContact C-N 3.32Å; V329-R331 PolarHBondContact O-N 3.1Å; R331-R333 PolarHBondContact O-N 3.43Å; R331-S334 PolarHBondContact O-N 3.12Å; R331-L335 HydrophobicContact CG-CD1 4.06Å; R331-L335 HydrophobicContact CG-CG 4.49Å; R331-L335 VanDerWaalsContact O-CG 3.3Å; R331-L335 WeakPolarHBondContact O-CG 3.36Å; R331-L335 PolarHBondContact O-N 2.94Å
332R93.1Very high90.9Very high120 Ų12052 Ų5245%0.45324%0.242SC..Hα-helixtrans-59.5-47.8177.3-176.6-178.3179.5-168.62.9111.5P328 V329 S334 L335 I336 F499P328-R332 WeakPolarHBondContact O-CB 3.45Å; P328-R332 PolarHBondContact O-N 2.74Å; V329-R332 PolarHBondContact O-N 3.23Å; R332-S334 PolarHBondContact O-N 2.99Å; R332-L335 PolarHBondContact O-N 3.38Å; R332-I336 HydrophobicContact CG-CD1 3.92Å; R332-I336 WeakPolarHBondContact O-CB 3.36Å; R332-I336 WeakPolarHBondContact O-CG1 3.32Å; R332-I336 PolarHBondContact O-N 3.27Å; R332-I336 VanDerWaalsContact O-N 3.07Å; R332-F499 VanDerWaalsContact NH2-CD1 3.27Å
333R93.1Very high91.7Very high12 Ų1249.2 Ų49.25%0.04522%0.219CC..Hα-helixtrans-62.2-42.5178.1-71.4175.8-175.8178.18.4112.1V329 L330 R331 I337 L443 L500 A515 L518V329-R333 WeakPolarHBondContact O-CG 3.42Å; V329-R333 PolarHBondContact O-N 2.84Å; L330-R333 PolarHBondContact O-N 3.22Å; R331-R333 PolarHBondContact O-N 3.43Å; R333-I337 WeakPolarHBondContact O-CB 3.35Å; R333-I337 WeakPolarHBondContact O-CG2 2.99Å; R333-I337 PolarHBondContact O-N 3.43Å; R333-L443 HydrophobicContact CB-CD2 4.35Å; R333-L443 HydrophobicContact CG-CD1 4.47Å; R333-L500 HydrophobicContact CB-CD2 4.36Å; R333-L500 HydrophobicContact CG-CD2 4.19Å; R333-A515 PolarHBondContact NH1-O 3.25Å; R333-L518 PolarHBondContact NH2-O 3.27Å
334S93.2Very high92.5Very high0 Ų048 Ų480%021%0.213CC..Hα-helixtrans-63.7-48178.8-57.50000111.6L324 L330 R331 R332 I336 I337 F338 F444L324-S334 PolarHBondContact O-OG 2.89Å; L330-S334 VanDerWaalsContact O-CB 3.25Å; L330-S334 WeakPolarHBondContact O-CB 3.33Å; L330-S334 PolarHBondContact O-N 3.02Å; L330-S334 PolarHBondContact O-OG 3.38Å; R331-S334 PolarHBondContact O-N 3.12Å; R332-S334 PolarHBondContact O-N 2.99Å; S334-I336 PolarHBondContact O-N 2.93Å; S334-I337 WeakPolarHBondContact O-CG2 3.12Å; S334-I337 PolarHBondContact O-N 2.71Å; S334-F338 WeakPolarHBondContact O-CB 3.33Å; S334-F338 WeakPolarHBondContact O-CD1 3.43Å; S334-F338 WeakPolarHBondContact O-CD2 3.46Å; S334-F338 WeakPolarHBondContact O-CG 3.48Å; S334-F338 PolarHBondContact O-N 3.42Å; S334-F444 WeakPolarHBondContact OG-CE1 3.3Å
335L95.5Very high93.2Very high97 Ų9747.9 Ų47.951%0.50821%0.212SC..Hα-helixtrans-63.3-43179.1-69.4173.8000112.3F325 R331 R332 Y339F325-L335 HydrophobicContact CE1-CD2 4.25Å; R331-L335 HydrophobicContact CG-CD1 4.06Å; R331-L335 HydrophobicContact CG-CG 4.49Å; R331-L335 VanDerWaalsContact O-CG 3.3Å; R331-L335 WeakPolarHBondContact O-CG 3.36Å; R331-L335 PolarHBondContact O-N 2.94Å; R332-L335 PolarHBondContact O-N 3.38Å; L335-Y339 PolarHBondContact O-N 3.18Å
336I96.9Very high93.8Very high19 Ų1944 Ų4410%0.09720%0.196CC..Hα-helixtrans-62.6-52.8176.2-72.1167.4000110.4R332 S334 F338 Y339 V340 F496 F499 L500R332-I336 HydrophobicContact CG-CD1 3.92Å; R332-I336 WeakPolarHBondContact O-CB 3.36Å; R332-I336 WeakPolarHBondContact O-CG1 3.32Å; R332-I336 PolarHBondContact O-N 3.27Å; R332-I336 VanDerWaalsContact O-N 3.07Å; S334-I336 PolarHBondContact O-N 2.93Å; I336-F338 VanDerWaalsContact C-N 3.26Å; I336-F338 PolarHBondContact O-N 2.94Å; I336-Y339 WeakPolarHBondContact O-CB 3.05Å; I336-Y339 PolarHBondContact O-N 3.5Å; I336-Y339 VanDerWaalsContact O-N 3.1Å; I336-V340 HydrophobicContact CG2-CG2 4.24Å; I336-V340 WeakPolarHBondContact O-CG2 3.31Å; I336-V340 PolarHBondContact O-N 3.27Å; I336-F496 HydrophobicContact CG2-CB 3.93Å; I336-F499 HydrophobicContact CD1-CB 3.87Å; I336-L500 HydrophobicContact CB-CD2 3.92Å; I336-L500 HydrophobicContact CB-CG 4.45Å; I336-L500 HydrophobicContact CD1-CD2 4.11Å; I336-L500 HydrophobicContact CG2-CD1 3.65Å; I336-L500 HydrophobicContact CG2-CD2 3.6Å; I336-L500 HydrophobicContact CG2-CG 3.6Å
337I96Very high94.4Very high0 Ų034.7 Ų34.70%016%0.16CC..Hα-helixtrans-64.2-34.6-175.5-15962.8000111R333 S334 Y339 V340 W341 I436 Y439 L443 F444 L500R333-I337 WeakPolarHBondContact O-CB 3.35Å; R333-I337 WeakPolarHBondContact O-CG2 2.99Å; R333-I337 PolarHBondContact O-N 3.43Å; S334-I337 WeakPolarHBondContact O-CG2 3.12Å; S334-I337 PolarHBondContact O-N 2.71Å; I337-Y339 PolarHBondContact O-N 3.5Å; I337-V340 HydrophobicContact CD1-CB 4.49Å; I337-V340 PolarHBondContact O-N 3.49Å; I337-W341 PolarHBondContact O-N 3.36Å; I337-I436 HydrophobicContact CD1-CD1 4.33Å; I337-I436 HydrophobicContact CD1-CG1 4.11Å; I337-Y439 HydrophobicContact CD1-CD1 4.02Å; I337-Y439 HydrophobicContact CD1-CE1 4.28Å; I337-L443 HydrophobicContact CB-CD2 4.25Å; I337-L443 HydrophobicContact CD1-CD2 4.41Å; I337-L443 HydrophobicContact CG1-CD2 4.25Å; I337-F444 HydrophobicContact CG2-CE2 3.9Å; I337-F444 HydrophobicContact CG2-CZ 3.76Å; I337-L500 HydrophobicContact CD1-CD1 4.27Å
338F96.6Very high95Very high13 Ų1331.2 Ų31.26%0.05715%0.148CC..Hα-helixtrans-59.5-45.2172.9-67-19000112.6F325 S334 I336 V340 W341 I342 L455 C456 I459F325-F338 AromaticContact CE1-CE2 3.91Å; F325-F338 HydrophobicContact CE1-CE2 3.91Å; F325-F338 AromaticContact CZ-CE2 3.59Å; F325-F338 HydrophobicContact CZ-CE2 3.59Å; F325-F338 HydrophobicContact CZ-CZ 4.24Å; S334-F338 WeakPolarHBondContact O-CB 3.33Å; S334-F338 WeakPolarHBondContact O-CD1 3.43Å; S334-F338 WeakPolarHBondContact O-CD2 3.46Å; S334-F338 WeakPolarHBondContact O-CG 3.48Å; S334-F338 PolarHBondContact O-N 3.42Å; I336-F338 VanDerWaalsContact C-N 3.26Å; I336-F338 PolarHBondContact O-N 2.94Å; F338-V340 VanDerWaalsContact C-N 3.34Å; F338-V340 PolarHBondContact O-N 2.91Å; F338-W341 PolarHBondContact O-N 3.5Å; F338-I342 WeakPolarHBondContact O-CG1 2.93Å; F338-I342 PolarHBondContact O-N 3.36Å; F338-L455 HydrophobicContact CE1-CB 4.5Å; F338-L455 HydrophobicContact CE1-CD2 4.12Å; F338-L455 HydrophobicContact CE1-CG 4.01Å; F338-L455 HydrophobicContact CE2-CD2 4.23Å; F338-L455 HydrophobicContact CZ-CD2 3.48Å; F338-L455 VanDerWaalsContact CZ-CD2 3.48Å; F338-L455 HydrophobicContact CZ-CG 3.86Å; F338-C456 VanDerWaalsContact CE1-SG 3.57Å; F338-I459 HydrophobicContact CB-CD1 4.18Å; F338-I459 HydrophobicContact CB-CG2 4.14Å; F338-I459 HydrophobicContact CD1-CD1 3.62Å; F338-I459 HydrophobicContact CD2-CD1 3.65Å; F338-I459 HydrophobicContact CE1-CD1 3.85Å; F338-I459 HydrophobicContact CE2-CD1 3.9Å; F338-I459 HydrophobicContact CG-CD1 3.53Å; F338-I459 HydrophobicContact CZ-CD1 4Å
339Y98Very high95.6Very high63 Ų6327.7 Ų27.725%0.24712%0.123CC..Hα-helixtrans-61.4-44.3174.2-179.6-92.5000111.4L335 I336 I337 W341 I342 A343 I489 V492 A493 F496L335-Y339 PolarHBondContact O-N 3.18Å; I336-Y339 WeakPolarHBondContact O-CB 3.05Å; I336-Y339 PolarHBondContact O-N 3.5Å; I336-Y339 VanDerWaalsContact O-N 3.1Å; I337-Y339 PolarHBondContact O-N 3.5Å; Y339-W341 VanDerWaalsContact C-N 3.29Å; Y339-W341 PolarHBondContact O-N 2.7Å; Y339-I342 PolarHBondContact O-N 3.29Å; Y339-I342 VanDerWaalsContact O-N 3.15Å; Y339-A343 HydrophobicContact CD1-CB 4.42Å; Y339-A343 HydrophobicContact CE1-CB 4.04Å; Y339-A343 WeakPolarHBondContact O-CB 3.4Å; Y339-A343 PolarHBondContact O-N 2.93Å; Y339-I489 PolarHBondContact OH-O 2.99Å; Y339-V492 HydrophobicContact CD1-CG1 4.38Å; Y339-V492 HydrophobicContact CE1-CB 3.93Å; Y339-V492 HydrophobicContact CE1-CG1 3.56Å; Y339-V492 HydrophobicContact CE2-CG1 4.44Å; Y339-V492 WeakPolarHBondContact OH-CB 3.4Å; Y339-A493 HydrophobicContact CD1-CB 4.29Å; Y339-A493 HydrophobicContact CE1-CB 3.9Å; Y339-F496 AromaticContact CD1-CD2 3.45Å; Y339-F496 HydrophobicContact CD1-CD2 3.45Å; Y339-F496 VanDerWaalsContact CD1-CD2 3.45Å; Y339-F496 AromaticContact CD1-CE2 3.84Å; Y339-F496 HydrophobicContact CD1-CE2 3.84Å; Y339-F496 HydrophobicContact CD1-CG 4.43Å; Y339-F496 HydrophobicContact CD2-CE2 4.34Å; Y339-F496 HydrophobicContact CE1-CD2 4.12Å; Y339-F496 HydrophobicContact CE1-CE2 4.33Å; Y339-F496 AromaticContact CG-CD2 3.79Å; Y339-F496 HydrophobicContact CG-CD2 3.79Å; Y339-F496 AromaticContact CG-CE2 3.85Å; Y339-F496 HydrophobicContact CG-CE2 3.85Å
340V98Very high96.1Very high0 Ų025.2 Ų25.20%011%0.108CC..Hα-helixtrans-60.9-39.5179-177.20000111.1I336 I337 F338 A343 V344 F397 I436 V497I336-V340 HydrophobicContact CG2-CG2 4.24Å; I336-V340 WeakPolarHBondContact O-CG2 3.31Å; I336-V340 PolarHBondContact O-N 3.27Å; I337-V340 HydrophobicContact CD1-CB 4.49Å; I337-V340 PolarHBondContact O-N 3.49Å; F338-V340 VanDerWaalsContact C-N 3.34Å; F338-V340 PolarHBondContact O-N 2.91Å; V340-A343 PolarHBondContact O-N 3.4Å; V340-V344 WeakPolarHBondContact O-CB 3.38Å; V340-V344 WeakPolarHBondContact O-CG1 3.33Å; V340-V344 PolarHBondContact O-N 2.87Å; V340-F397 HydrophobicContact CG1-CE2 3.47Å; V340-F397 VanDerWaalsContact CG1-CE2 3.47Å; V340-F397 HydrophobicContact CG1-CZ 3.65Å; V340-I436 HydrophobicContact CB-CD1 4.09Å; V340-I436 HydrophobicContact CG1-CD1 3.48Å; V340-I436 VanDerWaalsContact CG1-CD1 3.48Å; V340-I436 HydrophobicContact CG1-CG1 4.34Å; V340-V497 HydrophobicContact CG1-CG2 4.08Å; V340-V497 HydrophobicContact CG2-CG2 3.76Å
341W97.5Very high96.5Very high0 Ų025.2 Ų25.20%011%0.108CC..Hα-helixtrans-65.1-40.4173.5-86.3102.5000113.2I337 F338 Y339 V344 A345 Y433 I436 Y437 T440 M453 C456 A460I337-W341 PolarHBondContact O-N 3.36Å; F338-W341 PolarHBondContact O-N 3.5Å; Y339-W341 VanDerWaalsContact C-N 3.29Å; Y339-W341 PolarHBondContact O-N 2.7Å; W341-V344 WeakPolarHBondContact O-CG1 3.1Å; W341-A345 VanDerWaalsContact O-CB 3.23Å; W341-A345 WeakPolarHBondContact O-CB 3.32Å; W341-A345 PolarHBondContact O-N 2.64Å; W341-Y433 HydrophobicContact CE3-CE1 4.49Å; W341-Y433 AromaticContact CZ3-CE1 3.82Å; W341-Y433 HydrophobicContact CZ3-CE1 3.82Å; W341-I436 HydrophobicContact CB-CD1 4.46Å; W341-I436 HydrophobicContact CD2-CD1 3.82Å; W341-I436 HydrophobicContact CD2-CG1 4.45Å; W341-I436 HydrophobicContact CD2-CG2 4.31Å; W341-I436 HydrophobicContact CE3-CD1 4.5Å; W341-I436 HydrophobicContact CE3-CG2 4.25Å; W341-I436 HydrophobicContact CG-CD1 3.77Å; W341-I436 HydrophobicContact CH2-CG2 3.83Å; W341-I436 HydrophobicContact CZ2-CG1 4.33Å; W341-I436 HydrophobicContact CZ2-CG2 3.86Å; W341-I436 HydrophobicContact CZ3-CG2 4.03Å; W341-Y437 AromaticContact CH2-CD1 3.82Å; W341-Y437 HydrophobicContact CH2-CD1 3.82Å; W341-Y437 AromaticContact CH2-CD2 4Å; W341-Y437 HydrophobicContact CH2-CD2 4Å; W341-Y437 AromaticContact CH2-CE1 3.67Å; W341-Y437 HydrophobicContact CH2-CE1 3.67Å; W341-Y437 AromaticContact CH2-CE2 3.94Å; W341-Y437 HydrophobicContact CH2-CE2 3.94Å; W341-Y437 AromaticContact CH2-CG 3.89Å; W341-Y437 HydrophobicContact CH2-CG 3.89Å; W341-Y437 AromaticContact CH2-CZ 3.7Å; W341-Y437 HydrophobicContact CZ3-CE1 4.26Å; W341-Y437 HydrophobicContact CZ3-CE2 4.1Å; W341-Y437 AromaticContact CZ3-CZ 3.87Å; W341-T440 HydrophobicContact CZ2-CG2 4.4Å; W341-T440 WeakPolarHBondContact CZ2-OG1 3.47Å; W341-T440 PolarHBondContact NE1-OG1 3.47Å; W341-M453 HydrophobicContact CH2-CE 3.87Å; W341-M453 HydrophobicContact CZ2-CE 3.85Å; W341-M453 HydrophobicContact CZ2-SD 4.09Å; W341-C456 VanDerWaalsContact CD1-CB 3.46Å; W341-C456 HydrophobicContact CD2-CB 4.05Å; W341-C456 HydrophobicContact CG-CB 3.9Å; W341-C456 HydrophobicContact CZ2-CB 4.44Å; W341-A460 HydrophobicContact CB-CB 4.11Å; W341-A460 HydrophobicContact CD2-CB 4.48Å; W341-A460 HydrophobicContact CE3-CB 3.78Å
342I98Very high96.7Very high51 Ų5119.2 Ų19.226%0.2629%0.086SC..Hα-helixtrans-63.9-48.2173.4-67.7168.6000109.9F338 Y339 A345 C346 I459F338-I342 WeakPolarHBondContact O-CG1 2.93Å; F338-I342 PolarHBondContact O-N 3.36Å; Y339-I342 PolarHBondContact O-N 3.29Å; Y339-I342 VanDerWaalsContact O-N 3.15Å; I342-A345 PolarHBondContact O-N 3.46Å; I342-C346 WeakPolarHBondContact O-CB 3.37Å; I342-C346 PolarHBondContact O-N 3.15Å; I342-I459 HydrophobicContact CD1-CG2 3.58Å; I342-I459 HydrophobicContact CG1-CG2 3.5Å
343A98.4Very high96.8Very high0 Ų013.5 Ų13.50%06%0.064CC..Hα-helixtrans-63.5-49.8-175.500000111.8Y339 V340 A345 C346 V347 I489 A493Y339-A343 HydrophobicContact CD1-CB 4.42Å; Y339-A343 HydrophobicContact CE1-CB 4.04Å; Y339-A343 WeakPolarHBondContact O-CB 3.4Å; Y339-A343 PolarHBondContact O-N 2.93Å; V340-A343 PolarHBondContact O-N 3.4Å; A343-A345 VanDerWaalsContact C-N 3.35Å; A343-A345 PolarHBondContact O-N 2.88Å; A343-C346 PolarHBondContact O-N 3.26Å; A343-V347 WeakPolarHBondContact O-CG2 3.44Å; A343-V347 PolarHBondContact O-N 3.49Å; A343-I489 HydrophobicContact CB-CG2 3.55Å; A343-A493 HydrophobicContact CB-CB 3.65Å
344V98Very high96.9Very high0 Ų014.2 Ų14.20%07%0.069CC..Hα-helixtrans-60.8-45.2178.174.20000110.7V340 W341 Y348 F397 L429 V432 Y433 I436V340-V344 WeakPolarHBondContact O-CB 3.38Å; V340-V344 WeakPolarHBondContact O-CG1 3.33Å; V340-V344 PolarHBondContact O-N 2.87Å; W341-V344 WeakPolarHBondContact O-CG1 3.1Å; V344-Y348 WeakPolarHBondContact O-CB 3.33Å; V344-Y348 PolarHBondContact O-N 3.07Å; V344-F397 HydrophobicContact CB-CE1 4.26Å; V344-F397 HydrophobicContact CB-CZ 3.96Å; V344-F397 HydrophobicContact CG2-CZ 4.38Å; V344-L429 HydrophobicContact CB-CD2 4.36Å; V344-L429 HydrophobicContact CG2-CD2 3.69Å; V344-V432 HydrophobicContact CG2-CG1 4.03Å; V344-Y433 HydrophobicContact CB-CD2 4.39Å; V344-Y433 HydrophobicContact CG1-CD2 4.09Å; V344-Y433 HydrophobicContact CG1-CE2 4.03Å; V344-Y433 HydrophobicContact CG1-CG 4.48Å; V344-Y433 HydrophobicContact CG2-CD2 3.57Å; V344-Y433 HydrophobicContact CG2-CE2 4.26Å; V344-Y433 HydrophobicContact CG2-CG 3.94Å; V344-I436 HydrophobicContact CG1-CD1 4.17Å; V344-I436 HydrophobicContact CG1-CG2 4.42Å
345A97.4Very high96.9Very high0 Ų014.4 Ų14.40%07%0.07CC..Hα-helixtrans-66.2-43.5179.300000111.9W341 I342 A343 Y349 Y433 A460W341-A345 VanDerWaalsContact O-CB 3.23Å; W341-A345 WeakPolarHBondContact O-CB 3.32Å; W341-A345 PolarHBondContact O-N 2.64Å; I342-A345 PolarHBondContact O-N 3.46Å; A343-A345 VanDerWaalsContact C-N 3.35Å; A343-A345 PolarHBondContact O-N 2.88Å; A345-Y349 HydrophobicContact CB-CD2 4.16Å; A345-Y349 HydrophobicContact CB-CE2 4.31Å; A345-Y349 VanDerWaalsContact O-CB 3.3Å; A345-Y349 WeakPolarHBondContact O-CB 3.1Å; A345-Y349 WeakPolarHBondContact O-CD2 3.45Å; A345-Y349 PolarHBondContact O-N 2.94Å; A345-Y433 HydrophobicContact CB-CE2 4.33Å; A345-A460 HydrophobicContact CB-CB 4.07Å; A345-A460 WeakPolarHBondContact CB-O 3.02Å
346C98.2Very high96.6Very high4 Ų410.6 Ų10.63%0.0275%0.051CC..Hα-helixtrans-58.9-57.8179.4-174.30000111I342 A343 A350 G463 A467I342-C346 WeakPolarHBondContact O-CB 3.37Å; I342-C346 PolarHBondContact O-N 3.15Å; A343-C346 PolarHBondContact O-N 3.26Å; C346-A350 WeakPolarHBondContact O-CB 3.49Å; C346-A350 PolarHBondContact O-N 3.02Å; C346-G463 VanDerWaalsContact CA-O 3.31Å; C346-G463 WeakPolarHBondContact CA-O 3.44Å; C346-A467 VanDerWaalsContact O-CB 3.23Å; C346-A467 WeakPolarHBondContact O-CB 3.49Å
347V98.3Very high96.4Very high0 Ų010.7 Ų10.70%05%0.051CC..Hα-helixtrans-71-43.4-174.3-172.20000111.2A343 A350 L351 I404 L429 Y486 I489A343-V347 WeakPolarHBondContact O-CG2 3.44Å; A343-V347 PolarHBondContact O-N 3.49Å; V347-A350 PolarHBondContact O-N 2.81Å; V347-L351 HydrophobicContact CG1-CD1 3.93Å; V347-L351 HydrophobicContact CG1-CG 4.18Å; V347-L351 WeakPolarHBondContact O-CB 3.25Å; V347-L351 VanDerWaalsContact O-CG 3.28Å; V347-L351 WeakPolarHBondContact O-CG 3.45Å; V347-L351 PolarHBondContact O-N 3.43Å; V347-I404 HydrophobicContact CG1-CD1 4.07Å; V347-L429 HydrophobicContact CB-CD1 3.63Å; V347-L429 HydrophobicContact CG1-CD1 3.28Å; V347-Y486 HydrophobicContact CG1-CG 4.35Å; V347-I489 HydrophobicContact CG2-CB 4.16Å; V347-I489 HydrophobicContact CG2-CG2 3.88Å
348Y97.8Very high96.1Very high11 Ų1111.8 Ų11.84%0.0436%0.057CC..Hα-helixtrans-59.7-51.9178.5172.2-101.9000112.1F226 V344 A350 S352 K426 Y433F226-Y348 WeakPolarHBondContact CD1-OH 3.39Å; F226-Y348 VanDerWaalsContact CE1-OH 3.25Å; F226-Y348 WeakPolarHBondContact CE1-OH 3.31Å; V344-Y348 WeakPolarHBondContact O-CB 3.33Å; V344-Y348 PolarHBondContact O-N 3.07Å; Y348-A350 VanDerWaalsContact C-N 3.34Å; Y348-A350 PolarHBondContact O-N 3.23Å; Y348-S352 WeakPolarHBondContact O-CB 3.36Å; Y348-S352 PolarHBondContact O-N 2.98Å; Y348-S352 PolarHBondContact O-OG 2.86Å; Y348-K426 HydrophobicContact CD2-CG 4.45Å; Y348-Y433 AromaticContact CD1-CD2 4Å; Y348-Y433 HydrophobicContact CD1-CD2 4Å; Y348-Y433 HydrophobicContact CD1-CE2 4.02Å; Y348-Y433 HydrophobicContact CG-CD2 4.04Å; Y348-Y433 HydrophobicContact CG-CE2 4.4Å
349Y97.1Very high95.7Very high11 Ų1112 Ų124%0.0436%0.063CC..Hα-helixtrans-69.6-34.7-178.6-74-64.1000111.5V36 Y138 A345 S352 I353 Y433 R461 A464V36-Y349 HydrophobicContact CG2-CE1 4.43Å; Y138-Y349 HydrophobicContact CE1-CD1 4.15Å; Y138-Y349 HydrophobicContact CE1-CD2 4.36Å; Y138-Y349 HydrophobicContact CE1-CE1 4.13Å; Y138-Y349 HydrophobicContact CE1-CE2 4.4Å; Y138-Y349 HydrophobicContact CE1-CG 4.27Å; Y138-Y349 AromaticContact CZ-CD1 3.97Å; Y138-Y349 WeakPolarHBondContact OH-CD1 3.26Å; A345-Y349 HydrophobicContact CB-CD2 4.16Å; A345-Y349 HydrophobicContact CB-CE2 4.31Å; A345-Y349 VanDerWaalsContact O-CB 3.3Å; A345-Y349 WeakPolarHBondContact O-CB 3.1Å; A345-Y349 WeakPolarHBondContact O-CD2 3.45Å; A345-Y349 PolarHBondContact O-N 2.94Å; Y349-S352 PolarHBondContact O-N 2.96Å; Y349-I353 VanDerWaalsContact O-CB 3.3Å; Y349-I353 WeakPolarHBondContact O-CB 3.3Å; Y349-I353 VanDerWaalsContact O-CD1 3.31Å; Y349-I353 WeakPolarHBondContact O-CD1 3.31Å; Y349-I353 WeakPolarHBondContact O-CG1 3.34Å; Y349-I353 PolarHBondContact O-N 2.67Å; Y349-Y433 HydrophobicContact CE2-CE2 4.3Å; Y349-R461 PolarHBondContact OH-NH1 3.23Å; Y349-A464 HydrophobicContact CD2-CB 3.64Å; Y349-A464 HydrophobicContact CE2-CB 4.13Å; Y349-A464 HydrophobicContact CG-CB 4.35Å
350A97.5Very high95.2Very high1 Ų110.4 Ų10.41%0.0087%0.065CC..Hα-helixtrans-62.3-48.217800000111.7C346 V347 Y348 S352 I353 N354 A467 A471 Y486C346-A350 WeakPolarHBondContact O-CB 3.49Å; C346-A350 PolarHBondContact O-N 3.02Å; V347-A350 PolarHBondContact O-N 2.81Å; Y348-A350 VanDerWaalsContact C-N 3.34Å; Y348-A350 PolarHBondContact O-N 3.23Å; A350-S352 VanDerWaalsContact C-N 3.26Å; A350-S352 PolarHBondContact O-N 3.07Å; A350-I353 PolarHBondContact O-N 3.01Å; A350-N354 PolarHBondContact O-N 3.49Å; A350-A467 HydrophobicContact CB-CB 3.82Å; A350-A471 HydrophobicContact CB-CB 4.26Å; A350-Y486 HydrophobicContact CB-CD1 4.46Å; A350-Y486 HydrophobicContact CB-CE1 3.62Å; A350-Y486 HydrophobicContact CB-CE2 4.15Å; A350-Y486 VanDerWaalsContact CB-CZ 3.45Å; A350-Y486 WeakPolarHBondContact CB-OH 3.49Å
351L96.8Very high94.8Very high1 Ų112.5 Ų12.51%0.0058%0.08CC..Hα-helixtrans-68.5-24.6176.1-62-175000112.8V347 P355 F357 I404 V422 A425 K426 Y486V347-L351 HydrophobicContact CG1-CD1 3.93Å; V347-L351 HydrophobicContact CG1-CG 4.18Å; V347-L351 WeakPolarHBondContact O-CB 3.25Å; V347-L351 VanDerWaalsContact O-CG 3.28Å; V347-L351 WeakPolarHBondContact O-CG 3.45Å; V347-L351 PolarHBondContact O-N 3.43Å; L351-P355 VanDerWaalsContact O-CA 3.23Å; L351-P355 WeakPolarHBondContact O-CA 3.12Å; L351-P355 VanDerWaalsContact O-CB 3.28Å; L351-P355 WeakPolarHBondContact O-CB 3.11Å; L351-F357 HydrophobicContact CD2-CE1 3.81Å; L351-F357 HydrophobicContact CD2-CZ 4.41Å; L351-I404 HydrophobicContact CD1-CD1 4.23Å; L351-V422 HydrophobicContact CD1-CG1 4.46Å; L351-V422 HydrophobicContact CD2-CG1 3.83Å; L351-A425 HydrophobicContact CD1-CB 4.44Å; L351-K426 HydrophobicContact CB-CB 3.98Å; L351-K426 HydrophobicContact CB-CG 4.01Å; L351-K426 HydrophobicContact CD1-CB 4.01Å; L351-Y486 HydrophobicContact CD2-CD2 3.67Å; L351-Y486 HydrophobicContact CD2-CE2 3.77Å; L351-Y486 HydrophobicContact CG-CD2 4.49Å
352S95.9Very high94.6Very high1 Ų113 Ų131%0.0078%0.083CC..Hα-helixtrans-80.3-34.3175-56.20000112.7Y348 Y349 A350 F366 K426Y348-S352 WeakPolarHBondContact O-CB 3.36Å; Y348-S352 PolarHBondContact O-N 2.98Å; Y348-S352 PolarHBondContact O-OG 2.86Å; Y349-S352 PolarHBondContact O-N 2.96Å; A350-S352 VanDerWaalsContact C-N 3.26Å; A350-S352 PolarHBondContact O-N 3.07Å; S352-F366 WeakPolarHBondContact O-CZ 3.39Å; S352-K426 WeakPolarHBondContact OG-CE 3.32Å
353I95.5Very high94.3Very high0 Ų011.8 Ų11.80%08%0.077CC..Hα-helixtrans-77.9-34.5-179.4-70.1160.5000111T40 Q134 Y138 Y349 A350 A471 L472T40-I353 WeakPolarHBondContact CB-O 3.44Å; T40-I353 WeakPolarHBondContact CG2-O 3.38Å; T40-I353 WeakPolarHBondContact OG1-CA 3.18Å; T40-I353 PolarHBondContact OG1-O 3.13Å; Q134-I353 HydrophobicContact CG-CD1 3.9Å; Q134-I353 HydrophobicContact CG-CG1 4.47Å; Y138-I353 HydrophobicContact CE2-CD1 4.02Å; Y349-I353 VanDerWaalsContact O-CB 3.3Å; Y349-I353 WeakPolarHBondContact O-CB 3.3Å; Y349-I353 VanDerWaalsContact O-CD1 3.31Å; Y349-I353 WeakPolarHBondContact O-CD1 3.31Å; Y349-I353 WeakPolarHBondContact O-CG1 3.34Å; Y349-I353 PolarHBondContact O-N 2.67Å; A350-I353 PolarHBondContact O-N 3.01Å; I353-A471 HydrophobicContact CB-CB 4.32Å; I353-A471 HydrophobicContact CG2-CB 4.2Å; I353-L472 HydrophobicContact CG2-CD1 3.82Å; I353-L472 HydrophobicContact CG2-CD2 3.73Å; I353-L472 HydrophobicContact CG2-CG 3.68Å
354N94.5Very high94Very high27 Ų2717.1 Ų17.114%0.14410%0.102CC..  trans-139.473.9177.9-168.5-3.3000110.5A350 S356 F357 A471A350-N354 PolarHBondContact O-N 3.49Å; N354-S356 VanDerWaalsContact C-N 3.28Å; N354-S356 PolarHBondContact O-N 2.95Å; N354-F357 HydrophobicContact CB-CB 4.34Å; N354-F357 VanDerWaalsContact O-CD1 3.27Å; N354-F357 WeakPolarHBondContact O-CD1 3.15Å; N354-F357 PolarHBondContact OD1-N 3.3Å; N354-A471 HydrophobicContact CB-CB 3.9Å; N354-A471 PolarHBondContact ND2-O 2.95Å
355P92.7Very high93.8Very high3 Ų317.1 Ų17.12%0.01910%0.102CC..THydrogen-bonded Turntrans-71.2-23.4-178.129.1-34.8000113.2L351 F366 L423L351-P355 VanDerWaalsContact O-CA 3.23Å; L351-P355 WeakPolarHBondContact O-CA 3.12Å; L351-P355 VanDerWaalsContact O-CB 3.28Å; L351-P355 WeakPolarHBondContact O-CB 3.11Å; P355-F366 VanDerWaalsContact CD-CE2 3.48Å; P355-F366 HydrophobicContact CG-CD2 3.54Å; P355-F366 HydrophobicContact CG-CE2 3.43Å; P355-F366 VanDerWaalsContact CG-CE2 3.43Å; P355-F366 HydrophobicContact CG-CZ 4.47Å; P355-L423 HydrophobicContact CB-CD2 3.85Å
356S90.7Very high93.7Very high17 Ų1717.1 Ų17.112%0.11910%0.102CC..THydrogen-bonded Turntrans-96.919.3-17952.40000113.3N354 L358 G359N354-S356 VanDerWaalsContact C-N 3.28Å; N354-S356 PolarHBondContact O-N 2.95Å; S356-L358 PolarHBondContact O-N 3.03Å; S356-L358 VanDerWaalsContact O-N 3.12Å; S356-G359 WeakPolarHBondContact CA-O 3.39Å; S356-G359 WeakPolarHBondContact O-CA 3.23Å; S356-G359 PolarHBondContact O-N 2.9Å
357F91.8Very high93.5Very high22 Ų2219.1 Ų19.110%0.09611%0.112CC..THydrogen-bonded Turntrans-63.5-18-17880.7-77.9000114.3L351 N354 V422 A475 A479 V482 S483 Y486L351-F357 HydrophobicContact CD2-CE1 3.81Å; L351-F357 HydrophobicContact CD2-CZ 4.41Å; N354-F357 HydrophobicContact CB-CB 4.34Å; N354-F357 VanDerWaalsContact O-CD1 3.27Å; N354-F357 WeakPolarHBondContact O-CD1 3.15Å; N354-F357 PolarHBondContact OD1-N 3.3Å; F357-V422 HydrophobicContact CE1-CG1 4.02Å; F357-V422 HydrophobicContact CE1-CG2 3.9Å; F357-V422 HydrophobicContact CZ-CG2 4.38Å; F357-A475 HydrophobicContact CB-CB 4.21Å; F357-A475 HydrophobicContact CD2-CB 4.18Å; F357-A479 HydrophobicContact CD2-CB 4.1Å; F357-A479 WeakPolarHBondContact CE2-O 3.3Å; F357-V482 HydrophobicContact CE2-CG1 4.45Å; F357-S483 WeakPolarHBondContact CE2-OG 3.3Å; F357-S483 VanDerWaalsContact CZ-OG 3.31Å; F357-S483 WeakPolarHBondContact CZ-OG 3.18Å; F357-Y486 HydrophobicContact CE1-CE2 4.48Å; F357-Y486 HydrophobicContact CE2-CE2 4.47Å; F357-Y486 HydrophobicContact CZ-CD2 4.31Å; F357-Y486 HydrophobicContact CZ-CE2 4.17Å
358L90.3Very high93.4Very high22 Ų2221.8 Ų21.812%0.11513%0.126CC..THydrogen-bonded Turntrans-988.6172.5-65.7178.9000113.2S356 T407 K418 V422 A479S356-L358 PolarHBondContact O-N 3.03Å; S356-L358 VanDerWaalsContact O-N 3.12Å; L358-T407 HydrophobicContact CD1-CG2 4.14Å; L358-K418 HydrophobicContact CB-CB 4.02Å; L358-K418 HydrophobicContact CB-CD 4.13Å; L358-K418 HydrophobicContact CD1-CB 4.1Å; L358-K418 HydrophobicContact CD1-CD 4.32Å; L358-V422 HydrophobicContact CD1-CG2 3.73Å; L358-A479 HydrophobicContact CD2-CB 4.08Å
359G87.9Confident93.3Very high18 Ų1821.3 Ų21.319%0.18612%0.124CC..SBendtrans105.3-177.8-173.300000113.2S356S356-G359 WeakPolarHBondContact CA-O 3.39Å; S356-G359 WeakPolarHBondContact O-CA 3.23Å; S356-G359 PolarHBondContact O-N 2.9Å
360G87.2Confident93.2Very high29 Ų2920.8 Ų20.830%0.29912%0.122SC..SBendtrans85.5171.2-170.200000113Q415G360-Q415 VanDerWaalsContact N-OE1 3.14Å
361S90.4Very high93.2Very high45 Ų4526.2 Ų26.232%0.31515%0.145SC..  trans-82.6137.4-179.881.40000111.1N363 E364 S365S361-N363 VanDerWaalsContact C-N 3.35Å; S361-N363 PolarHBondContact O-N 3.24Å; S361-E364 WeakPolarHBondContact OG-CB 3.39Å; S361-E364 WeakPolarHBondContact OG-CG 3.2Å; S361-E364 PolarHBondContact OG-N 3.08Å; S361-E364 PolarHBondContact OG-OE2 2.95Å; S361-S365 VanDerWaalsContact O-CB 3.29Å; S361-S365 WeakPolarHBondContact O-CB 3.5Å; S361-S365 PolarHBondContact O-N 3.28Å; S361-S365 PolarHBondContact O-OG 3.03Å
362I91.5Very high93.2Very high9 Ų928.4 Ų28.45%0.04616%0.157CC..Hα-helixtrans-61.3-41.6179-170.5170.3000112T40 F41 E44 S365 F366T40-I362 HydrophobicContact CG2-CD1 3.61Å; T40-I362 HydrophobicContact CG2-CG1 4.04Å; F41-I362 HydrophobicContact CD1-CD1 3.99Å; F41-I362 HydrophobicContact CD1-CG1 4.1Å; F41-I362 HydrophobicContact CD1-CG2 4.35Å; F41-I362 HydrophobicContact CE1-CB 4.34Å; F41-I362 HydrophobicContact CE1-CD1 4.09Å; F41-I362 HydrophobicContact CE1-CG1 3.67Å; F41-I362 HydrophobicContact CE1-CG2 4.03Å; F41-I362 HydrophobicContact CZ-CG1 4.33Å; E44-I362 WeakPolarHBondContact OE2-CD1 3.35Å; I362-S365 PolarHBondContact O-N 3.37Å; I362-F366 HydrophobicContact CG1-CD2 4.3Å; I362-F366 HydrophobicContact CG1-CE2 4.37Å; I362-F366 WeakPolarHBondContact O-CD2 3.47Å; I362-F366 PolarHBondContact O-N 2.64Å
363N91.7Very high93.2Very high27 Ų2728.4 Ų28.414%0.14416%0.156CC..Hα-helixtrans-64.5-50.7-179.9-70-29.1000112F41 S361 S365 F366 I367F41-N363 WeakPolarHBondContact CE1-OD1 3.49Å; S361-N363 VanDerWaalsContact C-N 3.35Å; S361-N363 PolarHBondContact O-N 3.24Å; N363-S365 VanDerWaalsContact C-N 3.32Å; N363-S365 PolarHBondContact O-N 3.15Å; N363-F366 PolarHBondContact O-N 2.78Å; N363-I367 WeakPolarHBondContact O-CG1 3.49Å; N363-I367 PolarHBondContact O-N 3.22Å; N363-I367 VanDerWaalsContact O-N 3.12Å
364E92.9Very high93.2Very high111 Ų11130 Ų3052%0.51916%0.164SC..Hα-helixtrans-63.4-42.2179-65.4164.2164.200110.7S361 F366 I367 I368S361-E364 WeakPolarHBondContact OG-CB 3.39Å; S361-E364 WeakPolarHBondContact OG-CG 3.2Å; S361-E364 PolarHBondContact OG-N 3.08Å; S361-E364 PolarHBondContact OG-OE2 2.95Å; E364-F366 VanDerWaalsContact C-N 3.28Å; E364-F366 PolarHBondContact O-N 3.41Å; E364-I367 PolarHBondContact O-N 2.67Å; E364-I368 HydrophobicContact CB-CD1 4.15Å; E364-I368 VanDerWaalsContact O-CB 3.28Å; E364-I368 WeakPolarHBondContact O-CB 3.44Å; E364-I368 VanDerWaalsContact O-CG1 3.23Å; E364-I368 WeakPolarHBondContact O-CG1 3.39Å; E364-I368 PolarHBondContact O-N 3.45Å
365S94.7Very high93.2Very high0 Ų032.3 Ų32.30%018%0.181CC..Hα-helixtrans-57.3-42178.2-62.30000112.1S361 I362 N363 G369 M419 L423S361-S365 VanDerWaalsContact O-CB 3.29Å; S361-S365 WeakPolarHBondContact O-CB 3.5Å; S361-S365 PolarHBondContact O-N 3.28Å; S361-S365 PolarHBondContact O-OG 3.03Å; I362-S365 PolarHBondContact O-N 3.37Å; N363-S365 VanDerWaalsContact C-N 3.32Å; N363-S365 PolarHBondContact O-N 3.15Å; S365-G369 WeakPolarHBondContact O-CA 3.45Å; S365-G369 PolarHBondContact O-N 3.43Å; S365-M419 WeakPolarHBondContact OG-CG 3.38Å; S365-M419 PolarHBondContact OG-SD 3.43Å; S365-L423 VanDerWaalsContact O-CD2 3.28Å; S365-L423 WeakPolarHBondContact O-CD2 3.24Å
366F93.6Very high93.3Very high0 Ų033.7 Ų33.70%019%0.191CC..Hα-helixtrans-65.2-48.9176.5-99.2-103.5000112.9L37 T40 F41 Q230 L233 S352 P355 I362 N363 E364 G369 G370L37-F366 HydrophobicContact CB-CE1 3.97Å; L37-F366 HydrophobicContact CD1-CE1 4.08Å; T40-F366 HydrophobicContact CG2-CD2 4.33Å; T40-F366 HydrophobicContact CG2-CE2 3.21Å; T40-F366 HydrophobicContact CG2-CZ 3.39Å; F41-F366 HydrophobicContact CE1-CD2 4.4Å; F41-F366 HydrophobicContact CE2-CB 4.42Å; F41-F366 AromaticContact CE2-CD1 3.65Å; F41-F366 HydrophobicContact CE2-CD1 3.65Å; F41-F366 AromaticContact CE2-CD2 3.98Å; F41-F366 HydrophobicContact CE2-CD2 3.98Å; F41-F366 AromaticContact CE2-CE1 3.83Å; F41-F366 HydrophobicContact CE2-CE1 3.83Å; F41-F366 HydrophobicContact CE2-CE2 4.16Å; F41-F366 AromaticContact CE2-CG 3.73Å; F41-F366 HydrophobicContact CE2-CG 3.73Å; F41-F366 HydrophobicContact CE2-CZ 4.08Å; F41-F366 HydrophobicContact CZ-CB 3.85Å; F41-F366 AromaticContact CZ-CD1 3.9Å; F41-F366 HydrophobicContact CZ-CD1 3.9Å; F41-F366 AromaticContact CZ-CD2 3.56Å; F41-F366 HydrophobicContact CZ-CD2 3.56Å; F41-F366 HydrophobicContact CZ-CE1 4.38Å; F41-F366 HydrophobicContact CZ-CE2 4.09Å; F41-F366 AromaticContact CZ-CG 3.46Å; F41-F366 HydrophobicContact CZ-CG 3.46Å; F41-F366 VanDerWaalsContact CZ-CG 3.46Å; F41-F366 HydrophobicContact CZ-CZ 4.46Å; Q230-F366 HydrophobicContact CG-CD1 3.64Å; Q230-F366 HydrophobicContact CG-CE1 4.14Å; Q230-F366 PolarHBondContact NE2-O 3.18Å; L233-F366 HydrophobicContact CD2-CD1 4.38Å; L233-F366 HydrophobicContact CD2-CE1 4.01Å; S352-F366 WeakPolarHBondContact O-CZ 3.39Å; P355-F366 VanDerWaalsContact CD-CE2 3.48Å; P355-F366 HydrophobicContact CG-CD2 3.54Å; P355-F366 HydrophobicContact CG-CE2 3.43Å; P355-F366 VanDerWaalsContact CG-CE2 3.43Å; P355-F366 HydrophobicContact CG-CZ 4.47Å; I362-F366 HydrophobicContact CG1-CD2 4.3Å; I362-F366 HydrophobicContact CG1-CE2 4.37Å; I362-F366 WeakPolarHBondContact O-CD2 3.47Å; I362-F366 PolarHBondContact O-N 2.64Å; N363-F366 PolarHBondContact O-N 2.78Å; E364-F366 VanDerWaalsContact C-N 3.28Å; E364-F366 PolarHBondContact O-N 3.41Å; F366-G369 PolarHBondContact O-N 3.19Å; F366-G370 PolarHBondContact O-N 2.98Å
367I95.7Very high93.4Very high46 Ų4633 Ų3324%0.23619%0.185CC..Hα-helixtrans-67-50.9-175.9-65.7169.5000110N363 E364 G369 G370 F371N363-I367 WeakPolarHBondContact O-CG1 3.49Å; N363-I367 PolarHBondContact O-N 3.22Å; N363-I367 VanDerWaalsContact O-N 3.12Å; E364-I367 PolarHBondContact O-N 2.67Å; I367-G369 VanDerWaalsContact C-N 3.32Å; I367-G369 PolarHBondContact O-N 3.02Å; I367-G370 PolarHBondContact O-N 3.04Å; I367-F371 HydrophobicContact CG2-CD2 3.81Å; I367-F371 HydrophobicContact CG2-CE2 3.66Å; I367-F371 VanDerWaalsContact O-CD2 3.26Å; I367-F371 WeakPolarHBondContact O-CD2 3.25Å; I367-F371 PolarHBondContact O-N 3.33Å
368I96.3Very high93.5Very high57 Ų5737.7 Ų37.729%0.29221%0.206SC..Hα-helixtrans-60.4-45177.7-63.9168.5000109.9E364 G370 F371 L372 M419 I420 L423E364-I368 HydrophobicContact CB-CD1 4.15Å; E364-I368 VanDerWaalsContact O-CB 3.28Å; E364-I368 WeakPolarHBondContact O-CB 3.44Å; E364-I368 VanDerWaalsContact O-CG1 3.23Å; E364-I368 WeakPolarHBondContact O-CG1 3.39Å; E364-I368 PolarHBondContact O-N 3.45Å; I368-G370 VanDerWaalsContact C-N 3.32Å; I368-G370 PolarHBondContact O-N 3.36Å; I368-F371 PolarHBondContact O-N 2.86Å; I368-L372 HydrophobicContact CG2-CD1 3.82Å; I368-L372 HydrophobicContact CG2-CG 4.19Å; I368-L372 WeakPolarHBondContact O-CG 3.49Å; I368-L372 PolarHBondContact O-N 3.19Å; I368-M419 HydrophobicContact CD1-CE 4.18Å; I368-I420 HydrophobicContact CG2-CD1 4.23Å; I368-L423 HydrophobicContact CB-CD1 3.91Å; I368-L423 HydrophobicContact CG2-CD1 3.71Å
369G95.4Very high93.7Very high0 Ų040.5 Ų40.50%022%0.224CC..Hα-helixtrans-59.9-39.8177.600000113.2S365 F366 I367 E373S365-G369 WeakPolarHBondContact O-CA 3.45Å; S365-G369 PolarHBondContact O-N 3.43Å; F366-G369 PolarHBondContact O-N 3.19Å; I367-G369 VanDerWaalsContact C-N 3.32Å; I367-G369 PolarHBondContact O-N 3.02Å; G369-E373 WeakPolarHBondContact O-CG 3.28Å; G369-E373 PolarHBondContact O-N 3.15Å
370G95.4Very high93.9Very high0 Ų040.3 Ų40.30%022%0.218CC..Hα-helixtrans-67.4-39.7175.600000112.6F366 I367 I368F366-G370 PolarHBondContact O-N 2.98Å; I367-G370 PolarHBondContact O-N 3.04Å; I368-G370 VanDerWaalsContact C-N 3.32Å; I368-G370 PolarHBondContact O-N 3.36Å
371F96.7Very high94.1Very high115 Ų11540.4 Ų40.450%0.50421%0.212SC..Hα-helixtrans-66.5-38.4174.6-82.3-64.8000112.9I231 I367 I368 E373 M374 P375I231-F371 HydrophobicContact CD1-CD1 3.82Å; I231-F371 HydrophobicContact CD1-CD2 4.14Å; I231-F371 HydrophobicContact CD1-CE1 3.87Å; I231-F371 HydrophobicContact CD1-CE2 4.19Å; I231-F371 HydrophobicContact CD1-CG 3.96Å; I231-F371 HydrophobicContact CD1-CZ 4.05Å; I231-F371 HydrophobicContact CG1-CD2 4.45Å; I231-F371 HydrophobicContact CG2-CE2 4.16Å; I231-F371 HydrophobicContact CG2-CZ 4.27Å; I367-F371 HydrophobicContact CG2-CD2 3.81Å; I367-F371 HydrophobicContact CG2-CE2 3.66Å; I367-F371 VanDerWaalsContact O-CD2 3.26Å; I367-F371 WeakPolarHBondContact O-CD2 3.25Å; I367-F371 PolarHBondContact O-N 3.33Å; I368-F371 PolarHBondContact O-N 2.86Å; F371-E373 VanDerWaalsContact C-N 3.33Å; F371-E373 PolarHBondContact O-N 2.91Å; F371-M374 PolarHBondContact O-N 3.42Å; F371-P375 WeakPolarHBondContact O-CD 3.48Å
372L96.7Very high94.1Very high47 Ų4743.9 Ų43.925%0.24623%0.226CC..Hα-helixtrans-69.5-28.1180-72.5174.9000113.2I368 M374 P375 C376 L423 L424 S427I368-L372 HydrophobicContact CG2-CD1 3.82Å; I368-L372 HydrophobicContact CG2-CG 4.19Å; I368-L372 WeakPolarHBondContact O-CG 3.49Å; I368-L372 PolarHBondContact O-N 3.19Å; L372-M374 PolarHBondContact O-N 2.93Å; L372-P375 WeakPolarHBondContact O-CD 3.16Å; L372-C376 PolarHBondContact O-SG 3Å; L372-L423 HydrophobicContact CD1-CB 3.82Å; L372-L424 HydrophobicContact CD1-CD2 4.13Å; L372-L424 HydrophobicContact CD1-CG 4.44Å; L372-L424 HydrophobicContact CD2-CD2 4.15Å; L372-S427 WeakPolarHBondContact CB-OG 3.46Å
373E95.8Very high94.1Very high1 Ų144.6 Ų44.61%0.00523%0.231CC..Hα-helixtrans-64.1-38.6175-78.6-176.5-170.400112.9S227 G369 F371 C376 L377 K426 S427S227-E373 WeakPolarHBondContact OG-CB 3.28Å; S227-E373 PolarHBondContact OG-OE2 3.3Å; G369-E373 WeakPolarHBondContact O-CG 3.28Å; G369-E373 PolarHBondContact O-N 3.15Å; F371-E373 VanDerWaalsContact C-N 3.33Å; F371-E373 PolarHBondContact O-N 2.91Å; E373-C376 PolarHBondContact O-N 3.4Å; E373-L377 WeakPolarHBondContact O-CG 3.36Å; E373-L377 PolarHBondContact O-N 3.49Å; E373-K426 WeakPolarHBondContact OE1-CE 3.48Å; E373-K426 IonicContact OE1-NZ 3.71Å; E373-K426 PolarHBondContact OE1-NZ 2.8Å; E373-S427 PolarHBondContact N-OG 3.27Å
374M94.5Very high94.1Very high33 Ų3343.3 Ų43.316%0.16322%0.224CC..Hα-helixtrans-63.2-49.5-173.1-61.5179.1-179.100113I224 F228 I231 F371 L372 C376 L377 F378I224-M374 HydrophobicContact CG2-CG 4.42Å; F228-M374 HydrophobicContact CB-CE 4.32Å; F228-M374 HydrophobicContact CD1-CE 3.57Å; F228-M374 HydrophobicContact CD2-CE 3.83Å; F228-M374 HydrophobicContact CE1-CE 3.69Å; F228-M374 HydrophobicContact CE1-SD 4.45Å; F228-M374 HydrophobicContact CE2-CE 3.95Å; F228-M374 HydrophobicContact CG-CE 3.63Å; F228-M374 HydrophobicContact CZ-CE 3.88Å; F228-M374 HydrophobicContact CZ-SD 4.29Å; I231-M374 HydrophobicContact CD1-CE 3.41Å; I231-M374 VanDerWaalsContact CD1-CE 3.41Å; I231-M374 HydrophobicContact CD1-SD 4.33Å; F371-M374 PolarHBondContact O-N 3.42Å; L372-M374 PolarHBondContact O-N 2.93Å; M374-C376 VanDerWaalsContact C-N 3.33Å; M374-C376 PolarHBondContact O-N 3.07Å; M374-L377 PolarHBondContact O-N 3.48Å; M374-F378 PolarHBondContact O-N 3.1Å
375P95.1Very high93.8Very high77 Ų7743 Ų4350%0.523%0.226SC..Hα-helixtrans-58.9-40.9172.6-25.334000112.9F371 L372 L377 F378 V379F371-P375 WeakPolarHBondContact O-CD 3.48Å; L372-P375 WeakPolarHBondContact O-CD 3.16Å; P375-L377 PolarHBondContact O-N 2.91Å; P375-F378 PolarHBondContact O-N 3.46Å; P375-V379 WeakPolarHBondContact O-CG2 3.46Å; P375-V379 PolarHBondContact O-N 3.5Å
376C95Very high93.6Very high32 Ų3253 Ų5322%0.21626%0.264CS..Hα-helixtrans-61.6-43.3178.1-72.70000111.7L372 E373 M374 V379 I380 A431L372-C376 PolarHBondContact O-SG 3Å; E373-C376 PolarHBondContact O-N 3.4Å; M374-C376 VanDerWaalsContact C-N 3.33Å; M374-C376 PolarHBondContact O-N 3.07Å; C376-V379 PolarHBondContact O-N 3.37Å; C376-I380 WeakPolarHBondContact O-CG1 2.99Å; C376-I380 PolarHBondContact O-N 3.36Å; C376-A431 HydrophobicContact CB-CB 4.15Å
377L93.7Very high93.5Very high1 Ų158 Ų581%0.00529%0.286CS..Hα-helixtrans-64.6-39.3174.7-69.3172.7000111.9V220 G223 I224 E373 M374 P375 I380 L381 A434V220-L377 HydrophobicContact CG1-CB 4.4Å; V220-L377 HydrophobicContact CG1-CD2 4.08Å; G223-L377 VanDerWaalsContact C-CD1 3.48Å; I224-L377 HydrophobicContact CG1-CB 4.41Å; I224-L377 HydrophobicContact CG1-CD1 4.08Å; E373-L377 WeakPolarHBondContact O-CG 3.36Å; E373-L377 PolarHBondContact O-N 3.49Å; M374-L377 PolarHBondContact O-N 3.48Å; P375-L377 PolarHBondContact O-N 2.91Å; L377-I380 PolarHBondContact O-N 3.47Å; L377-L381 WeakPolarHBondContact O-CG 3.21Å; L377-L381 PolarHBondContact O-N 2.8Å; L377-A434 HydrophobicContact CD2-CB 3.84Å
378F93.6Very high93.4Very high122 Ų12256 Ų5654%0.53528%0.276SS..Hα-helixtrans-64.9-41.2175.8-170.7-104.9000112.4M374 P375 I380 L381 L382M374-F378 PolarHBondContact O-N 3.1Å; P375-F378 PolarHBondContact O-N 3.46Å; F378-I380 VanDerWaalsContact C-N 3.33Å; F378-I380 PolarHBondContact O-N 3.48Å; F378-L381 WeakPolarHBondContact O-CB 3.37Å; F378-L381 PolarHBondContact O-N 3.49Å; F378-L382 HydrophobicContact CD1-CD1 4.02Å; F378-L382 HydrophobicContact CE1-CD1 3.58Å; F378-L382 HydrophobicContact CE1-CG 4.28Å; F378-L382 HydrophobicContact CZ-CD1 4.14Å; F378-L382 HydrophobicContact CZ-CG 4.49Å; F378-L382 WeakPolarHBondContact O-CG 3.3Å; F378-L382 PolarHBondContact O-N 3.04Å
379V94.1Very high93.2Very high80 Ų8054 Ų5449%0.48527%0.265SS..Hα-helixtrans-58.3-47.4172.7170.50000110.1P375 C376 L381 L382 T383P375-V379 WeakPolarHBondContact O-CG2 3.46Å; P375-V379 PolarHBondContact O-N 3.5Å; C376-V379 PolarHBondContact O-N 3.37Å; V379-L381 VanDerWaalsContact C-N 3.34Å; V379-L381 PolarHBondContact O-N 2.8Å; V379-L382 PolarHBondContact O-N 3.2Å; V379-L382 VanDerWaalsContact O-N 3.09Å; V379-T383 HydrophobicContact CG1-CG2 4.05Å; V379-T383 WeakPolarHBondContact O-CB 3.3Å; V379-T383 WeakPolarHBondContact O-CG2 3.35Å; V379-T383 PolarHBondContact O-N 2.96Å; V379-T383 PolarHBondContact O-OG1 3.45Å
380I92.4Very high93.3Very high14 Ų1456.2 Ų56.27%0.07227%0.274CS..Hα-helixtrans-58.8-43.1177.2-70.3-58.8000112.2C376 L377 F378 L382 T383 I384 L392 A431 V435C376-I380 WeakPolarHBondContact O-CG1 2.99Å; C376-I380 PolarHBondContact O-N 3.36Å; L377-I380 PolarHBondContact O-N 3.47Å; F378-I380 VanDerWaalsContact C-N 3.33Å; F378-I380 PolarHBondContact O-N 3.48Å; I380-L382 PolarHBondContact O-N 3.27Å; I380-T383 PolarHBondContact O-N 2.92Å; I380-T383 VanDerWaalsContact O-N 3.16Å; I380-I384 HydrophobicContact CG2-CB 4.3Å; I380-I384 HydrophobicContact CG2-CD1 4.38Å; I380-I384 VanDerWaalsContact O-CB 3.23Å; I380-I384 WeakPolarHBondContact O-CB 3.43Å; I380-I384 WeakPolarHBondContact O-CG2 3.3Å; I380-I384 PolarHBondContact O-N 3.31Å; I380-L392 HydrophobicContact CD1-CD1 4.16Å; I380-L392 HydrophobicContact CD1-CD2 4.22Å; I380-A431 HydrophobicContact CD1-CB 4.1Å; I380-A431 HydrophobicContact CG1-CB 3.4Å; I380-V435 HydrophobicContact CD1-CG2 3.93Å; I380-V435 HydrophobicContact CG1-CG2 4.39Å; I380-V435 HydrophobicContact CG2-CG2 3.71Å
381L90.6Very high93.3Very high32 Ų3259.8 Ų59.817%0.16829%0.292CS..Hα-helixtrans-54.9-40.2176-75.8173000112.1V216 L217 V220 L377 F378 V379V216-L381 HydrophobicContact CG1-CD2 4.32Å; L217-L381 HydrophobicContact CD1-CD1 3.86Å; L217-L381 HydrophobicContact CD1-CD2 4.09Å; V220-L381 HydrophobicContact CB-CD2 3.6Å; V220-L381 HydrophobicContact CB-CG 4.22Å; V220-L381 HydrophobicContact CG1-CD2 3.8Å; V220-L381 HydrophobicContact CG1-CG 3.82Å; V220-L381 HydrophobicContact CG2-CD2 4.14Å; L377-L381 WeakPolarHBondContact O-CG 3.21Å; L377-L381 PolarHBondContact O-N 2.8Å; F378-L381 WeakPolarHBondContact O-CB 3.37Å; F378-L381 PolarHBondContact O-N 3.49Å; V379-L381 VanDerWaalsContact C-N 3.34Å; V379-L381 PolarHBondContact O-N 2.8Å
382L90.6Very high93.2Very high118 Ų11855.6 Ų55.662%0.61828%0.275SS*.Hα-helixtrans-79-29.8179.7-61.8179.5000113.1F378 V379 I380F378-L382 HydrophobicContact CD1-CD1 4.02Å; F378-L382 HydrophobicContact CE1-CD1 3.58Å; F378-L382 HydrophobicContact CE1-CG 4.28Å; F378-L382 HydrophobicContact CZ-CD1 4.14Å; F378-L382 HydrophobicContact CZ-CG 4.49Å; F378-L382 WeakPolarHBondContact O-CG 3.3Å; F378-L382 PolarHBondContact O-N 3.04Å; V379-L382 PolarHBondContact O-N 3.2Å; V379-L382 VanDerWaalsContact O-N 3.09Å; I380-L382 PolarHBondContact O-N 3.27Å
383T92.3Very high93.3Very high24 Ų2453.3 Ų53.315%0.14726%0.263CS..Hα-helixtrans-102.3-22.3-169.461.40000115.2V379 I380 N385 R386 F387V379-T383 HydrophobicContact CG1-CG2 4.05Å; V379-T383 WeakPolarHBondContact O-CB 3.3Å; V379-T383 WeakPolarHBondContact O-CG2 3.35Å; V379-T383 PolarHBondContact O-N 2.96Å; V379-T383 PolarHBondContact O-OG1 3.45Å; I380-T383 PolarHBondContact O-N 2.92Å; I380-T383 VanDerWaalsContact O-N 3.16Å; T383-N385 VanDerWaalsContact C-N 3.29Å; T383-N385 PolarHBondContact O-N 3.32Å; T383-R386 PolarHBondContact O-N 3.29Å; T383-F387 HydrophobicContact CG2-CD2 4.03Å; T383-F387 HydrophobicContact CG2-CE2 3.81Å; T383-F387 PolarHBondContact O-N 3.25Å
384I90.9Very high93.3Very high0 Ų055.5 Ų55.50%027%0.274CS..Hα-helixtrans-59.6-34.9-170.5-167.4170.5000114.6V216 I380 G388 R389 L392 V435 I438V216-I384 HydrophobicContact CG1-CG2 3.67Å; I380-I384 HydrophobicContact CG2-CB 4.3Å; I380-I384 HydrophobicContact CG2-CD1 4.38Å; I380-I384 VanDerWaalsContact O-CB 3.23Å; I380-I384 WeakPolarHBondContact O-CB 3.43Å; I380-I384 WeakPolarHBondContact O-CG2 3.3Å; I380-I384 PolarHBondContact O-N 3.31Å; I384-G388 PolarHBondContact O-N 2.83Å; I384-R389 HydrophobicContact CG1-CG 4.42Å; I384-R389 PolarHBondContact O-NH1 3.43Å; I384-L392 VanDerWaalsContact CA-CD1 3.5Å; I384-L392 HydrophobicContact CB-CD1 4.1Å; I384-L392 HydrophobicContact CG1-CD1 4.24Å; I384-V435 HydrophobicContact CD1-CG1 4.33Å; I384-V435 HydrophobicContact CD1-CG2 4.14Å; I384-I438 HydrophobicContact CD1-CB 4.43Å; I384-I438 HydrophobicContact CD1-CD1 3.5Å; I384-I438 VanDerWaalsContact CD1-CD1 3.5Å; I384-I438 HydrophobicContact CD1-CG2 4.43Å
385N87.5Confident93.5Very high104 Ų10457.5 Ų57.556%0.55629%0.288SS*.Hα-helixtrans-83.2-19.3177.1-69.3-33.5000113.2T383 R389T383-N385 VanDerWaalsContact C-N 3.29Å; T383-N385 PolarHBondContact O-N 3.32Å; N385-R389 PolarHBondContact OD1-NH1 2.98Å; N385-R389 PolarHBondContact OD1-NH2 3.47Å
386R89.6Confident93.6Very high210 Ų21054.2 Ų54.279%0.79227%0.268SS*.Hα-helixtrans-89.9-47.2-178-176.7175.3-179.4163.30.3112.9T383T383-R386 PolarHBondContact O-N 3.29Å
387F92.6Very high93.8Very high104 Ų10452.7 Ų52.746%0.45626%0.258SS..Hα-helixtrans-92.9-11.6-176.3-66.2-51.3000113.8T383 L391 L392T383-F387 HydrophobicContact CG2-CD2 4.03Å; T383-F387 HydrophobicContact CG2-CE2 3.81Å; T383-F387 PolarHBondContact O-N 3.25Å; F387-L391 HydrophobicContact CB-CD2 4.26Å; F387-L392 HydrophobicContact CB-CD2 4.33Å; F387-L392 HydrophobicContact CB-CG 4.28Å; F387-L392 HydrophobicContact CD2-CD2 4.4Å
388G91.7Very high94Very high4 Ų456 Ų564%0.04128%0.275CS..  trans78.9173.3-174.500000113.2I384 L392I384-G388 PolarHBondContact O-N 2.83Å; G388-L392 VanDerWaalsContact O-CD1 3.3Å; G388-L392 WeakPolarHBondContact O-CD1 3.34Å; G388-L392 VanDerWaalsContact O-CG 3.28Å; G388-L392 WeakPolarHBondContact O-CG 3.02Å
389R94Very high94.2Very high17 Ų1753.7 Ų53.76%0.06427%0.268CS..Hα-helixtrans-86.4-41.1-169.1-70.866.1163.2142.5-0.2110.8I384 N385 L391 L392 L393 V435 Y439 E442 E502I384-R389 HydrophobicContact CG1-CG 4.42Å; I384-R389 PolarHBondContact O-NH1 3.43Å; N385-R389 PolarHBondContact OD1-NH1 2.98Å; N385-R389 PolarHBondContact OD1-NH2 3.47Å; R389-L391 PolarHBondContact O-N 3.22Å; R389-L392 PolarHBondContact O-N 3.14Å; R389-L393 VanDerWaalsContact O-CG 3.31Å; R389-L393 WeakPolarHBondContact O-CG 3.22Å; R389-L393 PolarHBondContact O-N 2.96Å; R389-V435 HydrophobicContact CB-CG1 4.05Å; R389-V435 HydrophobicContact CG-CG1 4.22Å; R389-Y439 HydrophobicContact CB-CD2 3.29Å; R389-Y439 HydrophobicContact CB-CE2 3.97Å; R389-Y439 HydrophobicContact CB-CG 3.96Å; R389-Y439 HydrophobicContact CG-CD2 3.98Å; R389-E442 WeakPolarHBondContact CD-OE2 3.49Å; R389-E442 IonicContact CZ-OE1 3.06Å; R389-E442 IonicContact CZ-OE2 3.57Å; R389-E442 IonicContact NE-OE1 2.88Å; R389-E442 PolarHBondContact NE-OE1 3.35Å; R389-E442 VanDerWaalsContact NE-OE1 3.15Å; R389-E442 IonicContact NE-OE2 3.54Å; R389-E442 PolarHBondContact NE-OE2 3.44Å; R389-E442 IonicContact NH2-OE1 2.76Å; R389-E442 PolarHBondContact NH2-OE1 2.86Å; R389-E442 IonicContact NH2-OE2 2.64Å; R389-E502 PolarHBondContact N-OE1 3.47Å; R389-E502 PolarHBondContact N-OE2 3.44Å
390R95.7Very high94.4Very high46 Ų4649.9 Ų49.917%0.17425%0.245CC..Hα-helixtrans-64.3-45.4-176.5-178.4-179.267.3178.7-1.3111.5L393 M394 V497 L500 E502R390-L393 PolarHBondContact O-N 3.11Å; R390-M394 WeakPolarHBondContact O-CB 3.12Å; R390-M394 PolarHBondContact O-N 3.2Å; R390-V497 HydrophobicContact CG-CG1 3.95Å; R390-V497 WeakPolarHBondContact O-CG1 3.5Å; R390-L500 WeakPolarHBondContact CD-O 3.23Å; R390-L500 PolarHBondContact NH1-O 3.49Å; R390-E502 VanDerWaalsContact CB-OE2 3.25Å; R390-E502 WeakPolarHBondContact CB-OE2 3.35Å; R390-E502 PolarHBondContact N-OE2 3.45Å
391L95.5Very high94.7Very high74 Ų7449.6 Ų49.639%0.38724%0.244SC..Hα-helixtrans-63-43.9-179.9-178.560.7000111.3F387 R389 M394 V395F387-L391 HydrophobicContact CB-CD2 4.26Å; R389-L391 PolarHBondContact O-N 3.22Å; L391-M394 HydrophobicContact CD1-CE 4.04Å; L391-M394 PolarHBondContact O-N 3.17Å; L391-V395 HydrophobicContact CD1-CG2 3.74Å; L391-V395 HydrophobicContact CG-CG2 4.24Å; L391-V395 WeakPolarHBondContact O-CB 3.28Å; L391-V395 WeakPolarHBondContact O-CG2 3.23Å; L391-V395 PolarHBondContact O-N 3.44Å
392L96.2Very high95.1Very high27 Ų2754 Ų5414%0.14126%0.262CS..Hα-helixtrans-64.9-41178.7-70.7175.3000112.6I380 I384 F387 G388 R389 G396 V435I380-L392 HydrophobicContact CD1-CD1 4.16Å; I380-L392 HydrophobicContact CD1-CD2 4.22Å; I384-L392 VanDerWaalsContact CA-CD1 3.5Å; I384-L392 HydrophobicContact CB-CD1 4.1Å; I384-L392 HydrophobicContact CG1-CD1 4.24Å; F387-L392 HydrophobicContact CB-CD2 4.33Å; F387-L392 HydrophobicContact CB-CG 4.28Å; F387-L392 HydrophobicContact CD2-CD2 4.4Å; G388-L392 VanDerWaalsContact O-CD1 3.3Å; G388-L392 WeakPolarHBondContact O-CD1 3.34Å; G388-L392 VanDerWaalsContact O-CG 3.28Å; G388-L392 WeakPolarHBondContact O-CG 3.02Å; R389-L392 PolarHBondContact O-N 3.14Å; L392-G396 PolarHBondContact O-N 3.41Å; L392-V435 HydrophobicContact CB-CG1 4.49Å; L392-V435 HydrophobicContact CB-CG2 4.38Å; L392-V435 HydrophobicContact CD1-CG2 4.49Å
393L97.3Very high95.4Very high0 Ų049.3 Ų49.30%024%0.237CC..Hα-helixtrans-61.4-50.1173.5-71.9173.2000111R389 R390 G396 F397 V432 V435 I436 Y439 V497R389-L393 VanDerWaalsContact O-CG 3.31Å; R389-L393 WeakPolarHBondContact O-CG 3.22Å; R389-L393 PolarHBondContact O-N 2.96Å; R390-L393 PolarHBondContact O-N 3.11Å; L393-G396 PolarHBondContact O-N 2.99Å; L393-F397 WeakPolarHBondContact O-CD2 3.49Å; L393-F397 PolarHBondContact O-N 2.98Å; L393-V432 HydrophobicContact CD2-CG1 3.78Å; L393-V435 HydrophobicContact CD1-CG1 4.42Å; L393-V435 HydrophobicContact CD2-CB 3.94Å; L393-V435 HydrophobicContact CD2-CG1 3.94Å; L393-V435 HydrophobicContact CG-CB 4.34Å; L393-V435 HydrophobicContact CG-CG1 3.8Å; L393-I436 HydrophobicContact CD2-CB 4.09Å; L393-Y439 HydrophobicContact CD1-CD1 3.43Å; L393-Y439 VanDerWaalsContact CD1-CD1 3.43Å; L393-Y439 HydrophobicContact CD1-CE1 3.95Å; L393-Y439 HydrophobicContact CD1-CG 3.76Å; L393-V497 HydrophobicContact CB-CG1 3.69Å; L393-V497 HydrophobicContact CB-CG2 4.16Å; L393-V497 HydrophobicContact CD1-CG1 4.5Å
394M97.5Very high95.7Very high47 Ų4748.2 Ų48.223%0.23223%0.23CC..Hα-helixtrans-62.7-51.3-178-172.9-178.175.600111.8R390 L391 G396 F397 L398 V497 F498R390-M394 WeakPolarHBondContact O-CB 3.12Å; R390-M394 PolarHBondContact O-N 3.2Å; L391-M394 HydrophobicContact CD1-CE 4.04Å; L391-M394 PolarHBondContact O-N 3.17Å; M394-G396 VanDerWaalsContact C-N 3.32Å; M394-G396 PolarHBondContact O-N 2.91Å; M394-F397 PolarHBondContact O-N 2.92Å; M394-L398 HydrophobicContact CG-CD1 4Å; M394-L398 WeakPolarHBondContact O-CB 3.28Å; M394-L398 VanDerWaalsContact O-CG 3.25Å; M394-L398 WeakPolarHBondContact O-CG 3.15Å; M394-L398 PolarHBondContact O-N 3.21Å; M394-V497 HydrophobicContact CB-CG1 4.06Å; M394-F498 HydrophobicContact SD-CB 4.3Å; M394-F498 HydrophobicContact SD-CD2 4.07Å
395V97.2Very high96Very high75 Ų7551.8 Ų51.846%0.45525%0.246SC..Hα-helixtrans-63.6-40.2179.2172.10000110.7L391 L398 L399L391-V395 HydrophobicContact CD1-CG2 3.74Å; L391-V395 HydrophobicContact CG-CG2 4.24Å; L391-V395 WeakPolarHBondContact O-CB 3.28Å; L391-V395 WeakPolarHBondContact O-CG2 3.23Å; L391-V395 PolarHBondContact O-N 3.44Å; V395-L398 PolarHBondContact O-N 2.93Å; V395-L399 WeakPolarHBondContact O-CB 3.28Å; V395-L399 PolarHBondContact O-N 3.34Å
396G97.8Very high96.5Very high8 Ų850 Ų508%0.08224%0.236CC..Hα-helixtrans-63.2-45.4178.700000113L392 L393 M394 C400 V428L392-G396 PolarHBondContact O-N 3.41Å; L393-G396 PolarHBondContact O-N 2.99Å; M394-G396 VanDerWaalsContact C-N 3.32Å; M394-G396 PolarHBondContact O-N 2.91Å; G396-C400 WeakPolarHBondContact O-CB 3.42Å; G396-C400 PolarHBondContact O-N 2.85Å; G396-V428 WeakPolarHBondContact O-CG1 3.33Å
397F98.5Very high96.8Very high0 Ų040.1 Ų40.10%020%0.199CC..Hα-helixtrans-63.8-44.9174.7-82.1-62.9000112.5V340 V344 L393 M394 C400 T401 L429 V432 A490 A493 V497V340-F397 HydrophobicContact CG1-CE2 3.47Å; V340-F397 VanDerWaalsContact CG1-CE2 3.47Å; V340-F397 HydrophobicContact CG1-CZ 3.65Å; V344-F397 HydrophobicContact CB-CE1 4.26Å; V344-F397 HydrophobicContact CB-CZ 3.96Å; V344-F397 HydrophobicContact CG2-CZ 4.38Å; L393-F397 WeakPolarHBondContact O-CD2 3.49Å; L393-F397 PolarHBondContact O-N 2.98Å; M394-F397 PolarHBondContact O-N 2.92Å; F397-C400 WeakPolarHBondContact O-CB 3.48Å; F397-C400 PolarHBondContact O-N 2.68Å; F397-T401 PolarHBondContact O-N 3.48Å; F397-T401 PolarHBondContact O-OG1 3.04Å; F397-L429 HydrophobicContact CD1-CD2 4.35Å; F397-L429 HydrophobicContact CE1-CD2 3.94Å; F397-V432 HydrophobicContact CD2-CG1 4.04Å; F397-V432 HydrophobicContact CE1-CG1 4.15Å; F397-V432 HydrophobicContact CE2-CG1 3.52Å; F397-V432 HydrophobicContact CZ-CG1 3.6Å; F397-A490 WeakPolarHBondContact CB-O 3.29Å; F397-A490 HydrophobicContact CD1-CB 4.15Å; F397-A493 HydrophobicContact CD1-CB 3.82Å; F397-A493 HydrophobicContact CD2-CB 4.13Å; F397-A493 HydrophobicContact CE1-CB 3.73Å; F397-A493 HydrophobicContact CE2-CB 4.08Å; F397-A493 HydrophobicContact CG-CB 4.03Å; F397-A493 HydrophobicContact CZ-CB 3.86Å; F397-V497 HydrophobicContact CD2-CG2 4.33Å; F397-V497 HydrophobicContact CE2-CG2 4.32Å
398L98.3Very high96.9Very high70 Ų7037.6 Ų37.637%0.36619%0.192SC..Hα-helixtrans-66.2-38.4179.5-67.5175.6000112.3M394 V395 T401 F402 L491M394-L398 HydrophobicContact CG-CD1 4Å; M394-L398 WeakPolarHBondContact O-CB 3.28Å; M394-L398 VanDerWaalsContact O-CG 3.25Å; M394-L398 WeakPolarHBondContact O-CG 3.15Å; M394-L398 PolarHBondContact O-N 3.21Å; V395-L398 PolarHBondContact O-N 2.93Å; L398-T401 PolarHBondContact O-N 3.43Å; L398-F402 WeakPolarHBondContact O-CB 3.25Å; L398-F402 PolarHBondContact O-N 3.12Å; L398-L491 HydrophobicContact CD2-CD1 3.72Å
399L98.1Very high97.1Very high74 Ų7442.4 Ų42.439%0.38722%0.223SC..Hα-helixtrans-65.2-42.8174.6179.559.9000110.9V395 F402 L403 V428V395-L399 WeakPolarHBondContact O-CB 3.28Å; V395-L399 PolarHBondContact O-N 3.34Å; L399-F402 PolarHBondContact O-N 2.89Å; L399-L403 HydrophobicContact CD1-CD1 4.25Å; L399-L403 HydrophobicContact CD1-CG 4.27Å; L399-L403 HydrophobicContact CG-CD1 4.08Å; L399-L403 WeakPolarHBondContact O-CB 3.15Å; L399-L403 VanDerWaalsContact O-CG 3.25Å; L399-L403 WeakPolarHBondContact O-CG 3.22Å; L399-L403 PolarHBondContact O-N 2.97Å; L399-V428 HydrophobicContact CB-CG1 4.35Å; L399-V428 HydrophobicContact CD2-CG1 4.17Å; L399-V428 HydrophobicContact CD2-CG2 3.76Å; L399-V428 HydrophobicContact CG-CG1 4.4Å; L399-V428 HydrophobicContact CG-CG2 4.25Å
400C98.4Very high97.1Very high0 Ų043 Ų430%023%0.227CC..Hα-helixtrans-58.1-48.2172.2176.60000111.6G396 F397 F402 L403 I404 L429G396-C400 WeakPolarHBondContact O-CB 3.42Å; G396-C400 PolarHBondContact O-N 2.85Å; F397-C400 WeakPolarHBondContact O-CB 3.48Å; F397-C400 PolarHBondContact O-N 2.68Å; C400-F402 VanDerWaalsContact C-N 3.34Å; C400-F402 PolarHBondContact O-N 3.29Å; C400-L403 PolarHBondContact O-N 3.23Å; C400-I404 WeakPolarHBondContact O-CG1 3.47Å; C400-I404 PolarHBondContact O-N 3.18Å; C400-I404 VanDerWaalsContact SG-CD1 3.58Å; C400-L429 HydrophobicContact CB-CD1 4.33Å; C400-L429 HydrophobicContact CB-CG 4.26Å; C400-L429 WeakPolarHBondContact SG-CD1 3.25Å
401T98.6Very high97Very high8 Ų843.5 Ų43.55%0.04924%0.237CC..Hα-helixtrans-57.2-47.7176.3-65.60000111.4F397 L398 L403 I404 F405 G487 A490 L491F397-T401 PolarHBondContact O-N 3.48Å; F397-T401 PolarHBondContact O-OG1 3.04Å; L398-T401 PolarHBondContact O-N 3.43Å; T401-L403 PolarHBondContact O-N 3.46Å; T401-I404 PolarHBondContact O-N 3.44Å; T401-F405 HydrophobicContact CG2-CD2 3.69Å; T401-F405 HydrophobicContact CG2-CE2 3.57Å; T401-F405 HydrophobicContact CG2-CG 4.28Å; T401-F405 HydrophobicContact CG2-CZ 4.08Å; T401-F405 WeakPolarHBondContact O-CB 3.39Å; T401-F405 WeakPolarHBondContact O-CG 2.97Å; T401-F405 PolarHBondContact O-N 3.48Å; T401-G487 WeakPolarHBondContact CG2-O 3.42Å; T401-G487 PolarHBondContact OG1-O 3.45Å; T401-A490 WeakPolarHBondContact OG1-CB 3.36Å; T401-L491 HydrophobicContact CG2-CB 3.91Å; T401-L491 HydrophobicContact CG2-CD1 4.25Å; T401-L491 HydrophobicContact CG2-CG 4.46Å; T401-L491 WeakPolarHBondContact OG1-CA 3.49Å; T401-L491 PolarHBondContact OG1-N 3.32Å
402F98.5Very high96.6Very high125 Ų12545 Ų4555%0.54825%0.246SC..Hα-helixtrans-58.1-48.9178.9172.8-102.1000111.6L398 L399 C400 I404 F405 L406L398-F402 WeakPolarHBondContact O-CB 3.25Å; L398-F402 PolarHBondContact O-N 3.12Å; L399-F402 PolarHBondContact O-N 2.89Å; C400-F402 VanDerWaalsContact C-N 3.34Å; C400-F402 PolarHBondContact O-N 3.29Å; F402-I404 PolarHBondContact O-N 3.32Å; F402-F405 PolarHBondContact O-N 2.91Å; F402-L406 HydrophobicContact CE1-CD2 4.43Å; F402-L406 HydrophobicContact CZ-CD2 4.49Å; F402-L406 WeakPolarHBondContact O-CB 3.23Å; F402-L406 PolarHBondContact O-N 2.92Å
403L98.2Very high96.2Very high18 Ų1851 Ų519%0.09428%0.278CS..Hα-helixtrans-62.3-41.1179.7-69.6169.1000112.3L399 C400 T401 L421 L424 A425 V428L399-L403 HydrophobicContact CD1-CD1 4.25Å; L399-L403 HydrophobicContact CD1-CG 4.27Å; L399-L403 HydrophobicContact CG-CD1 4.08Å; L399-L403 WeakPolarHBondContact O-CB 3.15Å; L399-L403 VanDerWaalsContact O-CG 3.25Å; L399-L403 WeakPolarHBondContact O-CG 3.22Å; L399-L403 PolarHBondContact O-N 2.97Å; C400-L403 PolarHBondContact O-N 3.23Å; T401-L403 PolarHBondContact O-N 3.46Å; L403-L421 HydrophobicContact CD2-CD2 3.91Å; L403-L424 HydrophobicContact CD1-CB 3.94Å; L403-A425 HydrophobicContact CB-CB 3.86Å; L403-A425 HydrophobicContact CD1-CB 4.23Å; L403-V428 HydrophobicContact CD1-CG2 4.41Å
404I97.8Very high96Very high2 Ų255.9 Ų55.91%0.0130%0.301CS..Hα-helixtrans-69.9-44.6177.8-67.7175.6000111.2V347 L351 C400 T401 F402 L406 T407 A425 S483V347-I404 HydrophobicContact CG1-CD1 4.07Å; L351-I404 HydrophobicContact CD1-CD1 4.23Å; C400-I404 WeakPolarHBondContact O-CG1 3.47Å; C400-I404 PolarHBondContact O-N 3.18Å; C400-I404 VanDerWaalsContact SG-CD1 3.58Å; T401-I404 PolarHBondContact O-N 3.44Å; F402-I404 PolarHBondContact O-N 3.32Å; I404-L406 PolarHBondContact O-N 2.96Å; I404-T407 PolarHBondContact O-N 3.45Å; I404-T407 VanDerWaalsContact O-N 3.11Å; I404-T407 PolarHBondContact O-OG1 2.82Å; I404-A425 HydrophobicContact CD1-CB 4.29Å; I404-A425 HydrophobicContact CG1-CB 3.76Å; I404-S483 WeakPolarHBondContact CG2-O 3.48Å
405F98.2Very high95.7Very high74 Ų7457.9 Ų57.933%0.32531%0.31SS..Hα-helixtrans-68.1-26.7178.6-74-7.4000112.7T401 F402 T407 V408 P409T401-F405 HydrophobicContact CG2-CD2 3.69Å; T401-F405 HydrophobicContact CG2-CE2 3.57Å; T401-F405 HydrophobicContact CG2-CG 4.28Å; T401-F405 HydrophobicContact CG2-CZ 4.08Å; T401-F405 WeakPolarHBondContact O-CB 3.39Å; T401-F405 WeakPolarHBondContact O-CG 2.97Å; T401-F405 PolarHBondContact O-N 3.48Å; F402-F405 PolarHBondContact O-N 2.91Å; F405-T407 PolarHBondContact O-N 3.42Å; F405-V408 WeakPolarHBondContact O-CB 3.28Å; F405-V408 PolarHBondContact O-N 3.42Å; F405-P409 VanDerWaalsContact O-CD 3.26Å; F405-P409 WeakPolarHBondContact O-CD 3.46Å
406L97.3Very high95.5Very high67 Ų6759 Ų5935%0.35132%0.316SS..THydrogen-bonded Turntrans-63.4-22.1172.7-168.763000112.6F402 I404 P409 I410 L421F402-L406 HydrophobicContact CE1-CD2 4.43Å; F402-L406 HydrophobicContact CZ-CD2 4.49Å; F402-L406 WeakPolarHBondContact O-CB 3.23Å; F402-L406 PolarHBondContact O-N 2.92Å; I404-L406 PolarHBondContact O-N 2.96Å; L406-P409 WeakPolarHBondContact O-CD 3.47Å; L406-I410 VanDerWaalsContact O-CD1 3.26Å; L406-I410 WeakPolarHBondContact O-CD1 3.3Å; L406-I410 VanDerWaalsContact O-CG1 3.31Å; L406-I410 WeakPolarHBondContact O-CG1 3.28Å; L406-L421 HydrophobicContact CB-CD1 4.25Å; L406-L421 HydrophobicContact CD2-CD1 4.01Å; L406-L421 HydrophobicContact CD2-CD2 3.87Å; L406-L421 HydrophobicContact CG-CD1 4.01Å
407T96.2Very high95.3Very high2 Ų261.9 Ų61.91%0.01233%0.332CS..THydrogen-bonded Turntrans-76-22.9177.674.90000113.8L358 I404 F405 I410 K418 L421 V422L358-T407 HydrophobicContact CD1-CG2 4.14Å; I404-T407 PolarHBondContact O-N 3.45Å; I404-T407 VanDerWaalsContact O-N 3.11Å; I404-T407 PolarHBondContact O-OG1 2.82Å; F405-T407 PolarHBondContact O-N 3.42Å; T407-I410 PolarHBondContact O-N 3.47Å; T407-K418 WeakPolarHBondContact O-CE 3.23Å; T407-L421 HydrophobicContact CG2-CB 3.78Å; T407-L421 HydrophobicContact CG2-CD1 4.05Å; T407-V422 HydrophobicContact CG2-CG2 4.24Å
408V95Very high95.2Very high52 Ų5262 Ų6232%0.31533%0.332SS..SBendtrans-64.4-49.2-175.51790000112.9F405 I410 I480 I484F405-V408 WeakPolarHBondContact O-CB 3.28Å; F405-V408 PolarHBondContact O-N 3.42Å; V408-I410 VanDerWaalsContact C-N 3.26Å; V408-I410 PolarHBondContact O-N 2.73Å; V408-I480 HydrophobicContact CG1-CG2 4.2Å; V408-I484 HydrophobicContact CG2-CG1 3.95Å
409P95.4Very high95Very high105 Ų10559 Ų5968%0.68232%0.317SS*.SBendtrans-75.6-11.417930.9-37.4000113.9F405 L406F405-P409 VanDerWaalsContact O-CD 3.26Å; F405-P409 WeakPolarHBondContact O-CD 3.46Å; L406-P409 WeakPolarHBondContact O-CD 3.47Å
410I94.5Very high94.9Very high29 Ų2958.4 Ų58.415%0.14931%0.313CS..SBendtrans-73.5136.3-177.9-64.8175.3000109.7L406 T407 V408 Q414 V417 K418 L421L406-I410 VanDerWaalsContact O-CD1 3.26Å; L406-I410 WeakPolarHBondContact O-CD1 3.3Å; L406-I410 VanDerWaalsContact O-CG1 3.31Å; L406-I410 WeakPolarHBondContact O-CG1 3.28Å; T407-I410 PolarHBondContact O-N 3.47Å; V408-I410 VanDerWaalsContact C-N 3.26Å; V408-I410 PolarHBondContact O-N 2.73Å; I410-Q414 HydrophobicContact CG2-CB 3.71Å; I410-V417 HydrophobicContact CD1-CG1 3.91Å; I410-K418 HydrophobicContact CB-CG 4.22Å; I410-K418 HydrophobicContact CG2-CD 4.43Å; I410-K418 HydrophobicContact CG2-CG 3.88Å; I410-K418 WeakPolarHBondContact O-CE 3.48Å; I410-K418 PolarHBondContact O-NZ 2.89Å; I410-L421 HydrophobicContact CD1-CD1 3.49Å; I410-L421 VanDerWaalsContact CD1-CD1 3.49Å
411S92.1Very high94.9Very high56 Ų5659.4 Ų59.439%0.39232%0.318SS..  trans-63.8155178.568.40000112.1D413 Q414 K418S411-D413 PolarHBondContact O-N 2.95Å; S411-Q414 PolarHBondContact O-N 3.48Å; S411-K418 WeakPolarHBondContact O-CE 3.43Å; S411-K418 PolarHBondContact O-NZ 3.44Å
412N86.8Confident94.8Very high106 Ų10659.1 Ų59.157%0.56732%0.317SS*.THydrogen-bonded Turntrans-68.4-17.9-179.3-71.2-22.3000113.6Q414 Q415 K418N412-Q414 VanDerWaalsContact C-N 3.27Å; N412-Q414 PolarHBondContact O-N 3.48Å; N412-Q415 VanDerWaalsContact O-CG 3.23Å; N412-Q415 WeakPolarHBondContact O-CG 3.33Å; N412-K418 PolarHBondContact OD1-NZ 3.01Å
413D89.6Confident94.7Very high153 Ų15353.1 Ų53.182%0.81829%0.291SS*.THydrogen-bonded Turntrans-71.5-24176.7-51.1-45.7000112.2S411 Q415S411-D413 PolarHBondContact O-N 2.95Å; D413-Q415 VanDerWaalsContact C-N 3.29Å; D413-Q415 PolarHBondContact O-N 3.38Å
414Q91.7Very high94.7Very high102 Ų10255.2 Ų55.248%0.47730%0.301SS..  trans-91.651.2-178.5-64.1-168.3-11.400112.7I410 S411 N412 V416 V417 K418I410-Q414 HydrophobicContact CG2-CB 3.71Å; S411-Q414 PolarHBondContact O-N 3.48Å; N412-Q414 VanDerWaalsContact C-N 3.27Å; N412-Q414 PolarHBondContact O-N 3.48Å; Q414-V416 VanDerWaalsContact C-N 3.3Å; Q414-V416 PolarHBondContact O-N 3.03Å; Q414-V417 HydrophobicContact CB-CB 4.33Å; Q414-V417 HydrophobicContact CB-CG2 4.25Å; Q414-V417 PolarHBondContact O-N 3.38Å; Q414-V417 VanDerWaalsContact O-N 3.17Å; Q414-K418 PolarHBondContact O-N 3.02Å
415Q91.7Very high94.7Very high90 Ų9055.1 Ų55.142%0.42130%0.301SS..Hα-helixtrans-58.1-40-176.4-62.2-172.3-5.900112.9G360 N412 D413 V417 K418 M419G360-Q415 VanDerWaalsContact N-OE1 3.14Å; N412-Q415 VanDerWaalsContact O-CG 3.23Å; N412-Q415 WeakPolarHBondContact O-CG 3.33Å; D413-Q415 VanDerWaalsContact C-N 3.29Å; D413-Q415 PolarHBondContact O-N 3.38Å; Q415-V417 VanDerWaalsContact C-N 3.33Å; Q415-V417 PolarHBondContact O-N 3.2Å; Q415-K418 PolarHBondContact O-N 2.88Å; Q415-M419 WeakPolarHBondContact O-CB 3.4Å; Q415-M419 PolarHBondContact O-N 3.4Å
416V92.4Very high94.7Very high99 Ų9951.6 Ų51.660%0.629%0.285SS*.Hα-helixtrans-61.7-41.2179.3-179.50000111.3Q414 M419 I420Q414-V416 VanDerWaalsContact C-N 3.3Å; Q414-V416 PolarHBondContact O-N 3.03Å; V416-M419 HydrophobicContact CG1-CE 4.44Å; V416-M419 PolarHBondContact O-N 3.34Å; V416-I420 HydrophobicContact CG1-CG1 4.5Å; V416-I420 VanDerWaalsContact O-CG1 3.31Å; V416-I420 WeakPolarHBondContact O-CG1 3.08Å; V416-I420 PolarHBondContact O-N 2.79Å
417V94.9Very high94.6Very high67 Ų6748.4 Ų48.441%0.40627%0.269SS..Hα-helixtrans-66.2-45.5179-176.80000110.4I410 Q414 Q415 M419 I420 L421I410-V417 HydrophobicContact CD1-CG1 3.91Å; Q414-V417 HydrophobicContact CB-CB 4.33Å; Q414-V417 HydrophobicContact CB-CG2 4.25Å; Q414-V417 PolarHBondContact O-N 3.38Å; Q414-V417 VanDerWaalsContact O-N 3.17Å; Q415-V417 VanDerWaalsContact C-N 3.33Å; Q415-V417 PolarHBondContact O-N 3.2Å; V417-M419 VanDerWaalsContact C-N 3.35Å; V417-M419 PolarHBondContact O-N 3.21Å; V417-I420 PolarHBondContact O-N 2.94Å; V417-L421 HydrophobicContact CG1-CD1 4.24Å; V417-L421 WeakPolarHBondContact O-CG 3.17Å; V417-L421 PolarHBondContact O-N 3.2Å
418K95.4Very high94.7Very high2 Ų249.2 Ų49.21%0.00927%0.274CS..Hα-helixtrans-59.2-45.8175.8-68-173.5179.3-172.20111.5L358 T407 I410 S411 N412 Q414 Q415 L421 V422L358-K418 HydrophobicContact CB-CB 4.02Å; L358-K418 HydrophobicContact CB-CD 4.13Å; L358-K418 HydrophobicContact CD1-CB 4.1Å; L358-K418 HydrophobicContact CD1-CD 4.32Å; T407-K418 WeakPolarHBondContact O-CE 3.23Å; I410-K418 HydrophobicContact CB-CG 4.22Å; I410-K418 HydrophobicContact CG2-CD 4.43Å; I410-K418 HydrophobicContact CG2-CG 3.88Å; I410-K418 WeakPolarHBondContact O-CE 3.48Å; I410-K418 PolarHBondContact O-NZ 2.89Å; S411-K418 WeakPolarHBondContact O-CE 3.43Å; S411-K418 PolarHBondContact O-NZ 3.44Å; N412-K418 PolarHBondContact OD1-NZ 3.01Å; Q414-K418 PolarHBondContact O-N 3.02Å; Q415-K418 PolarHBondContact O-N 2.88Å; K418-L421 PolarHBondContact O-N 3.08Å; K418-V422 WeakPolarHBondContact O-CG2 3.3Å; K418-V422 PolarHBondContact O-N 3.03Å
419M94.8Very high94.8Very high8 Ų846.8 Ų46.84%0.03926%0.259CS..Hα-helixtrans-56.6-52.7177-178.4-175.776.100110.8S365 I368 Q415 V416 V417 L421 V422 L423S365-M419 WeakPolarHBondContact OG-CG 3.38Å; S365-M419 PolarHBondContact OG-SD 3.43Å; I368-M419 HydrophobicContact CD1-CE 4.18Å; Q415-M419 WeakPolarHBondContact O-CB 3.4Å; Q415-M419 PolarHBondContact O-N 3.4Å; V416-M419 HydrophobicContact CG1-CE 4.44Å; V416-M419 PolarHBondContact O-N 3.34Å; V417-M419 VanDerWaalsContact C-N 3.35Å; V417-M419 PolarHBondContact O-N 3.21Å; M419-L421 VanDerWaalsContact C-N 3.34Å; M419-L421 PolarHBondContact O-N 3.27Å; M419-V422 PolarHBondContact O-N 2.93Å; M419-L423 HydrophobicContact CG-CD1 3.94Å; M419-L423 HydrophobicContact CG-CG 4.38Å; M419-L423 VanDerWaalsContact O-CG 3.23Å; M419-L423 WeakPolarHBondContact O-CG 3.31Å; M419-L423 PolarHBondContact O-N 3.23Å
420I95.8Very high94.8Very high62 Ų6242.2 Ų42.232%0.31823%0.229SC..Hα-helixtrans-60-42.6179.9-65.4-63.3000111.9I368 V416 V417 V422 L423 L424I368-I420 HydrophobicContact CG2-CD1 4.23Å; V416-I420 HydrophobicContact CG1-CG1 4.5Å; V416-I420 VanDerWaalsContact O-CG1 3.31Å; V416-I420 WeakPolarHBondContact O-CG1 3.08Å; V416-I420 PolarHBondContact O-N 2.79Å; V417-I420 PolarHBondContact O-N 2.94Å; I420-V422 PolarHBondContact O-N 3.21Å; I420-L423 PolarHBondContact O-N 3.47Å; I420-L424 HydrophobicContact CG2-CD1 4.04Å; I420-L424 HydrophobicContact CG2-CG 4.4Å; I420-L424 WeakPolarHBondContact O-CB 3.32Å; I420-L424 VanDerWaalsContact O-CG 3.3Å; I420-L424 WeakPolarHBondContact O-CG 3.5Å; I420-L424 PolarHBondContact O-N 3Å
421L97.1Very high94.8Very high20 Ų2041.1 Ų41.111%0.10523%0.225CC..Hα-helixtrans-61.8-43.6176.8-71.2174000112.6L403 L406 T407 I410 V417 K418 M419 L424 A425L403-L421 HydrophobicContact CD2-CD2 3.91Å; L406-L421 HydrophobicContact CB-CD1 4.25Å; L406-L421 HydrophobicContact CD2-CD1 4.01Å; L406-L421 HydrophobicContact CD2-CD2 3.87Å; L406-L421 HydrophobicContact CG-CD1 4.01Å; T407-L421 HydrophobicContact CG2-CB 3.78Å; T407-L421 HydrophobicContact CG2-CD1 4.05Å; I410-L421 HydrophobicContact CD1-CD1 3.49Å; I410-L421 VanDerWaalsContact CD1-CD1 3.49Å; V417-L421 HydrophobicContact CG1-CD1 4.24Å; V417-L421 WeakPolarHBondContact O-CG 3.17Å; V417-L421 PolarHBondContact O-N 3.2Å; K418-L421 PolarHBondContact O-N 3.08Å; M419-L421 VanDerWaalsContact C-N 3.34Å; M419-L421 PolarHBondContact O-N 3.27Å; L421-L424 PolarHBondContact O-N 3.14Å; L421-A425 WeakPolarHBondContact O-CB 3.39Å; L421-A425 PolarHBondContact O-N 3.34Å
422V97.1Very high95Very high2 Ų238.7 Ų38.71%0.01221%0.207CC..Hα-helixtrans-62.1-45.1175.5166.80000111.3L351 F357 L358 T407 K418 M419 I420 L424 A425 K426L351-V422 HydrophobicContact CD1-CG1 4.46Å; L351-V422 HydrophobicContact CD2-CG1 3.83Å; F357-V422 HydrophobicContact CE1-CG1 4.02Å; F357-V422 HydrophobicContact CE1-CG2 3.9Å; F357-V422 HydrophobicContact CZ-CG2 4.38Å; L358-V422 HydrophobicContact CD1-CG2 3.73Å; T407-V422 HydrophobicContact CG2-CG2 4.24Å; K418-V422 WeakPolarHBondContact O-CG2 3.3Å; K418-V422 PolarHBondContact O-N 3.03Å; M419-V422 PolarHBondContact O-N 2.93Å; I420-V422 PolarHBondContact O-N 3.21Å; V422-L424 VanDerWaalsContact C-N 3.35Å; V422-L424 PolarHBondContact O-N 3.49Å; V422-A425 WeakPolarHBondContact O-CB 3.14Å; V422-A425 PolarHBondContact O-N 3.44Å; V422-K426 WeakPolarHBondContact O-CB 3.36Å; V422-K426 PolarHBondContact O-N 2.95Å
423L97.3Very high95.3Very high0 Ų034.3 Ų34.30%018%0.183CC..Hα-helixtrans-67-36-179.5-64.3177.1000112.2P355 S365 I368 L372 M419 I420 S427P355-L423 HydrophobicContact CB-CD2 3.85Å; S365-L423 VanDerWaalsContact O-CD2 3.28Å; S365-L423 WeakPolarHBondContact O-CD2 3.24Å; I368-L423 HydrophobicContact CB-CD1 3.91Å; I368-L423 HydrophobicContact CG2-CD1 3.71Å; L372-L423 HydrophobicContact CD1-CB 3.82Å; M419-L423 HydrophobicContact CG-CD1 3.94Å; M419-L423 HydrophobicContact CG-CG 4.38Å; M419-L423 VanDerWaalsContact O-CG 3.23Å; M419-L423 WeakPolarHBondContact O-CG 3.31Å; M419-L423 PolarHBondContact O-N 3.23Å; I420-L423 PolarHBondContact O-N 3.47Å; L423-S427 WeakPolarHBondContact O-CB 3.29Å; L423-S427 PolarHBondContact O-N 2.85Å; L423-S427 PolarHBondContact O-OG 3.44Å
424L97.4Very high95.5Very high61 Ų6127.8 Ų27.832%0.31915%0.15SC..Hα-helixtrans-64.4-45.3171.1-71.7172.1000111.1L372 L403 I420 L421 V422 K426 S427 V428L372-L424 HydrophobicContact CD1-CD2 4.13Å; L372-L424 HydrophobicContact CD1-CG 4.44Å; L372-L424 HydrophobicContact CD2-CD2 4.15Å; L403-L424 HydrophobicContact CD1-CB 3.94Å; I420-L424 HydrophobicContact CG2-CD1 4.04Å; I420-L424 HydrophobicContact CG2-CG 4.4Å; I420-L424 WeakPolarHBondContact O-CB 3.32Å; I420-L424 VanDerWaalsContact O-CG 3.3Å; I420-L424 WeakPolarHBondContact O-CG 3.5Å; I420-L424 PolarHBondContact O-N 3Å; L421-L424 PolarHBondContact O-N 3.14Å; V422-L424 VanDerWaalsContact C-N 3.35Å; V422-L424 PolarHBondContact O-N 3.49Å; L424-K426 PolarHBondContact O-N 2.89Å; L424-S427 PolarHBondContact O-N 2.86Å; L424-V428 WeakPolarHBondContact O-CG2 3.27Å; L424-V428 PolarHBondContact O-N 3.17Å
425A98.1Very high95.5Very high0 Ų023 Ų230%013%0.128CC..Hα-helixtrans-59.7-46177.600000111.7L351 L403 I404 L421 V422 S427 V428 L429L351-A425 HydrophobicContact CD1-CB 4.44Å; L403-A425 HydrophobicContact CB-CB 3.86Å; L403-A425 HydrophobicContact CD1-CB 4.23Å; I404-A425 HydrophobicContact CD1-CB 4.29Å; I404-A425 HydrophobicContact CG1-CB 3.76Å; L421-A425 WeakPolarHBondContact O-CB 3.39Å; L421-A425 PolarHBondContact O-N 3.34Å; V422-A425 WeakPolarHBondContact O-CB 3.14Å; V422-A425 PolarHBondContact O-N 3.44Å; A425-S427 VanDerWaalsContact C-N 3.34Å; A425-S427 PolarHBondContact O-N 2.8Å; A425-V428 PolarHBondContact O-N 3.13Å; A425-L429 PolarHBondContact O-N 3.24Å
426K97.2Very high95.6Very high0 Ų018.7 Ų18.70%011%0.108CC..Hα-helixtrans-57.3-45.6173.7-177.7-155.8169.1-134.60111.8Y348 L351 S352 E373 V422 L424 L429 S430Y348-K426 HydrophobicContact CD2-CG 4.45Å; L351-K426 HydrophobicContact CB-CB 3.98Å; L351-K426 HydrophobicContact CB-CG 4.01Å; L351-K426 HydrophobicContact CD1-CB 4.01Å; S352-K426 WeakPolarHBondContact OG-CE 3.32Å; E373-K426 WeakPolarHBondContact OE1-CE 3.48Å; E373-K426 IonicContact OE1-NZ 3.71Å; E373-K426 PolarHBondContact OE1-NZ 2.8Å; V422-K426 WeakPolarHBondContact O-CB 3.36Å; V422-K426 PolarHBondContact O-N 2.95Å; L424-K426 PolarHBondContact O-N 2.89Å; K426-L429 CarbonylContact O-C 3.2Å; K426-L429 WeakPolarHBondContact O-CA 3.34Å; K426-L429 WeakPolarHBondContact O-CB 3.33Å; K426-L429 PolarHBondContact O-N 3Å; K426-L429 VanDerWaalsContact O-N 3.15Å; K426-S430 PolarHBondContact O-N 3.35Å
427S96.8Very high95.5Very high0 Ų017 Ų170%09%0.091CC..Hα-helixtrans-67.5-39.4-177.7-57.70000112.3L372 E373 L423 L424 A425 L429 S430 A431L372-S427 WeakPolarHBondContact CB-OG 3.46Å; E373-S427 PolarHBondContact N-OG 3.27Å; L423-S427 WeakPolarHBondContact O-CB 3.29Å; L423-S427 PolarHBondContact O-N 2.85Å; L423-S427 PolarHBondContact O-OG 3.44Å; L424-S427 PolarHBondContact O-N 2.86Å; A425-S427 VanDerWaalsContact C-N 3.34Å; A425-S427 PolarHBondContact O-N 2.8Å; S427-L429 VanDerWaalsContact C-N 3.31Å; S427-L429 PolarHBondContact O-N 3.25Å; S427-S430 WeakPolarHBondContact O-CB 3.31Å; S427-S430 PolarHBondContact O-N 3.03Å; S427-A431 PolarHBondContact O-N 2.97Å
428V97.4Very high95.2Very high20 Ų2014.9 Ų14.912%0.1218%0.077CC..Hα-helixtrans-60.8-42.4170.3172.20000110.6G396 L399 L403 L424 A425 S430 A431 V432G396-V428 WeakPolarHBondContact O-CG1 3.33Å; L399-V428 HydrophobicContact CB-CG1 4.35Å; L399-V428 HydrophobicContact CD2-CG1 4.17Å; L399-V428 HydrophobicContact CD2-CG2 3.76Å; L399-V428 HydrophobicContact CG-CG1 4.4Å; L399-V428 HydrophobicContact CG-CG2 4.25Å; L403-V428 HydrophobicContact CD1-CG2 4.41Å; L424-V428 WeakPolarHBondContact O-CG2 3.27Å; L424-V428 PolarHBondContact O-N 3.17Å; A425-V428 PolarHBondContact O-N 3.13Å; V428-S430 PolarHBondContact O-N 2.83Å; V428-A431 WeakPolarHBondContact O-CB 3.25Å; V428-A431 PolarHBondContact O-N 3.29Å; V428-V432 WeakPolarHBondContact O-CG2 3.44Å; V428-V432 PolarHBondContact O-N 3.24Å
429L97.1Very high95.1Very high0 Ų014.8 Ų14.80%08%0.077CC..Hα-helixtrans-64.4-35.9175.6-98.8161.8000113.4V344 V347 F397 C400 A425 K426 S427 A431 V432 Y433V344-L429 HydrophobicContact CB-CD2 4.36Å; V344-L429 HydrophobicContact CG2-CD2 3.69Å; V347-L429 HydrophobicContact CB-CD1 3.63Å; V347-L429 HydrophobicContact CG1-CD1 3.28Å; F397-L429 HydrophobicContact CD1-CD2 4.35Å; F397-L429 HydrophobicContact CE1-CD2 3.94Å; C400-L429 HydrophobicContact CB-CD1 4.33Å; C400-L429 HydrophobicContact CB-CG 4.26Å; C400-L429 WeakPolarHBondContact SG-CD1 3.25Å; A425-L429 PolarHBondContact O-N 3.24Å; K426-L429 CarbonylContact O-C 3.2Å; K426-L429 WeakPolarHBondContact O-CA 3.34Å; K426-L429 WeakPolarHBondContact O-CB 3.33Å; K426-L429 PolarHBondContact O-N 3Å; K426-L429 VanDerWaalsContact O-N 3.15Å; S427-L429 VanDerWaalsContact C-N 3.31Å; S427-L429 PolarHBondContact O-N 3.25Å; L429-A431 VanDerWaalsContact C-N 3.32Å; L429-V432 WeakPolarHBondContact O-CB 3.36Å; L429-V432 PolarHBondContact O-N 3.16Å; L429-Y433 WeakPolarHBondContact O-CB 3.35Å; L429-Y433 PolarHBondContact O-N 3.41Å
430S95.2Very high94.9Very high9 Ų914.4 Ų14.46%0.0638%0.075CC..Hα-helixtrans-59.7-45172.9-175.10000111K426 S427 V428 Y433 A434K426-S430 PolarHBondContact O-N 3.35Å; S427-S430 WeakPolarHBondContact O-CB 3.31Å; S427-S430 PolarHBondContact O-N 3.03Å; V428-S430 PolarHBondContact O-N 2.83Å; S430-Y433 VanDerWaalsContact O-CB 3.26Å; S430-Y433 WeakPolarHBondContact O-CB 3.47Å; S430-Y433 PolarHBondContact O-N 2.9Å; S430-A434 PolarHBondContact O-N 3.3Å
431A94.8Very high94.5Very high7 Ų713.4 Ų13.46%0.0587%0.073CC..Hα-helixtrans-59.4-46.317200000112.6C376 I380 S427 V428 L429 Y433 A434 V435C376-A431 HydrophobicContact CB-CB 4.15Å; I380-A431 HydrophobicContact CD1-CB 4.1Å; I380-A431 HydrophobicContact CG1-CB 3.4Å; S427-A431 PolarHBondContact O-N 2.97Å; V428-A431 WeakPolarHBondContact O-CB 3.25Å; V428-A431 PolarHBondContact O-N 3.29Å; L429-A431 VanDerWaalsContact C-N 3.32Å; A431-Y433 VanDerWaalsContact C-N 3.27Å; A431-Y433 PolarHBondContact O-N 3Å; A431-A434 WeakPolarHBondContact O-CB 3.48Å; A431-A434 PolarHBondContact O-N 3.21Å; A431-A434 VanDerWaalsContact O-N 3.11Å; A431-V435 WeakPolarHBondContact O-CG2 3.46Å; A431-V435 PolarHBondContact O-N 3.3Å; A431-V435 VanDerWaalsContact O-N 3.09Å
432V96.2Very high94.1Very high4 Ų413.9 Ų13.92%0.0248%0.075CC..Hα-helixtrans-59-39.9174.31690000111.3V344 L393 F397 V428 L429 A434 V435 I436V344-V432 HydrophobicContact CG2-CG1 4.03Å; L393-V432 HydrophobicContact CD2-CG1 3.78Å; F397-V432 HydrophobicContact CD2-CG1 4.04Å; F397-V432 HydrophobicContact CE1-CG1 4.15Å; F397-V432 HydrophobicContact CE2-CG1 3.52Å; F397-V432 HydrophobicContact CZ-CG1 3.6Å; V428-V432 WeakPolarHBondContact O-CG2 3.44Å; V428-V432 PolarHBondContact O-N 3.24Å; L429-V432 WeakPolarHBondContact O-CB 3.36Å; L429-V432 PolarHBondContact O-N 3.16Å; V432-A434 VanDerWaalsContact C-N 3.33Å; V432-A434 PolarHBondContact O-N 2.96Å; V432-V435 PolarHBondContact O-N 3.27Å; V432-I436 PolarHBondContact O-N 3.37Å
433Y94.1Very high93.7Very high15 Ų1514 Ų146%0.0598%0.076CC..Hα-helixtrans-61.2-41.2174.9-141.4-57.6000111W341 V344 A345 Y348 Y349 L429 S430 A431 V435 I436 Y437 R461W341-Y433 HydrophobicContact CE3-CE1 4.49Å; W341-Y433 AromaticContact CZ3-CE1 3.82Å; W341-Y433 HydrophobicContact CZ3-CE1 3.82Å; V344-Y433 HydrophobicContact CB-CD2 4.39Å; V344-Y433 HydrophobicContact CG1-CD2 4.09Å; V344-Y433 HydrophobicContact CG1-CE2 4.03Å; V344-Y433 HydrophobicContact CG1-CG 4.48Å; V344-Y433 HydrophobicContact CG2-CD2 3.57Å; V344-Y433 HydrophobicContact CG2-CE2 4.26Å; V344-Y433 HydrophobicContact CG2-CG 3.94Å; A345-Y433 HydrophobicContact CB-CE2 4.33Å; Y348-Y433 AromaticContact CD1-CD2 4Å; Y348-Y433 HydrophobicContact CD1-CD2 4Å; Y348-Y433 HydrophobicContact CD1-CE2 4.02Å; Y348-Y433 HydrophobicContact CG-CD2 4.04Å; Y348-Y433 HydrophobicContact CG-CE2 4.4Å; Y349-Y433 HydrophobicContact CE2-CE2 4.3Å; L429-Y433 WeakPolarHBondContact O-CB 3.35Å; L429-Y433 PolarHBondContact O-N 3.41Å; S430-Y433 VanDerWaalsContact O-CB 3.26Å; S430-Y433 WeakPolarHBondContact O-CB 3.47Å; S430-Y433 PolarHBondContact O-N 2.9Å; A431-Y433 VanDerWaalsContact C-N 3.27Å; A431-Y433 PolarHBondContact O-N 3Å; Y433-V435 PolarHBondContact O-N 3.18Å; Y433-I436 HydrophobicContact CD1-CG2 4.33Å; Y433-I436 VanDerWaalsContact O-CG2 3.3Å; Y433-I436 WeakPolarHBondContact O-CG2 3.34Å; Y433-I436 PolarHBondContact O-N 3.41Å; Y433-Y437 AromaticContact CD1-CD2 3.85Å; Y433-Y437 HydrophobicContact CD1-CD2 3.85Å; Y433-Y437 AromaticContact CD1-CE2 3.39Å; Y433-Y437 HydrophobicContact CD1-CE2 3.39Å; Y433-Y437 HydrophobicContact CE1-CD2 4.19Å; Y433-Y437 AromaticContact CE1-CE2 3.33Å; Y433-Y437 HydrophobicContact CE1-CE2 3.33Å; Y433-Y437 AromaticContact CE1-CZ 3.96Å; Y433-Y437 VanDerWaalsContact O-CD2 3.25Å; Y433-Y437 WeakPolarHBondContact O-CD2 3.38Å; Y433-Y437 PolarHBondContact O-N 3.33Å; Y433-R461 PolarHBondContact OH-NH2 2.88Å
434A92Very high93.3Very high15 Ų1514 Ų1412%0.1248%0.076CC..Hα-helixtrans-64.2-40.6175.300000112.2V220 L377 S430 A431 V432V220-A434 HydrophobicContact CB-CB 4.44Å; V220-A434 HydrophobicContact CG1-CB 4Å; V220-A434 HydrophobicContact CG2-CB 4.12Å; L377-A434 HydrophobicContact CD2-CB 3.84Å; S430-A434 PolarHBondContact O-N 3.3Å; A431-A434 WeakPolarHBondContact O-CB 3.48Å; A431-A434 PolarHBondContact O-N 3.21Å; A431-A434 VanDerWaalsContact O-N 3.11Å; V432-A434 VanDerWaalsContact C-N 3.33Å; V432-A434 PolarHBondContact O-N 2.96Å
435V93.7Very high92.6Very high1 Ų111.1 Ų11.11%0.0066%0.061CC..Hα-helixtrans-67.5-39177.8-176.50000112I380 I384 R389 L392 L393 A431 V432 Y433 Y437 I438 Y439I380-V435 HydrophobicContact CD1-CG2 3.93Å; I380-V435 HydrophobicContact CG1-CG2 4.39Å; I380-V435 HydrophobicContact CG2-CG2 3.71Å; I384-V435 HydrophobicContact CD1-CG1 4.33Å; I384-V435 HydrophobicContact CD1-CG2 4.14Å; R389-V435 HydrophobicContact CB-CG1 4.05Å; R389-V435 HydrophobicContact CG-CG1 4.22Å; L392-V435 HydrophobicContact CB-CG1 4.49Å; L392-V435 HydrophobicContact CB-CG2 4.38Å; L392-V435 HydrophobicContact CD1-CG2 4.49Å; L393-V435 HydrophobicContact CD1-CG1 4.42Å; L393-V435 HydrophobicContact CD2-CB 3.94Å; L393-V435 HydrophobicContact CD2-CG1 3.94Å; L393-V435 HydrophobicContact CG-CB 4.34Å; L393-V435 HydrophobicContact CG-CG1 3.8Å; A431-V435 WeakPolarHBondContact O-CG2 3.46Å; A431-V435 PolarHBondContact O-N 3.3Å; A431-V435 VanDerWaalsContact O-N 3.09Å; V432-V435 PolarHBondContact O-N 3.27Å; Y433-V435 PolarHBondContact O-N 3.18Å; V435-Y437 VanDerWaalsContact C-N 3.3Å; V435-Y437 PolarHBondContact O-N 2.98Å; V435-I438 PolarHBondContact O-N 3.13Å; V435-Y439 VanDerWaalsContact O-CB 3.3Å; V435-Y439 WeakPolarHBondContact O-CB 3.44Å; V435-Y439 PolarHBondContact O-N 2.99Å
436I93.9Very high91.7Very high0 Ų013.5 Ų13.50%08%0.075CC..Hα-helixtrans-65-33.1-176.6-155.1-177.2000112.2I337 V340 W341 V344 L393 V432 Y433 Y439 T440I337-I436 HydrophobicContact CD1-CD1 4.33Å; I337-I436 HydrophobicContact CD1-CG1 4.11Å; V340-I436 HydrophobicContact CB-CD1 4.09Å; V340-I436 HydrophobicContact CG1-CD1 3.48Å; V340-I436 VanDerWaalsContact CG1-CD1 3.48Å; V340-I436 HydrophobicContact CG1-CG1 4.34Å; W341-I436 HydrophobicContact CB-CD1 4.46Å; W341-I436 HydrophobicContact CD2-CD1 3.82Å; W341-I436 HydrophobicContact CD2-CG1 4.45Å; W341-I436 HydrophobicContact CD2-CG2 4.31Å; W341-I436 HydrophobicContact CE3-CD1 4.5Å; W341-I436 HydrophobicContact CE3-CG2 4.25Å; W341-I436 HydrophobicContact CG-CD1 3.77Å; W341-I436 HydrophobicContact CH2-CG2 3.83Å; W341-I436 HydrophobicContact CZ2-CG1 4.33Å; W341-I436 HydrophobicContact CZ2-CG2 3.86Å; W341-I436 HydrophobicContact CZ3-CG2 4.03Å; V344-I436 HydrophobicContact CG1-CD1 4.17Å; V344-I436 HydrophobicContact CG1-CG2 4.42Å; L393-I436 HydrophobicContact CD2-CB 4.09Å; V432-I436 PolarHBondContact O-N 3.37Å; Y433-I436 HydrophobicContact CD1-CG2 4.33Å; Y433-I436 VanDerWaalsContact O-CG2 3.3Å; Y433-I436 WeakPolarHBondContact O-CG2 3.34Å; Y433-I436 PolarHBondContact O-N 3.41Å; I436-Y439 PolarHBondContact O-N 3.36Å; I436-T440 VanDerWaalsContact O-CB 3.26Å; I436-T440 WeakPolarHBondContact O-CB 3.49Å; I436-T440 PolarHBondContact O-N 3.21Å; I436-T440 PolarHBondContact O-OG1 3.35Å
437Y89.4Confident90.7Very high63 Ų6316 Ų1625%0.2479%0.091CC..Hα-helixtrans-59.4-48.8174-88.5-83.2000111.5W341 Y433 V435 S441 M453W341-Y437 AromaticContact CH2-CD1 3.82Å; W341-Y437 HydrophobicContact CH2-CD1 3.82Å; W341-Y437 AromaticContact CH2-CD2 4Å; W341-Y437 HydrophobicContact CH2-CD2 4Å; W341-Y437 AromaticContact CH2-CE1 3.67Å; W341-Y437 HydrophobicContact CH2-CE1 3.67Å; W341-Y437 AromaticContact CH2-CE2 3.94Å; W341-Y437 HydrophobicContact CH2-CE2 3.94Å; W341-Y437 AromaticContact CH2-CG 3.89Å; W341-Y437 HydrophobicContact CH2-CG 3.89Å; W341-Y437 AromaticContact CH2-CZ 3.7Å; W341-Y437 HydrophobicContact CZ3-CE1 4.26Å; W341-Y437 HydrophobicContact CZ3-CE2 4.1Å; W341-Y437 AromaticContact CZ3-CZ 3.87Å; Y433-Y437 AromaticContact CD1-CD2 3.85Å; Y433-Y437 HydrophobicContact CD1-CD2 3.85Å; Y433-Y437 AromaticContact CD1-CE2 3.39Å; Y433-Y437 HydrophobicContact CD1-CE2 3.39Å; Y433-Y437 HydrophobicContact CE1-CD2 4.19Å; Y433-Y437 AromaticContact CE1-CE2 3.33Å; Y433-Y437 HydrophobicContact CE1-CE2 3.33Å; Y433-Y437 AromaticContact CE1-CZ 3.96Å; Y433-Y437 VanDerWaalsContact O-CD2 3.25Å; Y433-Y437 WeakPolarHBondContact O-CD2 3.38Å; Y433-Y437 PolarHBondContact O-N 3.33Å; V435-Y437 VanDerWaalsContact C-N 3.3Å; V435-Y437 PolarHBondContact O-N 2.98Å; Y437-S441 PolarHBondContact O-N 2.87Å; Y437-M453 HydrophobicContact CD1-CE 3.05Å; Y437-M453 HydrophobicContact CE1-CE 3.5Å; Y437-M453 HydrophobicContact CG-CE 3.98Å
438I89.2Confident90Very high23 Ų2316.1 Ų16.112%0.1189%0.091CC..Hα-helixtrans-67.3-49179.3-66169.8000109.7V216 V220 I384 V435 T440 S441 E442V216-I438 HydrophobicContact CG1-CD1 4.1Å; V216-I438 HydrophobicContact CG2-CD1 4.44Å; V220-I438 HydrophobicContact CG2-CD1 3.88Å; I384-I438 HydrophobicContact CD1-CB 4.43Å; I384-I438 HydrophobicContact CD1-CD1 3.5Å; I384-I438 VanDerWaalsContact CD1-CD1 3.5Å; I384-I438 HydrophobicContact CD1-CG2 4.43Å; V435-I438 PolarHBondContact O-N 3.13Å; I438-T440 VanDerWaalsContact C-N 3.34Å; I438-T440 PolarHBondContact O-N 3.05Å; I438-S441 WeakPolarHBondContact O-CB 3.31Å; I438-S441 PolarHBondContact O-N 2.97Å; I438-S441 VanDerWaalsContact O-N 3.09Å; I438-S441 PolarHBondContact O-OG 3.34Å; I438-E442 HydrophobicContact CG2-CG 4.46Å; I438-E442 WeakPolarHBondContact CG2-OE1 3.43Å; I438-E442 PolarHBondContact O-N 3.49Å; I438-E442 VanDerWaalsContact O-N 3.08Å
439Y92Very high89.2Confident0 Ų017.3 Ų17.30%09%0.093CC..Hα-helixtrans-61.1-41.7-176.3-173.6-116.7000112.9I337 R389 L393 V435 I436 S441 E442 L443 L500 P501 T503I337-Y439 HydrophobicContact CD1-CD1 4.02Å; I337-Y439 HydrophobicContact CD1-CE1 4.28Å; R389-Y439 HydrophobicContact CB-CD2 3.29Å; R389-Y439 HydrophobicContact CB-CE2 3.97Å; R389-Y439 HydrophobicContact CB-CG 3.96Å; R389-Y439 HydrophobicContact CG-CD2 3.98Å; L393-Y439 HydrophobicContact CD1-CD1 3.43Å; L393-Y439 VanDerWaalsContact CD1-CD1 3.43Å; L393-Y439 HydrophobicContact CD1-CE1 3.95Å; L393-Y439 HydrophobicContact CD1-CG 3.76Å; V435-Y439 VanDerWaalsContact O-CB 3.3Å; V435-Y439 WeakPolarHBondContact O-CB 3.44Å; V435-Y439 PolarHBondContact O-N 2.99Å; I436-Y439 PolarHBondContact O-N 3.36Å; Y439-S441 VanDerWaalsContact C-N 3.29Å; Y439-S441 PolarHBondContact O-N 2.96Å; Y439-E442 PolarHBondContact O-N 3.33Å; Y439-E442 VanDerWaalsContact O-N 3.15Å; Y439-L443 HydrophobicContact CE1-CD2 4.29Å; Y439-L443 VanDerWaalsContact O-CB 3.25Å; Y439-L443 WeakPolarHBondContact O-CB 3.49Å; Y439-L443 PolarHBondContact O-N 3.34Å; Y439-L500 HydrophobicContact CE1-CB 4.35Å; Y439-L500 HydrophobicContact CE1-CD1 3.68Å; Y439-L500 WeakPolarHBondContact OH-CB 3.4Å; Y439-P501 PolarHBondContact OH-O 3.42Å; Y439-T503 HydrophobicContact CD2-CG2 4.02Å; Y439-T503 WeakPolarHBondContact CD2-OG1 3.33Å; Y439-T503 HydrophobicContact CE2-CG2 3.62Å; Y439-T503 WeakPolarHBondContact CE2-OG1 3.32Å
440T91.3Very high88.3Confident0 Ų023.7 Ų23.70%013%0.127CC..Hα-helixtrans-61-40.8176.2-57.30000111W341 I436 I438 E442 L443 F444 M453 C456W341-T440 HydrophobicContact CZ2-CG2 4.4Å; W341-T440 WeakPolarHBondContact CZ2-OG1 3.47Å; W341-T440 PolarHBondContact NE1-OG1 3.47Å; I436-T440 VanDerWaalsContact O-CB 3.26Å; I436-T440 WeakPolarHBondContact O-CB 3.49Å; I436-T440 PolarHBondContact O-N 3.21Å; I436-T440 PolarHBondContact O-OG1 3.35Å; I438-T440 VanDerWaalsContact C-N 3.34Å; I438-T440 PolarHBondContact O-N 3.05Å; T440-E442 VanDerWaalsContact C-N 3.31Å; T440-E442 PolarHBondContact O-N 2.9Å; T440-L443 PolarHBondContact O-N 2.9Å; T440-F444 HydrophobicContact CG2-CD2 3.97Å; T440-F444 HydrophobicContact CG2-CE2 3.92Å; T440-F444 VanDerWaalsContact O-CD2 3.27Å; T440-F444 WeakPolarHBondContact O-CD2 3.49Å; T440-F444 PolarHBondContact O-N 3.44Å; T440-M453 HydrophobicContact CG2-SD 3.53Å; T440-M453 VanDerWaalsContact CG2-SD 3.53Å; T440-C456 HydrophobicContact CG2-CB 4.29Å
441S86.8Confident87.6Confident41 Ų4126.1 Ų26.129%0.28714%0.142SC..Hα-helixtrans-66.5-31.3177.179.90000113.1Y437 I438 Y439 R449Y437-S441 PolarHBondContact O-N 2.87Å; I438-S441 WeakPolarHBondContact O-CB 3.31Å; I438-S441 PolarHBondContact O-N 2.97Å; I438-S441 VanDerWaalsContact O-N 3.09Å; I438-S441 PolarHBondContact O-OG 3.34Å; Y439-S441 VanDerWaalsContact C-N 3.29Å; Y439-S441 PolarHBondContact O-N 2.96Å; S441-R449 VanDerWaalsContact O-CD 3.28Å; S441-R449 WeakPolarHBondContact O-CD 3.27Å; S441-R449 PolarHBondContact O-NE 3.48Å
442E88.3Confident87.2Confident31 Ų3125.8 Ų25.815%0.14514%0.139CC..Hα-helixtrans-84.7-28.5178.8-66.2174.817800112.9R389 I438 Y439 T440 T503 L508R389-E442 WeakPolarHBondContact CD-OE2 3.49Å; R389-E442 IonicContact CZ-OE1 3.06Å; R389-E442 IonicContact CZ-OE2 3.57Å; R389-E442 IonicContact NE-OE1 2.88Å; R389-E442 PolarHBondContact NE-OE1 3.35Å; R389-E442 VanDerWaalsContact NE-OE1 3.15Å; R389-E442 IonicContact NE-OE2 3.54Å; R389-E442 PolarHBondContact NE-OE2 3.44Å; R389-E442 IonicContact NH2-OE1 2.76Å; R389-E442 PolarHBondContact NH2-OE1 2.86Å; R389-E442 IonicContact NH2-OE2 2.64Å; I438-E442 HydrophobicContact CG2-CG 4.46Å; I438-E442 WeakPolarHBondContact CG2-OE1 3.43Å; I438-E442 PolarHBondContact O-N 3.49Å; I438-E442 VanDerWaalsContact O-N 3.08Å; Y439-E442 PolarHBondContact O-N 3.33Å; Y439-E442 VanDerWaalsContact O-N 3.15Å; T440-E442 VanDerWaalsContact C-N 3.31Å; T440-E442 PolarHBondContact O-N 2.9Å; E442-T503 HydrophobicContact CB-CG2 3.93Å; E442-T503 VanDerWaalsContact OE2-CB 3.3Å; E442-T503 WeakPolarHBondContact OE2-CB 3.42Å; E442-T503 PolarHBondContact OE2-OG1 2.97Å; E442-L508 HydrophobicContact CB-CD2 4.27Å; E442-L508 HydrophobicContact CG-CD2 4.03Å
443L90Very high86.8Confident5 Ų527.4 Ų27.43%0.02615%0.147CC..Hα-helixtrans-70.9-32-178-173.265.7000112.6R333 I337 Y439 T440 L500 P501R333-L443 HydrophobicContact CB-CD2 4.35Å; R333-L443 HydrophobicContact CG-CD1 4.47Å; I337-L443 HydrophobicContact CB-CD2 4.25Å; I337-L443 HydrophobicContact CD1-CD2 4.41Å; I337-L443 HydrophobicContact CG1-CD2 4.25Å; Y439-L443 HydrophobicContact CE1-CD2 4.29Å; Y439-L443 VanDerWaalsContact O-CB 3.25Å; Y439-L443 WeakPolarHBondContact O-CB 3.49Å; Y439-L443 PolarHBondContact O-N 3.34Å; T440-L443 PolarHBondContact O-N 2.9Å; L443-L500 HydrophobicContact CD2-CD2 4.46Å; L443-P501 HydrophobicContact CD1-CG 3.77Å
444F88.6Confident86.3Confident0 Ų028.3 Ų28.30%016%0.161CC..SBendtrans-103.8141.5-177.2-65.8-68.8000112.6L324 S334 I337 T440 R449 A452L324-F444 HydrophobicContact CD2-CD1 3.79Å; L324-F444 HydrophobicContact CD2-CE1 3.6Å; L324-F444 HydrophobicContact CD2-CZ 4.36Å; S334-F444 WeakPolarHBondContact OG-CE1 3.3Å; I337-F444 HydrophobicContact CG2-CE2 3.9Å; I337-F444 HydrophobicContact CG2-CZ 3.76Å; T440-F444 HydrophobicContact CG2-CD2 3.97Å; T440-F444 HydrophobicContact CG2-CE2 3.92Å; T440-F444 VanDerWaalsContact O-CD2 3.27Å; T440-F444 WeakPolarHBondContact O-CD2 3.49Å; T440-F444 PolarHBondContact O-N 3.44Å; F444-R449 PolarHBondContact O-NE 3.12Å; F444-R449 PolarHBondContact O-NH2 3.47Å; F444-A452 HydrophobicContact CB-CB 3.97Å; F444-A452 HydrophobicContact CD1-CB 3.9Å; F444-A452 HydrophobicContact CD2-CB 3.4Å; F444-A452 VanDerWaalsContact CD2-CB 3.4Å; F444-A452 HydrophobicContact CE1-CB 4.22Å; F444-A452 HydrophobicContact CE2-CB 3.76Å; F444-A452 HydrophobicContact CG-CB 3.48Å; F444-A452 VanDerWaalsContact CG-CB 3.48Å; F444-A452 HydrophobicContact CZ-CB 4.16Å
445P83.2Confident86.1Confident0 Ų029.8 Ų29.80%017%0.166CC..  trans-70.9153.5-17824.9-27000112.1V447 I448 R449 A509 T511 I512 A515P445-V447 HydrophobicContact CB-CG2 4.27Å; P445-V447 HydrophobicContact CG-CG2 4.3Å; P445-V447 PolarHBondContact O-N 3.3Å; P445-I448 HydrophobicContact CG-CD1 3.91Å; P445-I448 HydrophobicContact CG-CG1 3.78Å; P445-I448 PolarHBondContact O-N 3.2Å; P445-R449 WeakPolarHBondContact O-CA 3.42Å; P445-R449 WeakPolarHBondContact O-CB 3.37Å; P445-R449 PolarHBondContact O-N 3.03Å; P445-A509 CarbonylContact C-O 3.43Å; P445-A509 WeakPolarHBondContact CA-O 3.44Å; P445-A509 HydrophobicContact CB-CB 3.87Å; P445-T511 VanDerWaalsContact CB-O 3.29Å; P445-T511 WeakPolarHBondContact CB-O 3.38Å; P445-I512 HydrophobicContact CG-CG1 4.33Å; P445-A515 HydrophobicContact CB-CB 4.17Å; P445-A515 HydrophobicContact CG-CB 3.84Å
446T79Confident86Confident49 Ų4929.7 Ų29.730%0.30117%0.166SC..Hα-helixtrans-48.6-40.9-174.5580000112.4I448 R449 A509 E510T446-I448 VanDerWaalsContact C-N 3.32Å; T446-I448 PolarHBondContact O-N 2.92Å; T446-R449 VanDerWaalsContact CG2-NH2 3.34Å; T446-R449 PolarHBondContact O-N 2.95Å; T446-A509 PolarHBondContact N-O 3.12Å; T446-E510 HydrophobicContact CG2-CG 4.44Å; T446-E510 WeakPolarHBondContact OG1-CA 3.42Å; T446-E510 PolarHBondContact OG1-O 3.22Å
447V76Confident85.6Confident54 Ų5430.4 Ų30.433%0.32717%0.171SC..Hα-helixtrans-62-31.2-176.8-65.80000114.3P319 P445 E510 I512P319-V447 HydrophobicContact CG-CB 4.05Å; P319-V447 HydrophobicContact CG-CG2 4.47Å; P319-V447 WeakPolarHBondContact CG-O 3.35Å; P445-V447 HydrophobicContact CB-CG2 4.27Å; P445-V447 HydrophobicContact CG-CG2 4.3Å; P445-V447 PolarHBondContact O-N 3.3Å; V447-E510 WeakPolarHBondContact CG1-O 3.35Å; V447-I512 HydrophobicContact CG2-CG1 4.24Å
448I80.9Confident85.5Confident2 Ų229.1 Ų29.11%0.0117%0.168CC..Hα-helixtrans-118.7-0178.861.7-175000113.6P319 L324 L330 P445 T446 N450 T451 A452P319-I448 HydrophobicContact CB-CG2 3.35Å; P319-I448 HydrophobicContact CG-CG2 3.42Å; P319-I448 VanDerWaalsContact CG-CG2 3.42Å; L324-I448 HydrophobicContact CD2-CD1 3.7Å; L324-I448 HydrophobicContact CD2-CG1 4.39Å; L324-I448 HydrophobicContact CG-CD1 4.49Å; L330-I448 HydrophobicContact CD1-CD1 4.15Å; P445-I448 HydrophobicContact CG-CD1 3.91Å; P445-I448 HydrophobicContact CG-CG1 3.78Å; P445-I448 PolarHBondContact O-N 3.2Å; T446-I448 VanDerWaalsContact C-N 3.32Å; T446-I448 PolarHBondContact O-N 2.92Å; I448-N450 PolarHBondContact O-N 2.98Å; I448-T451 WeakPolarHBondContact O-CB 3.39Å; I448-T451 PolarHBondContact O-N 3.05Å; I448-T451 VanDerWaalsContact O-N 3.16Å; I448-A452 WeakPolarHBondContact O-CB 3.28Å; I448-A452 PolarHBondContact O-N 2.91Å
449R82.5Confident85.6Confident44 Ų4429.8 Ų29.817%0.16617%0.171CC..Hα-helixtrans-54.5-50.1-170.5-178-179-64.2127.95.6113S441 F444 P445 T446 T451 A452 M453S441-R449 VanDerWaalsContact O-CD 3.28Å; S441-R449 WeakPolarHBondContact O-CD 3.27Å; S441-R449 PolarHBondContact O-NE 3.48Å; F444-R449 PolarHBondContact O-NE 3.12Å; F444-R449 PolarHBondContact O-NH2 3.47Å; P445-R449 WeakPolarHBondContact O-CA 3.42Å; P445-R449 WeakPolarHBondContact O-CB 3.37Å; P445-R449 PolarHBondContact O-N 3.03Å; T446-R449 VanDerWaalsContact CG2-NH2 3.34Å; T446-R449 PolarHBondContact O-N 2.95Å; R449-T451 VanDerWaalsContact C-N 3.34Å; R449-T451 PolarHBondContact O-N 3.26Å; R449-A452 PolarHBondContact O-N 3.21Å; R449-M453 VanDerWaalsContact O-CB 3.28Å; R449-M453 WeakPolarHBondContact O-CB 3.47Å; R449-M453 PolarHBondContact O-N 3.47Å
450N76.9Confident85.8Confident134 Ų13429.8 Ų29.872%0.71717%0.171SC*.Hα-helixtrans-65.3-39.8-178-70.2-9.5000111.5I448 M453 G454I448-N450 PolarHBondContact O-N 2.98Å; N450-M453 PolarHBondContact O-N 3.43Å; N450-G454 PolarHBondContact O-N 3.43Å
451T81.3Confident86Confident60 Ų6029.9 Ų29.937%0.36817%0.172SC..Hα-helixtrans-62.5-46174.8-55.10000111.2A321 I448 R449 G454 L455A321-T451 HydrophobicContact CB-CG2 3.88Å; I448-T451 WeakPolarHBondContact O-CB 3.39Å; I448-T451 PolarHBondContact O-N 3.05Å; I448-T451 VanDerWaalsContact O-N 3.16Å; R449-T451 VanDerWaalsContact C-N 3.34Å; R449-T451 PolarHBondContact O-N 3.26Å; T451-G454 PolarHBondContact O-N 3.02Å; T451-L455 WeakPolarHBondContact O-CB 3.46Å; T451-L455 PolarHBondContact O-N 3.36Å
452A86.9Confident86.4Confident0 Ų031.9 Ų31.90%018%0.182CC..Hα-helixtrans-63.8-45.2178.800000111.8L324 F444 I448 R449 L455 C456L324-A452 HydrophobicContact CD1-CB 4.21Å; L324-A452 HydrophobicContact CD2-CB 3.82Å; F444-A452 HydrophobicContact CB-CB 3.97Å; F444-A452 HydrophobicContact CD1-CB 3.9Å; F444-A452 HydrophobicContact CD2-CB 3.4Å; F444-A452 VanDerWaalsContact CD2-CB 3.4Å; F444-A452 HydrophobicContact CE1-CB 4.22Å; F444-A452 HydrophobicContact CE2-CB 3.76Å; F444-A452 HydrophobicContact CG-CB 3.48Å; F444-A452 VanDerWaalsContact CG-CB 3.48Å; F444-A452 HydrophobicContact CZ-CB 4.16Å; I448-A452 WeakPolarHBondContact O-CB 3.28Å; I448-A452 PolarHBondContact O-N 2.91Å; R449-A452 PolarHBondContact O-N 3.21Å; A452-L455 PolarHBondContact O-N 2.86Å; A452-C456 WeakPolarHBondContact O-CB 3.09Å; A452-C456 PolarHBondContact O-N 2.9Å; A452-C456 PolarHBondContact O-SG 3.23Å
453M86Confident86.8Confident39 Ų3930.4 Ų30.419%0.19218%0.175CC..Hα-helixtrans-62.9-44.7177.3-170.363-176.400111.9W341 Y437 T440 R449 N450 C456 S457W341-M453 HydrophobicContact CH2-CE 3.87Å; W341-M453 HydrophobicContact CZ2-CE 3.85Å; W341-M453 HydrophobicContact CZ2-SD 4.09Å; Y437-M453 HydrophobicContact CD1-CE 3.05Å; Y437-M453 HydrophobicContact CE1-CE 3.5Å; Y437-M453 HydrophobicContact CG-CE 3.98Å; T440-M453 HydrophobicContact CG2-SD 3.53Å; T440-M453 VanDerWaalsContact CG2-SD 3.53Å; R449-M453 VanDerWaalsContact O-CB 3.28Å; R449-M453 WeakPolarHBondContact O-CB 3.47Å; R449-M453 PolarHBondContact O-N 3.47Å; N450-M453 PolarHBondContact O-N 3.43Å; M453-C456 PolarHBondContact O-N 3.32Å; M453-S457 WeakPolarHBondContact O-CB 3.5Å; M453-S457 PolarHBondContact O-N 3.17Å
454G84.4Confident87.2Confident34 Ų3430.2 Ų30.235%0.35117%0.174SC..Hα-helixtrans-60.1-46.9175.300000112N450 T451 S457 M458N450-G454 PolarHBondContact O-N 3.43Å; T451-G454 PolarHBondContact O-N 3.02Å; G454-S457 PolarHBondContact O-N 3.37Å; G454-M458 WeakPolarHBondContact O-CB 3.26Å; G454-M458 VanDerWaalsContact O-CG 3.27Å; G454-M458 WeakPolarHBondContact O-CG 3.38Å; G454-M458 PolarHBondContact O-N 2.98Å
455L88.2Confident87.7Confident45 Ų4532.5 Ų32.524%0.23619%0.185CC..Hα-helixtrans-64.3-42.2178.1-175.558.6000112.1L324 F325 F338 T451 A452 S457 M458 I459L324-L455 HydrophobicContact CD1-CD2 3.92Å; F325-L455 HydrophobicContact CE2-CD2 4.35Å; F338-L455 HydrophobicContact CE1-CB 4.5Å; F338-L455 HydrophobicContact CE1-CD2 4.12Å; F338-L455 HydrophobicContact CE1-CG 4.01Å; F338-L455 HydrophobicContact CE2-CD2 4.23Å; F338-L455 HydrophobicContact CZ-CD2 3.48Å; F338-L455 VanDerWaalsContact CZ-CD2 3.48Å; F338-L455 HydrophobicContact CZ-CG 3.86Å; T451-L455 WeakPolarHBondContact O-CB 3.46Å; T451-L455 PolarHBondContact O-N 3.36Å; A452-L455 PolarHBondContact O-N 2.86Å; L455-S457 PolarHBondContact O-N 3.34Å; L455-M458 PolarHBondContact O-N 2.86Å; L455-I459 HydrophobicContact CD1-CD1 3.94Å; L455-I459 HydrophobicContact CD1-CG1 4.27Å; L455-I459 HydrophobicContact CG-CD1 3.85Å; L455-I459 WeakPolarHBondContact O-CB 3.47Å; L455-I459 WeakPolarHBondContact O-CG1 3.43Å; L455-I459 PolarHBondContact O-N 2.95Å
456C91.4Very high88.4Confident0 Ų033.9 Ų33.90%020%0.197CC..Hα-helixtrans-58.3-46.8173.5-73.10000111.8F338 W341 T440 A452 M453 M458 I459 A460F338-C456 VanDerWaalsContact CE1-SG 3.57Å; W341-C456 VanDerWaalsContact CD1-CB 3.46Å; W341-C456 HydrophobicContact CD2-CB 4.05Å; W341-C456 HydrophobicContact CG-CB 3.9Å; W341-C456 HydrophobicContact CZ2-CB 4.44Å; T440-C456 HydrophobicContact CG2-CB 4.29Å; A452-C456 WeakPolarHBondContact O-CB 3.09Å; A452-C456 PolarHBondContact O-N 2.9Å; A452-C456 PolarHBondContact O-SG 3.23Å; M453-C456 PolarHBondContact O-N 3.32Å; C456-M458 VanDerWaalsContact C-N 3.34Å; C456-M458 PolarHBondContact O-N 3.07Å; C456-I459 PolarHBondContact O-N 2.89Å; C456-A460 WeakPolarHBondContact O-CB 3.4Å; C456-A460 PolarHBondContact O-N 2.98Å
457S85.5Confident89.3Confident15 Ų1531.5 Ų31.511%0.10518%0.183CC..Hα-helixtrans-63.5-39.1178.6-172.50000112.5M453 G454 L455 A460 R461M453-S457 WeakPolarHBondContact O-CB 3.5Å; M453-S457 PolarHBondContact O-N 3.17Å; G454-S457 PolarHBondContact O-N 3.37Å; L455-S457 PolarHBondContact O-N 3.34Å; S457-A460 WeakPolarHBondContact O-CB 3.29Å; S457-R461 PolarHBondContact O-NE 3.31Å
458M86.8Confident90.3Very high35 Ų3529 Ų2917%0.17217%0.167CC..Hα-helixtrans-64.3-49.2175-73.9174.582.500111F142 Y146 G454 L455 C456 A460 R461F142-M458 HydrophobicContact CD1-CE 4.36Å; F142-M458 HydrophobicContact CD2-CB 3.91Å; F142-M458 HydrophobicContact CD2-CE 4.49Å; F142-M458 HydrophobicContact CD2-CG 4.28Å; F142-M458 WeakPolarHBondContact CD2-O 3.35Å; F142-M458 HydrophobicContact CE1-CE 3.62Å; F142-M458 HydrophobicContact CE2-CB 3.58Å; F142-M458 HydrophobicContact CE2-CE 3.81Å; F142-M458 HydrophobicContact CE2-CG 4.12Å; F142-M458 HydrophobicContact CZ-CB 4.34Å; F142-M458 HydrophobicContact CZ-CE 3.3Å; Y146-M458 HydrophobicContact CD2-CE 4.21Å; Y146-M458 HydrophobicContact CD2-SD 4.17Å; Y146-M458 HydrophobicContact CG-CE 4.47Å; G454-M458 WeakPolarHBondContact O-CB 3.26Å; G454-M458 VanDerWaalsContact O-CG 3.27Å; G454-M458 WeakPolarHBondContact O-CG 3.38Å; G454-M458 PolarHBondContact O-N 2.98Å; L455-M458 PolarHBondContact O-N 2.86Å; C456-M458 VanDerWaalsContact C-N 3.34Å; C456-M458 PolarHBondContact O-N 3.07Å; M458-A460 VanDerWaalsContact C-N 3.3Å; M458-A460 PolarHBondContact O-N 3.48Å; M458-R461 WeakPolarHBondContact O-CB 3.23Å; M458-R461 PolarHBondContact O-N 3.44Å
459I92.4Very high91.1Very high37 Ų3732.4 Ų32.419%0.1918%0.18CC..Hα-helixtrans-63.3-35.7178.3-71.8169.3000111.6F338 I342 L455 C456 R461 V462F338-I459 HydrophobicContact CB-CD1 4.18Å; F338-I459 HydrophobicContact CB-CG2 4.14Å; F338-I459 HydrophobicContact CD1-CD1 3.62Å; F338-I459 HydrophobicContact CD2-CD1 3.65Å; F338-I459 HydrophobicContact CE1-CD1 3.85Å; F338-I459 HydrophobicContact CE2-CD1 3.9Å; F338-I459 HydrophobicContact CG-CD1 3.53Å; F338-I459 HydrophobicContact CZ-CD1 4Å; I342-I459 HydrophobicContact CD1-CG2 3.58Å; I342-I459 HydrophobicContact CG1-CG2 3.5Å; L455-I459 HydrophobicContact CD1-CD1 3.94Å; L455-I459 HydrophobicContact CD1-CG1 4.27Å; L455-I459 HydrophobicContact CG-CD1 3.85Å; L455-I459 WeakPolarHBondContact O-CB 3.47Å; L455-I459 WeakPolarHBondContact O-CG1 3.43Å; L455-I459 PolarHBondContact O-N 2.95Å; C456-I459 PolarHBondContact O-N 2.89Å; I459-R461 PolarHBondContact O-N 3Å; I459-R461 VanDerWaalsContact O-N 3.11Å; I459-V462 VanDerWaalsContact O-CB 3.28Å; I459-V462 WeakPolarHBondContact O-CB 3.26Å; I459-V462 WeakPolarHBondContact O-CG2 3.35Å; I459-V462 PolarHBondContact O-N 3.36Å
460A94.9Very high91.8Very high0 Ų032.6 Ų32.60%018%0.183CC..Hα-helixtrans-56.7-27.4174.100000113W341 A345 C456 S457 M458 V462 G463 A464W341-A460 HydrophobicContact CB-CB 4.11Å; W341-A460 HydrophobicContact CD2-CB 4.48Å; W341-A460 HydrophobicContact CE3-CB 3.78Å; A345-A460 HydrophobicContact CB-CB 4.07Å; A345-A460 WeakPolarHBondContact CB-O 3.02Å; C456-A460 WeakPolarHBondContact O-CB 3.4Å; C456-A460 PolarHBondContact O-N 2.98Å; S457-A460 WeakPolarHBondContact O-CB 3.29Å; M458-A460 VanDerWaalsContact C-N 3.3Å; M458-A460 PolarHBondContact O-N 3.48Å; A460-V462 VanDerWaalsContact C-N 3.26Å; A460-V462 PolarHBondContact O-N 3.08Å; A460-G463 PolarHBondContact O-N 3.37Å; A460-G463 VanDerWaalsContact O-N 3.14Å; A460-A464 PolarHBondContact O-N 3.07Å
461R95.2Very high92.8Very high3 Ų326.3 Ų26.31%0.01115%0.149CC..Hα-helixtrans-68-25.7176.5-59.9-51.395173.34.8112.7F142 Y349 Y433 S457 M458 I459 G463 A464 I465F142-R461 HydrophobicContact CB-CB 4.15Å; F142-R461 HydrophobicContact CB-CG 3.93Å; F142-R461 HydrophobicContact CD2-CB 4.19Å; F142-R461 HydrophobicContact CD2-CG 4.34Å; Y349-R461 PolarHBondContact OH-NH1 3.23Å; Y433-R461 PolarHBondContact OH-NH2 2.88Å; S457-R461 PolarHBondContact O-NE 3.31Å; M458-R461 WeakPolarHBondContact O-CB 3.23Å; M458-R461 PolarHBondContact O-N 3.44Å; I459-R461 PolarHBondContact O-N 3Å; I459-R461 VanDerWaalsContact O-N 3.11Å; R461-G463 VanDerWaalsContact C-N 3.26Å; R461-G463 PolarHBondContact O-N 2.93Å; R461-A464 PolarHBondContact O-N 3.04Å; R461-I465 WeakPolarHBondContact O-CB 3.26Å; R461-I465 VanDerWaalsContact O-CG1 3.25Å; R461-I465 WeakPolarHBondContact O-CG1 3.33Å; R461-I465 PolarHBondContact O-N 2.92Å
462V95.9Very high93.4Very high83 Ų8323.7 Ų23.750%0.50313%0.133SC..Hα-helixtrans-60-42.4170.8-1790000110I459 A460 I465 A466I459-V462 VanDerWaalsContact O-CB 3.28Å; I459-V462 WeakPolarHBondContact O-CB 3.26Å; I459-V462 WeakPolarHBondContact O-CG2 3.35Å; I459-V462 PolarHBondContact O-N 3.36Å; A460-V462 VanDerWaalsContact C-N 3.26Å; A460-V462 PolarHBondContact O-N 3.08Å; V462-I465 PolarHBondContact O-N 3.37Å; V462-A466 PolarHBondContact O-N 3.17Å
463G97.7Very high93.8Very high0 Ų028.8 Ų28.80%015%0.152CC..Hα-helixtrans-62-45.1173.700000112.7C346 A460 R461 I465 A466 A467C346-G463 VanDerWaalsContact CA-O 3.31Å; C346-G463 WeakPolarHBondContact CA-O 3.44Å; A460-G463 PolarHBondContact O-N 3.37Å; A460-G463 VanDerWaalsContact O-N 3.14Å; R461-G463 VanDerWaalsContact C-N 3.26Å; R461-G463 PolarHBondContact O-N 2.93Å; G463-I465 PolarHBondContact O-N 3.4Å; G463-A466 PolarHBondContact O-N 3.3Å; G463-A467 WeakPolarHBondContact O-CB 3.42Å; G463-A467 PolarHBondContact O-N 3.18Å
464A97.5Very high94.2Very high0 Ų028.7 Ų28.70%015%0.152CC..Hα-helixtrans-67-33.6178.700000113.5Y138 Y349 A460 R461 A467 S468Y138-A464 HydrophobicContact CD1-CB 3.49Å; Y138-A464 VanDerWaalsContact CD1-CB 3.49Å; Y138-A464 HydrophobicContact CD2-CB 3.8Å; Y138-A464 VanDerWaalsContact CD2-O 3.28Å; Y138-A464 WeakPolarHBondContact CD2-O 3.46Å; Y138-A464 HydrophobicContact CE1-CB 3.73Å; Y138-A464 HydrophobicContact CE2-CB 3.99Å; Y138-A464 WeakPolarHBondContact CE2-O 3.41Å; Y138-A464 HydrophobicContact CG-CB 3.54Å; Y349-A464 HydrophobicContact CD2-CB 3.64Å; Y349-A464 HydrophobicContact CE2-CB 4.13Å; Y349-A464 HydrophobicContact CG-CB 4.35Å; A460-A464 PolarHBondContact O-N 3.07Å; R461-A464 PolarHBondContact O-N 3.04Å; A464-A467 WeakPolarHBondContact O-CB 3.41Å; A464-A467 PolarHBondContact O-N 3.09Å; A464-S468 PolarHBondContact O-N 3.18Å; A464-S468 PolarHBondContact O-OG 2.87Å
465I98Very high94.7Very high48 Ų4827.3 Ų27.325%0.24614%0.137CC..Hα-helixtrans-64.7-48.8171.7-71.5164.4000109.9I139 R461 V462 G463 A467 S468I139-I465 HydrophobicContact CG1-CD1 3.76Å; I139-I465 HydrophobicContact CG1-CG1 4.35Å; R461-I465 WeakPolarHBondContact O-CB 3.26Å; R461-I465 VanDerWaalsContact O-CG1 3.25Å; R461-I465 WeakPolarHBondContact O-CG1 3.33Å; R461-I465 PolarHBondContact O-N 2.92Å; V462-I465 PolarHBondContact O-N 3.37Å; G463-I465 PolarHBondContact O-N 3.4Å; I465-A467 VanDerWaalsContact C-N 3.31Å; I465-A467 PolarHBondContact O-N 3.2Å; I465-S468 WeakPolarHBondContact O-CB 3.42Å; I465-S468 PolarHBondContact O-N 3.36Å; I465-S468 VanDerWaalsContact O-N 3.16Å
466A98.1Very high94.9Very high29 Ų2929.1 Ų29.124%0.2415%0.145CC..Hα-helixtrans-59.8-41.817600000111.9V462 G463 S468 Y469 F470V462-A466 PolarHBondContact O-N 3.17Å; G463-A466 PolarHBondContact O-N 3.3Å; A466-S468 PolarHBondContact O-N 3.4Å; A466-Y469 PolarHBondContact O-N 2.81Å; A466-Y469 VanDerWaalsContact O-N 3.13Å; A466-F470 HydrophobicContact CB-CE2 4.05Å; A466-F470 HydrophobicContact CB-CZ 4.18Å; A466-F470 VanDerWaalsContact O-CG 3.32Å; A466-F470 WeakPolarHBondContact O-CG 3.02Å; A466-F470 PolarHBondContact O-N 3.3Å
467A98.1Very high94.8Very high0 Ų033 Ų330%017%0.166CC..Hα-helixtrans-53.8-40.2175.400000112.9C346 A350 G463 A464 I465 Y469 F470 A471C346-A467 VanDerWaalsContact O-CB 3.23Å; C346-A467 WeakPolarHBondContact O-CB 3.49Å; A350-A467 HydrophobicContact CB-CB 3.82Å; G463-A467 WeakPolarHBondContact O-CB 3.42Å; G463-A467 PolarHBondContact O-N 3.18Å; A464-A467 WeakPolarHBondContact O-CB 3.41Å; A464-A467 PolarHBondContact O-N 3.09Å; I465-A467 VanDerWaalsContact C-N 3.31Å; I465-A467 PolarHBondContact O-N 3.2Å; A467-Y469 VanDerWaalsContact C-N 3.33Å; A467-Y469 PolarHBondContact O-N 3.11Å; A467-F470 PolarHBondContact O-N 3.26Å; A467-A471 WeakPolarHBondContact O-CB 3.36Å; A467-A471 PolarHBondContact O-N 2.94Å
468S97.9Very high95.2Very high0 Ų038.8 Ų38.80%019%0.186CC..Hα-helixtrans-60.5-43.8-179.9-55.90000111.3S131 Q134 Y138 A464 I465 A466 L472S131-S468 PolarHBondContact OG-O 3.45Å; Q134-S468 WeakPolarHBondContact CG-OG 3.42Å; Y138-S468 WeakPolarHBondContact CD2-OG 3.43Å; Y138-S468 WeakPolarHBondContact CE2-OG 3.19Å; A464-S468 PolarHBondContact O-N 3.18Å; A464-S468 PolarHBondContact O-OG 2.87Å; I465-S468 WeakPolarHBondContact O-CB 3.42Å; I465-S468 PolarHBondContact O-N 3.36Å; I465-S468 VanDerWaalsContact O-N 3.16Å; A466-S468 PolarHBondContact O-N 3.4Å; S468-L472 WeakPolarHBondContact O-CB 3.35Å; S468-L472 PolarHBondContact O-N 3.02Å
469Y97.6Very high95.6Very high75 Ų7538.3 Ų38.329%0.29419%0.187SC..Hα-helixtrans-74.3-39.2176.6-75.4-88.3000112.7A466 A467 A471 W473 L474A466-Y469 PolarHBondContact O-N 2.81Å; A466-Y469 VanDerWaalsContact O-N 3.13Å; A467-Y469 VanDerWaalsContact C-N 3.33Å; A467-Y469 PolarHBondContact O-N 3.11Å; Y469-A471 VanDerWaalsContact C-N 3.34Å; Y469-A471 PolarHBondContact O-N 3.41Å; Y469-W473 WeakPolarHBondContact O-CA 3.45Å; Y469-W473 WeakPolarHBondContact O-CB 3.48Å; Y469-W473 PolarHBondContact O-N 3.1Å; Y469-W473 VanDerWaalsContact O-N 3.08Å; Y469-L474 PolarHBondContact O-N 2.87Å
470F97.6Very high95.6Very high48 Ų4840.2 Ų40.221%0.21120%0.197CC..Iπ-helixtrans-63-43.6177.4-63.2-18000111.4A466 A467 L474 A475 L485 Y486 I489A466-F470 HydrophobicContact CB-CE2 4.05Å; A466-F470 HydrophobicContact CB-CZ 4.18Å; A466-F470 VanDerWaalsContact O-CG 3.32Å; A466-F470 WeakPolarHBondContact O-CG 3.02Å; A466-F470 PolarHBondContact O-N 3.3Å; A467-F470 PolarHBondContact O-N 3.26Å; F470-L474 HydrophobicContact CD1-CD2 4.17Å; F470-A475 VanDerWaalsContact O-CB 3.28Å; F470-A475 WeakPolarHBondContact O-CB 3.42Å; F470-A475 PolarHBondContact O-N 3.13Å; F470-L485 HydrophobicContact CD1-CD2 3.98Å; F470-L485 HydrophobicContact CD2-CD2 3.87Å; F470-L485 HydrophobicContact CE1-CD2 3.84Å; F470-L485 HydrophobicContact CE2-CD2 3.71Å; F470-L485 HydrophobicContact CE2-CG 4.42Å; F470-L485 HydrophobicContact CG-CD2 4.01Å; F470-L485 HydrophobicContact CZ-CD2 3.7Å; F470-Y486 HydrophobicContact CB-CE1 3.75Å; F470-Y486 WeakPolarHBondContact CB-OH 3.44Å; F470-Y486 HydrophobicContact CD2-CE1 4Å; F470-Y486 HydrophobicContact CG-CE1 4.32Å; F470-I489 HydrophobicContact CE2-CD1 4.1Å
471A96.8Very high95.7Very high1 Ų144.8 Ų44.81%0.00822%0.221CC..Iπ-helixtrans-79.7-39.1-174.600000113.9A350 I353 N354 A467 Y469 Y486A350-A471 HydrophobicContact CB-CB 4.26Å; I353-A471 HydrophobicContact CB-CB 4.32Å; I353-A471 HydrophobicContact CG2-CB 4.2Å; N354-A471 HydrophobicContact CB-CB 3.9Å; N354-A471 PolarHBondContact ND2-O 2.95Å; A467-A471 WeakPolarHBondContact O-CB 3.36Å; A467-A471 PolarHBondContact O-N 2.94Å; Y469-A471 VanDerWaalsContact C-N 3.34Å; Y469-A471 PolarHBondContact O-N 3.41Å; A471-Y486 PolarHBondContact N-OH 3.09Å
472L95.4Very high95.7Very high5 Ų544.6 Ų44.63%0.02622%0.221CC..Iπ-helixtrans-106.1-9-171.4-60.9175.6000114.4R130 S131 Q134 I353 S468R130-L472 PolarHBondContact NH1-O 3.12Å; S131-L472 WeakPolarHBondContact OG-CB 3.41Å; Q134-L472 HydrophobicContact CB-CD1 3.89Å; Q134-L472 HydrophobicContact CG-CD1 4.29Å; I353-L472 HydrophobicContact CG2-CD1 3.82Å; I353-L472 HydrophobicContact CG2-CD2 3.73Å; I353-L472 HydrophobicContact CG2-CG 3.68Å; S468-L472 WeakPolarHBondContact O-CB 3.35Å; S468-L472 PolarHBondContact O-N 3.02Å
473W94.6Very high95.7Very high107 Ų10740.7 Ų40.741%0.40520%0.197SC..Iπ-helixtrans-123.8-54.6179.1-174.575.3000111.9S131 Y469S131-W473 VanDerWaalsContact OG-CB 3.26Å; S131-W473 WeakPolarHBondContact OG-CB 3.46Å; S131-W473 PolarHBondContact OG-N 3.49Å; Y469-W473 WeakPolarHBondContact O-CA 3.45Å; Y469-W473 WeakPolarHBondContact O-CB 3.48Å; Y469-W473 PolarHBondContact O-N 3.1Å; Y469-W473 VanDerWaalsContact O-N 3.08Å
474L95.4Very high95.7Very high37 Ų3744.1 Ų44.119%0.19421%0.214CC..Iπ-helixtrans-74.4-36.8-175.9-16864.6000112.7Y469 F470 E476 D477 Y478 V482 L485Y469-L474 PolarHBondContact O-N 2.87Å; F470-L474 HydrophobicContact CD1-CD2 4.17Å; L474-E476 VanDerWaalsContact C-N 3.27Å; L474-E476 PolarHBondContact O-N 3.46Å; L474-D477 PolarHBondContact O-N 3.24Å; L474-Y478 HydrophobicContact CD1-CD2 3.84Å; L474-Y478 PolarHBondContact O-N 3.19Å; L474-V482 HydrophobicContact CB-CG2 3.86Å; L474-V482 HydrophobicContact CD2-CG2 3.72Å; L474-V482 HydrophobicContact CG-CG2 3.54Å; L474-L485 HydrophobicContact CD2-CD2 4.41Å
475A94.9Very high95.7Very high5 Ų546.7 Ų46.74%0.04123%0.228CC..Hα-helixtrans-69-24.5-178.200000113.5F357 F470 D477 A479 V482F357-A475 HydrophobicContact CB-CB 4.21Å; F357-A475 HydrophobicContact CD2-CB 4.18Å; F470-A475 VanDerWaalsContact O-CB 3.28Å; F470-A475 WeakPolarHBondContact O-CB 3.42Å; F470-A475 PolarHBondContact O-N 3.13Å; A475-D477 VanDerWaalsContact C-N 3.35Å; A475-A479 WeakPolarHBondContact O-CA 3.47Å; A475-A479 WeakPolarHBondContact O-CB 3.2Å; A475-A479 PolarHBondContact O-N 3.18Å; A475-V482 HydrophobicContact CB-CB 4.35Å; A475-V482 HydrophobicContact CB-CG1 4.16Å; A475-V482 HydrophobicContact CB-CG2 4.21Å
476E90.4Very high95.7Very high84 Ų8444.5 Ų44.539%0.39322%0.216SC..Hα-helixtrans-63.7-41.9179.2-169.2172.1157.100111.2R130 L474R130-E476 IonicContact NH1-OE2 2.68Å; R130-E476 PolarHBondContact NH1-OE2 3.17Å; L474-E476 VanDerWaalsContact C-N 3.27Å; L474-E476 PolarHBondContact O-N 3.46Å
477D90.7Very high95.7Very high82 Ų8243.1 Ų43.144%0.43921%0.205SC..Hα-helixtrans-95.2-29.1179.5-51.1-45.7000112.5K127 L474 A475K127-D477 IonicContact NZ-OD1 3.96Å; K127-D477 PolarHBondContact NZ-OD1 3.34Å; K127-D477 IonicContact NZ-OD2 2.97Å; K127-D477 PolarHBondContact NZ-OD2 2.93Å; L474-D477 PolarHBondContact O-N 3.24Å; A475-D477 VanDerWaalsContact C-N 3.35Å
478Y94.5Very high95.7Very high135 Ų13545.2 Ų45.253%0.52922%0.22SC..Hα-helixtrans-135.948.7-168-53.9-74000113.9L474 I480 L481 V482L474-Y478 HydrophobicContact CD1-CD2 3.84Å; L474-Y478 PolarHBondContact O-N 3.19Å; Y478-I480 VanDerWaalsContact C-N 3.33Å; Y478-I480 PolarHBondContact O-N 3.31Å; Y478-L481 HydrophobicContact CG-CD2 4.5Å; Y478-L481 WeakPolarHBondContact O-CB 3.36Å; Y478-L481 PolarHBondContact O-N 3.42Å; Y478-L481 VanDerWaalsContact O-N 3.08Å; Y478-V482 WeakPolarHBondContact O-CG2 3.22Å; Y478-V482 PolarHBondContact O-N 2.99Å
479A94.1Very high95.8Very high25 Ų2546.4 Ų46.421%0.20723%0.226CC..Hα-helixtrans-50.8-42.6-176.300000115F357 L358 A475 V482 S483F357-A479 HydrophobicContact CD2-CB 4.1Å; F357-A479 WeakPolarHBondContact CE2-O 3.3Å; L358-A479 HydrophobicContact CD2-CB 4.08Å; A475-A479 WeakPolarHBondContact O-CA 3.47Å; A475-A479 WeakPolarHBondContact O-CB 3.2Å; A475-A479 PolarHBondContact O-N 3.18Å; A479-V482 PolarHBondContact O-N 3.4Å; A479-S483 PolarHBondContact O-N 3.22Å; A479-S483 PolarHBondContact O-OG 2.91Å; A479-S483 VanDerWaalsContact O-OG 3.09Å
480I93.5Very high95.8Very high77 Ų7742.8 Ų42.840%0.39521%0.212SC..Hα-helixtrans-68.2-42.6179.5-60.5174.7000111.1V408 Y478 V482 S483 I484V408-I480 HydrophobicContact CG1-CG2 4.2Å; Y478-I480 VanDerWaalsContact C-N 3.33Å; Y478-I480 PolarHBondContact O-N 3.31Å; I480-V482 VanDerWaalsContact C-N 3.29Å; I480-V482 PolarHBondContact O-N 2.73Å; I480-S483 WeakPolarHBondContact O-CB 3.44Å; I480-S483 PolarHBondContact O-N 3.2Å; I480-I484 HydrophobicContact CG2-CD1 4.42Å; I480-I484 WeakPolarHBondContact O-CG1 3.14Å; I480-I484 PolarHBondContact O-N 2.92Å; I480-I484 VanDerWaalsContact O-N 3.1Å
481L95.2Very high95.9Very high96 Ų9643.7 Ų43.750%0.50322%0.218SC..Hα-helixtrans-61.1-41.9176.5179.264.9000110.9Y478 S483 I484 L485Y478-L481 HydrophobicContact CG-CD2 4.5Å; Y478-L481 WeakPolarHBondContact O-CB 3.36Å; Y478-L481 PolarHBondContact O-N 3.42Å; Y478-L481 VanDerWaalsContact O-N 3.08Å; L481-S483 VanDerWaalsContact C-N 3.32Å; L481-S483 PolarHBondContact O-N 3.08Å; L481-I484 PolarHBondContact O-N 2.9Å; L481-L485 PolarHBondContact O-N 3.49Å
482V96.5Very high95.9Very high0 Ų046.2 Ų46.20%023%0.234CC..Hα-helixtrans-63.8-37.4176.9171.40000111.7F357 L474 A475 Y478 A479 I480 I484 L485 Y486F357-V482 HydrophobicContact CE2-CG1 4.45Å; L474-V482 HydrophobicContact CB-CG2 3.86Å; L474-V482 HydrophobicContact CD2-CG2 3.72Å; L474-V482 HydrophobicContact CG-CG2 3.54Å; A475-V482 HydrophobicContact CB-CB 4.35Å; A475-V482 HydrophobicContact CB-CG1 4.16Å; A475-V482 HydrophobicContact CB-CG2 4.21Å; Y478-V482 WeakPolarHBondContact O-CG2 3.22Å; Y478-V482 PolarHBondContact O-N 2.99Å; A479-V482 PolarHBondContact O-N 3.4Å; I480-V482 VanDerWaalsContact C-N 3.29Å; I480-V482 PolarHBondContact O-N 2.73Å; V482-I484 PolarHBondContact O-N 3.22Å; V482-L485 WeakPolarHBondContact O-CB 3.08Å; V482-L485 PolarHBondContact O-N 3.38Å; V482-Y486 HydrophobicContact CG1-CD1 4.37Å; V482-Y486 HydrophobicContact CG1-CD2 4.04Å; V482-Y486 HydrophobicContact CG1-CE1 3.7Å; V482-Y486 HydrophobicContact CG1-CE2 3.32Å; V482-Y486 WeakPolarHBondContact CG1-OH 3.03Å; V482-Y486 WeakPolarHBondContact O-CD2 2.94Å; V482-Y486 VanDerWaalsContact O-CG 3.28Å; V482-Y486 PolarHBondContact O-N 2.85Å
483S95.9Very high96.1Very high0 Ų046 Ų460%023%0.232CC..Hα-helixtrans-60-46171.9-59.20000111.6F357 I404 A479 I480 L481 L485 Y486 G487F357-S483 WeakPolarHBondContact CE2-OG 3.3Å; F357-S483 VanDerWaalsContact CZ-OG 3.31Å; F357-S483 WeakPolarHBondContact CZ-OG 3.18Å; I404-S483 WeakPolarHBondContact CG2-O 3.48Å; A479-S483 PolarHBondContact O-N 3.22Å; A479-S483 PolarHBondContact O-OG 2.91Å; A479-S483 VanDerWaalsContact O-OG 3.09Å; I480-S483 WeakPolarHBondContact O-CB 3.44Å; I480-S483 PolarHBondContact O-N 3.2Å; L481-S483 VanDerWaalsContact C-N 3.32Å; L481-S483 PolarHBondContact O-N 3.08Å; S483-L485 VanDerWaalsContact C-N 3.29Å; S483-L485 PolarHBondContact O-N 2.98Å; S483-Y486 PolarHBondContact O-N 2.7Å; S483-G487 PolarHBondContact O-N 3.11Å
484I97.3Very high96.2Very high73 Ų7341 Ų4137%0.37421%0.214SC..Hα-helixtrans-62.2-39.7177.1-63.6167.9000110.8V408 I480 L481 V482 G487 S488V408-I484 HydrophobicContact CG2-CG1 3.95Å; I480-I484 HydrophobicContact CG2-CD1 4.42Å; I480-I484 WeakPolarHBondContact O-CG1 3.14Å; I480-I484 PolarHBondContact O-N 2.92Å; I480-I484 VanDerWaalsContact O-N 3.1Å; L481-I484 PolarHBondContact O-N 2.9Å; V482-I484 PolarHBondContact O-N 3.22Å; I484-G487 PolarHBondContact O-N 2.59Å; I484-S488 WeakPolarHBondContact O-CB 3.09Å; I484-S488 PolarHBondContact O-N 2.97Å; I484-S488 PolarHBondContact O-OG 3.22Å
485L98Very high96.3Very high53 Ų5342.6 Ų42.628%0.27723%0.225SC..Hα-helixtrans-61.7-46.2175.9-176.464.9000111.6F470 L474 L481 V482 S483 S488 I489F470-L485 HydrophobicContact CD1-CD2 3.98Å; F470-L485 HydrophobicContact CD2-CD2 3.87Å; F470-L485 HydrophobicContact CE1-CD2 3.84Å; F470-L485 HydrophobicContact CE2-CD2 3.71Å; F470-L485 HydrophobicContact CE2-CG 4.42Å; F470-L485 HydrophobicContact CG-CD2 4.01Å; F470-L485 HydrophobicContact CZ-CD2 3.7Å; L474-L485 HydrophobicContact CD2-CD2 4.41Å; L481-L485 PolarHBondContact O-N 3.49Å; V482-L485 WeakPolarHBondContact O-CB 3.08Å; V482-L485 PolarHBondContact O-N 3.38Å; S483-L485 VanDerWaalsContact C-N 3.29Å; S483-L485 PolarHBondContact O-N 2.98Å; L485-S488 WeakPolarHBondContact CA-OG 3.3Å; L485-S488 PolarHBondContact O-N 3.35Å; L485-S488 PolarHBondContact O-OG 2.83Å; L485-I489 HydrophobicContact CD1-CD1 4.14Å; L485-I489 HydrophobicContact CD1-CG1 4.48Å; L485-I489 HydrophobicContact CG-CD1 3.97Å; L485-I489 VanDerWaalsContact O-CG1 3.26Å; L485-I489 WeakPolarHBondContact O-CG1 3.21Å; L485-I489 PolarHBondContact O-N 3.17Å
486Y98.2Very high96.4Very high2 Ų245.9 Ų45.91%0.00824%0.239CC..Hα-helixtrans-62.9-46.7177.3-64.4-22.1000112.4V347 A350 L351 F357 F470 A471 V482 S483 S488 I489 A490V347-Y486 HydrophobicContact CG1-CG 4.35Å; A350-Y486 HydrophobicContact CB-CD1 4.46Å; A350-Y486 HydrophobicContact CB-CE1 3.62Å; A350-Y486 HydrophobicContact CB-CE2 4.15Å; A350-Y486 VanDerWaalsContact CB-CZ 3.45Å; A350-Y486 WeakPolarHBondContact CB-OH 3.49Å; L351-Y486 HydrophobicContact CD2-CD2 3.67Å; L351-Y486 HydrophobicContact CD2-CE2 3.77Å; L351-Y486 HydrophobicContact CG-CD2 4.49Å; F357-Y486 HydrophobicContact CE1-CE2 4.48Å; F357-Y486 HydrophobicContact CE2-CE2 4.47Å; F357-Y486 HydrophobicContact CZ-CD2 4.31Å; F357-Y486 HydrophobicContact CZ-CE2 4.17Å; F470-Y486 HydrophobicContact CB-CE1 3.75Å; F470-Y486 WeakPolarHBondContact CB-OH 3.44Å; F470-Y486 HydrophobicContact CD2-CE1 4Å; F470-Y486 HydrophobicContact CG-CE1 4.32Å; A471-Y486 PolarHBondContact N-OH 3.09Å; V482-Y486 HydrophobicContact CG1-CD1 4.37Å; V482-Y486 HydrophobicContact CG1-CD2 4.04Å; V482-Y486 HydrophobicContact CG1-CE1 3.7Å; V482-Y486 HydrophobicContact CG1-CE2 3.32Å; V482-Y486 WeakPolarHBondContact CG1-OH 3.03Å; V482-Y486 WeakPolarHBondContact O-CD2 2.94Å; V482-Y486 VanDerWaalsContact O-CG 3.28Å; V482-Y486 PolarHBondContact O-N 2.85Å; S483-Y486 PolarHBondContact O-N 2.7Å; Y486-S488 VanDerWaalsContact C-N 3.33Å; Y486-S488 PolarHBondContact O-N 3.34Å; Y486-I489 PolarHBondContact O-N 2.85Å; Y486-A490 WeakPolarHBondContact O-CB 3.12Å; Y486-A490 PolarHBondContact O-N 3.04Å
487G98Very high96.7Very high0 Ų041.9 Ų41.90%022%0.22CC..Hα-helixtrans-63.5-37.4178.800000112.7T401 S483 I484 L491T401-G487 WeakPolarHBondContact CG2-O 3.42Å; T401-G487 PolarHBondContact OG1-O 3.45Å; S483-G487 PolarHBondContact O-N 3.11Å; I484-G487 PolarHBondContact O-N 2.59Å; G487-L491 VanDerWaalsContact O-CB 3.3Å; G487-L491 WeakPolarHBondContact O-CB 2.96Å; G487-L491 PolarHBondContact O-N 2.02Å
488S98.3Very high96.9Very high44 Ų4443.2 Ų43.231%0.30822%0.222SC..Hα-helixtrans-71-41177.261.90000113.1I484 L485 Y486 A490 L491 V492I484-S488 WeakPolarHBondContact O-CB 3.09Å; I484-S488 PolarHBondContact O-N 2.97Å; I484-S488 PolarHBondContact O-OG 3.22Å; L485-S488 WeakPolarHBondContact CA-OG 3.3Å; L485-S488 PolarHBondContact O-N 3.35Å; L485-S488 PolarHBondContact O-OG 2.83Å; Y486-S488 VanDerWaalsContact C-N 3.33Å; Y486-S488 PolarHBondContact O-N 3.34Å; S488-A490 VanDerWaalsContact C-N 3.34Å; S488-A490 PolarHBondContact O-N 3.43Å; S488-L491 WeakPolarHBondContact O-CB 3.31Å; S488-L491 PolarHBondContact O-N 3.06Å; S488-V492 WeakPolarHBondContact O-CG2 3.19Å; S488-V492 PolarHBondContact O-N 3.05Å
489I98.5Very high96.9Very high25 Ų2540.9 Ų40.913%0.12822%0.215CC..Hα-helixtrans-59.2-46.1173.3-70.3167.9000110.6Y339 A343 V347 F470 L485 Y486 A493Y339-I489 PolarHBondContact OH-O 2.99Å; A343-I489 HydrophobicContact CB-CG2 3.55Å; V347-I489 HydrophobicContact CG2-CB 4.16Å; V347-I489 HydrophobicContact CG2-CG2 3.88Å; F470-I489 HydrophobicContact CE2-CD1 4.1Å; L485-I489 HydrophobicContact CD1-CD1 4.14Å; L485-I489 HydrophobicContact CD1-CG1 4.48Å; L485-I489 HydrophobicContact CG-CD1 3.97Å; L485-I489 VanDerWaalsContact O-CG1 3.26Å; L485-I489 WeakPolarHBondContact O-CG1 3.21Å; L485-I489 PolarHBondContact O-N 3.17Å; Y486-I489 PolarHBondContact O-N 2.85Å; I489-A493 PolarHBondContact O-N 2.02Å; I489-A493 VanDerWaalsContact O-N 3.17Å
490A98.4Very high96.9Very high0 Ų039.7 Ų39.70%021%0.205CC..Hα-helixtrans-64.3-39.3176.100000112.2F397 T401 Y486 S488 A493 G494F397-A490 WeakPolarHBondContact CB-O 3.29Å; F397-A490 HydrophobicContact CD1-CB 4.15Å; T401-A490 WeakPolarHBondContact OG1-CB 3.36Å; Y486-A490 WeakPolarHBondContact O-CB 3.12Å; Y486-A490 PolarHBondContact O-N 3.04Å; S488-A490 VanDerWaalsContact C-N 3.34Å; S488-A490 PolarHBondContact O-N 3.43Å; A490-A493 WeakPolarHBondContact O-CB 3.47Å; A490-A493 PolarHBondContact O-N 3.38Å; A490-G494 PolarHBondContact O-N 3.27Å
491L98.5Very high96.9Very high66 Ų6636 Ų3635%0.34619%0.186SC..Hα-helixtrans-62.4-49.5-179.4-179.858.9000111.3L398 T401 G487 S488 A493 G494 V495L398-L491 HydrophobicContact CD2-CD1 3.72Å; T401-L491 HydrophobicContact CG2-CB 3.91Å; T401-L491 HydrophobicContact CG2-CD1 4.25Å; T401-L491 HydrophobicContact CG2-CG 4.46Å; T401-L491 WeakPolarHBondContact OG1-CA 3.49Å; T401-L491 PolarHBondContact OG1-N 3.32Å; G487-L491 VanDerWaalsContact O-CB 3.3Å; G487-L491 WeakPolarHBondContact O-CB 2.96Å; G487-L491 PolarHBondContact O-N 2.02Å; S488-L491 WeakPolarHBondContact O-CB 3.31Å; S488-L491 PolarHBondContact O-N 3.06Å; L491-A493 PolarHBondContact O-N 2.64Å; L491-G494 PolarHBondContact O-N 3.49Å; L491-V495 WeakPolarHBondContact O-CG2 3.5Å; L491-V495 PolarHBondContact O-N 3.39Å
492V98.3Very high96.8Very high55 Ų5533.1 Ų33.133%0.33317%0.17SC..Hα-helixtrans-61.2-37.7178175.60000110.3Y339 S488 V495 F496Y339-V492 HydrophobicContact CD1-CG1 4.38Å; Y339-V492 HydrophobicContact CE1-CB 3.93Å; Y339-V492 HydrophobicContact CE1-CG1 3.56Å; Y339-V492 HydrophobicContact CE2-CG1 4.44Å; Y339-V492 WeakPolarHBondContact OH-CB 3.4Å; S488-V492 WeakPolarHBondContact O-CG2 3.19Å; S488-V492 PolarHBondContact O-N 3.05Å; V492-V495 PolarHBondContact O-N 2.89Å; V492-F496 HydrophobicContact CG1-CD1 4.23Å; V492-F496 HydrophobicContact CG1-CD2 4.16Å; V492-F496 HydrophobicContact CG1-CE1 3.92Å; V492-F496 HydrophobicContact CG1-CE2 3.84Å; V492-F496 HydrophobicContact CG1-CG 4.35Å; V492-F496 HydrophobicContact CG1-CZ 3.71Å; V492-F496 WeakPolarHBondContact O-CB 3.41Å; V492-F496 WeakPolarHBondContact O-CG 3.26Å; V492-F496 PolarHBondContact O-N 3.24Å
493A98.3Very high96.4Very high0 Ų033.5 Ų33.50%017%0.172CC..Hα-helixtrans-65-44.7176.700000111.7Y339 A343 F397 I489 A490 L491 V495 F496 V497Y339-A493 HydrophobicContact CD1-CB 4.29Å; Y339-A493 HydrophobicContact CE1-CB 3.9Å; A343-A493 HydrophobicContact CB-CB 3.65Å; F397-A493 HydrophobicContact CD1-CB 3.82Å; F397-A493 HydrophobicContact CD2-CB 4.13Å; F397-A493 HydrophobicContact CE1-CB 3.73Å; F397-A493 HydrophobicContact CE2-CB 4.08Å; F397-A493 HydrophobicContact CG-CB 4.03Å; F397-A493 HydrophobicContact CZ-CB 3.86Å; I489-A493 PolarHBondContact O-N 2.02Å; I489-A493 VanDerWaalsContact O-N 3.17Å; A490-A493 WeakPolarHBondContact O-CB 3.47Å; A490-A493 PolarHBondContact O-N 3.38Å; L491-A493 PolarHBondContact O-N 2.64Å; A493-V495 VanDerWaalsContact C-N 3.33Å; A493-V495 PolarHBondContact O-N 2.82Å; A493-F496 PolarHBondContact O-N 3.26Å; A493-V497 VanDerWaalsContact O-CG2 3.28Å; A493-V497 WeakPolarHBondContact O-CG2 3.07Å; A493-V497 PolarHBondContact O-N 3.45Å
494G97.7Very high95.9Very high1 Ų134.6 Ų34.61%0.0118%0.182CC..Hα-helixtrans-58.1-43.5174.500000112.6A490 L491 V497 F498A490-G494 PolarHBondContact O-N 3.27Å; L491-G494 PolarHBondContact O-N 3.49Å; G494-V497 PolarHBondContact O-N 2.8Å; G494-F498 PolarHBondContact O-N 3.4Å
495V97.3Very high95.1Very high72 Ų7235.5 Ų35.544%0.43621%0.209SC..Hα-helixtrans-66-41.4175.3173.80000111.5L491 V492 A493 V497 F498 F499L491-V495 WeakPolarHBondContact O-CG2 3.5Å; L491-V495 PolarHBondContact O-N 3.39Å; V492-V495 PolarHBondContact O-N 2.89Å; A493-V495 VanDerWaalsContact C-N 3.33Å; A493-V495 PolarHBondContact O-N 2.82Å; V495-V497 VanDerWaalsContact C-N 3.35Å; V495-V497 PolarHBondContact O-N 3.19Å; V495-F498 WeakPolarHBondContact O-CB 2.99Å; V495-F498 PolarHBondContact O-N 3.42Å; V495-F499 HydrophobicContact CG1-CE2 4.16Å; V495-F499 WeakPolarHBondContact O-CD2 3.29Å
496F97.4Very high94.3Very high74 Ų7436.7 Ų36.733%0.32521%0.212SC..Hα-helixtrans-66.4-36.7179.1-78.34.4000112.7I336 Y339 V492 A493 F498 F499I336-F496 HydrophobicContact CG2-CB 3.93Å; Y339-F496 AromaticContact CD1-CD2 3.45Å; Y339-F496 HydrophobicContact CD1-CD2 3.45Å; Y339-F496 VanDerWaalsContact CD1-CD2 3.45Å; Y339-F496 AromaticContact CD1-CE2 3.84Å; Y339-F496 HydrophobicContact CD1-CE2 3.84Å; Y339-F496 HydrophobicContact CD1-CG 4.43Å; Y339-F496 HydrophobicContact CD2-CE2 4.34Å; Y339-F496 HydrophobicContact CE1-CD2 4.12Å; Y339-F496 HydrophobicContact CE1-CE2 4.33Å; Y339-F496 AromaticContact CG-CD2 3.79Å; Y339-F496 HydrophobicContact CG-CD2 3.79Å; Y339-F496 AromaticContact CG-CE2 3.85Å; Y339-F496 HydrophobicContact CG-CE2 3.85Å; V492-F496 HydrophobicContact CG1-CD1 4.23Å; V492-F496 HydrophobicContact CG1-CD2 4.16Å; V492-F496 HydrophobicContact CG1-CE1 3.92Å; V492-F496 HydrophobicContact CG1-CE2 3.84Å; V492-F496 HydrophobicContact CG1-CG 4.35Å; V492-F496 HydrophobicContact CG1-CZ 3.71Å; V492-F496 WeakPolarHBondContact O-CB 3.41Å; V492-F496 WeakPolarHBondContact O-CG 3.26Å; V492-F496 PolarHBondContact O-N 3.24Å; A493-F496 PolarHBondContact O-N 3.26Å; F496-F498 PolarHBondContact O-N 3.37Å; F496-F499 PolarHBondContact O-N 3.39Å; F496-F499 VanDerWaalsContact O-N 3.08Å
497V96.9Very high93.3Very high0 Ų041 Ų410%025%0.248CC..Hα-helixtrans-59.4-31.3174.8168.30000112.1V340 R390 L393 M394 F397 A493 G494 V495 F499 L500V340-V497 HydrophobicContact CG1-CG2 4.08Å; V340-V497 HydrophobicContact CG2-CG2 3.76Å; R390-V497 HydrophobicContact CG-CG1 3.95Å; R390-V497 WeakPolarHBondContact O-CG1 3.5Å; L393-V497 HydrophobicContact CB-CG1 3.69Å; L393-V497 HydrophobicContact CB-CG2 4.16Å; L393-V497 HydrophobicContact CD1-CG1 4.5Å; M394-V497 HydrophobicContact CB-CG1 4.06Å; F397-V497 HydrophobicContact CD2-CG2 4.33Å; F397-V497 HydrophobicContact CE2-CG2 4.32Å; A493-V497 VanDerWaalsContact O-CG2 3.28Å; A493-V497 WeakPolarHBondContact O-CG2 3.07Å; A493-V497 PolarHBondContact O-N 3.45Å; G494-V497 PolarHBondContact O-N 2.8Å; V495-V497 VanDerWaalsContact C-N 3.35Å; V495-V497 PolarHBondContact O-N 3.19Å; V497-F499 PolarHBondContact O-N 2.8Å; V497-L500 WeakPolarHBondContact O-CB 3.41Å; V497-L500 PolarHBondContact O-N 3.34Å
498F94.4Very high92.3Very high109 Ų10945.5 Ų45.548%0.47827%0.271SS..Hα-helixtrans-55.9-34.4175.6178.3-97.6000112.6M394 G494 V495 F496 L500M394-F498 HydrophobicContact SD-CB 4.3Å; M394-F498 HydrophobicContact SD-CD2 4.07Å; G494-F498 PolarHBondContact O-N 3.4Å; V495-F498 WeakPolarHBondContact O-CB 2.99Å; V495-F498 PolarHBondContact O-N 3.42Å; F496-F498 PolarHBondContact O-N 3.37Å; F498-L500 VanDerWaalsContact C-N 3.26Å; F498-L500 PolarHBondContact O-N 3.26Å
499F93.9Very high91.3Very high86 Ų8643.7 Ų43.738%0.37726%0.259SS..THydrogen-bonded Turntrans-83.24.7-179.5-61.5-67.4000114.3R332 I336 V495 F496 V497R332-F499 VanDerWaalsContact NH2-CD1 3.27Å; I336-F499 HydrophobicContact CD1-CB 3.87Å; V495-F499 HydrophobicContact CG1-CE2 4.16Å; V495-F499 WeakPolarHBondContact O-CD2 3.29Å; F496-F499 PolarHBondContact O-N 3.39Å; F496-F499 VanDerWaalsContact O-N 3.08Å; V497-F499 PolarHBondContact O-N 2.8Å
500L94.5Very high90.2Very high0 Ų048.7 Ų48.70%028%0.282CS..SBendtrans-97.1156.5173.8-60.2173.7000111.1R333 I336 I337 R390 Y439 L443 V497 F498R333-L500 HydrophobicContact CB-CD2 4.36Å; R333-L500 HydrophobicContact CG-CD2 4.19Å; I336-L500 HydrophobicContact CB-CD2 3.92Å; I336-L500 HydrophobicContact CB-CG 4.45Å; I336-L500 HydrophobicContact CD1-CD2 4.11Å; I336-L500 HydrophobicContact CG2-CD1 3.65Å; I336-L500 HydrophobicContact CG2-CD2 3.6Å; I336-L500 HydrophobicContact CG2-CG 3.6Å; I337-L500 HydrophobicContact CD1-CD1 4.27Å; R390-L500 WeakPolarHBondContact CD-O 3.23Å; R390-L500 PolarHBondContact NH1-O 3.49Å; Y439-L500 HydrophobicContact CE1-CB 4.35Å; Y439-L500 HydrophobicContact CE1-CD1 3.68Å; Y439-L500 WeakPolarHBondContact OH-CB 3.4Å; L443-L500 HydrophobicContact CD2-CD2 4.46Å; V497-L500 WeakPolarHBondContact O-CB 3.41Å; V497-L500 PolarHBondContact O-N 3.34Å; F498-L500 VanDerWaalsContact C-N 3.26Å; F498-L500 PolarHBondContact O-N 3.26Å
501P92.6Very high89.3Confident1 Ų151.6 Ų51.61%0.00630%0.3CS..PPolyproline II helixtrans-79.9149.9177.332.9-37.5000112.2Y439 L443 L518Y439-P501 PolarHBondContact OH-O 3.42Å; L443-P501 HydrophobicContact CD1-CG 3.77Å; P501-L518 HydrophobicContact CB-CD2 4.05Å; P501-L518 HydrophobicContact CG-CD2 4.19Å
502E93.2Very high88.2Confident34 Ų3449.9 Ų49.916%0.15929%0.29CS..PPolyproline II helixtrans-69.8140.6166.4-177.954.1-109.700110.6R389 R390 A504 K506R389-E502 PolarHBondContact N-OE1 3.47Å; R389-E502 PolarHBondContact N-OE2 3.44Å; R390-E502 VanDerWaalsContact CB-OE2 3.25Å; R390-E502 WeakPolarHBondContact CB-OE2 3.35Å; R390-E502 PolarHBondContact N-OE2 3.45Å; E502-A504 HydrophobicContact CG-CB 4.33Å; E502-A504 VanDerWaalsContact OE1-CB 3.31Å; E502-A504 WeakPolarHBondContact OE1-CB 3.21Å; E502-A504 PolarHBondContact OE1-N 3.11Å; E502-K506 WeakPolarHBondContact O-CD 3.42Å; E502-K506 WeakPolarHBondContact O-CE 3.33Å; E502-K506 PolarHBondContact O-NZ 2.9Å
503T89.4Confident87.2Confident8 Ų852.3 Ų52.35%0.04930%0.298CS..  trans-111.8-18.4-179.355.10000113.2Y439 E442 G505 K506Y439-T503 HydrophobicContact CD2-CG2 4.02Å; Y439-T503 WeakPolarHBondContact CD2-OG1 3.33Å; Y439-T503 HydrophobicContact CE2-CG2 3.62Å; Y439-T503 WeakPolarHBondContact CE2-OG1 3.32Å; E442-T503 HydrophobicContact CB-CG2 3.93Å; E442-T503 VanDerWaalsContact OE2-CB 3.3Å; E442-T503 WeakPolarHBondContact OE2-CB 3.42Å; E442-T503 PolarHBondContact OE2-OG1 2.97Å; T503-G505 PolarHBondContact O-N 3.07Å; T503-K506 WeakPolarHBondContact O-CB 3.46Å; T503-K506 PolarHBondContact O-N 2.74Å
504A84.2Confident86Confident24 Ų2454.9 Ų54.920%0.19831%0.312CS..THydrogen-bonded Turntrans-60.8134.5-178.500000112.7E502 K506E502-A504 HydrophobicContact CG-CB 4.33Å; E502-A504 VanDerWaalsContact OE1-CB 3.31Å; E502-A504 WeakPolarHBondContact OE1-CB 3.21Å; E502-A504 PolarHBondContact OE1-N 3.11Å; A504-K506 PolarHBondContact O-N 3.5Å
505G80.9Confident85Confident92 Ų9254.8 Ų54.895%0.94831%0.311SS*.THydrogen-bonded Turntrans71.12.8-179.800000114.9T503T503-G505 PolarHBondContact O-N 3.07Å
506K80.7Confident83.9Confident77 Ų7753.9 Ų53.934%0.33530%0.302SS..SBendtrans-95.5147.1177-62.4-178.1-179.1173.20110.7E502 T503 A504 L518E502-K506 WeakPolarHBondContact O-CD 3.42Å; E502-K506 WeakPolarHBondContact O-CE 3.33Å; E502-K506 PolarHBondContact O-NZ 2.9Å; T503-K506 WeakPolarHBondContact O-CB 3.46Å; T503-K506 PolarHBondContact O-N 2.74Å; A504-K506 PolarHBondContact O-N 3.5Å; K506-L518 HydrophobicContact CD-CD2 3.72Å; K506-L518 HydrophobicContact CD-CG 4.06Å
507A77.2Confident82.9Confident92 Ų9258.9 Ų58.976%0.7632%0.319SS*.PPolyproline II helixtrans-62.1140.6171.600000110.3A509A507-A509 PolarHBondContact O-N 3.19Å
508L77.1Confident81.5Confident96 Ų9660.2 Ų60.250%0.50333%0.326SS..PPolyproline II helixtrans-63.9128.3175.9-72.6167000109.3E442 E510E442-L508 HydrophobicContact CB-CD2 4.27Å; E442-L508 HydrophobicContact CG-CD2 4.03Å; L508-E510 PolarHBondContact O-N 2.97Å
509A78.7Confident79.8Confident5 Ų562.5 Ų62.54%0.04134%0.335CS..PPolyproline II helixtrans-62.4128.8174.700000110.1P445 T446 A507 D514 A515P445-A509 CarbonylContact C-O 3.43Å; P445-A509 WeakPolarHBondContact CA-O 3.44Å; P445-A509 HydrophobicContact CB-CB 3.87Å; T446-A509 PolarHBondContact N-O 3.12Å; A507-A509 PolarHBondContact O-N 3.19Å; A509-D514 HydrophobicContact CB-CB 3.88Å; A509-A515 HydrophobicContact CB-CB 3.89Å
510E74.2Confident77.8Confident131 Ų13161.3 Ų61.361%0.61233%0.333SS*.  trans-92.5-45.7175-63.7-168.3162.700110.3T446 V447 L508T446-E510 HydrophobicContact CG2-CG 4.44Å; T446-E510 WeakPolarHBondContact OG1-CA 3.42Å; T446-E510 PolarHBondContact OG1-O 3.22Å; V447-E510 WeakPolarHBondContact CG1-O 3.35Å; L508-E510 PolarHBondContact O-N 2.97Å
511T79.3Confident75.4Confident61 Ų6168.3 Ų68.337%0.37437%0.365SS..SBendtrans-101.9163.9179.371.30000112.5P445 E513 D514 A515P445-T511 VanDerWaalsContact CB-O 3.29Å; P445-T511 WeakPolarHBondContact CB-O 3.38Å; T511-E513 PolarHBondContact O-N 3.48Å; T511-E513 PolarHBondContact OG1-N 2.58Å; T511-D514 WeakPolarHBondContact CB-OD2 3.47Å; T511-D514 PolarHBondContact N-OD2 3.45Å; T511-D514 PolarHBondContact O-N 3.31Å; T511-D514 PolarHBondContact OG1-N 3.28Å; T511-D514 VanDerWaalsContact OG1-N 3.17Å; T511-D514 PolarHBondContact OG1-OD2 3.23Å; T511-A515 PolarHBondContact O-N 3.26Å
512I77Confident72.8Confident30 Ų3075.1 Ų75.115%0.15440%0.395CS..Hα-helixtrans-59-34.9171.9-70.5170.9000111.2D323 L330 P445 V447 A515 E516D323-I512 HydrophobicContact CB-CD1 4.27Å; L330-I512 HydrophobicContact CD1-CG1 4.35Å; L330-I512 HydrophobicContact CD1-CG2 3.66Å; P445-I512 HydrophobicContact CG-CG1 4.33Å; V447-I512 HydrophobicContact CG2-CG1 4.24Å; I512-A515 PolarHBondContact O-N 2.85Å; I512-E516 PolarHBondContact O-N 3.4Å
513E75.5Confident69.9Low105 Ų10578.9 Ų78.949%0.49142%0.423SS..Hα-helixtrans-70-39.1-179.9-66.9171.5-168.500111.9R327 T511 A515 E516 R517R327-E513 IonicContact NH2-OE1 2.8Å; T511-E513 PolarHBondContact O-N 3.48Å; T511-E513 PolarHBondContact OG1-N 2.58Å; E513-A515 VanDerWaalsContact C-N 3.28Å; E513-A515 PolarHBondContact O-N 2.78Å; E513-E516 PolarHBondContact O-N 2.73Å; E513-R517 WeakPolarHBondContact O-CG 3.21Å; E513-R517 PolarHBondContact O-N 3.48Å
514D74.7Confident67Low54 Ų5487.7 Ų87.729%0.28946%0.46SS..Hα-helixtrans-62-39.2174.4-58.6-40.6000111.4A509 T511 E516 R517 L518A509-D514 HydrophobicContact CB-CB 3.88Å; T511-D514 WeakPolarHBondContact CB-OD2 3.47Å; T511-D514 PolarHBondContact N-OD2 3.45Å; T511-D514 PolarHBondContact O-N 3.31Å; T511-D514 PolarHBondContact OG1-N 3.28Å; T511-D514 VanDerWaalsContact OG1-N 3.17Å; T511-D514 PolarHBondContact OG1-OD2 3.23Å; D514-E516 VanDerWaalsContact C-N 3.33Å; D514-E516 PolarHBondContact O-N 3.13Å; D514-R517 PolarHBondContact O-N 2.71Å; D514-L518 PolarHBondContact O-N 2.73Å
515A75.4Confident64.5Low0 Ų096.2 Ų96.20%049%0.487CS..Hα-helixtrans-63.7-38.2176.900000111.7L330 R333 P445 A509 T511 I512 E513 L518L330-A515 HydrophobicContact CD2-CB 4.23Å; R333-A515 PolarHBondContact NH1-O 3.25Å; P445-A515 HydrophobicContact CB-CB 4.17Å; P445-A515 HydrophobicContact CG-CB 3.84Å; A509-A515 HydrophobicContact CB-CB 3.89Å; T511-A515 PolarHBondContact O-N 3.26Å; I512-A515 PolarHBondContact O-N 2.85Å; E513-A515 VanDerWaalsContact C-N 3.28Å; E513-A515 PolarHBondContact O-N 2.78Å; A515-L518 VanDerWaalsContact O-CB 3.24Å; A515-L518 WeakPolarHBondContact O-CB 3.36Å; A515-L518 PolarHBondContact O-N 3.31Å
516E75Confident62.1Low52 Ų5298.5 Ų98.524%0.24349%0.487CS..Hα-helixtrans-70.6-33.8176-67.1-171.7134.200112.8R327 V329 I512 E513 D514 L518R327-E516 VanDerWaalsContact CB-OE1 3.29Å; R327-E516 WeakPolarHBondContact CB-OE1 3.44Å; R327-E516 WeakPolarHBondContact CD-OE1 3.4Å; R327-E516 WeakPolarHBondContact CD-OE2 3.48Å; R327-E516 IonicContact CZ-OE2 3.88Å; R327-E516 IonicContact NH1-OE2 2.81Å; R327-E516 PolarHBondContact NH1-OE2 3.24Å; V329-E516 HydrophobicContact CB-CG 4.19Å; I512-E516 PolarHBondContact O-N 3.4Å; E513-E516 PolarHBondContact O-N 2.73Å; D514-E516 VanDerWaalsContact C-N 3.33Å; D514-E516 PolarHBondContact O-N 3.13Å; E516-L518 PolarHBondContact O-N 3.16Å
517R75.9Confident59.7Low180 Ų180103.5 Ų103.568%0.67950%0.504SS*.Hα-helixtrans-67.4-18.2175.6-72.4176.7-173.9-176.93.7113.7E513 D514 K519E513-R517 WeakPolarHBondContact O-CG 3.21Å; E513-R517 PolarHBondContact O-N 3.48Å; D514-R517 PolarHBondContact O-N 2.71Å; R517-K519 PolarHBondContact O-N 2.98Å
518L68.5Low57.4Low27 Ų27106.9 Ų106.914%0.14150%0.504CS..SBendtrans-65.767.8171.1-133.3135.2000108.8R333 P501 K506 D514 A515 E516R333-L518 PolarHBondContact NH2-O 3.27Å; P501-L518 HydrophobicContact CB-CD2 4.05Å; P501-L518 HydrophobicContact CG-CD2 4.19Å; K506-L518 HydrophobicContact CD-CD2 3.72Å; K506-L518 HydrophobicContact CD-CG 4.06Å; D514-L518 PolarHBondContact O-N 2.73Å; A515-L518 VanDerWaalsContact O-CB 3.24Å; A515-L518 WeakPolarHBondContact O-CB 3.36Å; A515-L518 PolarHBondContact O-N 3.31Å; E516-L518 PolarHBondContact O-N 3.16Å
519K57.1Low55.2Low157 Ų157107.5 Ų107.568%0.68352%0.523SS*.  trans-63.3153.8-176.2-77-175177.9179.90110.6R517 H521R517-K519 PolarHBondContact O-N 2.98Å; K519-H521 PolarHBondContact O-N 3.11Å
520D53.4Low53.2Low62 Ų62112.8 Ų112.833%0.33255%0.554SS.*  trans-6478.1168.7-57.4-30.7000108.8F522D520-F522 HydrophobicContact CB-CE2 4.24Å; D520-F522 WeakPolarHBondContact O-CD2 3.19Å; D520-F522 PolarHBondContact O-N 3.15Å
521H43.5Very low51.7Low146 Ų146110.2 Ų110.268%0.67655%0.551SS**  trans-67.791.7163.2-88.2-14.5000107.3K519K519-H521 PolarHBondContact O-N 3.11Å
522F39.1Very low49.6Very low144 Ų144114.1 Ų114.163%0.63257%0.569SS**  trans-48.3128.2151.6-63.6-83.1000106.6D520 K524D520-F522 HydrophobicContact CB-CE2 4.24Å; D520-F522 WeakPolarHBondContact O-CD2 3.19Å; D520-F522 PolarHBondContact O-N 3.15Å; F522-K524 VanDerWaalsContact C-N 3.28Å; F522-K524 PolarHBondContact O-N 2.97Å
523P31.8Very low47.6Very low113 Ų113121.7 Ų121.773%0.73460%0.601SS**  trans-64.890.3-173.825.2-32.4000109.8R525P523-R525 PolarHBondContact O-N 3.31Å
524K28.1Very low45.9Very low193 Ų193123.9 Ų123.984%0.83961%0.611SS**  trans-70.2116.7147.7-76.3-170.9176.1-175.80104.4F522 C526F522-K524 VanDerWaalsContact C-N 3.28Å; F522-K524 PolarHBondContact O-N 2.97Å; K524-C526 PolarHBondContact O-N 3.01Å
525R30.4Very low44.4Very low204 Ų204129 Ų12977%0.7764%0.635SS**  trans-36.8116.8166.4-88.1174.4166.9170.1-3.9107.2P523 R527P523-R525 PolarHBondContact O-N 3.31Å; R525-R527 PolarHBondContact O-N 3.21Å
526C30.6Very low42.9Very low140 Ų140136.2 Ų136.295%0.94667%0.674SS**  trans-65.375.5160.1-79.60000106.9K524K524-C526 PolarHBondContact O-N 3.01Å
527R30.2Very low41.5Very low182 Ų182139 Ų13969%0.68770%0.695SS**  trans-96.1125.8151.3-85.1-172.1177.7-177.5-2.3105.1R525R525-R527 PolarHBondContact O-N 3.21Å
528Q29.7Very low40.2Very low163 Ų163138.4 Ų138.476%0.76270%0.702SS**  trans69.282.9162.6-67.4146.5-43.300116.2
529A31Very low39.2Very low108 Ų108144.9 Ų144.989%0.89374%0.737SS**SBendtrans-122.227.8142.100000110.8
530V35.7Very low38.9Very low117 Ų117150 Ų15071%0.70976%0.759SS**SBendtrans-109.22174.3-176.40000111.4
531S42.7Very low38.1Very low76 Ų76154.5 Ų154.553%0.53178%0.78SS.*SBendtrans-91.9-13.4-173.9-173.40000116.1
532D36.8Very low37.9Very low144 Ų144154.9 Ų154.977%0.7779%0.786SS**SBendtrans-110.89.2-170.9-65.5-7.1000114
533K35.3Very low37.8Very low189 Ų189155.5 Ų155.582%0.82280%0.795SS**SBendtrans-111.8-7.2172.6-92.3-170174.4-173.80115.4
534E39.6Very low38.1Very low150 Ų150158 Ų15870%0.70180%0.798SS**SBendtrans-96.5-4.4174.4-72.7-175.3154.100113.5
535M42.8Very low38.8Very low161 Ų161155.8 Ų155.879%0.79380%0.796SS**THydrogen-bonded Turntrans-86.2-12.8175.9-128.2171.872.100114.5
536D43.5Very low39.3Very low152 Ų152152.6 Ų152.681%0.81380%0.797SS**THydrogen-bonded Turntrans-94.45.9179.8-87.1-8.3000114.3
537T46.8Very low40Very low111 Ų111153.5 Ų153.568%0.68179%0.787SS**SBendtrans-126.313.8-179.445.20000115.6
538M47.9Very low40.7Very low168 Ų168151.3 Ų151.383%0.82879%0.794SS**SBendtrans-110.31.8170-86.8-169.3172.100115.9
539D47Very low41.6Very low163 Ų163150.3 Ų150.387%0.87280%0.797SS**  trans-116.344.8172.9-83.2-21.8000113.3
540K50.3Low42.6Very low265 Ų265154.2 Ų154.2100%1.15279%0.788SS**  trans-139.50157.5-75.9-171.8-179.6177.70109.1

Retrieved 540 of 540 residues in 637.9 ms (Link to these results)

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